#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hmy n LEU 867 N 0.00 4.26 -4.92 1.20 4.77 -1.26 -4.98 117.00 116.07 3hmy n LEU 867 Ca 0.00 -2.34 -0.30 0.00 -0.03 0.00 0.00 56.01 53.34 3hmy n LEU 867 Cb 0.00 -0.51 0.16 0.00 -2.33 0.00 0.00 43.42 40.74 3hmy n LEU 867 CO 0.00 0.82 0.85 -1.81 -1.33 0.00 0.00 177.39 175.93 3hmy s ASP 868 N -1.03 3.48 0.50 -1.43 1.01 -1.26 -2.54 116.67 115.39 3hmy s ASP 868 Ca 0.46 0.41 0.08 0.00 0.71 0.00 0.00 52.55 54.21 3hmy s ASP 868 Cb 0.28 -0.58 0.04 0.00 1.01 0.00 0.00 42.92 43.68 3hmy s ASP 868 CO 0.24 -2.52 0.61 0.00 0.21 0.00 0.00 175.17 173.71 3hmy n TRP 870 N -1.96 0.00 0.00 0.00 -0.00 -1.26 -4.97 117.44 109.25 3hmy n TRP 870 Ca 0.09 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.59 3hmy n TRP 870 Cb 0.61 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.92 3hmy n TRP 870 CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 177.69 175.78 3hmy n GLU 875 N 13.64 0.00 -2.52 5.87 4.07 -1.26 -5.23 120.64 135.21 3hmy n GLU 875 Ca 0.00 0.00 -0.41 0.00 -0.06 0.00 0.00 57.16 56.69 3hmy n GLU 875 Cb 0.00 0.00 -0.04 0.00 -0.06 0.00 0.00 31.44 31.34 3hmy n GLU 875 CO 0.00 0.00 0.00 0.34 -0.06 0.00 0.00 177.13 177.41 3hmy s ASP 876 N 0.00 7.29 0.14 4.31 2.15 -1.26 -4.93 116.67 124.37 3hmy s ASP 876 Ca 0.00 2.11 -0.19 0.00 0.43 0.00 0.00 52.55 54.91 3hmy s ASP 876 Cb 0.00 -2.61 0.01 0.00 -0.30 0.00 0.00 42.92 40.03 3hmy s ASP 876 CO 0.00 -0.19 1.70 0.40 -0.17 0.00 0.00 175.17 176.92 3hmy h ILE 877 N 3.59 0.78 -0.95 4.11 5.03 -2.00 0.13 117.51 128.19 3hmy h ILE 877 Ca -0.45 -0.01 0.08 0.00 -0.12 0.00 0.00 64.86 64.36 3hmy h ILE 877 Cb 1.21 0.73 -0.07 0.00 -3.03 0.00 0.00 36.82 35.66 3hmy h ILE 877 CO 0.71 0.01 0.60 0.44 -0.68 0.00 0.00 178.15 179.23 3hmy h ASP 878 N 0.04 0.92 -0.29 1.72 3.32 -1.98 0.11 116.42 120.26 3hmy h ASP 878 Ca 0.13 0.03 -0.06 0.00 0.02 0.00 0.00 57.03 57.14 3hmy h ASP 878 Cb 0.18 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.56 3hmy h ASP 878 CO -0.24 0.55 -0.06 0.58 -1.72 0.00 0.00 179.24 178.35 3hmy h VAL 879 N 1.03 1.28 -0.29 -1.35 2.07 -1.72 -2.04 116.25 115.22 3hmy h VAL 879 Ca 0.44 -1.07 0.02 0.00 0.82 0.00 0.00 66.70 66.90 3hmy h VAL 879 Cb 0.29 1.39 -0.02 0.00 -1.52 0.00 0.00 31.29 31.42 3hmy h VAL 879 CO -0.21 0.34 0.16 0.40 0.02 0.00 0.00 177.57 178.28 3hmy h ILE 880 N 0.32 1.01 -0.69 4.57 2.04 0.03 0.57 117.51 125.36 3hmy h ILE 880 Ca 0.08 -0.11 0.04 0.00 1.00 0.00 0.00 64.86 65.86 3hmy h ILE 880 Cb 0.53 0.65 -0.05 0.00 -0.74 0.00 0.00 36.82 37.22 3hmy h ILE 880 CO 0.03 0.06 0.42 -0.07 0.00 0.00 0.00 178.15 178.58 3hmy h LEU 881 N 0.33 0.67 -0.00 1.44 3.38 -0.73 -0.29 115.31 120.10 3hmy h LEU 881 Ca 0.12 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 3hmy h LEU 881 Cb 0.02 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.64 3hmy h LEU 881 CO -0.07 0.45 -0.00 0.50 0.09 0.00 0.00 178.44 179.41 3hmy h LYS 882 N 0.80 0.01 -0.43 1.13 3.64 -0.98 -3.08 116.57 117.66 3hmy h LYS 882 Ca 0.29 -0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.63 3hmy h LYS 882 Cb 0.08 -0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.87 3hmy h LYS 882 CO -0.13 0.39 0.14 0.87 -2.27 0.00 0.00 179.45 178.45 3hmy h LYS 883 N -0.38 0.62 -0.01 1.90 1.57 -0.71 -2.79 116.57 116.78 3hmy h LYS 883 Ca 0.00 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 3hmy h LYS 883 Cb 0.39 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.59 3hmy h LYS 883 CO 0.00 0.54 -0.04 -1.13 -0.57 0.00 0.00 179.45 178.24 3hmy n SER 884 N -4.35 0.60 -4.66 0.86 3.41 -0.13 -4.84 113.62 104.51 3hmy n SER 884 Ca 0.03 -0.97 -0.43 0.00 -0.26 0.00 0.00 58.87 57.24 3hmy n SER 884 Cb 0.17 -0.03 -0.02 0.00 -0.26 0.00 0.00 64.21 64.07 3hmy n SER 884 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 3hmy s THR 885 N -2.19 4.52 -1.16 6.66 2.01 -1.05 -0.06 115.64 124.36 3hmy s THR 885 Ca 0.38 1.83 0.11 0.00 0.31 0.00 0.00 61.69 64.32 3hmy s THR 885 Cb 0.21 -4.18 0.03 0.00 0.01 0.00 0.00 72.50 68.57 3hmy s THR 885 CO 0.40 -0.15 0.74 2.30 -0.69 0.00 0.00 174.62 177.22 3hmy n ILE 886 N 5.29 0.00 -3.64 1.82 -5.35 -0.10 -4.94 119.36 112.44 3hmy n ILE 886 Ca 0.13 -0.42 -0.06 0.00 -0.27 0.00 0.00 62.75 62.12 3hmy n ILE 886 Cb 0.46 1.17 -0.07 0.00 -1.74 0.00 0.00 39.64 39.45 3hmy n ILE 886 CO 0.00 0.00 0.00 -0.22 -1.76 0.00 0.00 176.55 174.57 3hmy s LEU 887 N -1.47 -0.88 -0.29 7.28 2.96 -1.18 -4.79 118.68 120.30 3hmy s LEU 887 Ca 0.11 1.41 -0.00 0.00 -0.22 0.00 0.00 54.13 55.43 3hmy s LEU 887 Cb 0.09 2.29 0.14 0.00 0.50 0.00 0.00 46.19 49.21 3hmy s LEU 887 CO 0.24 -0.22 0.31 0.21 -1.32 0.00 0.00 176.35 175.56 3hmy s ASN 888 N 1.59 1.53 -0.14 3.68 3.84 -1.26 -1.32 114.94 122.87 3hmy s ASN 888 Ca -0.10 -0.76 -0.29 0.00 0.21 0.00 0.00 52.86 51.92 3hmy s ASN 888 Cb -0.05 0.57 -0.01 0.00 -0.55 0.00 0.00 41.25 41.21 3hmy s ASN 888 CO -0.19 -0.38 1.17 -0.76 -2.79 0.00 0.00 177.10 174.14 3hmy s LEU 889 N 2.34 4.20 0.17 3.21 1.43 -0.16 -0.84 118.68 129.05 3hmy s LEU 889 Ca 0.10 1.65 0.07 0.00 -1.03 0.00 0.00 54.13 54.92 3hmy s LEU 889 Cb -0.14 -3.55 -0.04 0.00 0.03 0.00 0.00 46.19 42.49 3hmy s LEU 889 CO -0.32 -0.65 -0.15 -0.62 0.23 0.00 0.00 176.35 174.85 3hmy s ASP 890 N 1.56 2.41 -0.18 2.29 2.15 0.51 -4.15 116.67 121.26 3hmy s ASP 890 Ca 0.52 -0.94 0.00 0.00 0.43 0.00 0.00 52.55 52.57 3hmy s ASP 890 Cb -0.21 -0.12 0.04 0.00 -0.30 0.00 0.00 42.92 42.33 3hmy s ASP 890 CO 0.16 -0.15 -0.10 -0.63 -0.17 0.00 0.00 175.17 174.28 3hmy s ILE 891 N -2.61 1.47 0.00 4.11 1.01 -1.26 -1.27 121.20 122.65 3hmy s ILE 891 Ca 0.18 -0.80 -0.00 0.00 0.00 0.00 0.00 60.65 60.02 3hmy s ILE 891 Cb -0.02 -1.53 -0.01 0.00 0.01 0.00 0.00 42.46 40.91 3hmy s ILE 891 CO 0.05 0.23 -0.00 0.20 0.00 0.00 0.00 174.94 175.42 3hmy s ASN 892 N 1.49 0.07 -1.45 3.58 0.01 -0.95 -4.70 114.94 112.99 3hmy s ASN 892 Ca 0.01 -0.15 -0.11 0.00 -0.71 0.00 0.00 52.86 51.90 3hmy s ASN 892 Cb -0.15 0.05 0.07 0.00 0.41 0.00 0.00 41.25 41.62 3hmy s ASN 892 CO -0.09 -0.10 0.74 0.59 -1.51 0.00 0.00 177.10 176.73 3hmy n ASN 893 N 2.58 -4.66 -3.11 -1.22 3.02 -1.26 -1.31 115.26 109.30 3hmy n ASN 893 Ca -0.16 -0.56 -0.21 0.00 -0.03 0.00 0.00 54.58 53.62 3hmy n ASN 893 Cb 0.58 -3.77 0.01 0.00 -0.61 0.00 0.00 39.78 35.99 3hmy n ASN 893 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 3hmy n ASP 894 N -2.58 -4.48 -4.04 6.41 8.00 -1.26 -4.97 116.55 113.63 3hmy n ASP 894 Ca -0.00 -0.26 -0.22 0.00 0.71 0.00 0.00 54.79 55.01 3hmy n ASP 894 Cb 0.55 -3.68 -0.16 0.00 -0.02 0.00 0.00 41.12 37.81 3hmy n ASP 894 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3hmy s ILE 895 N -2.96 0.96 -0.15 0.53 -1.09 -0.43 -5.13 121.20 112.94 3hmy s ILE 895 Ca 0.30 -0.45 -0.16 0.00 -2.23 0.00 0.00 60.65 58.11 3hmy s ILE 895 Cb -0.15 -0.85 -0.04 0.00 -1.58 0.00 0.00 42.46 39.84 3hmy s ILE 895 CO 0.37 0.29 0.39 -0.63 -1.23 0.00 0.00 174.94 174.14 3hmy s ILE 896 N 0.17 5.23 0.18 2.92 1.01 -1.26 -2.23 121.20 127.22 3hmy s ILE 896 Ca -0.04 0.75 -0.13 0.00 0.00 0.00 0.00 60.65 61.23 3hmy s ILE 896 Cb -0.10 -3.73 0.01 0.00 0.01 0.00 0.00 42.46 38.65 3hmy s ILE 896 CO 0.01 0.33 0.41 -0.94 0.00 0.00 0.00 174.94 174.75 3hmy s SER 897 N 0.67 -0.12 -0.27 3.58 1.04 -0.40 -4.76 113.70 113.45 3hmy s SER 897 Ca 0.21 -0.67 -0.17 0.00 0.48 0.00 0.00 55.95 55.80 3hmy s SER 897 Cb -0.14 0.51 -0.03 0.00 0.10 0.00 0.00 66.02 66.46 3hmy s SER 897 CO 0.07 -0.99 0.47 -0.62 0.98 0.00 0.00 173.24 173.16 3hmy s ASP 898 N -2.92 6.38 -0.25 7.02 2.15 -1.26 -0.36 116.67 127.43 3hmy s ASP 898 Ca 0.13 0.44 0.13 0.00 0.43 0.00 0.00 52.55 53.69 3hmy s ASP 898 Cb 0.01 -2.26 0.62 0.00 -0.30 0.00 0.00 42.92 40.99 3hmy s ASP 898 CO -0.01 -0.26 1.58 2.30 -0.17 0.00 0.00 175.17 178.61 3hmy n ILE 899 N 5.15 2.58 0.16 4.11 -5.35 -0.02 -4.53 119.36 121.47 3hmy n ILE 899 Ca -0.05 -1.90 0.02 0.00 -0.27 0.00 0.00 62.75 60.55 3hmy n ILE 899 Cb 0.50 -0.30 0.26 0.00 -1.74 0.00 0.00 39.64 38.36 3hmy n ILE 899 CO 0.00 0.00 0.00 0.77 -1.76 0.00 0.00 176.55 175.56 3hmy h SER 900 N 2.17 0.00 0.00 7.28 4.64 -1.91 -3.47 113.55 122.25 3hmy h SER 900 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 3hmy h SER 900 Cb 1.80 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.89 3hmy h SER 900 CO 0.43 0.50 0.00 0.61 -0.87 0.00 0.00 176.83 177.50 3hmy n GLY 901 N 0.16 1.93 0.03 -0.77 0.00 -1.26 -4.91 105.19 100.36 3hmy n GLY 901 Ca -0.01 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.14 3hmy n GLY 901 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3hmy n PHE 902 N -0.81 0.24 -3.78 1.61 3.72 -1.26 -4.98 117.46 112.19 3hmy n PHE 902 Ca 0.00 0.07 -0.23 0.00 -0.05 0.00 0.00 57.45 57.24 3hmy n PHE 902 Cb 0.00 -0.50 0.02 0.00 -0.94 0.00 0.00 39.48 38.06 3hmy n PHE 902 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 3hmy n ASN 903 N -1.73 -1.53 -4.74 4.37 3.02 -1.26 -4.79 115.26 108.60 3hmy n ASN 903 Ca 0.05 -0.85 -0.41 0.00 -0.03 0.00 0.00 54.58 53.34 3hmy n ASN 903 Cb 0.37 -3.84 -0.03 0.00 -0.61 0.00 0.00 39.78 35.68 3hmy n ASN 903 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 3hmy s SER 904 N -4.21 6.91 0.33 6.41 0.01 -1.26 -4.82 113.70 117.06 3hmy s SER 904 Ca 0.10 2.44 -0.27 0.00 1.31 0.00 0.00 55.95 59.53 3hmy s SER 904 Cb -0.05 -2.62 -0.09 0.00 0.21 0.00 0.00 66.02 63.47 3hmy s SER 904 CO 0.83 -0.50 1.08 -0.94 0.41 0.00 0.00 173.24 174.12 3hmy s SER 905 N 0.10 7.07 -0.18 2.44 1.04 -1.13 -4.30 113.70 118.73 3hmy s SER 905 Ca 0.54 2.18 -0.00 0.00 0.48 0.00 0.00 55.95 59.15 3hmy s SER 905 Cb -0.37 -2.61 0.01 0.00 0.10 0.00 0.00 66.02 63.15 3hmy s SER 905 CO 0.41 -0.28 -0.16 -0.69 0.98 0.00 0.00 173.24 173.50 3hmy s VAL 906 N -1.35 2.44 -0.34 5.02 1.01 -1.26 -0.79 120.40 125.13 3hmy s VAL 906 Ca 0.50 -0.82 -0.11 0.00 0.00 0.00 0.00 61.98 61.55 3hmy s VAL 906 Cb -0.28 -2.05 -0.00 0.00 0.00 0.00 0.00 36.38 34.05 3hmy s VAL 906 CO 0.36 0.51 0.20 -0.63 0.00 0.00 0.00 175.10 175.54 3hmy s ILE 907 N 1.26 4.87 -0.28 2.22 -1.09 0.13 -4.96 121.20 123.34 3hmy s ILE 907 Ca 0.03 -0.45 -0.11 0.00 -2.23 0.00 0.00 60.65 57.90 3hmy s ILE 907 Cb -0.14 -3.55 -0.05 0.00 -1.58 0.00 0.00 42.46 37.15 3hmy s ILE 907 CO -0.09 -0.04 0.18 -0.89 -1.23 0.00 0.00 174.94 172.88 3hmy s THR 908 N 1.64 5.27 0.63 2.92 2.01 -1.26 -0.52 115.64 126.32 3hmy s THR 908 Ca 0.05 0.15 -0.10 0.00 0.31 0.00 0.00 61.69 62.10 3hmy s THR 908 Cb -0.18 -3.51 -0.02 0.00 0.01 0.00 0.00 72.50 68.81 3hmy s THR 908 CO 0.08 0.25 1.01 -0.31 -0.69 0.00 0.00 174.62 174.96 3hmy s TYR 909 N 1.75 3.48 0.26 4.92 1.51 -0.61 -4.99 117.35 123.66 3hmy s TYR 909 Ca 0.07 1.07 -0.06 0.00 -1.01 0.00 0.00 57.07 57.15 3hmy s TYR 909 Cb -0.16 -2.78 0.49 0.00 -0.11 0.00 0.00 41.96 39.40 3hmy s TYR 909 CO 0.11 -0.82 1.61 -1.00 -1.11 0.00 0.00 175.55 174.35 3hmy h PRO 910 N -0.34 0.07 -0.65 -1.71 0.13 -1.87 -2.64 132.00 124.98 3hmy h PRO 910 Ca -0.45 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 3hmy h PRO 910 Cb 1.22 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.33 3hmy h PRO 910 CO 0.62 0.05 0.00 -3.47 -0.23 0.00 0.00 178.00 174.97 3hmy n ASP 911 N -5.41 4.56 -4.66 1.44 2.03 0.74 -4.83 116.55 110.42 3hmy n ASP 911 Ca 0.15 -2.61 -0.43 0.00 0.52 0.00 0.00 54.79 52.43 3hmy n ASP 911 Cb 0.53 -0.60 -0.03 0.00 -0.72 0.00 0.00 41.12 40.30 3hmy n ASP 911 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3hmy s ALA 912 N -2.19 3.67 0.24 -1.67 0.00 -1.00 -4.39 121.76 116.42 3hmy s ALA 912 Ca 0.44 0.11 0.05 0.00 0.00 0.00 0.00 51.96 52.56 3hmy s ALA 912 Cb 0.31 -3.48 -0.03 0.00 0.00 0.00 0.00 23.12 19.92 3hmy s ALA 912 CO 0.16 -1.00 0.32 -0.65 0.00 0.00 0.00 175.76 174.58 3hmy s GLN 913 N 3.07 3.32 -0.12 0.00 -0.21 -0.17 -4.92 119.66 120.62 3hmy s GLN 913 Ca 0.42 -0.82 0.00 0.00 0.02 0.00 0.00 55.36 54.98 3hmy s GLN 913 Cb -0.15 -2.82 -0.02 0.00 1.00 0.00 0.00 33.01 31.02 3hmy s GLN 913 CO 0.07 0.43 -0.13 -0.51 -2.12 0.00 0.00 175.29 173.03 3hmy s LEU 914 N -3.90 2.75 0.27 2.90 1.43 -1.26 0.71 118.68 121.59 3hmy s LEU 914 Ca 0.34 -0.29 0.02 0.00 -1.03 0.00 0.00 54.13 53.16 3hmy s LEU 914 Cb -0.09 -1.61 -0.04 0.00 0.03 0.00 0.00 46.19 44.48 3hmy s LEU 914 CO 0.28 0.19 0.14 0.68 0.23 0.00 0.00 176.35 177.88 3hmy s VAL 915 N 0.18 0.28 0.33 -1.59 -7.23 -0.57 -4.92 120.40 106.88 3hmy s VAL 915 Ca -0.07 -2.00 -0.28 0.00 -1.81 0.00 0.00 61.98 57.81 3hmy s VAL 915 Cb -0.15 -2.54 -0.13 0.00 0.56 0.00 0.00 36.38 34.12 3hmy s VAL 915 CO 0.05 0.00 1.28 -2.65 -0.31 0.00 0.00 175.10 173.47 3hmy n PRO 916 N -0.48 2.06 -1.86 4.82 -0.02 -1.26 0.20 135.00 138.46 3hmy n PRO 916 Ca 0.01 0.72 0.00 0.00 -2.02 0.00 0.00 63.50 62.22 3hmy n PRO 916 Cb 0.65 -2.30 0.00 0.00 -0.02 0.00 0.00 33.50 31.84 3hmy n PRO 916 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hmy n GLY 917 N 0.95 4.38 0.18 -1.23 0.00 0.16 -4.34 105.19 105.28 3hmy n GLY 917 Ca 0.06 -2.20 0.04 0.00 0.00 0.00 0.00 46.02 43.92 3hmy n GLY 917 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3hmy h ILE 918 N 0.92 0.97 -0.22 -0.61 6.09 -1.87 -3.38 117.51 119.40 3hmy h ILE 918 Ca 0.00 -1.69 -0.24 0.00 -1.37 0.00 0.00 64.86 61.56 3hmy h ILE 918 Cb 0.00 2.01 -0.16 0.00 0.47 0.00 0.00 36.82 39.14 3hmy h ILE 918 CO 0.00 0.42 -0.54 -3.20 -3.07 0.00 0.00 178.15 171.76 3hmy n ASN 919 N -3.54 -2.69 0.00 2.19 5.15 -1.26 -4.80 115.26 110.31 3hmy n ASN 919 Ca -0.00 -3.24 0.00 0.00 -0.60 0.00 0.00 54.58 50.74 3hmy n ASN 919 Cb 0.55 1.63 0.00 0.00 -0.53 0.00 0.00 39.78 41.43 3hmy n ASN 919 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3hmy n GLY 920 N 1.71 0.16 3.71 8.20 0.00 -1.26 -5.05 105.19 112.66 3hmy n GLY 920 Ca 0.11 -1.51 -0.23 0.00 0.00 0.00 0.00 46.02 44.39 3hmy n GLY 920 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hmy s LYS 921 N -0.10 2.37 0.21 1.61 1.02 -1.26 -0.67 119.74 122.92 3hmy s LYS 921 Ca 0.00 -1.48 0.02 0.00 0.02 0.00 0.00 55.97 54.53 3hmy s LYS 921 Cb 0.00 -2.19 -0.05 0.00 -0.52 0.00 0.00 37.83 35.07 3hmy s LYS 921 CO 0.00 0.21 0.02 0.00 -0.92 0.00 0.00 175.35 174.66 3hmy s ALA 922 N -2.38 1.57 0.00 5.17 0.00 0.13 -4.51 121.76 121.75 3hmy s ALA 922 Ca 0.35 -1.70 -0.27 0.00 0.00 0.00 0.00 51.96 50.34 3hmy s ALA 922 Cb -0.04 0.63 -0.04 0.00 0.00 0.00 0.00 23.12 23.67 3hmy s ALA 922 CO 0.22 -0.33 0.85 0.42 0.00 0.00 0.00 175.76 176.92 3hmy s ILE 923 N -3.60 4.85 -0.17 0.00 1.01 0.24 -1.52 121.20 122.02 3hmy s ILE 923 Ca 0.28 1.78 0.01 0.00 0.00 0.00 0.00 60.65 62.72 3hmy s ILE 923 Cb 0.06 -4.19 0.01 0.00 0.01 0.00 0.00 42.46 38.35 3hmy s ILE 923 CO 0.07 0.25 -0.19 -2.28 0.00 0.00 0.00 174.94 172.79 3hmy s HIS 924 N 0.60 2.76 -0.16 3.97 2.46 0.22 -0.14 115.29 125.00 3hmy s HIS 924 Ca 0.44 -1.46 -0.02 0.00 0.47 0.00 0.00 55.06 54.49 3hmy s HIS 924 Cb -0.20 -1.90 -0.02 0.00 -0.13 0.00 0.00 32.58 30.34 3hmy s HIS 924 CO 0.24 -0.70 -0.09 -0.51 -2.47 0.00 0.00 174.74 171.21 3hmy s LEU 925 N 1.11 2.88 0.44 8.88 1.43 0.14 -1.00 118.68 132.57 3hmy s LEU 925 Ca 0.00 -0.30 0.07 0.00 -1.03 0.00 0.00 54.13 52.88 3hmy s LEU 925 Cb -0.14 -1.68 -0.01 0.00 0.03 0.00 0.00 46.19 44.39 3hmy s LEU 925 CO -0.08 0.12 0.39 0.68 0.23 0.00 0.00 176.35 177.69 3hmy s VAL 926 N 0.64 2.46 -1.28 -1.59 -7.23 -1.26 -1.54 120.40 110.60 3hmy s VAL 926 Ca -0.05 -1.37 -0.11 0.00 -1.81 0.00 0.00 61.98 58.64 3hmy s VAL 926 Cb -0.15 -2.83 0.16 0.00 0.56 0.00 0.00 36.38 34.11 3hmy s VAL 926 CO 0.03 0.00 1.82 -3.20 -0.31 0.00 0.00 175.10 173.43 3hmy n ASN 927 N -1.59 5.02 -3.68 4.85 5.15 -1.16 -4.70 115.26 119.16 3hmy n ASN 927 Ca 0.03 -3.06 -0.10 0.00 -0.60 0.00 0.00 54.58 50.84 3hmy n ASN 927 Cb 0.62 -1.51 -0.05 0.00 -0.53 0.00 0.00 39.78 38.31 3hmy n ASN 927 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 3hmy s ASN 928 N 1.46 -0.18 0.62 1.20 2.20 -1.26 -4.91 114.94 114.07 3hmy s ASN 928 Ca 0.41 -0.33 0.34 0.00 -0.94 0.00 0.00 52.86 52.34 3hmy s ASN 928 Cb 0.08 0.44 1.95 0.00 -2.00 0.00 0.00 41.25 41.72 3hmy s ASN 928 CO -0.00 -0.80 2.24 -0.33 -2.94 0.00 0.00 177.10 175.27 3hmy h GLU 929 N 2.56 0.00 -0.00 3.55 4.39 -1.95 -2.16 114.58 120.96 3hmy h GLU 929 Ca -0.34 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.36 3hmy h GLU 929 Cb 1.24 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.89 3hmy h GLU 929 CO 0.48 0.00 -0.21 0.43 -1.16 0.00 0.00 179.01 178.55 3hmy n SER 930 N -3.56 0.49 -4.33 1.42 7.64 -1.26 -4.63 113.62 109.38 3hmy n SER 930 Ca -0.02 -0.38 -0.46 0.00 1.01 0.00 0.00 58.87 59.01 3hmy n SER 930 Cb 0.15 -0.03 -0.03 0.00 -1.01 0.00 0.00 64.21 63.29 3hmy n SER 930 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 3hmy s SER 931 N -2.68 6.59 -0.06 6.43 0.15 -0.81 -0.19 113.70 123.12 3hmy s SER 931 Ca 0.22 -2.37 -0.29 0.00 0.70 0.00 0.00 55.95 54.20 3hmy s SER 931 Cb 0.19 -2.23 0.11 0.00 -1.71 0.00 0.00 66.02 62.38 3hmy s SER 931 CO 0.54 -0.70 0.89 -1.83 1.20 0.00 0.00 173.24 173.34 3hmy s GLU 932 N 0.80 0.78 -0.09 5.44 -1.05 -1.26 -4.54 118.70 118.77 3hmy s GLU 932 Ca 0.15 -0.06 0.01 0.00 -0.15 0.00 0.00 54.97 54.91 3hmy s GLU 932 Cb -0.15 0.36 0.02 0.00 -0.44 0.00 0.00 34.13 33.92 3hmy s GLU 932 CO -0.05 -0.30 -0.09 0.08 0.95 0.00 0.00 175.26 175.85 3hmy s VAL 933 N -2.12 1.06 -0.13 1.83 1.01 -0.54 -1.58 120.40 119.93 3hmy s VAL 933 Ca 0.00 -0.36 -0.01 0.00 0.00 0.00 0.00 61.98 61.61 3hmy s VAL 933 Cb -0.01 -1.03 -0.02 0.00 0.00 0.00 0.00 36.38 35.32 3hmy s VAL 933 CO -0.03 0.36 -0.10 -0.63 0.00 0.00 0.00 175.10 174.70 3hmy s ILE 934 N 1.26 3.31 -0.26 2.22 1.01 0.32 -1.13 121.20 127.93 3hmy s ILE 934 Ca -0.03 -0.57 -0.07 0.00 0.00 0.00 0.00 60.65 59.97 3hmy s ILE 934 Cb -0.14 -2.40 -0.02 0.00 0.01 0.00 0.00 42.46 39.91 3hmy s ILE 934 CO -0.03 0.52 0.06 -0.69 0.00 0.00 0.00 174.94 174.80 3hmy s VAL 935 N 0.27 4.15 -0.54 2.92 1.01 -0.21 0.19 120.40 128.19 3hmy s VAL 935 Ca -0.08 -0.32 -0.20 0.00 0.00 0.00 0.00 61.98 61.39 3hmy s VAL 935 Cb -0.15 -2.98 0.07 0.00 0.00 0.00 0.00 36.38 33.32 3hmy s VAL 935 CO 0.05 0.29 0.69 -2.28 0.00 0.00 0.00 175.10 173.84 3hmy s HIS 936 N 1.58 2.99 0.23 5.22 2.46 0.03 -0.76 115.29 127.04 3hmy s HIS 936 Ca 0.06 -0.60 -0.31 0.00 0.47 0.00 0.00 55.06 54.67 3hmy s HIS 936 Cb -0.15 -3.74 -0.13 0.00 -0.13 0.00 0.00 32.58 28.43 3hmy s HIS 936 CO 0.03 -1.16 1.46 1.63 -2.47 0.00 0.00 174.74 174.23 3hmy n LYS 937 N 6.40 2.14 -1.96 2.88 5.02 -0.80 -2.86 118.16 128.98 3hmy n LYS 937 Ca -0.06 0.76 -0.34 0.00 -2.02 0.00 0.00 58.31 56.65 3hmy n LYS 937 Cb 0.45 -2.46 0.03 0.00 -0.02 0.00 0.00 35.03 33.03 3hmy n LYS 937 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3hmy s ALA 938 N 0.10 2.58 0.48 7.82 0.00 -1.26 -4.71 121.76 126.77 3hmy s ALA 938 Ca 0.69 0.62 0.23 0.00 0.00 0.00 0.00 51.96 53.50 3hmy s ALA 938 Cb -0.63 -3.32 1.26 0.00 0.00 0.00 0.00 23.12 20.43 3hmy s ALA 938 CO 0.48 -1.04 1.91 0.52 0.00 0.00 0.00 175.76 177.62 3hmy h MET 939 N 0.47 0.20 0.00 0.00 0.00 -1.92 0.71 114.93 114.38 3hmy h MET 939 Ca -0.48 -0.01 -0.01 0.00 0.00 0.00 0.00 59.70 59.20 3hmy h MET 939 Cb 1.25 -0.04 -0.00 0.00 0.00 0.00 0.00 31.60 32.80 3hmy h MET 939 CO 0.55 0.13 -0.03 -0.44 0.00 0.00 0.00 176.91 177.12 3hmy h ASP 940 N 0.20 0.00 0.00 1.22 3.32 -1.93 -3.18 116.42 116.05 3hmy h ASP 940 Ca 0.39 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.44 3hmy h ASP 940 Cb 1.23 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.78 3hmy h ASP 940 CO -0.08 0.03 0.00 2.30 -1.72 0.00 0.00 179.24 179.77 3hmy n ILE 941 N -3.16 0.00 -0.30 0.35 -5.35 -0.40 -4.80 119.36 105.70 3hmy n ILE 941 Ca -0.00 -0.42 0.13 0.00 -0.27 0.00 0.00 62.75 62.19 3hmy n ILE 941 Cb 0.27 1.11 0.31 0.00 -1.74 0.00 0.00 39.64 39.59 3hmy n ILE 941 CO 0.00 0.00 0.00 -0.08 -1.76 0.00 0.00 176.55 174.71 3hmy h GLU 942 N 0.00 0.35 -0.78 6.28 4.81 -0.90 -1.91 114.58 122.43 3hmy h GLU 942 Ca 0.00 -0.02 -0.54 0.00 -0.13 0.00 0.00 59.36 58.67 3hmy h GLU 942 Cb 0.05 -0.08 -0.33 0.00 0.63 0.00 0.00 28.75 29.02 3hmy h GLU 942 CO 0.00 0.23 -0.11 0.66 -0.73 0.00 0.00 179.01 179.06 3hmy n TYR 943 N -5.08 2.66 0.10 0.92 0.53 -1.26 -4.72 117.16 110.31 3hmy n TYR 943 Ca 0.22 -2.40 -0.04 0.00 -1.02 0.00 0.00 57.90 54.66 3hmy n TYR 943 Cb 0.67 -0.75 0.00 0.00 -1.03 0.00 0.00 39.34 38.22 3hmy n TYR 943 CO 0.00 0.00 0.00 -0.97 -1.02 0.00 0.00 176.86 174.87 3hmy h ASN 944 N 1.92 0.00 -0.44 7.72 -0.73 -1.67 -3.30 115.58 119.07 3hmy h ASN 944 Ca 0.43 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.60 3hmy h ASN 944 Cb 1.33 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.92 3hmy h ASN 944 CO 0.99 0.82 0.00 -0.90 -0.37 0.00 0.00 177.43 177.97 3hmy n ASP 945 N -3.49 4.59 -0.01 1.15 5.75 -1.26 -4.02 116.55 119.27 3hmy n ASP 945 Ca -0.00 -2.81 -0.13 0.00 -0.01 0.00 0.00 54.79 51.84 3hmy n ASP 945 Cb 0.81 -0.57 -0.09 0.00 -1.03 0.00 0.00 41.12 40.23 3hmy n ASP 945 CO 0.00 0.00 0.00 -0.03 -0.11 0.00 0.00 177.20 177.06 3hmy h MET 946 N 2.96 0.01 0.00 0.11 4.05 -1.69 -3.40 114.93 116.96 3hmy h MET 946 Ca 0.00 -0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 3hmy h MET 946 Cb 1.57 -0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.37 3hmy h MET 946 CO 0.30 0.42 -0.64 1.19 0.23 0.00 0.00 176.91 178.41 3hmy n PHE 947 N -4.89 0.00 -2.74 1.39 3.72 -1.26 -0.94 117.46 112.74 3hmy n PHE 947 Ca -0.08 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 57.11 3hmy n PHE 947 Cb 0.22 0.00 0.03 0.00 -0.94 0.00 0.00 39.48 38.79 3hmy n PHE 947 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 3hmy s ASN 948 N -1.30 5.39 0.62 4.37 0.01 -1.26 -4.88 114.94 117.91 3hmy s ASN 948 Ca 0.00 -0.05 -0.15 0.00 -0.71 0.00 0.00 52.86 51.95 3hmy s ASN 948 Cb 0.00 -0.90 -0.02 0.00 0.41 0.00 0.00 41.25 40.74 3hmy s ASN 948 CO 0.00 -1.03 1.07 0.20 -1.51 0.00 0.00 177.10 175.83 3hmy s ASN 949 N -4.39 5.55 0.09 -1.22 0.02 -1.05 -4.64 114.94 109.29 3hmy s ASN 949 Ca 0.56 1.84 -0.26 0.00 -1.02 0.00 0.00 52.86 53.98 3hmy s ASN 949 Cb -0.10 -2.53 0.08 0.00 0.02 0.00 0.00 41.25 38.72 3hmy s ASN 949 CO 0.37 -1.32 0.73 0.72 0.02 0.00 0.00 177.10 177.62 3hmy s PHE 950 N -2.50 -0.45 -0.00 2.20 -0.71 -1.09 -3.53 117.98 111.90 3hmy s PHE 950 Ca 0.64 0.27 0.03 0.00 -1.04 0.00 0.00 56.93 56.82 3hmy s PHE 950 Cb -0.17 0.55 -0.01 0.00 -1.21 0.00 0.00 43.02 42.19 3hmy s PHE 950 CO 0.40 -0.72 -0.08 0.99 -1.34 0.00 0.00 175.22 174.47 3hmy s THR 951 N -3.46 0.66 -0.10 -4.49 2.01 -0.54 -0.80 115.64 108.92 3hmy s THR 951 Ca 0.03 -0.40 0.04 0.00 0.31 0.00 0.00 61.69 61.66 3hmy s THR 951 Cb -0.01 -0.56 -0.00 0.00 0.01 0.00 0.00 72.50 71.93 3hmy s THR 951 CO -0.11 0.15 -0.23 -0.69 -0.69 0.00 0.00 174.62 173.06 3hmy s VAL 952 N -0.26 2.19 0.04 3.82 1.01 -0.26 -0.22 120.40 126.72 3hmy s VAL 952 Ca 0.03 -0.98 0.01 0.00 0.00 0.00 0.00 61.98 61.04 3hmy s VAL 952 Cb -0.04 -1.84 -0.02 0.00 0.00 0.00 0.00 36.38 34.48 3hmy s VAL 952 CO -0.00 0.56 -0.06 -0.94 0.00 0.00 0.00 175.10 174.65 3hmy s SER 953 N 0.29 0.68 -0.26 3.32 1.04 -0.08 -0.35 113.70 118.34 3hmy s SER 953 Ca -0.16 -0.58 -0.31 0.00 0.48 0.00 0.00 55.95 55.38 3hmy s SER 953 Cb -0.17 0.06 0.17 0.00 0.10 0.00 0.00 66.02 66.19 3hmy s SER 953 CO 0.08 -0.26 1.29 0.72 0.98 0.00 0.00 173.24 176.04 3hmy s PHE 954 N -1.64 -0.10 0.23 5.02 -0.71 -0.68 -0.25 117.98 119.85 3hmy s PHE 954 Ca -0.10 0.15 -0.21 0.00 -1.04 0.00 0.00 56.93 55.73 3hmy s PHE 954 Cb -0.08 0.49 -0.08 0.00 -1.21 0.00 0.00 43.02 42.13 3hmy s PHE 954 CO -0.01 -0.10 0.76 -1.58 -1.34 0.00 0.00 175.22 172.95 3hmy s TRP 955 N -1.25 3.69 0.01 3.49 0.52 0.43 -0.50 118.94 125.35 3hmy s TRP 955 Ca 0.07 1.47 0.02 0.00 0.02 0.00 0.00 56.10 57.69 3hmy s TRP 955 Cb -0.01 -2.68 -0.01 0.00 -1.15 0.00 0.00 33.47 29.62 3hmy s TRP 955 CO -0.06 0.34 -0.08 -1.17 0.02 0.00 0.00 176.95 176.01 3hmy s LEU 956 N -1.88 2.10 -0.06 2.99 2.96 0.11 -1.34 118.68 123.56 3hmy s LEU 956 Ca 0.43 -0.28 -0.02 0.00 -0.22 0.00 0.00 54.13 54.03 3hmy s LEU 956 Cb -0.18 -0.31 0.03 0.00 0.50 0.00 0.00 46.19 46.24 3hmy s LEU 956 CO 0.22 -0.01 0.06 -0.60 -1.32 0.00 0.00 176.35 174.71 3hmy s ARG 957 N -0.68 -0.06 -0.06 1.98 3.52 -0.26 -1.20 118.95 122.19 3hmy s ARG 957 Ca -0.01 0.31 0.04 0.00 -0.13 0.00 0.00 55.73 55.94 3hmy s ARG 957 Cb -0.05 -0.72 -0.00 0.00 -1.56 0.00 0.00 34.95 32.62 3hmy s ARG 957 CO 0.00 -0.38 -0.19 0.08 -0.81 0.00 0.00 175.30 174.00 3hmy s VAL 958 N 2.17 1.63 0.70 7.11 1.01 -1.26 -1.15 120.40 130.59 3hmy s VAL 958 Ca 0.05 -0.80 -0.16 0.00 0.00 0.00 0.00 61.98 61.06 3hmy s VAL 958 Cb -0.13 -1.41 0.02 0.00 0.00 0.00 0.00 36.38 34.87 3hmy s VAL 958 CO -0.04 0.46 1.21 -2.16 0.00 0.00 0.00 175.10 174.57 3hmy s PRO 959 N 0.18 2.35 0.05 2.72 0.04 -1.26 0.91 135.00 139.99 3hmy s PRO 959 Ca -0.09 1.78 -0.31 0.00 0.04 0.00 0.00 61.00 62.42 3hmy s PRO 959 Cb -0.14 -1.86 -0.07 0.00 0.04 0.00 0.00 34.50 32.47 3hmy s PRO 959 CO 0.04 -1.68 1.50 0.21 0.04 0.00 0.00 177.00 177.12 3hmy s LYS 960 N -3.78 4.25 -0.08 4.56 2.20 0.45 -4.47 119.74 122.87 3hmy s LYS 960 Ca 0.75 2.14 -0.30 0.00 -0.36 0.00 0.00 55.97 58.20 3hmy s LYS 960 Cb -0.30 -3.51 -0.03 0.00 -1.51 0.00 0.00 37.83 32.49 3hmy s LYS 960 CO 0.43 -0.61 1.19 0.08 -0.36 0.00 0.00 175.35 176.07 3hmy s VAL 961 N 2.21 4.31 0.85 4.02 1.01 -1.26 -4.79 120.40 126.75 3hmy s VAL 961 Ca 0.68 1.63 -0.11 0.00 0.00 0.00 0.00 61.98 64.18 3hmy s VAL 961 Cb -0.36 -4.05 0.11 0.00 0.00 0.00 0.00 36.38 32.08 3hmy s VAL 961 CO 0.29 -0.02 1.13 -0.94 0.00 0.00 0.00 175.10 175.57 3hmy s SER 962 N 1.50 3.58 0.22 3.32 1.04 -1.26 -4.80 113.70 117.30 3hmy s SER 962 Ca 0.55 2.08 -0.08 0.00 0.48 0.00 0.00 55.95 58.98 3hmy s SER 962 Cb -0.23 -2.55 0.22 0.00 0.10 0.00 0.00 66.02 63.55 3hmy s SER 962 CO 0.20 -2.66 1.88 0.00 0.98 0.00 0.00 173.24 173.64 3hmy h ALA 963 N -1.46 1.06 -0.28 5.32 0.00 -1.95 -1.17 119.26 120.79 3hmy h ALA 963 Ca -0.44 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.43 3hmy h ALA 963 Cb 1.26 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 3hmy h ALA 963 CO 0.46 0.40 0.17 0.77 0.00 0.00 0.00 179.25 181.05 3hmy h SER 964 N 1.07 0.32 0.64 0.00 0.02 -2.00 -2.45 113.55 111.15 3hmy h SER 964 Ca 0.32 -0.03 -0.05 0.00 -0.84 0.00 0.00 61.79 61.19 3hmy h SER 964 Cb -0.06 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.39 3hmy h SER 964 CO -0.09 0.26 -0.22 0.45 -1.14 0.00 0.00 176.83 176.09 3hmy h HIS 965 N 0.36 0.00 -0.28 3.45 -0.00 -1.82 -0.43 115.15 116.43 3hmy h HIS 965 Ca 0.10 0.00 -0.18 0.00 -0.00 0.00 0.00 60.37 60.29 3hmy h HIS 965 Cb -0.01 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 27.39 3hmy h HIS 965 CO -0.05 0.22 -0.52 -0.07 -0.00 0.00 0.00 177.93 177.50 3hmy h LEU 966 N 0.00 0.89 -0.18 2.43 3.38 -0.86 0.31 115.31 121.27 3hmy h LEU 966 Ca -0.00 -0.46 -0.15 0.00 0.09 0.00 0.00 57.88 57.36 3hmy h LEU 966 Cb 0.60 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.10 3hmy h LEU 966 CO 0.03 1.24 -0.45 -0.33 0.09 0.00 0.00 178.44 179.02 3hmy h GLU 967 N 0.62 0.63 -0.02 1.13 5.08 -1.12 0.68 114.58 121.59 3hmy h GLU 967 Ca 0.02 -0.43 -0.19 0.00 -1.00 0.00 0.00 59.36 57.75 3hmy h GLU 967 Cb 1.11 0.06 0.01 0.00 0.50 0.00 0.00 28.75 30.44 3hmy h GLU 967 CO 0.11 1.05 -0.74 0.37 -1.00 0.00 0.00 179.01 178.81 3hmy h GLN 968 N 0.31 0.53 -0.06 2.33 4.15 -1.07 -3.38 115.11 117.91 3hmy h GLN 968 Ca -0.00 -0.55 0.00 0.00 0.77 0.00 0.00 58.65 58.87 3hmy h GLN 968 Cb 1.07 0.15 0.00 0.00 0.21 0.00 0.00 27.48 28.91 3hmy h GLN 968 CO 0.10 1.18 0.00 0.66 -1.93 0.00 0.00 178.83 178.84 3hmy n TYR 969 N -4.10 0.08 -0.16 3.99 4.01 0.11 -4.77 117.16 116.33 3hmy n TYR 969 Ca -0.10 -0.37 0.28 0.00 -0.16 0.00 0.00 57.90 57.55 3hmy n TYR 969 Cb 0.74 -0.03 0.72 0.00 -0.31 0.00 0.00 39.34 40.45 3hmy n TYR 969 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 3hmy h GLY 970 N 0.51 0.00 -2.11 2.72 0.00 -0.79 -0.39 103.07 103.02 3hmy h GLY 970 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3hmy h GLY 970 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 176.54 175.24 3hmy n THR 971 N -4.09 0.30 -2.88 4.70 -2.24 -1.26 -3.46 114.28 105.34 3hmy n THR 971 Ca 0.18 -0.64 -0.43 0.00 -2.27 0.00 0.00 64.05 60.89 3hmy n THR 971 Cb 0.98 1.16 -0.05 0.00 -2.10 0.00 0.00 70.33 70.32 3hmy n THR 971 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3hmy s ASN 972 N -1.70 6.37 -0.17 3.42 2.47 -0.15 -5.00 114.94 120.17 3hmy s ASN 972 Ca 0.35 -0.27 -0.19 0.00 0.42 0.00 0.00 52.86 53.17 3hmy s ASN 972 Cb 0.22 -2.42 -0.03 0.00 -1.45 0.00 0.00 41.25 37.57 3hmy s ASN 972 CO 0.31 -1.11 0.53 -0.70 -3.72 0.00 0.00 177.10 172.41 3hmy s GLU 973 N 3.69 4.24 -0.01 0.43 2.12 -1.26 -4.33 118.70 123.58 3hmy s GLU 973 Ca 0.30 0.47 0.03 0.00 0.36 0.00 0.00 54.97 56.13 3hmy s GLU 973 Cb -0.13 -3.53 -0.01 0.00 0.26 0.00 0.00 34.13 30.73 3hmy s GLU 973 CO 0.21 -0.08 -0.09 1.52 -0.54 0.00 0.00 175.26 176.28 3hmy s TYR 974 N 1.40 0.82 0.46 5.30 1.13 -0.19 -4.80 117.35 121.48 3hmy s TYR 974 Ca 0.26 -0.16 -0.13 0.00 -1.41 0.00 0.00 57.07 55.63 3hmy s TYR 974 Cb -0.15 -0.53 -0.07 0.00 -1.10 0.00 0.00 41.96 40.10 3hmy s TYR 974 CO 0.10 -0.02 0.87 -1.12 -2.51 0.00 0.00 175.55 172.87 3hmy s SER 975 N -0.19 6.53 0.00 -0.18 0.01 -1.04 -0.54 113.70 118.29 3hmy s SER 975 Ca 0.03 1.31 0.00 0.00 1.31 0.00 0.00 55.95 58.60 3hmy s SER 975 Cb -0.04 -2.40 0.00 0.00 0.21 0.00 0.00 66.02 63.79 3hmy s SER 975 CO -0.00 -0.51 0.00 2.30 0.41 0.00 0.00 173.24 175.44 3hmy n ILE 976 N -1.54 0.00 -3.76 1.44 -5.35 -0.42 -1.16 119.36 108.58 3hmy n ILE 976 Ca 0.04 0.00 -0.16 0.00 -0.27 0.00 0.00 62.75 62.37 3hmy n ILE 976 Cb 0.54 -0.41 -0.16 0.00 -1.74 0.00 0.00 39.64 37.86 3hmy n ILE 976 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 3hmy s ILE 977 N -1.63 -0.07 0.05 7.28 1.01 -1.17 -0.68 121.20 125.99 3hmy s ILE 977 Ca 0.00 0.25 -0.23 0.00 0.00 0.00 0.00 60.65 60.67 3hmy s ILE 977 Cb 0.00 -0.09 0.06 0.00 0.01 0.00 0.00 42.46 42.43 3hmy s ILE 977 CO 0.00 0.10 0.54 -0.55 0.00 0.00 0.00 174.94 175.03 3hmy s SER 978 N 1.22 -0.47 0.00 3.58 0.15 -0.57 -0.41 113.70 117.20 3hmy s SER 978 Ca -0.07 0.19 0.01 0.00 0.70 0.00 0.00 55.95 56.78 3hmy s SER 978 Cb -0.13 0.51 0.03 0.00 -1.71 0.00 0.00 66.02 64.72 3hmy s SER 978 CO -0.03 -0.74 0.94 -1.54 1.20 0.00 0.00 173.24 173.06 3hmy n SER 979 N 0.34 1.92 -4.74 5.45 3.41 -0.20 -0.27 113.62 119.54 3hmy n SER 979 Ca -0.18 -1.81 -0.39 0.00 -0.26 0.00 0.00 58.87 56.22 3hmy n SER 979 Cb 0.61 -0.02 -0.05 0.00 -0.26 0.00 0.00 64.21 64.48 3hmy n SER 979 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 3hmy s MET 980 N -0.83 4.37 0.00 4.33 -1.94 -1.25 0.64 119.30 124.62 3hmy s MET 980 Ca 0.03 0.77 0.00 0.00 -1.71 0.00 0.00 55.69 54.78 3hmy s MET 980 Cb 0.01 -3.38 0.00 0.00 2.01 0.00 0.00 34.83 33.47 3hmy s MET 980 CO 0.02 0.26 0.00 1.17 -0.01 0.00 0.00 175.02 176.46 3hmy n LYS 981 N 3.12 0.00 0.20 2.03 3.00 -1.26 -4.86 118.16 120.38 3hmy n LYS 981 Ca -0.05 0.00 0.09 0.00 -0.00 0.00 0.00 58.31 58.35 3hmy n LYS 981 Cb 0.51 0.00 0.14 0.00 0.00 0.00 0.00 35.03 35.68 3hmy n LYS 981 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.40 178.43 3hmy h SER 986 N 0.00 0.00 1.40 3.14 0.87 -2.01 -3.34 113.55 113.62 3hmy h SER 986 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 3hmy h SER 986 Cb 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 3hmy h SER 986 CO 0.00 0.16 -0.27 -0.29 -0.53 0.00 0.00 176.83 175.90 3hmy h ILE 987 N 0.00 0.00 -4.60 2.23 2.10 -1.99 -3.48 117.51 111.76 3hmy h ILE 987 Ca -0.00 -0.67 -0.21 0.00 1.08 0.00 0.00 64.86 65.05 3hmy h ILE 987 Cb 1.11 1.51 0.13 0.00 -1.09 0.00 0.00 36.82 38.48 3hmy h ILE 987 CO 0.02 0.00 -0.56 0.61 -1.08 0.00 0.00 178.15 177.14 3hmy n GLY 988 N 1.25 -0.25 3.81 8.18 0.00 -1.25 -4.98 105.19 111.95 3hmy n GLY 988 Ca 0.04 0.05 -0.33 0.00 0.00 0.00 0.00 46.02 45.78 3hmy n GLY 988 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3hmy s SER 989 N -3.74 6.11 0.00 1.61 0.15 -1.26 -4.70 113.70 111.87 3hmy s SER 989 Ca 0.10 1.75 0.00 0.00 0.70 0.00 0.00 55.95 58.50 3hmy s SER 989 Cb -0.01 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.77 3hmy s SER 989 CO 0.51 -0.94 0.00 0.61 1.20 0.00 0.00 173.24 174.62 3hmy n GLY 990 N -1.07 0.65 3.25 9.45 0.00 0.47 -3.87 105.19 114.07 3hmy n GLY 990 Ca 0.08 -1.84 -0.14 0.00 0.00 0.00 0.00 46.02 44.12 3hmy n GLY 990 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 3hmy s TRP 991 N -2.41 1.26 -0.02 1.61 1.48 -1.26 -0.39 118.94 119.22 3hmy s TRP 991 Ca 0.00 -0.80 -0.23 0.00 -1.06 0.00 0.00 56.10 54.02 3hmy s TRP 991 Cb 0.00 -0.66 0.05 0.00 -1.16 0.00 0.00 33.47 31.69 3hmy s TRP 991 CO 0.00 0.04 0.49 -1.54 -4.06 0.00 0.00 176.95 171.88 3hmy s SER 992 N -3.17 -0.42 -0.20 -2.66 1.04 -0.46 -1.03 113.70 106.81 3hmy s SER 992 Ca 0.18 0.35 -0.03 0.00 0.48 0.00 0.00 55.95 56.93 3hmy s SER 992 Cb 0.03 0.44 -0.01 0.00 0.10 0.00 0.00 66.02 66.58 3hmy s SER 992 CO 0.01 -0.56 -0.08 -0.69 0.98 0.00 0.00 173.24 172.90 3hmy s VAL 993 N -1.50 3.19 0.22 5.02 1.01 0.45 -1.13 120.40 127.66 3hmy s VAL 993 Ca -0.11 -0.57 0.01 0.00 0.00 0.00 0.00 61.98 61.31 3hmy s VAL 993 Cb -0.02 -2.42 -0.05 0.00 0.00 0.00 0.00 36.38 33.89 3hmy s VAL 993 CO 0.05 0.46 0.08 -0.94 0.00 0.00 0.00 175.10 174.75 3hmy s SER 994 N 1.19 1.02 0.01 3.32 1.04 0.30 -1.30 113.70 119.28 3hmy s SER 994 Ca 0.02 -1.33 0.04 0.00 0.48 0.00 0.00 55.95 55.16 3hmy s SER 994 Cb -0.14 0.19 -0.01 0.00 0.10 0.00 0.00 66.02 66.15 3hmy s SER 994 CO -0.02 -0.71 -0.12 -0.76 0.98 0.00 0.00 173.24 172.61 3hmy s LEU 995 N -3.25 2.08 -0.27 2.42 1.43 0.30 -0.33 118.68 121.07 3hmy s LEU 995 Ca 0.34 -0.30 -0.03 0.00 -1.03 0.00 0.00 54.13 53.11 3hmy s LEU 995 Cb 0.07 -0.56 0.10 0.00 0.03 0.00 0.00 46.19 45.84 3hmy s LEU 995 CO 0.11 0.09 0.18 -0.75 0.23 0.00 0.00 176.35 176.20 3hmy s LYS 996 N -0.62 0.21 7.72 1.70 2.20 -0.63 -1.02 119.74 129.31 3hmy s LYS 996 Ca 0.03 -0.31 0.00 0.00 -0.36 0.00 0.00 55.97 55.33 3hmy s LYS 996 Cb -0.06 -1.10 0.00 0.00 -1.51 0.00 0.00 37.83 35.16 3hmy s LYS 996 CO 0.00 -0.95 0.00 0.41 -0.36 0.00 0.00 175.35 174.45 3hmy n GLY 997 N 5.28 3.26 2.14 5.54 0.00 -1.22 -1.36 105.19 118.82 3hmy n GLY 997 Ca -0.05 -0.14 -0.25 0.00 0.00 0.00 0.00 46.02 45.58 3hmy n GLY 997 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3hmy n ASN 998 N 6.75 4.74 -4.42 1.61 5.03 -1.26 -4.92 115.26 122.79 3hmy n ASN 998 Ca 0.00 -3.68 -0.33 0.00 0.87 0.00 0.00 54.58 51.44 3hmy n ASN 998 Cb 0.00 -0.84 -0.14 0.00 -1.02 0.00 0.00 39.78 37.78 3hmy n ASN 998 CO 0.00 0.00 0.00 0.20 -1.83 0.00 0.00 177.26 175.63 3hmy s ASN 999 N -1.64 4.02 -0.20 6.41 0.01 -0.47 -1.70 114.94 121.37 3hmy s ASN 999 Ca 0.58 -0.27 -0.07 0.00 -0.71 0.00 0.00 52.86 52.40 3hmy s ASN 999 Cb 0.48 -1.26 -0.03 0.00 0.41 0.00 0.00 41.25 40.84 3hmy s ASN 999 CO 0.06 0.25 0.04 -0.22 -1.51 0.00 0.00 177.10 175.72 3hmy s LEU 1000N -0.15 3.56 -0.07 0.60 2.96 -0.42 -1.60 118.68 123.56 3hmy s LEU 1000Ca -0.01 -0.06 0.04 0.00 -0.22 0.00 0.00 54.13 53.88 3hmy s LEU 1000Cb -0.13 -1.91 0.00 0.00 0.50 0.00 0.00 46.19 44.65 3hmy s LEU 1000CO 0.03 0.10 -0.19 -0.63 -1.32 0.00 0.00 176.35 174.35 3hmy s ILE 1001N 0.79 1.61 -0.17 6.68 1.01 0.55 -1.06 121.20 130.61 3hmy s ILE 1001Ca 0.02 -0.78 -0.04 0.00 0.00 0.00 0.00 60.65 59.86 3hmy s ILE 1001Cb -0.14 -1.41 -0.03 0.00 0.01 0.00 0.00 42.46 40.90 3hmy s ILE 1001CO 0.02 0.46 -0.03 0.86 0.00 0.00 0.00 174.94 176.25 3hmy s TRP 1002N 0.34 3.03 -0.02 3.97 -0.11 -0.66 -0.54 118.94 124.94 3hmy s TRP 1002Ca -0.13 -0.36 0.04 0.00 1.22 0.00 0.00 56.10 56.87 3hmy s TRP 1002Cb -0.15 -1.99 -0.00 0.00 -1.50 0.00 0.00 33.47 29.82 3hmy s TRP 1002CO 0.05 -0.10 -0.13 0.99 -4.62 0.00 0.00 176.95 173.14 3hmy s THR 1003N 0.55 1.05 -0.06 5.86 2.01 -0.29 -1.53 115.64 123.23 3hmy s THR 1003Ca -0.02 -0.53 0.04 0.00 0.31 0.00 0.00 61.69 61.48 3hmy s THR 1003Cb -0.14 -0.90 -0.00 0.00 0.01 0.00 0.00 72.50 71.47 3hmy s THR 1003CO 0.02 0.31 -0.19 -0.76 -0.69 0.00 0.00 174.62 173.31 3hmy s LEU 1004N -0.07 1.93 -0.06 4.42 1.43 -0.48 -1.35 118.68 124.50 3hmy s LEU 1004Ca 0.00 -0.42 -0.00 0.00 -1.03 0.00 0.00 54.13 52.68 3hmy s LEU 1004Cb -0.08 -1.12 0.03 0.00 0.03 0.00 0.00 46.19 45.05 3hmy s LEU 1004CO 0.00 0.15 -0.02 -0.75 0.23 0.00 0.00 176.35 175.97 3hmy s LYS 1005N 0.18 0.72 0.80 1.70 2.20 0.48 -1.72 119.74 124.10 3hmy s LYS 1005Ca -0.09 0.01 -0.05 0.00 -0.36 0.00 0.00 55.97 55.48 3hmy s LYS 1005Cb -0.14 -0.93 0.16 0.00 -1.51 0.00 0.00 37.83 35.40 3hmy s LYS 1005CO 0.04 -0.22 1.10 0.16 -0.36 0.00 0.00 175.35 176.08 3hmy s ASP 1006N 1.55 3.91 0.41 1.43 1.47 -0.60 -0.40 116.67 124.44 3hmy s ASP 1006Ca -0.01 -0.23 0.28 0.00 1.18 0.00 0.00 52.55 53.76 3hmy s ASP 1006Cb -0.13 -0.01 1.47 0.00 -0.34 0.00 0.00 42.92 43.92 3hmy s ASP 1006CO -0.03 -2.17 1.85 0.77 0.68 0.00 0.00 175.17 176.26 3hmy h SER 1007N -0.89 0.00 0.00 2.11 4.64 -1.09 -1.12 113.55 117.20 3hmy h SER 1007Ca -0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 3hmy h SER 1007Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 3hmy h SER 1007CO 0.38 0.00 -0.06 0.00 -0.87 0.00 0.00 176.83 176.28 3hmy n ALA 1008N -1.86 2.65 -0.53 5.18 0.00 -1.26 -4.91 120.51 119.77 3hmy n ALA 1008Ca -0.01 -0.55 0.00 0.00 0.00 0.00 0.00 53.44 52.88 3hmy n ALA 1008Cb 0.07 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.52 3hmy n ALA 1008CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hmy n GLY 1009N 1.27 0.76 3.75 0.00 0.00 -0.42 -5.03 105.19 105.52 3hmy n GLY 1009Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 3hmy n GLY 1009CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3hmy s GLU 1010N -0.47 4.38 0.09 1.61 2.56 -1.26 -4.81 118.70 120.80 3hmy s GLU 1010Ca 0.00 2.12 0.08 0.00 0.00 0.00 0.00 54.97 57.17 3hmy s GLU 1010Cb 0.00 -3.15 -0.03 0.00 2.00 0.00 0.00 34.13 32.95 3hmy s GLU 1010CO 0.00 -0.23 -0.20 0.08 -0.56 0.00 0.00 175.26 174.35 3hmy s VAL 1011N -0.34 1.66 -0.01 3.70 1.01 -1.26 -1.56 120.40 123.61 3hmy s VAL 1011Ca 0.54 -1.45 0.01 0.00 0.00 0.00 0.00 61.98 61.08 3hmy s VAL 1011Cb -0.38 -1.50 0.01 0.00 0.00 0.00 0.00 36.38 34.51 3hmy s VAL 1011CO 0.43 -0.01 -0.02 -0.13 0.00 0.00 0.00 175.10 175.37 3hmy s ARG 1012N -1.73 0.27 0.04 2.72 1.81 -0.70 -5.01 118.95 116.35 3hmy s ARG 1012Ca 0.06 -0.06 -0.01 0.00 -1.72 0.00 0.00 55.73 54.00 3hmy s ARG 1012Cb -0.10 -0.31 -0.03 0.00 -0.45 0.00 0.00 34.95 34.06 3hmy s ARG 1012CO 0.04 0.01 -0.01 -0.65 -0.68 0.00 0.00 175.30 174.00 3hmy s GLN 1013N 0.22 0.51 -0.15 3.54 -0.21 -1.26 -1.39 119.66 120.92 3hmy s GLN 1013Ca -0.02 -0.97 0.00 0.00 0.02 0.00 0.00 55.36 54.39 3hmy s GLN 1013Cb -0.05 0.18 0.03 0.00 1.00 0.00 0.00 33.01 34.17 3hmy s GLN 1013CO -0.01 -0.10 -0.11 0.42 -2.12 0.00 0.00 175.29 173.37 3hmy s ILE 1014N -2.99 1.43 -0.27 1.08 1.01 -0.58 -4.73 121.20 116.15 3hmy s ILE 1014Ca -0.02 -0.62 -0.04 0.00 0.00 0.00 0.00 60.65 59.97 3hmy s ILE 1014Cb 0.01 -1.41 0.01 0.00 0.01 0.00 0.00 42.46 41.09 3hmy s ILE 1014CO -0.07 0.37 0.01 -0.89 0.00 0.00 0.00 174.94 174.36 3hmy s THR 1015N 1.53 3.43 -0.29 2.92 2.01 -1.26 -1.65 115.64 122.32 3hmy s THR 1015Ca 0.04 -0.82 -0.10 0.00 0.31 0.00 0.00 61.69 61.12 3hmy s THR 1015Cb -0.13 -2.73 -0.03 0.00 0.01 0.00 0.00 72.50 69.61 3hmy s THR 1015CO -0.10 0.17 0.16 0.12 -0.69 0.00 0.00 174.62 174.28 3hmy s PHE 1016N 1.42 3.18 -0.28 4.92 5.36 -0.23 -4.97 117.98 127.38 3hmy s PHE 1016Ca 0.02 -0.26 -0.18 0.00 -0.96 0.00 0.00 56.93 55.54 3hmy s PHE 1016Cb -0.17 -2.35 -0.02 0.00 -0.34 0.00 0.00 43.02 40.14 3hmy s PHE 1016CO -0.01 -0.32 0.54 1.03 -1.46 0.00 0.00 175.22 174.99 3hmy s ARG 1017N 1.68 3.99 0.71 10.12 3.00 -1.26 -1.31 118.95 135.88 3hmy s ARG 1017Ca 0.06 0.26 -0.14 0.00 0.00 0.00 0.00 55.73 55.91 3hmy s ARG 1017Cb -0.16 -3.68 0.03 0.00 0.00 0.00 0.00 34.95 31.13 3hmy s ARG 1017CO 0.08 -0.43 1.15 0.34 0.00 0.00 0.00 175.30 176.44 3hmy s ASP 1018N 1.59 4.56 0.53 0.23 2.15 -0.69 -4.96 116.67 120.08 3hmy s ASP 1018Ca 0.22 2.13 -0.22 0.00 0.43 0.00 0.00 52.55 55.11 3hmy s ASP 1018Cb -0.15 -2.56 -0.06 0.00 -0.30 0.00 0.00 42.92 39.84 3hmy s ASP 1018CO 0.10 -2.00 1.26 0.18 -0.17 0.00 0.00 175.17 174.54 3hmy n LEU 1019N -2.75 4.84 -0.02 -1.34 4.77 -1.26 -4.92 117.00 116.31 3hmy n LEU 1019Ca 0.11 0.97 -0.04 0.00 -0.03 0.00 0.00 56.01 57.03 3hmy n LEU 1019Cb 0.51 -1.52 0.19 0.00 -2.33 0.00 0.00 43.42 40.27 3hmy n LEU 1019CO 0.48 -0.86 0.77 -0.65 -1.33 0.00 0.00 177.39 175.81 3hmy h PRO 1020N 1.37 0.59 -6.25 3.23 0.11 -1.93 -3.40 132.00 125.71 3hmy h PRO 1020Ca -0.50 -0.20 -0.53 0.00 0.11 0.00 0.00 66.00 64.88 3hmy h PRO 1020Cb 1.31 -0.05 -0.07 0.00 0.11 0.00 0.00 31.00 32.31 3hmy h PRO 1020CO 0.56 0.74 1.15 0.34 -0.21 0.00 0.00 178.00 180.58 3hmy s ASP 1021N -6.77 6.00 0.46 -2.05 -1.08 -1.25 -1.88 116.67 110.11 3hmy s ASP 1021Ca -0.08 -0.40 0.32 0.00 -0.52 0.00 0.00 52.55 51.87 3hmy s ASP 1021Cb 0.14 -2.56 1.57 0.00 -1.46 0.00 0.00 42.92 40.61 3hmy s ASP 1021CO 0.80 -1.93 1.96 0.11 0.52 0.00 0.00 175.17 176.63 3hmy h LYS 1022N 10.95 0.00 -0.01 4.34 1.79 -1.44 -1.00 116.57 131.20 3hmy h LYS 1022Ca -0.23 0.00 -0.09 0.00 -2.18 0.00 0.00 60.65 58.15 3hmy h LYS 1022Cb 1.07 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.70 3hmy h LYS 1022CO 1.28 0.00 -0.44 0.35 -1.08 0.00 0.00 179.45 179.56 3hmy h PHE 1023N 0.00 0.04 -0.05 -1.35 3.57 -1.90 -3.16 116.94 114.09 3hmy h PHE 1023Ca 0.00 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.49 3hmy h PHE 1023Cb 0.18 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 38.91 3hmy h PHE 1023CO 0.00 0.46 0.00 0.09 -2.23 0.00 0.00 178.31 176.63 3hmy n ASN 1024N -4.02 2.04 -4.78 0.41 3.02 -0.53 -5.04 115.26 106.37 3hmy n ASN 1024Ca -0.02 -1.52 -0.31 0.00 -0.03 0.00 0.00 54.58 52.70 3hmy n ASN 1024Cb 0.47 -0.02 0.08 0.00 -0.61 0.00 0.00 39.78 39.70 3hmy n ASN 1024CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3hmy s ALA 1025N -0.95 2.34 -0.16 5.41 0.00 -0.49 -4.95 121.76 122.96 3hmy s ALA 1025Ca 0.14 0.21 0.20 0.00 0.00 0.00 0.00 51.96 52.51 3hmy s ALA 1025Cb 0.10 -3.24 -0.10 0.00 0.00 0.00 0.00 23.12 19.87 3hmy s ALA 1025CO 0.14 -1.65 0.85 0.66 0.00 0.00 0.00 175.76 175.77 3hmy n TYR 1026N -3.43 0.84 -2.13 0.00 4.01 -1.26 -4.15 117.16 111.03 3hmy n TYR 1026Ca 0.09 0.26 -0.32 0.00 -0.16 0.00 0.00 57.90 57.76 3hmy n TYR 1026Cb 0.53 -0.97 0.02 0.00 -0.31 0.00 0.00 39.34 38.61 3hmy n TYR 1026CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 3hmy n LEU 1027N -2.73 6.07 -2.79 7.72 4.77 -1.26 -4.68 117.00 124.10 3hmy n LEU 1027Ca -0.06 -4.96 -0.16 0.00 -0.03 0.00 0.00 56.01 50.80 3hmy n LEU 1027Cb 0.70 -0.73 0.00 0.00 -2.33 0.00 0.00 43.42 41.07 3hmy n LEU 1027CO 0.42 1.98 -0.07 0.00 -1.33 0.00 0.00 177.39 178.39 3hmy n ALA 1028N -0.56 3.44 -0.99 -1.18 0.00 -1.24 -4.40 120.51 115.59 3hmy n ALA 1028Ca 0.47 -3.53 0.00 0.00 0.00 0.00 0.00 53.44 50.39 3hmy n ALA 1028Cb 0.52 -0.85 0.00 0.00 0.00 0.00 0.00 19.45 19.11 3hmy n ALA 1028CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3hmy n ASN 1029N -0.06 -0.99 -4.81 0.00 4.05 0.26 -4.55 115.26 109.17 3hmy n ASN 1029Ca 0.20 0.00 -0.31 0.00 0.45 0.00 0.00 54.58 54.92 3hmy n ASN 1029Cb 0.72 -0.24 -0.06 0.00 1.23 0.00 0.00 39.78 41.43 3hmy n ASN 1029CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 177.26 173.67 3hmy s LYS 1030N -0.04 3.00 0.08 1.20 1.02 -1.26 -4.76 119.74 118.97 3hmy s LYS 1030Ca 0.00 -0.64 -0.31 0.00 0.02 0.00 0.00 55.97 55.04 3hmy s LYS 1030Cb 0.00 -2.79 -0.07 0.00 -0.52 0.00 0.00 37.83 34.45 3hmy s LYS 1030CO 0.00 0.57 1.37 -1.58 -0.92 0.00 0.00 175.35 174.80 3hmy s TRP 1031N -1.42 3.14 0.08 3.18 0.52 0.04 -4.51 118.94 119.98 3hmy s TRP 1031Ca 0.30 0.95 0.03 0.00 0.02 0.00 0.00 56.10 57.40 3hmy s TRP 1031Cb -0.12 -3.65 -0.03 0.00 -1.15 0.00 0.00 33.47 28.52 3hmy s TRP 1031CO 0.23 -2.29 -0.10 0.14 0.02 0.00 0.00 176.95 174.96 3hmy s VAL 1032N 1.49 0.81 -0.31 4.03 -7.23 -0.34 -4.91 120.40 113.93 3hmy s VAL 1032Ca 0.64 -1.45 -0.12 0.00 -1.81 0.00 0.00 61.98 59.24 3hmy s VAL 1032Cb -0.34 -1.12 -0.03 0.00 0.56 0.00 0.00 36.38 35.44 3hmy s VAL 1032CO 0.29 -0.49 0.21 0.12 -0.31 0.00 0.00 175.10 174.92 3hmy s PHE 1033N -2.09 3.22 -0.09 2.82 5.36 -1.26 0.05 117.98 126.00 3hmy s PHE 1033Ca 0.00 -0.09 -0.09 0.00 -0.96 0.00 0.00 56.93 55.79 3hmy s PHE 1033Cb -0.05 -2.43 -0.05 0.00 -0.34 0.00 0.00 43.02 40.15 3hmy s PHE 1033CO -0.00 -0.28 0.22 0.42 -1.46 0.00 0.00 175.22 174.12 3hmy s ILE 1034N 1.73 5.37 -0.11 3.12 -1.09 0.35 -0.12 121.20 130.45 3hmy s ILE 1034Ca 0.06 0.40 -0.04 0.00 -2.23 0.00 0.00 60.65 58.84 3hmy s ILE 1034Cb -0.17 -3.50 0.05 0.00 -1.58 0.00 0.00 42.46 37.27 3hmy s ILE 1034CO 0.10 0.60 0.22 -0.89 -1.23 0.00 0.00 174.94 173.74 3hmy s THR 1035N -1.00 -0.28 -0.24 2.92 2.01 -0.24 -1.68 115.64 117.13 3hmy s THR 1035Ca 0.17 0.28 0.01 0.00 0.31 0.00 0.00 61.69 62.46 3hmy s THR 1035Cb -0.13 -0.37 0.06 0.00 0.01 0.00 0.00 72.50 72.07 3hmy s THR 1035CO 0.07 0.12 -0.06 -0.63 -0.69 0.00 0.00 174.62 173.43 3hmy s ILE 1036N 2.09 1.62 0.14 1.82 1.01 0.53 0.65 121.20 129.06 3hmy s ILE 1036Ca -0.01 -1.30 -0.06 0.00 0.00 0.00 0.00 60.65 59.28 3hmy s ILE 1036Cb -0.12 -1.87 -0.06 0.00 0.01 0.00 0.00 42.46 40.42 3hmy s ILE 1036CO -0.07 -0.11 0.40 0.42 0.00 0.00 0.00 174.94 175.57 3hmy s THR 1037N 1.35 5.13 -0.21 2.92 -4.23 -0.41 -1.10 115.64 119.09 3hmy s THR 1037Ca -0.06 0.17 -0.02 0.00 -1.18 0.00 0.00 61.69 60.60 3hmy s THR 1037Cb -0.19 -3.62 0.06 0.00 1.34 0.00 0.00 72.50 70.09 3hmy s THR 1037CO -0.06 0.08 0.04 0.20 -0.54 0.00 0.00 174.62 174.34 3hmy s ASN 1038N -2.28 3.07 -0.41 3.99 0.01 0.02 -1.17 114.94 118.18 3hmy s ASN 1038Ca 0.40 -0.92 -0.10 0.00 -0.71 0.00 0.00 52.86 51.52 3hmy s ASN 1038Cb -0.12 -0.64 0.06 0.00 0.41 0.00 0.00 41.25 40.96 3hmy s ASN 1038CO 0.23 -0.31 0.26 -0.62 -1.51 0.00 0.00 177.10 175.14 3hmy s ASP 1039N 1.82 5.71 0.63 -1.22 -1.08 -0.73 -2.69 116.67 119.11 3hmy s ASP 1039Ca -0.00 -1.34 0.34 0.00 -0.52 0.00 0.00 52.55 51.02 3hmy s ASP 1039Cb -0.17 -2.02 1.91 0.00 -1.46 0.00 0.00 42.92 41.19 3hmy s ASP 1039CO -0.10 -0.51 2.18 0.03 0.52 0.00 0.00 175.17 177.29 3hmy h ARG 1040N 8.45 0.00 -0.01 4.34 2.47 -1.88 -0.11 114.38 127.65 3hmy h ARG 1040Ca -0.24 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.48 3hmy h ARG 1040Cb 1.09 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.41 3hmy h ARG 1040CO 0.74 0.00 -0.35 1.28 0.56 0.00 0.00 179.97 182.21 3hmy n LEU 1041N -3.45 0.97 0.00 3.04 4.77 -1.26 -4.35 117.00 116.72 3hmy n LEU 1041Ca -0.01 -0.24 0.00 0.00 -0.03 0.00 0.00 56.01 55.73 3hmy n LEU 1041Cb 0.22 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 3hmy n LEU 1041CO 0.23 0.19 0.00 -1.54 -1.33 0.00 0.00 177.39 174.94 3hmy n SER 1042N -0.83 0.00 -3.57 -1.43 3.41 -0.07 -4.88 113.62 106.26 3hmy n SER 1042Ca 0.10 0.00 -0.16 0.00 -0.26 0.00 0.00 58.87 58.55 3hmy n SER 1042Cb 0.35 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.23 3hmy n SER 1042CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3hmy s SER 1043N 1.02 1.07 -0.11 4.04 1.04 -1.09 -0.92 113.70 118.74 3hmy s SER 1043Ca 0.00 -1.57 -0.03 0.00 0.48 0.00 0.00 55.95 54.83 3hmy s SER 1043Cb 0.00 0.54 -0.03 0.00 0.10 0.00 0.00 66.02 66.62 3hmy s SER 1043CO 0.00 -1.06 0.01 0.00 0.98 0.00 0.00 173.24 173.16 3hmy s ALA 1044N -3.56 3.27 -0.06 5.32 0.00 0.68 -1.76 121.76 125.65 3hmy s ALA 1044Ca 0.37 -0.80 0.03 0.00 0.00 0.00 0.00 51.96 51.57 3hmy s ALA 1044Cb 0.03 -1.55 0.00 0.00 0.00 0.00 0.00 23.12 21.60 3hmy s ALA 1044CO 0.21 0.50 -0.16 -0.80 0.00 0.00 0.00 175.76 175.52 3hmy s ASN 1045N -0.59 2.06 -0.21 0.00 0.01 -0.32 -1.22 114.94 114.67 3hmy s ASN 1045Ca 0.10 -0.35 -0.07 0.00 -0.71 0.00 0.00 52.86 51.83 3hmy s ASN 1045Cb -0.12 -0.77 -0.04 0.00 0.41 0.00 0.00 41.25 40.74 3hmy s ASN 1045CO 0.02 0.10 0.06 -0.22 -1.51 0.00 0.00 177.10 175.56 3hmy s LEU 1046N 0.33 3.64 0.08 0.60 0.20 0.51 -1.28 118.68 122.75 3hmy s LEU 1046Ca -0.10 -0.05 0.10 0.00 0.69 0.00 0.00 54.13 54.77 3hmy s LEU 1046Cb -0.14 -1.94 -0.03 0.00 -0.43 0.00 0.00 46.19 43.65 3hmy s LEU 1046CO 0.03 0.09 -0.25 -0.31 -0.29 0.00 0.00 176.35 175.62 3hmy s TYR 1047N 0.90 2.19 -0.09 5.38 1.51 0.21 -0.58 117.35 126.88 3hmy s TYR 1047Ca 0.04 -0.40 0.01 0.00 -1.01 0.00 0.00 57.07 55.71 3hmy s TYR 1047Cb -0.14 -1.26 0.02 0.00 -0.11 0.00 0.00 41.96 40.48 3hmy s TYR 1047CO 0.03 0.20 -0.08 0.42 -1.11 0.00 0.00 175.55 175.01 3hmy s ILE 1048N -0.93 0.96 -1.49 2.71 1.01 -0.46 -1.08 121.20 121.93 3hmy s ILE 1048Ca 0.11 -0.31 -0.10 0.00 0.00 0.00 0.00 60.65 60.36 3hmy s ILE 1048Cb -0.10 -0.95 0.07 0.00 0.01 0.00 0.00 42.46 41.49 3hmy s ILE 1048CO 0.04 0.34 0.84 0.59 0.00 0.00 0.00 174.94 176.75 3hmy n ASN 1049N 4.45 -3.36 0.00 3.58 3.02 0.83 -1.26 115.26 122.51 3hmy n ASN 1049Ca -0.17 -0.84 0.00 0.00 -0.03 0.00 0.00 54.58 53.54 3hmy n ASN 1049Cb 0.51 -3.72 0.00 0.00 -0.61 0.00 0.00 39.78 35.96 3hmy n ASN 1049CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3hmy n GLY 1050N -1.66 0.61 3.60 7.41 0.00 -1.26 -5.00 105.19 108.88 3hmy n GLY 1050Ca -0.07 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.61 3hmy n GLY 1050CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hmy s VAL 1051N -2.79 4.41 -0.02 1.61 1.01 -0.39 -4.86 120.40 119.37 3hmy s VAL 1051Ca 0.00 -0.18 -0.30 0.00 0.00 0.00 0.00 61.98 61.50 3hmy s VAL 1051Cb 0.00 -2.95 -0.06 0.00 0.00 0.00 0.00 36.38 33.37 3hmy s VAL 1051CO 0.00 0.50 1.69 -0.22 0.00 0.00 0.00 175.10 177.06 3hmy s LEU 1052N 0.16 4.34 -0.03 3.92 2.96 -1.26 -1.35 118.68 127.42 3hmy s LEU 1052Ca 0.02 2.33 0.08 0.00 -0.22 0.00 0.00 54.13 56.34 3hmy s LEU 1052Cb -0.13 -3.54 -0.12 0.00 0.50 0.00 0.00 46.19 42.90 3hmy s LEU 1052CO 0.01 -0.93 0.14 0.23 -1.32 0.00 0.00 176.35 174.48 3hmy n MET 1053N 6.87 0.92 -3.53 1.98 2.81 0.25 -4.95 117.12 121.47 3hmy n MET 1053Ca 0.17 -0.06 -0.10 0.00 -1.81 0.00 0.00 57.70 55.91 3hmy n MET 1053Cb 0.42 -1.19 -0.02 0.00 -0.71 0.00 0.00 33.22 31.72 3hmy n MET 1053CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 3hmy s GLY 1054N -3.20 -0.48 0.10 3.03 0.00 -1.02 -4.94 107.32 100.81 3hmy s GLY 1054Ca -0.03 0.52 -0.25 0.00 0.00 0.00 0.00 44.72 44.96 3hmy s GLY 1054CO 0.33 0.17 0.61 -0.45 0.00 0.00 0.00 173.10 173.76 3hmy s SER 1055N -2.71 -0.58 -0.26 1.64 0.15 -1.26 -0.36 113.70 110.33 3hmy s SER 1055Ca 0.04 0.19 -0.15 0.00 0.70 0.00 0.00 55.95 56.74 3hmy s SER 1055Cb -0.02 0.57 0.08 0.00 -1.71 0.00 0.00 66.02 64.95 3hmy s SER 1055CO -0.08 -0.86 0.63 0.00 1.20 0.00 0.00 173.24 174.13 3hmy s ALA 1056N -3.01 -1.72 0.26 5.45 0.00 -0.36 -4.90 121.76 117.48 3hmy s ALA 1056Ca -0.02 2.25 -0.30 0.00 0.00 0.00 0.00 51.96 53.89 3hmy s ALA 1056Cb -0.01 -1.34 -0.10 0.00 0.00 0.00 0.00 23.12 21.68 3hmy s ALA 1056CO -0.06 -0.37 1.42 -2.00 0.00 0.00 0.00 175.76 174.75 3hmy s GLU 1057N 1.61 4.28 -0.05 0.00 2.12 -1.26 -0.23 118.70 125.17 3hmy s GLU 1057Ca -0.10 2.28 0.07 0.00 0.36 0.00 0.00 54.97 57.59 3hmy s GLU 1057Cb -0.06 -3.11 0.11 0.00 0.26 0.00 0.00 34.13 31.33 3hmy s GLU 1057CO -0.19 -0.39 1.03 0.44 -0.54 0.00 0.00 175.26 175.62 3hmy n ILE 1058N 2.17 1.25 -2.28 -3.70 -5.35 -0.10 -4.85 119.36 106.50 3hmy n ILE 1058Ca 0.06 -1.39 -0.36 0.00 -0.27 0.00 0.00 62.75 60.79 3hmy n ILE 1058Cb 0.40 0.25 -0.01 0.00 -1.74 0.00 0.00 39.64 38.55 3hmy n ILE 1058CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 3hmy s THR 1059N -1.62 3.17 0.00 7.28 -4.23 -1.20 -3.31 115.64 115.73 3hmy s THR 1059Ca 0.12 0.81 0.00 0.00 -1.18 0.00 0.00 61.69 61.44 3hmy s THR 1059Cb 0.11 -3.38 0.00 0.00 1.34 0.00 0.00 72.50 70.57 3hmy s THR 1059CO 0.01 -0.08 0.00 0.61 -0.54 0.00 0.00 174.62 174.62 3hmy n GLY 1060N 0.30 0.57 3.82 3.99 0.00 -1.26 -5.06 105.19 107.55 3hmy n GLY 1060Ca 0.09 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.73 3hmy n GLY 1060CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hmy s LEU 1061N 0.00 4.46 0.00 0.99 1.43 -1.21 -5.07 118.68 119.28 3hmy s LEU 1061Ca 0.00 0.95 0.00 0.00 -1.03 0.00 0.00 54.13 54.05 3hmy s LEU 1061Cb 0.00 -2.60 0.00 0.00 0.03 0.00 0.00 46.19 43.62 3hmy s LEU 1061CO 0.00 0.29 0.00 0.61 0.23 0.00 0.00 176.35 177.48 3hmy n GLY 1062N 1.98 1.28 3.77 -3.19 0.00 -1.26 -5.01 105.19 102.76 3hmy n GLY 1062Ca -0.13 -1.60 -0.39 0.00 0.00 0.00 0.00 46.02 43.89 3hmy n GLY 1062CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hmy s ALA 1063N -3.62 3.29 -0.46 4.61 0.00 -1.26 -4.79 121.76 119.53 3hmy s ALA 1063Ca 0.00 1.12 -0.12 0.00 0.00 0.00 0.00 51.96 52.95 3hmy s ALA 1063Cb 0.00 -3.43 0.09 0.00 0.00 0.00 0.00 23.12 19.77 3hmy s ALA 1063CO 0.00 -0.62 0.34 0.42 0.00 0.00 0.00 175.76 175.90 3hmy s ILE 1064N -1.28 4.72 -0.84 0.00 1.01 -0.12 -0.49 121.20 124.20 3hmy s ILE 1064Ca 0.54 -1.31 -0.08 0.00 0.00 0.00 0.00 60.65 59.79 3hmy s ILE 1064Cb -0.35 -3.89 0.22 0.00 0.01 0.00 0.00 42.46 38.44 3hmy s ILE 1064CO 0.46 -0.60 0.75 -0.13 0.00 0.00 0.00 174.94 175.42 3hmy s ARG 1065N 1.52 3.40 0.74 2.79 0.52 -1.26 -4.01 118.95 122.64 3hmy s ARG 1065Ca 0.04 -2.76 -0.05 0.00 -0.52 0.00 0.00 55.73 52.44 3hmy s ARG 1065Cb -0.24 -4.20 0.11 0.00 0.52 0.00 0.00 34.95 31.14 3hmy s ARG 1065CO 0.04 -1.25 1.03 -1.83 0.02 0.00 0.00 175.30 173.31 3hmy s GLU 1066N -0.42 1.75 0.74 3.54 -1.05 -1.25 -4.14 118.70 117.87 3hmy s GLU 1066Ca 0.22 -0.72 -0.11 0.00 -0.15 0.00 0.00 54.97 54.20 3hmy s GLU 1066Cb -0.12 -2.23 0.04 0.00 -0.44 0.00 0.00 34.13 31.38 3hmy s GLU 1066CO -0.08 -1.46 1.09 0.34 0.95 0.00 0.00 175.26 176.10 3hmy s ASP 1067N -4.66 4.74 0.11 0.83 2.15 0.21 -4.91 116.67 115.13 3hmy s ASP 1067Ca 0.65 1.82 0.20 0.00 0.43 0.00 0.00 52.55 55.64 3hmy s ASP 1067Cb -0.07 -2.52 0.82 0.00 -0.30 0.00 0.00 42.92 40.84 3hmy s ASP 1067CO 0.45 -1.88 1.61 -3.20 -0.17 0.00 0.00 175.17 171.99 3hmy n ASN 1068N -3.29 0.30 -4.39 -0.34 2.85 -1.26 -4.73 115.26 104.40 3hmy n ASN 1068Ca 0.09 0.57 -0.30 0.00 -0.11 0.00 0.00 54.58 54.83 3hmy n ASN 1068Cb 0.53 -0.64 -0.14 0.00 1.24 0.00 0.00 39.78 40.78 3hmy n ASN 1068CO 0.00 0.00 0.00 0.20 -2.11 0.00 0.00 177.26 175.35 3hmy s ASN 1069N -3.57 3.40 -0.26 1.20 0.01 -1.26 -1.90 114.94 112.55 3hmy s ASN 1069Ca 0.07 -0.60 -0.07 0.00 -0.71 0.00 0.00 52.86 51.55 3hmy s ASN 1069Cb 0.10 -0.36 -0.01 0.00 0.41 0.00 0.00 41.25 41.39 3hmy s ASN 1069CO 0.35 0.23 0.07 -0.63 -1.51 0.00 0.00 177.10 175.61 3hmy s ILE 1070N -0.93 4.15 -0.23 0.60 1.01 0.06 -4.51 121.20 121.34 3hmy s ILE 1070Ca 0.13 -0.37 -0.07 0.00 0.00 0.00 0.00 60.65 60.34 3hmy s ILE 1070Cb -0.10 -3.00 -0.03 0.00 0.01 0.00 0.00 42.46 39.33 3hmy s ILE 1070CO 0.04 0.25 0.07 -0.89 0.00 0.00 0.00 174.94 174.41 3hmy s THR 1071N 1.57 4.39 -0.44 2.92 2.01 0.63 -1.04 115.64 125.68 3hmy s THR 1071Ca 0.05 -0.15 -0.14 0.00 0.31 0.00 0.00 61.69 61.76 3hmy s THR 1071Cb -0.16 -3.04 0.06 0.00 0.01 0.00 0.00 72.50 69.37 3hmy s THR 1071CO 0.03 0.36 0.34 -0.76 -0.69 0.00 0.00 174.62 173.91 3hmy s LEU 1072N 1.34 5.38 -0.21 4.42 1.02 -0.28 -1.52 118.68 128.84 3hmy s LEU 1072Ca 0.05 -1.22 -0.30 0.00 0.02 0.00 0.00 54.13 52.68 3hmy s LEU 1072Cb -0.15 -2.14 0.15 0.00 0.02 0.00 0.00 46.19 44.07 3hmy s LEU 1072CO 0.03 -0.57 1.14 -0.75 0.02 0.00 0.00 176.35 176.23 3hmy s LYS 1073N 1.62 0.38 -0.40 1.70 2.20 0.14 -1.46 119.74 123.92 3hmy s LYS 1073Ca 0.04 0.07 -0.29 0.00 -0.36 0.00 0.00 55.97 55.43 3hmy s LYS 1073Cb -0.22 0.18 0.02 0.00 -1.51 0.00 0.00 37.83 36.30 3hmy s LYS 1073CO 0.07 -0.12 1.15 -0.51 -0.36 0.00 0.00 175.35 175.58 3hmy s LEU 1074N -1.17 3.77 -0.22 5.43 1.43 -1.26 -3.68 118.68 122.97 3hmy s LEU 1074Ca 0.03 0.78 -0.04 0.00 -1.03 0.00 0.00 54.13 53.87 3hmy s LEU 1074Cb -0.01 -3.55 -0.01 0.00 0.03 0.00 0.00 46.19 42.66 3hmy s LEU 1074CO -0.03 -1.11 -0.04 -0.62 0.23 0.00 0.00 176.35 174.78 3hmy s ASP 1075N 2.30 4.29 -0.73 2.29 2.15 -0.31 -4.60 116.67 122.06 3hmy s ASP 1075Ca 0.49 -0.43 0.00 0.00 0.43 0.00 0.00 52.55 53.04 3hmy s ASP 1075Cb -0.10 -1.73 0.00 0.00 -0.30 0.00 0.00 42.92 40.78 3hmy s ASP 1075CO 0.25 -0.03 0.00 0.54 -0.17 0.00 0.00 175.17 175.76 3hmy n ARG 1076N 4.79 -0.67 -3.15 4.34 1.74 -1.26 -2.51 116.66 119.94 3hmy n ARG 1076Ca -0.18 0.44 -0.40 0.00 -0.77 0.00 0.00 57.85 56.93 3hmy n ARG 1076Cb 0.51 -4.40 -0.07 0.00 -1.02 0.00 0.00 32.46 27.48 3hmy n ARG 1076CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3hmy n ASN 1078N 5.61 0.34 -4.47 0.00 3.02 -1.26 -4.65 115.26 113.85 3hmy n ASN 1078Ca -0.02 0.53 -0.43 0.00 -0.03 0.00 0.00 54.58 54.63 3hmy n ASN 1078Cb 0.49 -0.62 -0.05 0.00 -0.61 0.00 0.00 39.78 38.99 3hmy n ASN 1078CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 3hmy s ASN 1079N -3.63 6.26 0.65 6.41 3.84 -1.26 -4.93 114.94 122.27 3hmy s ASN 1079Ca 0.12 -0.75 0.43 0.00 0.21 0.00 0.00 52.86 52.87 3hmy s ASN 1079Cb 0.16 -2.35 2.26 0.00 -0.55 0.00 0.00 41.25 40.77 3hmy s ASN 1079CO 0.55 -1.04 2.31 0.78 -2.79 0.00 0.00 177.10 176.91 3hmy h ASN 1080N 9.14 0.00 -0.34 -4.21 2.35 -1.91 -1.82 115.58 118.79 3hmy h ASN 1080Ca -0.27 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.48 3hmy h ASN 1080Cb 1.09 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.46 3hmy h ASN 1080CO 1.02 0.00 0.00 0.59 -1.65 0.00 0.00 177.43 177.40 3hmy n ASN 1081N -3.11 3.05 -4.78 5.81 3.02 -1.26 -4.44 115.26 113.56 3hmy n ASN 1081Ca -0.02 -1.94 -0.37 0.00 -0.03 0.00 0.00 54.58 52.22 3hmy n ASN 1081Cb 0.11 -0.22 -0.02 0.00 -0.61 0.00 0.00 39.78 39.04 3hmy n ASN 1081CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 3hmy s GLN 1082N -1.56 3.91 0.14 3.52 2.00 -0.69 -4.95 119.66 122.04 3hmy s GLN 1082Ca 0.37 1.66 -0.19 0.00 -2.00 0.00 0.00 55.36 55.20 3hmy s GLN 1082Cb 0.21 -2.44 0.05 0.00 0.80 0.00 0.00 33.01 31.63 3hmy s GLN 1082CO 0.30 -0.39 0.48 1.52 -0.50 0.00 0.00 175.29 176.70 3hmy s TYR 1083N -1.61 -0.31 0.12 1.67 -0.85 -1.26 -2.97 117.35 112.14 3hmy s TYR 1083Ca 0.61 0.03 -0.07 0.00 -0.52 0.00 0.00 57.07 57.12 3hmy s TYR 1083Cb -0.26 0.37 -0.01 0.00 0.38 0.00 0.00 41.96 42.45 3hmy s TYR 1083CO 0.31 -0.77 0.18 0.14 -1.52 0.00 0.00 175.55 173.89 3hmy s VAL 1084N -3.79 0.12 -0.04 -3.49 -7.23 -0.59 -4.39 120.40 100.98 3hmy s VAL 1084Ca 0.03 -1.42 0.04 0.00 -1.81 0.00 0.00 61.98 58.82 3hmy s VAL 1084Cb 0.01 -1.64 -0.00 0.00 0.56 0.00 0.00 36.38 35.30 3hmy s VAL 1084CO -0.11 -0.53 -0.16 -0.44 -0.31 0.00 0.00 175.10 173.54 3hmy s SER 1085N -2.93 2.05 -0.02 4.85 0.01 -0.30 -0.69 113.70 116.67 3hmy s SER 1085Ca 0.12 -0.33 0.03 0.00 1.31 0.00 0.00 55.95 57.08 3hmy s SER 1085Cb 0.05 -0.56 0.00 0.00 0.21 0.00 0.00 66.02 65.72 3hmy s SER 1085CO -0.05 0.14 -0.09 -0.63 0.41 0.00 0.00 173.24 173.02 3hmy s ILE 1086N 0.04 0.78 0.03 1.44 1.01 0.80 -1.10 121.20 124.20 3hmy s ILE 1086Ca -0.03 -0.37 0.00 0.00 0.00 0.00 0.00 60.65 60.25 3hmy s ILE 1086Cb -0.11 -0.68 -0.03 0.00 0.01 0.00 0.00 42.46 41.65 3hmy s ILE 1086CO 0.02 0.24 -0.04 -0.62 0.00 0.00 0.00 174.94 174.54 3hmy s ASP 1087N 0.11 0.43 -1.49 3.58 2.15 -0.45 -0.59 116.67 120.41 3hmy s ASP 1087Ca -0.02 -0.64 -0.13 0.00 0.43 0.00 0.00 52.55 52.20 3hmy s ASP 1087Cb -0.08 0.11 0.09 0.00 -0.30 0.00 0.00 42.92 42.75 3hmy s ASP 1087CO 0.00 -0.36 0.77 0.29 -0.17 0.00 0.00 175.17 175.71 3hmy n LYS 1088N 1.18 -4.38 -1.65 4.34 4.76 -1.26 -0.42 118.16 120.74 3hmy n LYS 1088Ca -0.21 0.54 -0.48 0.00 -2.87 0.00 0.00 58.31 55.29 3hmy n LYS 1088Cb 0.56 -5.34 -0.05 0.00 -1.84 0.00 0.00 35.03 28.37 3hmy n LYS 1088CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 3hmy n PHE 1089N -4.39 2.04 -3.76 2.13 7.35 -1.26 -4.39 117.46 115.19 3hmy n PHE 1089Ca 0.02 0.39 -0.13 0.00 -0.76 0.00 0.00 57.45 56.97 3hmy n PHE 1089Cb 0.53 -2.48 -0.09 0.00 0.35 0.00 0.00 39.48 37.79 3hmy n PHE 1089CO 0.00 0.00 0.00 0.50 -0.76 0.00 0.00 176.76 176.50 3hmy s ARG 1090N 0.70 0.59 -0.02 -4.13 3.52 0.66 -0.98 118.95 119.27 3hmy s ARG 1090Ca 0.80 0.04 0.04 0.00 -0.13 0.00 0.00 55.73 56.47 3hmy s ARG 1090Cb -0.76 0.27 -0.01 0.00 -1.56 0.00 0.00 34.95 32.89 3hmy s ARG 1090CO 0.41 -0.14 -0.15 0.42 -0.81 0.00 0.00 175.30 175.04 3hmy s ILE 1091N -0.83 1.18 0.16 4.11 1.01 -0.43 -0.91 121.20 125.50 3hmy s ILE 1091Ca -0.09 -0.61 0.10 0.00 0.00 0.00 0.00 60.65 60.04 3hmy s ILE 1091Cb -0.04 -1.01 -0.04 0.00 0.01 0.00 0.00 42.46 41.38 3hmy s ILE 1091CO 0.03 0.34 -0.17 -0.36 0.00 0.00 0.00 174.94 174.79 3hmy s PHE 1092N -0.14 2.51 -0.32 3.97 0.40 0.69 -0.92 117.98 124.17 3hmy s PHE 1092Ca 0.01 -0.27 0.03 0.00 -0.60 0.00 0.00 56.93 56.10 3hmy s PHE 1092Cb -0.08 -1.28 0.46 0.00 0.51 0.00 0.00 43.02 42.63 3hmy s PHE 1092CO 0.00 0.45 1.65 0.00 0.70 0.00 0.00 175.22 178.03 3hmy s LYS 1094N -2.30 1.23 -0.56 0.00 -2.85 -1.23 -2.07 119.74 111.96 3hmy s LYS 1094Ca 0.40 -0.85 -0.22 0.00 -1.00 0.00 0.00 55.97 54.30 3hmy s LYS 1094Cb 0.33 0.48 0.06 0.00 -2.06 0.00 0.00 37.83 36.64 3hmy s LYS 1094CO 0.07 -0.50 0.84 0.00 0.10 0.00 0.00 175.35 175.86 3hmy s ALA 1095N -3.86 3.23 0.46 0.59 0.00 -1.26 -2.82 121.76 118.10 3hmy s ALA 1095Ca 0.08 -1.58 -0.24 0.00 0.00 0.00 0.00 51.96 50.22 3hmy s ALA 1095Cb 0.01 -3.63 -0.07 0.00 0.00 0.00 0.00 23.12 19.42 3hmy s ALA 1095CO -0.06 -2.35 1.34 -0.51 0.00 0.00 0.00 175.76 174.18 3hmy s LEU 1096N 3.50 4.07 0.43 0.00 1.43 -1.26 -4.99 118.68 121.87 3hmy s LEU 1096Ca 0.23 2.72 -0.00 0.00 -1.03 0.00 0.00 54.13 56.05 3hmy s LEU 1096Cb -0.16 -4.04 -0.01 0.00 0.03 0.00 0.00 46.19 42.01 3hmy s LEU 1096CO 0.14 -1.13 0.65 0.54 0.23 0.00 0.00 176.35 176.78 3hmy s ASN 1097N -0.79 5.98 0.29 2.29 6.03 -1.26 -4.87 114.94 122.61 3hmy s ASN 1097Ca 0.62 0.38 0.02 0.00 -1.03 0.00 0.00 52.86 52.86 3hmy s ASN 1097Cb -0.39 -1.72 0.71 0.00 -3.03 0.00 0.00 41.25 36.82 3hmy s ASN 1097CO 0.49 -0.59 1.64 -0.65 -2.03 0.00 0.00 177.10 175.96 3hmy h PRO 1098N 0.47 0.17 -0.59 3.55 0.11 -1.97 -0.66 132.00 133.07 3hmy h PRO 1098Ca -0.47 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.62 3hmy h PRO 1098Cb 1.24 -0.04 -0.03 0.00 0.11 0.00 0.00 31.00 32.28 3hmy h PRO 1098CO 0.59 0.11 0.35 0.87 -0.21 0.00 0.00 178.00 179.71 3hmy h LYS 1099N 0.18 0.81 -0.61 1.05 1.57 -1.98 -0.12 116.57 117.46 3hmy h LYS 1099Ca 0.55 -0.08 -0.09 0.00 -1.87 0.00 0.00 60.65 59.17 3hmy h LYS 1099Cb 1.13 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 33.25 3hmy h LYS 1099CO -0.68 0.59 0.03 0.93 -0.57 0.00 0.00 179.45 179.75 3hmy h GLU 1100N 0.80 1.06 -0.55 3.15 5.08 -1.56 -2.15 114.58 120.42 3hmy h GLU 1100Ca 0.21 -0.32 -0.06 0.00 -1.00 0.00 0.00 59.36 58.19 3hmy h GLU 1100Cb -0.01 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.11 3hmy h GLU 1100CO -0.04 1.02 0.10 0.82 -1.00 0.00 0.00 179.01 179.91 3hmy h ILE 1101N 0.96 1.24 -0.39 3.13 2.04 -0.78 0.35 117.51 124.07 3hmy h ILE 1101Ca 0.18 -0.91 -0.02 0.00 1.00 0.00 0.00 64.86 65.11 3hmy h ILE 1101Cb 0.52 0.71 -0.02 0.00 -0.74 0.00 0.00 36.82 37.30 3hmy h ILE 1101CO 0.02 0.33 0.15 -0.08 0.00 0.00 0.00 178.15 178.57 3hmy h GLU 1102N 0.83 0.58 -0.61 2.37 4.57 -0.76 -0.51 114.58 121.05 3hmy h GLU 1102Ca 0.17 -0.11 -0.08 0.00 -1.18 0.00 0.00 59.36 58.16 3hmy h GLU 1102Cb 0.36 -0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 28.83 3hmy h GLU 1102CO 0.01 0.56 0.05 -0.22 -1.18 0.00 0.00 179.01 178.23 3hmy h LYS 1103N 0.48 1.05 0.62 1.92 1.63 -1.09 -1.76 116.57 119.41 3hmy h LYS 1103Ca 0.13 -0.31 -0.03 0.00 -0.85 0.00 0.00 60.65 59.59 3hmy h LYS 1103Cb 0.21 -0.11 0.00 0.00 -0.60 0.00 0.00 32.23 31.73 3hmy h LYS 1103CO -0.01 1.00 -0.31 1.25 -3.45 0.00 0.00 179.45 177.93 3hmy h LEU 1104N 0.95 -0.75 0.20 5.20 6.46 -0.72 -1.60 115.31 125.05 3hmy h LEU 1104Ca 0.18 0.03 0.01 0.00 -0.12 0.00 0.00 57.88 57.98 3hmy h LEU 1104Cb 0.49 0.20 -0.04 0.00 -0.73 0.00 0.00 40.66 40.58 3hmy h LEU 1104CO 0.02 -0.52 -0.53 0.22 -0.62 0.00 0.00 178.44 177.01 3hmy h TYR 1105N -0.85 -1.52 0.00 1.25 3.20 -1.02 -2.41 116.97 115.62 3hmy h TYR 1105Ca -0.08 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.82 3hmy h TYR 1105Cb 0.66 0.63 0.00 0.00 1.54 0.00 0.00 36.73 39.57 3hmy h TYR 1105CO -0.04 -0.62 0.00 1.79 -1.64 0.00 0.00 178.16 177.65 3hmy h THR 1106N -0.81 0.00 0.00 1.81 1.35 -1.36 -2.57 112.91 111.33 3hmy h THR 1106Ca -0.02 -0.18 0.00 0.00 -0.55 0.00 0.00 66.41 65.66 3hmy h THR 1106Cb 0.79 0.89 0.00 0.00 -1.73 0.00 0.00 68.15 68.10 3hmy h THR 1106CO -0.24 0.00 0.00 0.77 -0.25 0.00 0.00 175.52 175.80 3hmy h SER 1107N 0.00 0.00 1.01 5.36 4.64 -0.75 -2.74 113.55 121.07 3hmy h SER 1107Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3hmy h SER 1107Cb 0.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.34 3hmy h SER 1107CO 0.00 0.00 -0.80 1.88 -0.87 0.00 0.00 176.83 177.04 3hmy h TYR 1108N 0.00 0.00 0.00 4.77 0.05 -1.52 -3.42 116.97 116.85 3hmy h TYR 1108Ca 0.00 0.00 -0.62 0.00 0.05 0.00 0.00 58.73 58.16 3hmy h TYR 1108Cb 0.45 0.00 0.01 0.00 1.01 0.00 0.00 36.73 38.20 3hmy h TYR 1108CO 0.00 0.00 3.14 1.28 -1.05 0.00 0.00 178.16 181.53 3hmy n LEU 1109N -2.49 6.67 -4.55 3.88 4.77 -1.03 -4.77 117.00 119.48 3hmy n LEU 1109Ca 0.01 -3.77 -0.43 0.00 -0.03 0.00 0.00 56.01 51.79 3hmy n LEU 1109Cb 0.51 -1.43 -0.04 0.00 -2.33 0.00 0.00 43.42 40.12 3hmy n LEU 1109CO 0.38 1.09 1.89 -1.54 -1.33 0.00 0.00 177.39 177.89 3hmy n SER 1110N 5.12 2.66 0.00 -1.43 3.41 -1.26 -4.84 113.62 117.29 3hmy n SER 1110Ca 0.59 0.10 0.05 0.00 -0.26 0.00 0.00 58.87 59.35 3hmy n SER 1110Cb 0.29 -1.47 0.31 0.00 -0.26 0.00 0.00 64.21 63.08 3hmy n SER 1110CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 3hmy n ILE 1111N 7.67 0.00 0.07 -1.33 5.41 -1.26 -3.43 119.36 126.49 3hmy n ILE 1111Ca 0.36 0.00 0.04 0.00 1.00 0.00 0.00 62.75 64.15 3hmy n ILE 1111Cb 0.40 -0.69 -0.04 0.00 -0.71 0.00 0.00 39.64 38.60 3hmy n ILE 1111CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 176.55 177.26 3hmy h THR 1112N 0.00 0.36 -3.36 1.39 1.35 -1.95 -3.44 112.91 107.26 3hmy h THR 1112Ca 0.00 -1.67 -0.65 0.00 -0.55 0.00 0.00 66.41 63.55 3hmy h THR 1112Cb 0.00 1.90 -0.24 0.00 -1.73 0.00 0.00 68.15 68.08 3hmy h THR 1112CO 0.00 0.20 -0.69 -0.36 -0.25 0.00 0.00 175.52 174.42 3hmy s PHE 1113N -3.07 2.98 0.61 4.73 0.40 -1.22 -0.51 117.98 121.89 3hmy s PHE 1113Ca -0.01 -0.52 -0.15 0.00 -0.60 0.00 0.00 56.93 55.65 3hmy s PHE 1113Cb 0.09 -2.00 -0.03 0.00 0.51 0.00 0.00 43.02 41.59 3hmy s PHE 1113CO 0.79 -0.22 1.05 -0.51 0.70 0.00 0.00 175.22 177.04 3hmy s LEU 1114N 0.73 3.43 0.17 -0.37 1.43 -0.90 -4.89 118.68 118.28 3hmy s LEU 1114Ca -0.02 1.74 0.08 0.00 -1.03 0.00 0.00 54.13 54.90 3hmy s LEU 1114Cb -0.15 -4.52 -0.04 0.00 0.03 0.00 0.00 46.19 41.51 3hmy s LEU 1114CO 0.02 -1.15 -0.16 -0.13 0.23 0.00 0.00 176.35 175.15 3hmy s ARG 1115N -4.29 1.24 0.74 1.70 0.52 -1.26 -0.73 118.95 116.88 3hmy s ARG 1115Ca 0.62 -1.42 -0.05 0.00 -0.52 0.00 0.00 55.73 54.35 3hmy s ARG 1115Cb -0.15 -1.20 0.16 0.00 0.52 0.00 0.00 34.95 34.28 3hmy s ARG 1115CO 0.40 0.23 1.01 -0.40 0.02 0.00 0.00 175.30 176.57 3hmy n ASP 1116N 0.16 0.84 -0.21 0.23 5.68 0.11 -4.60 116.55 118.76 3hmy n ASP 1116Ca -0.12 -1.83 0.21 0.00 -0.50 0.00 0.00 54.79 52.55 3hmy n ASP 1116Cb 0.58 -0.70 0.57 0.00 -1.14 0.00 0.00 41.12 40.43 3hmy n ASP 1116CO 0.00 0.00 0.00 0.15 -1.33 0.00 0.00 177.20 176.02 3hmy h PHE 1117N -0.97 0.38 0.00 2.11 3.57 -1.13 -0.69 116.94 120.21 3hmy h PHE 1117Ca -0.33 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.18 3hmy h PHE 1117Cb 1.10 -0.12 0.00 0.00 2.79 0.00 0.00 35.95 39.73 3hmy h PHE 1117CO 0.00 0.10 -0.19 0.91 -2.23 0.00 0.00 178.31 176.90 3hmy n TRP 1118N -4.45 0.44 0.00 0.41 5.03 -1.26 -4.88 117.44 112.73 3hmy n TRP 1118Ca 0.18 0.13 0.00 0.00 3.03 0.00 0.00 57.50 60.84 3hmy n TRP 1118Cb 0.75 -0.66 0.00 0.00 -1.03 0.00 0.00 31.31 30.37 3hmy n TRP 1118CO 0.00 0.00 0.00 0.41 -0.03 0.00 0.00 177.69 178.07 3hmy n GLY 1119N 1.40 0.60 3.94 6.99 0.00 -0.26 -0.78 105.19 117.08 3hmy n GLY 1119Ca 0.06 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.83 3hmy n GLY 1119CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3hmy s ASN 1120N -2.64 5.43 0.33 1.61 0.01 -1.26 -4.71 114.94 113.72 3hmy s ASN 1120Ca 0.00 0.46 -0.29 0.00 -0.71 0.00 0.00 52.86 52.31 3hmy s ASN 1120Cb 0.00 -1.41 -0.11 0.00 0.41 0.00 0.00 41.25 40.13 3hmy s ASN 1120CO 0.00 -1.11 1.55 -2.65 -1.51 0.00 0.00 177.10 173.38 3hmy n PRO 1121N -2.51 2.69 -2.34 -0.60 -0.02 -1.26 0.04 135.00 131.01 3hmy n PRO 1121Ca 0.05 0.95 -0.40 0.00 -2.02 0.00 0.00 63.50 62.08 3hmy n PRO 1121Cb 0.58 -2.71 -0.03 0.00 -0.02 0.00 0.00 33.50 31.32 3hmy n PRO 1121CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3hmy s LEU 1122N -1.17 4.45 0.14 2.45 0.20 0.10 -4.50 118.68 120.35 3hmy s LEU 1122Ca 0.59 2.41 0.09 0.00 0.69 0.00 0.00 54.13 57.90 3hmy s LEU 1122Cb -0.49 -3.71 -0.04 0.00 -0.43 0.00 0.00 46.19 41.53 3hmy s LEU 1122CO 0.55 -0.35 -0.19 -0.13 -0.29 0.00 0.00 176.35 175.94 3hmy s ARG 1123N -1.71 1.23 0.68 1.98 1.81 -1.26 -0.63 118.95 121.05 3hmy s ARG 1123Ca 0.48 -1.33 -0.11 0.00 -1.72 0.00 0.00 55.73 53.05 3hmy s ARG 1123Cb -0.34 -1.37 -0.00 0.00 -0.45 0.00 0.00 34.95 32.79 3hmy s ARG 1123CO 0.44 0.29 1.07 0.71 -0.68 0.00 0.00 175.30 177.13 3hmy s TYR 1124N -1.74 3.37 -1.35 -0.53 2.02 -0.33 -4.07 117.35 114.73 3hmy s TYR 1124Ca 0.13 1.17 -0.10 0.00 -0.37 0.00 0.00 57.07 57.89 3hmy s TYR 1124Cb -0.07 -2.94 0.08 0.00 -0.40 0.00 0.00 41.96 38.63 3hmy s TYR 1124CO 0.06 -1.07 0.56 -0.25 -1.57 0.00 0.00 175.55 173.28 3hmy n ASP 1125N -2.96 -3.83 -4.11 2.29 8.00 0.35 -4.94 116.55 111.34 3hmy n ASP 1125Ca 0.07 -0.47 -0.24 0.00 0.71 0.00 0.00 54.79 54.86 3hmy n ASP 1125Cb 0.56 -3.16 -0.15 0.00 -0.02 0.00 0.00 41.12 38.35 3hmy n ASP 1125CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3hmy s THR 1126N -3.00 1.21 0.10 -3.53 2.01 -1.26 -5.00 115.64 106.17 3hmy s THR 1126Ca 0.45 -0.63 -0.30 0.00 0.31 0.00 0.00 61.69 61.52 3hmy s THR 1126Cb -0.24 -1.02 -0.06 0.00 0.01 0.00 0.00 72.50 71.20 3hmy s THR 1126CO 0.55 0.35 1.09 -1.61 -0.69 0.00 0.00 174.62 174.31 3hmy s GLU 1127N -0.19 4.55 0.01 4.92 2.02 -1.26 -4.20 118.70 124.54 3hmy s GLU 1127Ca 0.02 1.65 0.02 0.00 0.02 0.00 0.00 54.97 56.68 3hmy s GLU 1127Cb -0.08 -3.35 -0.01 0.00 0.10 0.00 0.00 34.13 30.80 3hmy s GLU 1127CO 0.00 -0.04 -0.06 0.71 0.02 0.00 0.00 175.26 175.90 3hmy s TYR 1128N 0.45 0.50 -0.10 1.61 2.02 0.05 -4.45 117.35 117.43 3hmy s TYR 1128Ca 0.53 -0.18 -0.12 0.00 -0.37 0.00 0.00 57.07 56.92 3hmy s TYR 1128Cb -0.27 -0.31 -0.05 0.00 -0.40 0.00 0.00 41.96 40.93 3hmy s TYR 1128CO 0.31 -0.03 0.29 0.71 -1.57 0.00 0.00 175.55 175.26 3hmy s TYR 1129N -0.41 3.58 -0.14 2.71 2.02 0.60 -0.04 117.35 125.67 3hmy s TYR 1129Ca -0.01 0.70 -0.10 0.00 -0.37 0.00 0.00 57.07 57.30 3hmy s TYR 1129Cb -0.04 -2.21 -0.05 0.00 -0.40 0.00 0.00 41.96 39.26 3hmy s TYR 1129CO -0.00 0.50 0.19 -0.51 -1.57 0.00 0.00 175.55 174.17 3hmy s LEU 1130N -0.43 4.32 -0.06 -1.29 1.43 -1.26 -0.15 118.68 121.24 3hmy s LEU 1130Ca 0.18 0.47 0.01 0.00 -1.03 0.00 0.00 54.13 53.75 3hmy s LEU 1130Cb -0.14 -2.19 0.02 0.00 0.03 0.00 0.00 46.19 43.92 3hmy s LEU 1130CO 0.07 0.28 -0.05 -0.63 0.23 0.00 0.00 176.35 176.25 3hmy s ILE 1131N -0.38 0.67 -0.06 -0.59 1.01 -0.80 -4.03 121.20 117.02 3hmy s ILE 1131Ca 0.14 -0.16 -0.30 0.00 0.00 0.00 0.00 60.65 60.34 3hmy s ILE 1131Cb -0.12 -0.69 -0.03 0.00 0.01 0.00 0.00 42.46 41.62 3hmy s ILE 1131CO 0.03 0.27 1.25 -2.16 0.00 0.00 0.00 174.94 174.33 3hmy s PRO 1132N 1.16 4.32 0.32 2.79 0.04 -1.26 -0.25 135.00 142.12 3hmy s PRO 1132Ca -0.07 1.73 0.05 0.00 0.04 0.00 0.00 61.00 62.75 3hmy s PRO 1132Cb -0.14 -3.60 0.69 0.00 0.04 0.00 0.00 34.50 31.49 3hmy s PRO 1132CO -0.01 -0.51 1.85 0.28 0.04 0.00 0.00 177.00 178.64 3hmy h VAL 1133N 5.08 0.86 0.00 -0.36 2.07 -1.59 -1.28 116.25 121.03 3hmy h VAL 1133Ca -0.34 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 66.90 3hmy h VAL 1133Cb 1.16 -0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.88 3hmy h VAL 1133CO 0.90 0.15 0.00 0.00 0.02 0.00 0.00 177.57 178.64 3hmy n ALA 1134N -2.39 1.77 -2.99 1.67 0.00 -1.26 -3.72 120.51 113.59 3hmy n ALA 1134Ca 0.19 0.03 -0.16 0.00 0.00 0.00 0.00 53.44 53.50 3hmy n ALA 1134Cb 0.42 -1.37 -0.00 0.00 0.00 0.00 0.00 19.45 18.50 3hmy n ALA 1134CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3hmy n SER 1135N -2.05 -0.92 0.00 0.00 7.64 -0.55 -5.00 113.62 112.74 3hmy n SER 1135Ca 0.03 -3.11 0.00 0.00 1.01 0.00 0.00 58.87 56.80 3hmy n SER 1135Cb 0.25 0.47 0.00 0.00 -1.01 0.00 0.00 64.21 63.92 3hmy n SER 1135CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 3hmy n SER 1136N 1.01 0.00 -0.68 6.43 3.41 -0.78 -1.38 113.62 121.64 3hmy n SER 1136Ca 0.16 0.49 0.09 0.00 -0.26 0.00 0.00 58.87 59.36 3hmy n SER 1136Cb 0.62 -0.49 0.29 0.00 -0.26 0.00 0.00 64.21 64.37 3hmy n SER 1136CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3hmy n SER 1137N -1.49 2.01 -4.60 4.04 3.41 -1.26 -4.89 113.62 110.84 3hmy n SER 1137Ca -0.00 -1.83 -0.33 0.00 -0.26 0.00 0.00 58.87 56.45 3hmy n SER 1137Cb 0.01 -0.17 -0.11 0.00 -0.26 0.00 0.00 64.21 63.68 3hmy n SER 1137CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 3hmy s LYS 1138N -1.65 2.66 0.41 4.33 -0.14 -0.48 -1.25 119.74 123.62 3hmy s LYS 1138Ca 0.31 -0.64 0.08 0.00 -1.36 0.00 0.00 55.97 54.36 3hmy s LYS 1138Cb 0.17 -2.55 -0.03 0.00 -1.68 0.00 0.00 37.83 33.73 3hmy s LYS 1138CO 0.24 0.63 0.31 -0.51 -0.76 0.00 0.00 175.35 175.26 3hmy s ASP 1139N -1.16 4.87 -0.14 2.83 1.01 0.49 -4.40 116.67 120.17 3hmy s ASP 1139Ca 0.15 -0.83 -0.05 0.00 0.71 0.00 0.00 52.55 52.53 3hmy s ASP 1139Cb -0.11 -0.57 -0.04 0.00 1.01 0.00 0.00 42.92 43.21 3hmy s ASP 1139CO 0.05 -0.60 0.05 -0.69 0.21 0.00 0.00 175.17 174.20 3hmy s VAL 1140N -2.50 4.71 0.24 -1.27 1.01 -1.26 -1.51 120.40 119.83 3hmy s VAL 1140Ca 0.45 -0.08 0.07 0.00 0.00 0.00 0.00 61.98 62.43 3hmy s VAL 1140Cb -0.01 -3.06 -0.05 0.00 0.00 0.00 0.00 36.38 33.25 3hmy s VAL 1140CO 0.26 0.54 -0.10 -1.58 0.00 0.00 0.00 175.10 174.22 3hmy s GLN 1141N -0.28 1.42 -0.09 2.72 2.00 0.11 -1.25 119.66 124.29 3hmy s GLN 1141Ca 0.08 -1.68 0.01 0.00 -2.00 0.00 0.00 55.36 51.78 3hmy s GLN 1141Cb -0.12 -1.11 -0.02 0.00 0.80 0.00 0.00 33.01 32.56 3hmy s GLN 1141CO 0.02 0.11 -0.13 -1.17 -0.50 0.00 0.00 175.29 173.62 3hmy s LEU 1142N -3.37 2.78 -0.02 3.68 2.96 -1.26 -1.06 118.68 122.38 3hmy s LEU 1142Ca 0.26 -0.24 -0.22 0.00 -0.22 0.00 0.00 54.13 53.70 3hmy s LEU 1142Cb 0.01 -1.60 -0.15 0.00 0.50 0.00 0.00 46.19 44.95 3hmy s LEU 1142CO 0.09 0.26 1.00 0.50 -1.32 0.00 0.00 176.35 176.87 3hmy h LYS 1143N 6.01 -0.33 -2.16 1.98 1.63 -1.27 -3.49 116.57 118.94 3hmy h LYS 1143Ca -0.36 0.02 0.13 0.00 -0.85 0.00 0.00 60.65 59.59 3hmy h LYS 1143Cb 1.18 0.08 -0.16 0.00 -0.60 0.00 0.00 32.23 32.73 3hmy h LYS 1143CO 0.53 0.02 0.54 -0.80 -3.45 0.00 0.00 179.45 176.30 3hmy s ASN 1144N -5.24 -0.33 0.43 4.20 0.01 -1.26 -5.03 114.94 107.73 3hmy s ASN 1144Ca -0.13 -0.01 -0.26 0.00 -0.71 0.00 0.00 52.86 51.75 3hmy s ASN 1144Cb 0.01 0.35 -0.09 0.00 0.41 0.00 0.00 41.25 41.93 3hmy s ASN 1144CO 0.48 -0.57 1.46 -0.63 -1.51 0.00 0.00 177.10 176.33 3hmy s ILE 1145N -3.02 2.02 0.00 0.60 -1.09 -1.26 -0.46 121.20 117.99 3hmy s ILE 1145Ca 0.06 0.02 0.00 0.00 -2.23 0.00 0.00 60.65 58.50 3hmy s ILE 1145Cb -0.01 -3.01 0.00 0.00 -1.58 0.00 0.00 42.46 37.86 3hmy s ILE 1145CO -0.08 0.00 0.00 0.35 -1.23 0.00 0.00 174.94 173.98 3hmy n THR 1146N 0.02 0.00 -2.46 2.92 -2.24 0.56 -4.97 114.28 108.11 3hmy n THR 1146Ca 0.04 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.82 3hmy n THR 1146Cb 0.41 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.64 3hmy n THR 1146CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3hmy n ASP 1147N 0.00 0.04 -4.94 3.42 -0.08 0.39 -4.34 116.55 111.03 3hmy n ASP 1147Ca 0.00 -0.44 -0.24 0.00 -1.51 0.00 0.00 54.79 52.60 3hmy n ASP 1147Cb 0.00 0.00 0.06 0.00 2.34 0.00 0.00 41.12 43.52 3hmy n ASP 1147CO 0.00 0.00 0.00 -0.72 0.12 0.00 0.00 177.20 176.60 3hmy s TYR 1148N 1.53 2.90 0.17 -0.67 1.13 -1.26 -1.23 117.35 119.92 3hmy s TYR 1148Ca 0.00 0.31 0.10 0.00 -1.41 0.00 0.00 57.07 56.07 3hmy s TYR 1148Cb 0.00 -3.06 -0.04 0.00 -1.10 0.00 0.00 41.96 37.76 3hmy s TYR 1148CO 0.00 -1.25 -0.18 -1.64 -2.51 0.00 0.00 175.55 169.97 3hmy s MET 1149N -5.10 1.74 0.21 -3.49 -1.94 -1.26 -0.75 119.30 108.71 3hmy s MET 1149Ca 0.59 -1.37 -0.13 0.00 -1.71 0.00 0.00 55.69 53.06 3hmy s MET 1149Cb -0.11 -2.00 0.00 0.00 2.01 0.00 0.00 34.83 34.74 3hmy s MET 1149CO 0.43 0.43 0.45 1.52 -0.01 0.00 0.00 175.02 177.84 3hmy s TYR 1150N -1.56 0.22 0.21 -0.03 1.13 -0.23 -1.49 117.35 115.60 3hmy s TYR 1150Ca 0.21 -0.58 -0.13 0.00 -1.41 0.00 0.00 57.07 55.17 3hmy s TYR 1150Cb -0.09 0.21 -0.07 0.00 -1.10 0.00 0.00 41.96 40.90 3hmy s TYR 1150CO 0.11 -0.91 0.59 -0.51 -2.51 0.00 0.00 175.55 172.32 3hmy s LEU 1151N -2.96 4.23 0.03 -3.49 1.43 -0.61 0.09 118.68 117.39 3hmy s LEU 1151Ca 0.17 1.08 -0.01 0.00 -1.03 0.00 0.00 54.13 54.34 3hmy s LEU 1151Cb 0.00 -3.59 -0.02 0.00 0.03 0.00 0.00 46.19 42.61 3hmy s LEU 1151CO 0.03 -0.02 -0.02 0.42 0.23 0.00 0.00 176.35 176.99 3hmy s THR 1152N -1.69 0.14 0.11 5.49 -4.23 -0.57 -4.69 115.64 110.20 3hmy s THR 1152Ca 0.45 -1.14 -0.31 0.00 -1.18 0.00 0.00 61.69 59.51 3hmy s THR 1152Cb -0.13 -0.61 -0.07 0.00 1.34 0.00 0.00 72.50 73.03 3hmy s THR 1152CO 0.20 -0.63 1.31 0.20 -0.54 0.00 0.00 174.62 175.16 3hmy s ASN 1153N -1.85 6.92 0.36 3.99 0.01 -1.26 -0.38 114.94 122.73 3hmy s ASN 1153Ca -0.10 2.23 -0.25 0.00 -0.71 0.00 0.00 52.86 54.03 3hmy s ASN 1153Cb -0.05 -2.59 -0.10 0.00 0.41 0.00 0.00 41.25 38.93 3hmy s ASN 1153CO -0.03 -0.57 0.98 0.00 -1.51 0.00 0.00 177.10 175.97 3hmy s ALA 1154N 0.95 3.16 0.83 0.60 0.00 -0.38 -4.81 121.76 122.11 3hmy s ALA 1154Ca 0.61 0.58 -0.10 0.00 0.00 0.00 0.00 51.96 53.05 3hmy s ALA 1154Cb -0.34 -3.21 0.09 0.00 0.00 0.00 0.00 23.12 19.65 3hmy s ALA 1154CO 0.31 0.04 1.10 -1.25 0.00 0.00 0.00 175.76 175.96 3hmy s PRO 1155N -2.28 1.79 0.23 0.00 0.04 -1.26 -4.79 135.00 128.72 3hmy s PRO 1155Ca 0.54 1.23 0.05 0.00 0.04 0.00 0.00 61.00 62.86 3hmy s PRO 1155Cb -0.19 -1.84 -0.05 0.00 0.04 0.00 0.00 34.50 32.46 3hmy s PRO 1155CO 0.24 -1.99 -0.05 -1.54 0.04 0.00 0.00 177.00 173.70 3hmy s SER 1156N -3.19 2.18 -0.05 6.66 1.04 -1.26 -0.64 113.70 118.43 3hmy s SER 1156Ca 0.63 -1.16 0.06 0.00 0.48 0.00 0.00 55.95 55.96 3hmy s SER 1156Cb -0.19 -0.06 -0.01 0.00 0.10 0.00 0.00 66.02 65.86 3hmy s SER 1156CO 0.57 -0.40 -0.23 -0.47 0.98 0.00 0.00 173.24 173.69 3hmy s TYR 1157N -3.24 2.25 -0.00 5.02 5.04 0.51 -4.80 117.35 122.13 3hmy s TYR 1157Ca 0.26 -0.67 -0.01 0.00 -2.44 0.00 0.00 57.07 54.21 3hmy s TYR 1157Cb 0.04 -1.49 -0.00 0.00 0.35 0.00 0.00 41.96 40.86 3hmy s TYR 1157CO 0.08 -0.21 0.02 0.95 -1.34 0.00 0.00 175.55 175.05 3hmy s THR 1158N -0.10 0.02 -0.30 4.34 -4.23 -1.26 -1.04 115.64 113.07 3hmy s THR 1158Ca -0.04 -0.20 -0.03 0.00 -1.18 0.00 0.00 61.69 60.23 3hmy s THR 1158Cb -0.13 -0.10 0.10 0.00 1.34 0.00 0.00 72.50 73.71 3hmy s THR 1158CO 0.03 -0.11 0.13 0.21 -0.54 0.00 0.00 174.62 174.35 3hmy s ASN 1159N -0.33 3.55 0.21 3.99 3.84 -0.06 -5.00 114.94 121.15 3hmy s ASN 1159Ca -0.04 -1.40 -0.10 0.00 0.21 0.00 0.00 52.86 51.53 3hmy s ASN 1159Cb -0.02 -0.41 0.16 0.00 -0.55 0.00 0.00 41.25 40.42 3hmy s ASN 1159CO -0.00 -0.43 1.87 1.23 -2.79 0.00 0.00 177.10 176.98 3hmy h GLY 1160N 8.27 1.09 0.48 1.21 0.00 -1.97 0.94 103.07 113.08 3hmy h GLY 1160Ca -0.17 -0.42 0.05 0.00 0.00 0.00 0.00 47.33 46.78 3hmy h GLY 1160CO 0.43 0.41 -0.09 1.70 0.00 0.00 0.00 176.54 178.99 3hmy h LYS 1161N 1.04 -0.06 -0.00 4.80 3.64 -1.95 -2.38 116.57 121.65 3hmy h LYS 1161Ca 0.28 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.66 3hmy h LYS 1161Cb -0.09 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.74 3hmy h LYS 1161CO -0.06 -0.04 -0.29 1.28 -2.27 0.00 0.00 179.45 178.07 3hmy n LEU 1162N -5.25 0.53 -3.52 5.20 4.77 -1.16 -4.96 117.00 112.60 3hmy n LEU 1162Ca -0.02 0.02 -0.20 0.00 -0.03 0.00 0.00 56.01 55.78 3hmy n LEU 1162Cb 0.17 -0.25 0.06 0.00 -2.33 0.00 0.00 43.42 41.08 3hmy n LEU 1162CO 0.21 0.11 -0.00 -3.20 -1.33 0.00 0.00 177.39 173.19 3hmy n ASN 1163N -1.20 -3.33 -4.08 -1.43 5.15 0.29 -5.02 115.26 105.64 3hmy n ASN 1163Ca 0.09 -0.77 -0.11 0.00 -0.60 0.00 0.00 54.58 53.19 3hmy n ASN 1163Cb 0.33 -4.51 -0.11 0.00 -0.53 0.00 0.00 39.78 34.96 3hmy n ASN 1163CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 3hmy s ILE 1164N -3.50 0.45 -0.03 -1.44 -4.36 -0.98 -4.60 121.20 106.74 3hmy s ILE 1164Ca 0.18 -1.39 -0.30 0.00 -0.26 0.00 0.00 60.65 58.88 3hmy s ILE 1164Cb -0.04 -0.98 0.11 0.00 1.25 0.00 0.00 42.46 42.80 3hmy s ILE 1164CO 0.78 -0.64 0.95 -0.72 0.24 0.00 0.00 174.94 175.56 3hmy s TYR 1165N -2.40 -0.29 -0.21 1.37 1.13 -0.79 -0.88 117.35 115.28 3hmy s TYR 1165Ca -0.03 0.16 -0.31 0.00 -1.41 0.00 0.00 57.07 55.49 3hmy s TYR 1165Cb -0.03 0.54 0.15 0.00 -1.10 0.00 0.00 41.96 41.52 3hmy s TYR 1165CO -0.03 -0.49 1.18 1.52 -2.51 0.00 0.00 175.55 175.21 3hmy s TYR 1166N -2.99 -0.19 0.19 -3.49 -0.85 -0.20 -1.40 117.35 108.42 3hmy s TYR 1166Ca 0.06 0.27 -0.30 0.00 -0.52 0.00 0.00 57.07 56.58 3hmy s TYR 1166Cb -0.01 0.49 -0.08 0.00 0.38 0.00 0.00 41.96 42.73 3hmy s TYR 1166CO -0.08 -0.20 1.25 -0.98 -1.52 0.00 0.00 175.55 174.02 3hmy s ARG 1167N -1.49 4.44 0.52 -3.49 1.04 -1.26 -0.37 118.95 118.34 3hmy s ARG 1167Ca 0.05 1.95 -0.20 0.00 -1.04 0.00 0.00 55.73 56.49 3hmy s ARG 1167Cb -0.01 -3.22 -0.06 0.00 -2.04 0.00 0.00 34.95 29.62 3hmy s ARG 1167CO -0.04 -0.17 1.13 1.03 -0.04 0.00 0.00 175.30 177.22 3hmy s ARG 1168N -0.16 3.50 0.45 3.89 0.52 0.19 -4.85 118.95 122.48 3hmy s ARG 1168Ca 0.55 1.64 0.08 0.00 -0.52 0.00 0.00 55.73 57.47 3hmy s ARG 1168Cb -0.34 -2.12 -0.00 0.00 0.52 0.00 0.00 34.95 33.00 3hmy s ARG 1168CO 0.37 -0.74 0.43 -0.51 0.02 0.00 0.00 175.30 174.87 3hmy s LEU 1169N -3.56 3.29 -0.53 2.53 1.43 -1.26 -4.71 118.68 115.87 3hmy s LEU 1169Ca 0.70 -0.80 0.00 0.00 -1.03 0.00 0.00 54.13 53.00 3hmy s LEU 1169Cb -0.25 -1.95 0.00 0.00 0.03 0.00 0.00 46.19 44.03 3hmy s LEU 1169CO 0.28 -0.77 0.00 -1.22 0.23 0.00 0.00 176.35 174.87 3hmy n TYR 1170N -1.65 -0.07 -4.26 0.29 4.01 -1.26 -4.94 117.16 109.28 3hmy n TYR 1170Ca 0.04 0.00 -0.27 0.00 -0.16 0.00 0.00 57.90 57.51 3hmy n TYR 1170Cb 0.62 -1.38 -0.09 0.00 -0.31 0.00 0.00 39.34 38.18 3hmy n TYR 1170CO 0.00 0.00 0.00 -0.80 -0.46 0.00 0.00 176.86 175.60 3hmy s ASN 1171N -2.90 4.38 0.00 7.72 0.01 -1.26 -5.05 114.94 117.84 3hmy s ASN 1171Ca 0.00 -0.51 0.00 0.00 -0.71 0.00 0.00 52.86 51.64 3hmy s ASN 1171Cb 0.00 -0.80 0.00 0.00 0.41 0.00 0.00 41.25 40.86 3hmy s ASN 1171CO 0.00 0.11 0.00 0.61 -1.51 0.00 0.00 177.10 176.31 3hmy n GLY 1172N 0.13 -2.08 3.78 0.66 0.00 -1.26 -4.72 105.19 101.70 3hmy n GLY 1172Ca -0.11 -2.13 -0.36 0.00 0.00 0.00 0.00 46.02 43.42 3hmy n GLY 1172CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hmy s LEU 1173N 0.00 3.96 -0.24 0.99 1.43 -0.38 -4.99 118.68 119.44 3hmy s LEU 1173Ca 0.00 2.12 -0.10 0.00 -1.03 0.00 0.00 54.13 55.12 3hmy s LEU 1173Cb 0.00 -4.37 -0.05 0.00 0.03 0.00 0.00 46.19 41.81 3hmy s LEU 1173CO 0.00 -0.83 0.14 -0.54 0.23 0.00 0.00 176.35 175.36 3hmy s LYS 1174N -2.89 3.98 0.08 1.70 1.02 -1.26 -4.21 119.74 118.17 3hmy s LYS 1174Ca 0.65 -0.31 0.04 0.00 0.02 0.00 0.00 55.97 56.37 3hmy s LYS 1174Cb -0.23 -3.50 -0.04 0.00 -0.52 0.00 0.00 37.83 33.55 3hmy s LYS 1174CO 0.28 0.01 0.02 -0.06 -0.92 0.00 0.00 175.35 174.67 3hmy s PHE 1175N 1.18 3.03 -0.05 3.18 0.40 0.94 -0.28 117.98 126.38 3hmy s PHE 1175Ca 0.07 0.00 0.03 0.00 -0.60 0.00 0.00 56.93 56.42 3hmy s PHE 1175Cb -0.14 -1.56 0.01 0.00 0.51 0.00 0.00 43.02 41.84 3hmy s PHE 1175CO 0.05 0.49 -0.11 0.42 0.70 0.00 0.00 175.22 176.77 3hmy s ILE 1176N -1.32 1.02 -0.21 0.64 1.01 0.79 -0.77 121.20 122.36 3hmy s ILE 1176Ca 0.26 -0.44 -0.12 0.00 0.00 0.00 0.00 60.65 60.35 3hmy s ILE 1176Cb -0.12 -0.92 -0.05 0.00 0.01 0.00 0.00 42.46 41.38 3hmy s ILE 1176CO 0.19 0.32 0.22 -0.63 0.00 0.00 0.00 174.94 175.03 3hmy s ILE 1177N 0.46 5.34 0.15 2.92 1.01 -1.26 -0.97 121.20 128.85 3hmy s ILE 1177Ca -0.09 0.33 0.10 0.00 0.00 0.00 0.00 60.65 60.99 3hmy s ILE 1177Cb -0.13 -3.55 -0.04 0.00 0.01 0.00 0.00 42.46 38.75 3hmy s ILE 1177CO 0.02 0.36 -0.24 -0.54 0.00 0.00 0.00 174.94 174.54 3hmy s LYS 1178N 0.84 1.37 0.13 2.79 1.02 -0.43 -0.49 119.74 124.97 3hmy s LYS 1178Ca 0.11 -1.38 -0.31 0.00 0.02 0.00 0.00 55.97 54.41 3hmy s LYS 1178Cb -0.13 -1.71 -0.08 0.00 -0.52 0.00 0.00 37.83 35.39 3hmy s LYS 1178CO 0.03 0.39 1.33 1.03 -0.92 0.00 0.00 175.35 177.21 3hmy s ARG 1179N -2.33 4.36 0.20 1.68 0.52 -1.26 -1.14 118.95 120.98 3hmy s ARG 1179Ca 0.15 2.01 -0.03 0.00 -0.52 0.00 0.00 55.73 57.34 3hmy s ARG 1179Cb -0.09 -3.25 0.14 0.00 0.52 0.00 0.00 34.95 32.27 3hmy s ARG 1179CO 0.07 -0.35 1.54 -0.92 0.02 0.00 0.00 175.30 175.65 3hmy h TYR 1180N 6.43 0.72 -3.50 -0.53 3.20 -1.66 -3.44 116.97 118.19 3hmy h TYR 1180Ca -0.43 -0.23 -0.10 0.00 3.14 0.00 0.00 58.73 61.11 3hmy h TYR 1180Cb 1.21 -0.15 -0.16 0.00 1.54 0.00 0.00 36.73 39.17 3hmy h TYR 1180CO 0.65 0.96 -0.32 0.95 -1.64 0.00 0.00 178.16 178.76 3hmy s THR 1181N -4.13 0.10 0.06 1.81 -4.23 -1.26 -5.02 115.64 102.97 3hmy s THR 1181Ca -0.08 -0.85 -0.34 0.00 -1.18 0.00 0.00 61.69 59.24 3hmy s THR 1181Cb 0.12 -1.02 -0.13 0.00 1.34 0.00 0.00 72.50 72.81 3hmy s THR 1181CO 0.84 -0.47 1.68 -0.81 -0.54 0.00 0.00 174.62 175.32 3hmy n PRO 1182N 0.45 2.08 -3.03 3.99 -0.04 -1.26 -4.98 135.00 132.21 3hmy n PRO 1182Ca -0.18 0.76 -0.23 0.00 -0.04 0.00 0.00 63.50 63.81 3hmy n PRO 1182Cb 0.60 -2.54 0.01 0.00 -0.04 0.00 0.00 33.50 31.52 3hmy n PRO 1182CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3hmy s ASN 1183N 2.11 5.90 0.00 3.54 6.03 -1.26 -4.99 114.94 126.27 3hmy s ASN 1183Ca 0.85 0.31 0.00 0.00 -1.03 0.00 0.00 52.86 52.99 3hmy s ASN 1183Cb -0.71 -1.60 0.00 0.00 -3.03 0.00 0.00 41.25 35.91 3hmy s ASN 1183CO 0.44 -0.64 0.00 -3.20 -2.03 0.00 0.00 177.10 171.67 3hmy n ASN 1184N -2.04 0.00 -2.80 3.54 4.05 -1.26 -1.41 115.26 115.34 3hmy n ASN 1184Ca 0.01 0.00 -0.21 0.00 0.45 0.00 0.00 54.58 54.83 3hmy n ASN 1184Cb 0.57 0.00 -0.01 0.00 1.23 0.00 0.00 39.78 41.57 3hmy n ASN 1184CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 3hmy n GLU 1185N 0.00 2.27 -3.76 1.20 1.02 -1.26 -4.89 120.64 115.22 3hmy n GLU 1185Ca 0.00 -4.04 -0.27 0.00 -0.02 0.00 0.00 57.16 52.83 3hmy n GLU 1185Cb 0.00 -1.88 0.05 0.00 -0.02 0.00 0.00 31.44 29.59 3hmy n GLU 1185CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 3hmy n ILE 1186N -0.15 -2.66 -1.66 -3.67 5.41 -0.50 -4.87 119.36 111.26 3hmy n ILE 1186Ca 0.26 -0.04 -0.44 0.00 1.00 0.00 0.00 62.75 63.54 3hmy n ILE 1186Cb 0.63 -3.44 -0.02 0.00 -0.71 0.00 0.00 39.64 36.10 3hmy n ILE 1186CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 3hmy n ASP 1187N -2.93 2.38 0.21 4.38 8.00 -1.26 -4.86 116.55 122.47 3hmy n ASP 1187Ca 0.01 1.17 0.10 0.00 0.71 0.00 0.00 54.79 56.78 3hmy n ASP 1187Cb 0.55 -1.40 0.25 0.00 -0.02 0.00 0.00 41.12 40.50 3hmy n ASP 1187CO 0.00 0.00 0.00 0.77 -0.39 0.00 0.00 177.20 177.58 3hmy h SER 1188N 3.21 0.00 -3.43 -2.24 4.64 -1.96 -3.46 113.55 110.31 3hmy h SER 1188Ca -0.44 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.34 3hmy h SER 1188Cb 1.29 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.35 3hmy h SER 1188CO 0.68 0.16 -0.08 0.72 -0.87 0.00 0.00 176.83 177.44 3hmy s PHE 1189N -3.28 3.49 -0.21 4.77 -0.71 -1.26 -1.18 117.98 119.60 3hmy s PHE 1189Ca 0.04 0.99 -0.18 0.00 -1.04 0.00 0.00 56.93 56.75 3hmy s PHE 1189Cb 0.07 -2.34 -0.03 0.00 -1.21 0.00 0.00 43.02 39.51 3hmy s PHE 1189CO 0.66 0.31 0.49 0.08 -1.34 0.00 0.00 175.22 175.42 3hmy s VAL 1190N -1.70 5.12 0.10 -2.49 1.01 0.19 -4.84 120.40 117.79 3hmy s VAL 1190Ca 0.45 0.89 -0.05 0.00 0.00 0.00 0.00 61.98 63.26 3hmy s VAL 1190Cb -0.13 -3.81 -0.05 0.00 0.00 0.00 0.00 36.38 32.39 3hmy s VAL 1190CO 0.20 0.18 0.34 -0.54 0.00 0.00 0.00 175.10 175.28 3hmy s LYS 1191N 1.65 3.61 0.22 2.72 1.02 -1.26 -2.12 119.74 125.57 3hmy s LYS 1191Ca 0.22 -0.10 -0.31 0.00 0.02 0.00 0.00 55.97 55.81 3hmy s LYS 1191Cb -0.15 -2.93 -0.11 0.00 -0.52 0.00 0.00 37.83 34.12 3hmy s LYS 1191CO 0.09 0.53 1.59 0.45 -0.92 0.00 0.00 175.35 177.09 3hmy s SER 1192N -2.22 6.50 0.00 2.83 0.15 0.34 -1.34 113.70 119.96 3hmy s SER 1192Ca 0.37 2.76 0.00 0.00 0.70 0.00 0.00 55.95 59.77 3hmy s SER 1192Cb -0.13 -2.61 0.00 0.00 -1.71 0.00 0.00 66.02 61.57 3hmy s SER 1192CO 0.23 -0.86 0.00 0.61 1.20 0.00 0.00 173.24 174.42 3hmy n GLY 1193N 3.20 0.29 3.75 9.45 0.00 0.19 -4.96 105.19 117.10 3hmy n GLY 1193Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 3hmy n GLY 1193CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hmy s ASP 1194N -2.41 7.17 -0.02 1.61 1.11 -0.45 -4.80 116.67 118.88 3hmy s ASP 1194Ca 0.00 2.26 -0.18 0.00 0.18 0.00 0.00 52.55 54.81 3hmy s ASP 1194Cb 0.00 -2.62 -0.05 0.00 1.07 0.00 0.00 42.92 41.32 3hmy s ASP 1194CO 0.00 -0.26 0.52 -0.36 1.18 0.00 0.00 175.17 176.25 3hmy s PHE 1195N -0.66 3.68 0.31 4.23 0.08 -1.26 -0.42 117.98 123.93 3hmy s PHE 1195Ca 0.48 1.09 0.05 0.00 0.12 0.00 0.00 56.93 58.67 3hmy s PHE 1195Cb -0.32 -2.50 -0.03 0.00 -0.57 0.00 0.00 43.02 39.60 3hmy s PHE 1195CO 0.40 0.42 0.27 0.96 -0.10 0.00 0.00 175.22 177.17 3hmy s ILE 1196N -0.38 0.00 -0.09 0.64 -4.36 0.53 -1.97 121.20 115.58 3hmy s ILE 1196Ca 0.28 -1.96 0.02 0.00 -0.26 0.00 0.00 60.65 58.72 3hmy s ILE 1196Cb -0.17 -2.51 0.01 0.00 1.25 0.00 0.00 42.46 41.04 3hmy s ILE 1196CO 0.15 0.00 -0.15 -0.54 0.24 0.00 0.00 174.94 174.64 3hmy s LYS 1197N -3.53 2.05 -0.20 0.37 1.02 -0.29 -1.69 119.74 117.46 3hmy s LYS 1197Ca 0.40 -0.52 -0.10 0.00 0.02 0.00 0.00 55.97 55.77 3hmy s LYS 1197Cb 0.03 -1.69 -0.05 0.00 -0.52 0.00 0.00 37.83 35.60 3hmy s LYS 1197CO 0.24 0.00 0.13 -1.17 -0.92 0.00 0.00 175.35 173.63 3hmy s LEU 1198N 0.78 4.15 0.17 3.17 2.96 -1.26 -1.31 118.68 127.33 3hmy s LEU 1198Ca -0.12 0.19 0.10 0.00 -0.22 0.00 0.00 54.13 54.08 3hmy s LEU 1198Cb -0.16 -2.08 -0.04 0.00 0.50 0.00 0.00 46.19 44.42 3hmy s LEU 1198CO 0.02 0.16 -0.21 -0.31 -1.32 0.00 0.00 176.35 174.69 3hmy s TYR 1199N 0.47 2.02 -0.14 5.38 1.51 -0.15 0.02 117.35 126.46 3hmy s TYR 1199Ca 0.07 -0.42 -0.03 0.00 -1.01 0.00 0.00 57.07 55.69 3hmy s TYR 1199Cb -0.12 -1.02 -0.03 0.00 -0.11 0.00 0.00 41.96 40.69 3hmy s TYR 1199CO -0.01 0.38 -0.06 0.08 -1.11 0.00 0.00 175.55 174.84 3hmy s VAL 1200N -1.76 3.71 -0.54 0.71 1.01 -0.04 -0.15 120.40 123.35 3hmy s VAL 1200Ca 0.17 -0.43 -0.17 0.00 0.00 0.00 0.00 61.98 61.55 3hmy s VAL 1200Cb -0.07 -2.61 0.12 0.00 0.00 0.00 0.00 36.38 33.82 3hmy s VAL 1200CO 0.08 0.51 0.54 -0.55 0.00 0.00 0.00 175.10 175.67 3hmy s SER 1201N 0.26 6.18 -0.14 3.32 0.15 0.62 -1.31 113.70 122.78 3hmy s SER 1201Ca -0.04 -1.64 0.02 0.00 0.70 0.00 0.00 55.95 54.99 3hmy s SER 1201Cb -0.14 -2.23 0.00 0.00 -1.71 0.00 0.00 66.02 61.94 3hmy s SER 1201CO 0.03 -0.89 -0.20 -0.47 1.20 0.00 0.00 173.24 172.91 3hmy s TYR 1202N 1.86 2.69 -1.58 3.44 6.14 0.22 -4.37 117.35 125.76 3hmy s TYR 1202Ca 0.05 -1.16 -0.11 0.00 0.64 0.00 0.00 57.07 56.48 3hmy s TYR 1202Cb -0.28 -1.82 0.09 0.00 0.42 0.00 0.00 41.96 40.38 3hmy s TYR 1202CO 0.04 -0.51 0.69 0.09 0.64 0.00 0.00 175.55 176.50 3hmy n ASN 1203N 3.93 -2.50 0.00 4.32 3.02 -1.26 -0.09 115.26 122.68 3hmy n ASN 1203Ca -0.19 -0.97 0.00 0.00 -0.03 0.00 0.00 54.58 53.38 3hmy n ASN 1203Cb 0.52 -3.04 0.00 0.00 -0.61 0.00 0.00 39.78 36.65 3hmy n ASN 1203CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 3hmy n ASN 1204N -2.80 0.00 -4.81 6.41 4.05 -1.26 -4.98 115.26 111.88 3hmy n ASN 1204Ca -0.06 0.00 -0.36 0.00 0.45 0.00 0.00 54.58 54.61 3hmy n ASN 1204Cb 0.56 -1.01 -0.07 0.00 1.23 0.00 0.00 39.78 40.49 3hmy n ASN 1204CO 0.00 0.00 0.00 0.20 -3.05 0.00 0.00 177.26 174.41 3hmy s ASN 1205N -2.71 5.94 -0.16 1.20 0.01 0.87 -5.09 114.94 115.00 3hmy s ASN 1205Ca 0.00 0.33 -0.10 0.00 -0.71 0.00 0.00 52.86 52.38 3hmy s ASN 1205Cb 0.00 -1.83 -0.05 0.00 0.41 0.00 0.00 41.25 39.78 3hmy s ASN 1205CO 0.00 0.38 0.18 -1.61 -1.51 0.00 0.00 177.10 174.55 3hmy s GLU 1206N -1.06 3.98 -0.08 -0.60 2.02 -1.26 -0.61 118.70 121.07 3hmy s GLU 1206Ca 0.15 -0.09 0.01 0.00 0.02 0.00 0.00 54.97 55.06 3hmy s GLU 1206Cb -0.12 -3.34 0.02 0.00 0.10 0.00 0.00 34.13 30.79 3hmy s GLU 1206CO 0.05 0.45 -0.10 -1.01 0.02 0.00 0.00 175.26 174.66 3hmy s HIS 1207N -0.09 1.44 0.44 1.61 3.76 -0.43 -4.95 115.29 117.06 3hmy s HIS 1207Ca 0.13 -0.61 -0.24 0.00 -0.15 0.00 0.00 55.06 54.18 3hmy s HIS 1207Cb -0.12 -1.12 -0.08 0.00 1.11 0.00 0.00 32.58 32.37 3hmy s HIS 1207CO 0.02 -0.37 1.22 -1.50 -0.85 0.00 0.00 174.74 173.25 3hmy s ILE 1208N 1.09 2.91 -0.15 0.60 2.07 -1.26 -0.86 121.20 125.59 3hmy s ILE 1208Ca -0.07 0.73 -0.12 0.00 -1.41 0.00 0.00 60.65 59.79 3hmy s ILE 1208Cb -0.14 -3.40 -0.05 0.00 0.13 0.00 0.00 42.46 39.00 3hmy s ILE 1208CO -0.01 0.04 0.24 -0.69 -1.91 0.00 0.00 174.94 172.61 3hmy s VAL 1209N -1.41 5.34 0.07 4.00 1.01 0.10 -1.42 120.40 128.10 3hmy s VAL 1209Ca 0.61 0.43 -0.10 0.00 0.00 0.00 0.00 61.98 62.91 3hmy s VAL 1209Cb -0.33 -3.56 0.04 0.00 0.00 0.00 0.00 36.38 32.53 3hmy s VAL 1209CO 0.40 0.45 0.49 0.61 0.00 0.00 0.00 175.10 177.06 3hmy n GLY 1210N 3.08 0.91 2.98 4.51 0.00 -0.72 -4.64 105.19 111.32 3hmy n GLY 1210Ca -0.14 -1.02 -0.28 0.00 0.00 0.00 0.00 46.02 44.58 3hmy n GLY 1210CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3hmy s TYR 1211N -4.01 1.85 0.38 1.61 5.04 0.21 -0.40 117.35 122.04 3hmy s TYR 1211Ca 0.11 -0.96 -0.24 0.00 -2.44 0.00 0.00 57.07 53.54 3hmy s TYR 1211Cb -0.01 -1.41 -0.10 0.00 0.35 0.00 0.00 41.96 40.79 3hmy s TYR 1211CO 0.02 -0.56 0.98 -1.25 -1.34 0.00 0.00 175.55 173.40 3hmy s PRO 1212N 1.45 4.32 0.18 4.97 0.04 -1.26 -0.96 135.00 143.74 3hmy s PRO 1212Ca 0.02 1.33 -0.33 0.00 0.04 0.00 0.00 61.00 62.06 3hmy s PRO 1212Cb -0.13 -2.52 -0.14 0.00 0.04 0.00 0.00 34.50 31.75 3hmy s PRO 1212CO -0.08 0.04 1.43 1.17 0.04 0.00 0.00 177.00 179.60 3hmy n LYS 1213N -0.03 1.85 -1.32 4.56 4.81 -0.12 -0.27 118.16 127.63 3hmy n LYS 1213Ca 0.05 0.66 -0.11 0.00 -0.87 0.00 0.00 58.31 58.04 3hmy n LYS 1213Cb 0.51 -2.34 -0.05 0.00 0.02 0.00 0.00 35.03 33.18 3hmy n LYS 1213CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 3hmy n ASP 1214N 2.62 -5.43 -4.71 3.14 8.00 -1.26 -4.92 116.55 113.99 3hmy n ASP 1214Ca 0.15 0.28 -0.33 0.00 0.71 0.00 0.00 54.79 55.60 3hmy n ASP 1214Cb 0.28 -3.91 0.12 0.00 -0.02 0.00 0.00 41.12 37.59 3hmy n ASP 1214CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 3hmy s GLY 1215N -2.48 2.01 0.32 0.44 0.00 0.62 -4.90 107.32 103.35 3hmy s GLY 1215Ca 0.00 0.70 -0.28 0.00 0.00 0.00 0.00 44.72 45.14 3hmy s GLY 1215CO 0.00 1.11 1.20 -2.01 0.00 0.00 0.00 173.10 173.40 3hmy n ASN 1216N -3.42 2.29 -3.70 1.64 5.15 -1.26 -4.85 115.26 111.10 3hmy n ASN 1216Ca 0.12 1.20 -0.14 0.00 -0.60 0.00 0.00 54.58 55.16 3hmy n ASN 1216Cb 0.51 -1.42 -0.08 0.00 -0.53 0.00 0.00 39.78 38.27 3hmy n ASN 1216CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3hmy s ALA 1217N -1.05 -0.99 -0.31 5.20 0.00 -1.26 -2.75 121.76 120.60 3hmy s ALA 1217Ca 0.57 0.50 -0.29 0.00 0.00 0.00 0.00 51.96 52.73 3hmy s ALA 1217Cb -0.61 0.10 0.01 0.00 0.00 0.00 0.00 23.12 22.62 3hmy s ALA 1217CO 0.61 -0.31 1.20 -0.06 0.00 0.00 0.00 175.76 177.21 3hmy s PHE 1218N -1.49 2.88 -1.55 0.00 0.08 -0.31 -3.54 117.98 114.05 3hmy s PHE 1218Ca -0.12 0.99 -0.14 0.00 0.12 0.00 0.00 56.93 57.78 3hmy s PHE 1218Cb -0.04 -3.83 0.09 0.00 -0.57 0.00 0.00 43.02 38.68 3hmy s PHE 1218CO 0.04 -1.33 0.92 -1.71 -0.10 0.00 0.00 175.22 173.05 3hmy n ASN 1219N 7.30 -4.62 -1.43 1.36 5.15 -1.26 -1.78 115.26 119.98 3hmy n ASN 1219Ca 0.13 -0.77 -0.11 0.00 -0.60 0.00 0.00 54.58 53.23 3hmy n ASN 1219Cb 0.47 -3.70 -0.04 0.00 -0.53 0.00 0.00 39.78 35.97 3hmy n ASN 1219CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 3hmy n ASN 1220N -2.76 -2.92 0.00 1.20 4.13 -1.23 -4.69 115.26 108.99 3hmy n ASN 1220Ca 0.04 0.26 0.00 0.00 1.68 0.00 0.00 54.58 56.57 3hmy n ASN 1220Cb 0.52 -2.79 0.00 0.00 -1.54 0.00 0.00 39.78 35.98 3hmy n ASN 1220CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 3hmy n LEU 1221N -1.83 2.31 -4.31 3.41 4.77 -0.73 -4.94 117.00 115.68 3hmy n LEU 1221Ca -0.11 0.00 -0.46 0.00 -0.03 0.00 0.00 56.01 55.41 3hmy n LEU 1221Cb 0.38 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.43 3hmy n LEU 1221CO 0.16 0.39 0.25 -1.81 -1.33 0.00 0.00 177.39 175.05 3hmy s ASP 1222N -3.76 6.39 -0.08 -1.43 1.01 -1.00 -4.56 116.67 113.25 3hmy s ASP 1222Ca 0.00 -2.19 -0.30 0.00 0.71 0.00 0.00 52.55 50.78 3hmy s ASP 1222Cb 0.00 -2.20 -0.04 0.00 1.01 0.00 0.00 42.92 41.69 3hmy s ASP 1222CO 0.00 -0.73 1.52 -0.13 0.21 0.00 0.00 175.17 176.05 3hmy s ARG 1223N 0.97 4.20 -0.19 8.23 3.00 -0.46 -1.16 118.95 133.54 3hmy s ARG 1223Ca 0.10 2.02 -0.29 0.00 0.00 0.00 0.00 55.73 57.56 3hmy s ARG 1223Cb -0.21 -3.89 -0.01 0.00 0.00 0.00 0.00 34.95 30.84 3hmy s ARG 1223CO -0.02 -0.79 1.27 0.42 0.00 0.00 0.00 175.30 176.18 3hmy s ILE 1224N 3.75 4.26 0.59 1.52 1.01 -1.11 -0.68 121.20 130.54 3hmy s ILE 1224Ca 0.67 1.51 -0.18 0.00 0.00 0.00 0.00 60.65 62.64 3hmy s ILE 1224Cb -0.30 -4.03 -0.04 0.00 0.01 0.00 0.00 42.46 38.11 3hmy s ILE 1224CO 0.25 -0.20 1.17 -0.76 0.00 0.00 0.00 174.94 175.41 3hmy s LEU 1225N 3.67 3.65 0.04 2.97 1.43 -0.84 -4.78 118.68 124.80 3hmy s LEU 1225Ca 0.55 2.28 0.05 0.00 -1.03 0.00 0.00 54.13 55.98 3hmy s LEU 1225Cb -0.21 -4.59 -0.02 0.00 0.03 0.00 0.00 46.19 41.40 3hmy s LEU 1225CO 0.16 -1.51 -0.14 -0.13 0.23 0.00 0.00 176.35 174.96 3hmy s ARG 1226N -3.42 0.91 -0.30 1.70 1.81 0.47 -4.20 118.95 115.93 3hmy s ARG 1226Ca 0.75 -0.74 -0.04 0.00 -1.72 0.00 0.00 55.73 53.98 3hmy s ARG 1226Cb -0.27 -0.91 0.03 0.00 -0.45 0.00 0.00 34.95 33.35 3hmy s ARG 1226CO 0.32 0.23 0.04 0.08 -0.68 0.00 0.00 175.30 175.29 3hmy s VAL 1227N -0.84 3.46 -0.67 3.52 1.01 -0.37 -1.76 120.40 124.75 3hmy s VAL 1227Ca 0.01 -1.08 -0.01 0.00 0.00 0.00 0.00 61.98 60.90 3hmy s VAL 1227Cb -0.08 -2.89 0.00 0.00 0.00 0.00 0.00 36.38 33.41 3hmy s VAL 1227CO 0.01 -0.04 0.13 0.61 0.00 0.00 0.00 175.10 175.82 3hmy n GLY 1228N 4.75 0.12 3.74 4.51 0.00 -0.51 0.21 105.19 118.01 3hmy n GLY 1228Ca -0.14 -0.47 -0.41 0.00 0.00 0.00 0.00 46.02 45.00 3hmy n GLY 1228CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3hmy s TYR 1229N -2.62 3.23 -0.09 1.61 6.14 -1.26 -3.75 117.35 120.61 3hmy s TYR 1229Ca 0.07 1.26 0.17 0.00 0.64 0.00 0.00 57.07 59.21 3hmy s TYR 1229Cb -0.03 -3.61 0.33 0.00 0.42 0.00 0.00 41.96 39.07 3hmy s TYR 1229CO 0.08 -1.86 1.16 0.27 0.64 0.00 0.00 175.55 175.84 3hmy n ASN 1230N 2.28 0.34 -4.68 4.32 0.23 -1.26 -5.02 115.26 111.46 3hmy n ASN 1230Ca 0.05 -2.03 -0.42 0.00 -0.53 0.00 0.00 54.58 51.65 3hmy n ASN 1230Cb 0.43 -0.08 -0.03 0.00 -2.08 0.00 0.00 39.78 38.02 3hmy n ASN 1230CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3hmy s ALA 1231N -0.72 3.69 0.46 -2.53 0.00 -1.26 -4.92 121.76 116.48 3hmy s ALA 1231Ca 0.21 1.29 -0.25 0.00 0.00 0.00 0.00 51.96 53.21 3hmy s ALA 1231Cb 0.28 -3.75 -0.08 0.00 0.00 0.00 0.00 23.12 19.57 3hmy s ALA 1231CO -0.10 -1.25 1.42 -0.35 0.00 0.00 0.00 175.76 175.48 3hmy n PRO 1232N 6.10 2.20 -0.65 0.00 -0.04 -1.26 -2.57 135.00 138.78 3hmy n PRO 1232Ca 0.17 0.78 0.00 0.00 -0.04 0.00 0.00 63.50 64.42 3hmy n PRO 1232Cb 0.40 -2.61 0.00 0.00 -0.04 0.00 0.00 33.50 31.25 3hmy n PRO 1232CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3hmy n GLY 1233N 0.61 1.08 3.34 0.55 0.00 -1.26 -4.98 105.19 104.52 3hmy n GLY 1233Ca 0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.70 3hmy n GLY 1233CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hmy s ILE 1234N -3.00 4.06 0.33 -0.61 1.01 -1.06 -5.07 121.20 116.85 3hmy s ILE 1234Ca 0.00 -0.81 -0.29 0.00 0.00 0.00 0.00 60.65 59.55 3hmy s ILE 1234Cb 0.00 -3.17 -0.11 0.00 0.01 0.00 0.00 42.46 39.19 3hmy s ILE 1234CO 0.00 -0.04 1.56 -2.16 0.00 0.00 0.00 174.94 174.31 3hmy s PRO 1235N 1.49 4.10 -0.23 2.79 0.04 -1.26 -4.80 135.00 137.13 3hmy s PRO 1235Ca 0.02 2.61 -0.02 0.00 0.04 0.00 0.00 61.00 63.64 3hmy s PRO 1235Cb -0.18 -2.99 0.02 0.00 0.04 0.00 0.00 34.50 31.39 3hmy s PRO 1235CO 0.03 -0.62 -0.08 -1.17 0.04 0.00 0.00 177.00 175.21 3hmy s LEU 1236N -1.21 2.94 -0.27 -3.56 2.96 -1.26 -0.95 118.68 117.33 3hmy s LEU 1236Ca 0.59 -0.74 -0.26 0.00 -0.22 0.00 0.00 54.13 53.51 3hmy s LEU 1236Cb -0.48 -1.65 0.00 0.00 0.50 0.00 0.00 46.19 44.57 3hmy s LEU 1236CO 0.55 -0.08 0.89 -0.31 -1.32 0.00 0.00 176.35 176.07 3hmy s TYR 1237N 1.35 3.25 0.00 5.38 2.02 -0.14 -4.86 117.35 124.35 3hmy s TYR 1237Ca 0.02 1.09 0.00 0.00 -0.37 0.00 0.00 57.07 57.81 3hmy s TYR 1237Cb -0.15 -3.24 0.00 0.00 -0.40 0.00 0.00 41.96 38.17 3hmy s TYR 1237CO -0.06 -0.52 0.06 0.36 -1.57 0.00 0.00 175.55 173.82 3hmy n LYS 1238N 6.25 3.05 -2.08 -0.62 2.85 -1.26 -0.62 118.16 125.74 3hmy n LYS 1238Ca 0.07 -0.06 -0.42 0.00 -1.05 0.00 0.00 58.31 56.85 3hmy n LYS 1238Cb 0.47 -0.38 -0.03 0.00 -0.65 0.00 0.00 35.03 34.45 3hmy n LYS 1238CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 177.40 177.56 3hmy s LYS 1239N -0.45 4.19 0.32 -1.58 2.20 -1.26 -4.55 119.74 118.61 3hmy s LYS 1239Ca 0.00 2.10 0.08 0.00 -0.36 0.00 0.00 55.97 57.79 3hmy s LYS 1239Cb 0.00 -3.93 -0.06 0.00 -1.51 0.00 0.00 37.83 32.33 3hmy s LYS 1239CO 0.00 -0.81 -0.06 -1.64 -0.36 0.00 0.00 175.35 172.48 3hmy s MET 1240N 3.85 1.70 -0.09 4.03 -1.94 -0.68 -0.99 119.30 125.18 3hmy s MET 1240Ca 0.70 -1.88 0.01 0.00 -1.71 0.00 0.00 55.69 52.81 3hmy s MET 1240Cb -0.32 -1.40 0.02 0.00 2.01 0.00 0.00 34.83 35.14 3hmy s MET 1240CO 0.27 0.06 -0.10 -2.00 -0.01 0.00 0.00 175.02 173.24 3hmy s GLU 1241N -3.69 1.66 -0.28 2.03 2.12 0.56 -0.34 118.70 120.76 3hmy s GLU 1241Ca 0.31 -0.35 -0.22 0.00 0.36 0.00 0.00 54.97 55.08 3hmy s GLU 1241Cb 0.04 -1.54 -0.01 0.00 0.26 0.00 0.00 34.13 32.88 3hmy s GLU 1241CO 0.14 -0.13 0.71 0.00 -0.54 0.00 0.00 175.26 175.44 3hmy s ALA 1242N 1.21 3.58 0.13 6.30 0.00 0.44 -1.62 121.76 131.80 3hmy s ALA 1242Ca -0.04 -0.42 0.01 0.00 0.00 0.00 0.00 51.96 51.50 3hmy s ALA 1242Cb -0.14 -3.16 -0.04 0.00 0.00 0.00 0.00 23.12 19.78 3hmy s ALA 1242CO -0.03 -0.98 -0.01 0.14 0.00 0.00 0.00 175.76 174.88 3hmy s VAL 1243N 2.70 0.48 -0.39 0.00 -7.23 -0.82 0.53 120.40 115.67 3hmy s VAL 1243Ca 0.29 -1.93 0.03 0.00 -1.81 0.00 0.00 61.98 58.56 3hmy s VAL 1243Cb -0.15 -1.91 0.11 0.00 0.56 0.00 0.00 36.38 34.99 3hmy s VAL 1243CO 0.10 -0.64 0.14 -0.75 -0.31 0.00 0.00 175.10 173.63 3hmy s LYS 1244N -3.93 1.44 -0.00 4.82 2.47 -1.26 -1.46 119.74 121.82 3hmy s LYS 1244Ca 0.19 -1.94 0.17 0.00 -1.56 0.00 0.00 55.97 52.82 3hmy s LYS 1244Cb 0.06 -2.90 -0.19 0.00 -1.46 0.00 0.00 37.83 33.34 3hmy s LYS 1244CO -0.01 -1.02 0.69 1.28 0.16 0.00 0.00 175.35 176.46 3hmy n LEU 1245N 3.97 0.73 -3.74 5.43 4.32 -1.26 -5.05 117.00 121.39 3hmy n LEU 1245Ca 0.04 -0.45 -0.06 0.00 -0.02 0.00 0.00 56.01 55.52 3hmy n LEU 1245Cb 0.38 0.00 -0.02 0.00 -1.62 0.00 0.00 43.42 42.17 3hmy n LEU 1245CO 0.23 0.18 0.59 0.00 -1.22 0.00 0.00 177.39 177.18 3hmy s ARG 1246N -2.68 1.40 -0.96 3.23 1.70 -1.26 -5.03 118.95 115.35 3hmy s ARG 1246Ca 0.05 -0.74 -0.09 0.00 -0.47 0.00 0.00 55.73 54.49 3hmy s ARG 1246Cb 0.13 0.50 -0.02 0.00 -0.57 0.00 0.00 34.95 34.99 3hmy s ARG 1246CO 0.71 -0.64 0.77 -3.47 -1.08 0.00 0.00 175.30 171.59 3hmy n ASP 1247N -0.44 -6.31 -0.34 -2.89 -0.08 -1.26 -4.90 116.55 100.32 3hmy n ASP 1247Ca -0.06 -0.66 0.15 0.00 -1.51 0.00 0.00 54.79 52.70 3hmy n ASP 1247Cb 0.61 -4.13 0.34 0.00 2.34 0.00 0.00 41.12 40.28 3hmy n ASP 1247CO 0.00 0.00 0.00 0.25 0.12 0.00 0.00 177.20 177.57 3hmy h LEU 1248N -0.79 0.70 -0.27 -2.67 5.85 -1.98 -1.75 115.31 114.39 3hmy h LEU 1248Ca -0.45 0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.39 3hmy h LEU 1248Cb 1.25 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.28 3hmy h LEU 1248CO 0.40 0.18 0.00 0.29 -0.34 0.00 0.00 178.44 178.98 3hmy n LYS 1249N -4.84 0.17 -3.82 1.25 5.02 -1.26 -4.78 118.16 109.90 3hmy n LYS 1249Ca 0.24 0.27 -0.37 0.00 -2.02 0.00 0.00 58.31 56.44 3hmy n LYS 1249Cb 0.64 -1.75 -0.06 0.00 -0.02 0.00 0.00 35.03 33.84 3hmy n LYS 1249CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 3hmy s THR 1250N -3.16 5.44 -1.45 -0.18 2.01 -0.66 -4.99 115.64 112.64 3hmy s THR 1250Ca 0.08 0.30 -0.11 0.00 0.31 0.00 0.00 61.69 62.27 3hmy s THR 1250Cb 0.12 -3.45 0.04 0.00 0.01 0.00 0.00 72.50 69.22 3hmy s THR 1250CO 0.46 0.61 2.36 -1.22 -0.69 0.00 0.00 174.62 176.14 3hmy n TYR 1251N 2.03 3.04 -4.43 4.92 4.01 -1.26 -4.89 117.16 120.58 3hmy n TYR 1251Ca -0.19 -2.96 -0.22 0.00 -0.16 0.00 0.00 57.90 54.38 3hmy n TYR 1251Cb 0.54 -2.35 -0.10 0.00 -0.31 0.00 0.00 39.34 37.12 3hmy n TYR 1251CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 3hmy s SER 1252N 2.19 2.91 0.08 7.72 1.04 -1.26 -4.30 113.70 122.08 3hmy s SER 1252Ca 0.52 -1.15 0.03 0.00 0.48 0.00 0.00 55.95 55.83 3hmy s SER 1252Cb 0.15 -0.19 -0.03 0.00 0.10 0.00 0.00 66.02 66.04 3hmy s SER 1252CO -0.06 -0.27 -0.10 -0.69 0.98 0.00 0.00 173.24 173.10 3hmy s VAL 1253N -2.92 0.85 0.18 5.02 1.01 0.79 -4.83 120.40 120.50 3hmy s VAL 1253Ca 0.29 -1.45 0.09 0.00 0.00 0.00 0.00 61.98 60.91 3hmy s VAL 1253Cb 0.02 -1.12 -0.04 0.00 0.00 0.00 0.00 36.38 35.24 3hmy s VAL 1253CO 0.12 -0.47 -0.10 -1.10 0.00 0.00 0.00 175.10 173.55 3hmy s GLN 1254N -2.34 2.04 -0.09 2.72 1.11 -0.53 -1.21 119.66 121.36 3hmy s GLN 1254Ca 0.00 -1.28 -0.00 0.00 0.01 0.00 0.00 55.36 54.09 3hmy s GLN 1254Cb -0.06 -2.15 0.02 0.00 -1.01 0.00 0.00 33.01 29.82 3hmy s GLN 1254CO 0.00 0.43 -0.06 -0.51 0.01 0.00 0.00 175.29 175.17 3hmy s LEU 1255N -2.82 1.08 -0.19 2.90 1.43 -1.26 -1.94 118.68 117.87 3hmy s LEU 1255Ca 0.25 -0.23 -0.06 0.00 -1.03 0.00 0.00 54.13 53.05 3hmy s LEU 1255Cb -0.09 -0.70 -0.03 0.00 0.03 0.00 0.00 46.19 45.40 3hmy s LEU 1255CO 0.15 -0.12 0.04 -0.75 0.23 0.00 0.00 176.35 175.90 3hmy s LYS 1256N 1.60 3.81 -0.07 1.70 2.20 -0.64 0.05 119.74 128.39 3hmy s LYS 1256Ca 0.02 -0.43 -0.07 0.00 -0.36 0.00 0.00 55.97 55.13 3hmy s LYS 1256Cb -0.13 -3.17 -0.04 0.00 -1.51 0.00 0.00 37.83 32.98 3hmy s LYS 1256CO -0.06 0.13 0.20 -1.17 -0.36 0.00 0.00 175.35 174.09 3hmy s LEU 1257N 0.73 4.39 0.16 5.43 2.96 -0.06 -0.32 118.68 131.97 3hmy s LEU 1257Ca 0.02 0.52 0.10 0.00 -0.22 0.00 0.00 54.13 54.56 3hmy s LEU 1257Cb -0.14 -2.30 -0.04 0.00 0.50 0.00 0.00 46.19 44.21 3hmy s LEU 1257CO 0.02 0.35 -0.23 -0.31 -1.32 0.00 0.00 176.35 174.86 3hmy s TYR 1258N -1.12 2.15 0.00 5.38 1.51 -0.16 -0.11 117.35 125.00 3hmy s TYR 1258Ca 0.20 -0.39 0.00 0.00 -1.01 0.00 0.00 57.07 55.87 3hmy s TYR 1258Cb -0.13 -1.11 0.00 0.00 -0.11 0.00 0.00 41.96 40.61 3hmy s TYR 1258CO 0.09 0.39 0.00 -0.40 -1.11 0.00 0.00 175.55 174.52 3hmy n ASP 1259N 0.55 0.00 0.11 2.29 5.68 -0.62 -4.30 116.55 120.25 3hmy n ASP 1259Ca -0.15 -0.95 0.12 0.00 -0.50 0.00 0.00 54.79 53.30 3hmy n ASP 1259Cb 0.55 0.00 0.47 0.00 -1.14 0.00 0.00 41.12 41.00 3hmy n ASP 1259CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 3hmy n ASP 1260N -2.86 0.62 -1.17 -1.12 5.68 -1.26 -2.37 116.55 114.07 3hmy n ASP 1260Ca 0.00 0.63 0.12 0.00 -0.50 0.00 0.00 54.79 55.04 3hmy n ASP 1260Cb 0.00 -0.77 0.25 0.00 -1.14 0.00 0.00 41.12 39.46 3hmy n ASP 1260CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 3hmy n LYS 1261N -2.16 2.51 -1.30 0.11 4.01 -1.26 -4.93 118.16 115.14 3hmy n LYS 1261Ca 0.03 -2.30 -0.08 0.00 -0.51 0.00 0.00 58.31 55.45 3hmy n LYS 1261Cb 0.26 -1.52 -0.03 0.00 -0.51 0.00 0.00 35.03 33.23 3hmy n LYS 1261CO 0.00 0.00 0.00 0.09 -1.11 0.00 0.00 177.40 176.38 3hmy n ASN 1262N 1.46 -3.94 -4.86 4.39 3.02 -1.00 -5.02 115.26 109.31 3hmy n ASN 1262Ca 0.20 0.19 -0.32 0.00 -0.03 0.00 0.00 54.58 54.63 3hmy n ASN 1262Cb 0.59 -2.25 -0.06 0.00 -0.61 0.00 0.00 39.78 37.46 3hmy n ASN 1262CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3hmy s ALA 1263N -2.32 3.36 0.03 5.41 0.00 -1.26 -4.82 121.76 122.17 3hmy s ALA 1263Ca 0.00 -0.04 -0.30 0.00 0.00 0.00 0.00 51.96 51.62 3hmy s ALA 1263Cb 0.00 -2.71 -0.05 0.00 0.00 0.00 0.00 23.12 20.36 3hmy s ALA 1263CO 0.00 0.32 1.27 0.45 0.00 0.00 0.00 175.76 177.80 3hmy s SER 1264N -2.39 6.99 0.00 0.00 0.15 -1.26 -1.59 113.70 115.60 3hmy s SER 1264Ca 0.53 2.04 0.24 0.00 0.70 0.00 0.00 55.95 59.45 3hmy s SER 1264Cb -0.10 -2.57 0.21 0.00 -1.71 0.00 0.00 66.02 61.84 3hmy s SER 1264CO 0.19 -0.57 1.24 0.18 1.20 0.00 0.00 173.24 175.49 3hmy n LEU 1265N 4.48 2.31 0.00 3.45 4.77 0.84 -4.91 117.00 127.94 3hmy n LEU 1265Ca 0.11 -0.80 0.00 0.00 -0.03 0.00 0.00 56.01 55.29 3hmy n LEU 1265Cb 0.45 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.53 3hmy n LEU 1265CO 0.56 0.40 0.00 0.61 -1.33 0.00 0.00 177.39 177.64 3hmy n GLY 1266N 1.37 1.04 3.88 -0.72 0.00 -1.22 -3.38 105.19 106.16 3hmy n GLY 1266Ca 0.12 -2.22 -0.35 0.00 0.00 0.00 0.00 46.02 43.57 3hmy n GLY 1266CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hmy s LEU 1267N 0.00 4.36 0.07 0.99 1.43 -0.27 -0.88 118.68 124.37 3hmy s LEU 1267Ca 0.00 0.68 -0.31 0.00 -1.03 0.00 0.00 54.13 53.47 3hmy s LEU 1267Cb 0.00 -2.85 -0.07 0.00 0.03 0.00 0.00 46.19 43.30 3hmy s LEU 1267CO 0.00 0.21 1.41 -0.69 0.23 0.00 0.00 176.35 177.51 3hmy s VAL 1268N -1.36 3.46 0.00 -1.59 1.01 0.11 -1.77 120.40 120.26 3hmy s VAL 1268Ca 0.31 0.97 0.00 0.00 0.00 0.00 0.00 61.98 63.26 3hmy s VAL 1268Cb -0.14 -3.63 0.00 0.00 0.00 0.00 0.00 36.38 32.62 3hmy s VAL 1268CO 0.17 0.04 0.00 0.61 0.00 0.00 0.00 175.10 175.92 3hmy n GLY 1269N 3.59 4.11 3.09 4.51 0.00 0.38 -4.35 105.19 116.51 3hmy n GLY 1269Ca 0.12 -0.72 -0.10 0.00 0.00 0.00 0.00 46.02 45.33 3hmy n GLY 1269CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3hmy s THR 1270N -0.35 0.44 -0.02 2.61 -4.23 -1.26 -1.12 115.64 111.72 3hmy s THR 1270Ca 0.00 -1.51 0.01 0.00 -1.18 0.00 0.00 61.69 59.01 3hmy s THR 1270Cb 0.00 -1.12 0.01 0.00 1.34 0.00 0.00 72.50 72.73 3hmy s THR 1270CO 0.00 -0.71 -0.03 -2.28 -0.54 0.00 0.00 174.62 171.06 3hmy s HIS 1271N -2.74 0.44 0.01 3.99 2.46 0.13 -4.87 115.29 114.70 3hmy s HIS 1271Ca 0.00 -0.08 -0.25 0.00 0.47 0.00 0.00 55.06 55.21 3hmy s HIS 1271Cb -0.01 -0.36 -0.05 0.00 -0.13 0.00 0.00 32.58 32.03 3hmy s HIS 1271CO -0.04 -0.07 0.75 1.21 -2.47 0.00 0.00 174.74 174.13 3hmy s ASN 1272N 0.33 7.15 0.00 9.88 3.84 -1.26 -0.83 114.94 134.05 3hmy s ASN 1272Ca -0.03 1.38 0.00 0.00 0.21 0.00 0.00 52.86 54.41 3hmy s ASN 1272Cb -0.07 -2.45 0.00 0.00 -0.55 0.00 0.00 41.25 38.18 3hmy s ASN 1272CO -0.00 -0.03 0.00 0.61 -2.79 0.00 0.00 177.10 174.88 3hmy n GLY 1273N 2.61 -0.57 3.09 1.21 0.00 -0.54 -4.99 105.19 105.99 3hmy n GLY 1273Ca -0.02 -1.00 -0.08 0.00 0.00 0.00 0.00 46.02 44.92 3hmy n GLY 1273CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3hmy s GLN 1274N -1.52 0.58 -0.21 1.61 0.00 -1.26 -0.19 119.66 118.66 3hmy s GLN 1274Ca 0.00 -0.99 -0.00 0.00 -0.00 0.00 0.00 55.36 54.37 3hmy s GLN 1274Cb 0.00 0.21 0.02 0.00 0.00 0.00 0.00 33.01 33.24 3hmy s GLN 1274CO 0.00 -0.12 -0.12 0.42 0.00 0.00 0.00 175.29 175.46 3hmy s ILE 1275N -3.21 2.55 0.00 3.63 1.01 -1.26 -5.01 121.20 118.91 3hmy s ILE 1275Ca 0.00 -0.93 0.00 0.00 0.00 0.00 0.00 60.65 59.72 3hmy s ILE 1275Cb 0.03 -2.19 0.00 0.00 0.01 0.00 0.00 42.46 40.31 3hmy s ILE 1275CO -0.07 0.38 0.00 0.61 0.00 0.00 0.00 174.94 175.85 3hmy n GLY 1276N 4.65 3.77 1.40 6.18 0.00 -1.26 -1.59 105.19 118.34 3hmy n GLY 1276Ca -0.19 -0.04 0.10 0.00 0.00 0.00 0.00 46.02 45.89 3hmy n GLY 1276CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3hmy n ASN 1277N 5.76 4.26 -4.76 1.61 3.02 -1.26 -4.99 115.26 118.90 3hmy n ASN 1277Ca 0.00 -2.22 -0.32 0.00 -0.03 0.00 0.00 54.58 52.01 3hmy n ASN 1277Cb 0.00 -0.51 0.09 0.00 -0.61 0.00 0.00 39.78 38.74 3hmy n ASN 1277CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 3hmy s ASP 1278N -0.98 4.53 0.80 6.41 1.01 -0.62 -4.99 116.67 122.83 3hmy s ASP 1278Ca 0.48 1.92 -0.12 0.00 0.71 0.00 0.00 52.55 55.54 3hmy s ASP 1278Cb 0.28 -2.54 0.08 0.00 1.01 0.00 0.00 42.92 41.76 3hmy s ASP 1278CO 0.28 -2.02 1.15 -2.84 0.21 0.00 0.00 175.17 171.95 3hmy s PRO 1279N -4.62 1.79 0.27 8.23 0.02 -1.26 -4.51 135.00 134.92 3hmy s PRO 1279Ca 0.64 1.52 -0.31 0.00 0.02 0.00 0.00 61.00 62.87 3hmy s PRO 1279Cb -0.19 -1.82 -0.12 0.00 0.02 0.00 0.00 34.50 32.40 3hmy s PRO 1279CO 0.52 -2.05 1.64 -1.71 -0.33 0.00 0.00 177.00 175.06 3hmy n ASN 1280N -3.45 3.91 -3.88 2.53 2.85 -1.26 -4.70 115.26 111.24 3hmy n ASN 1280Ca 0.12 1.12 -0.09 0.00 -0.11 0.00 0.00 54.58 55.62 3hmy n ASN 1280Cb 0.52 -1.59 -0.07 0.00 1.24 0.00 0.00 39.78 39.87 3hmy n ASN 1280CO 0.00 0.00 0.00 -0.13 -2.11 0.00 0.00 177.26 175.02 3hmy s ARG 1281N -0.01 0.87 -0.64 1.20 0.52 0.73 -4.95 118.95 116.66 3hmy s ARG 1281Ca 0.67 -1.00 -0.19 0.00 -0.52 0.00 0.00 55.73 54.69 3hmy s ARG 1281Cb -0.50 0.34 0.11 0.00 0.52 0.00 0.00 34.95 35.42 3hmy s ARG 1281CO 0.44 -0.28 0.75 -0.51 0.02 0.00 0.00 175.30 175.72 3hmy s ASP 1282N -2.88 6.26 -0.04 0.23 1.01 -1.26 -1.47 116.67 118.52 3hmy s ASP 1282Ca 0.07 -1.56 -0.18 0.00 0.71 0.00 0.00 52.55 51.58 3hmy s ASP 1282Cb 0.05 -2.31 -0.05 0.00 1.01 0.00 0.00 42.92 41.62 3hmy s ASP 1282CO -0.10 -1.08 0.50 -0.63 0.21 0.00 0.00 175.17 174.07 3hmy s ILE 1283N 2.55 5.03 0.13 0.77 1.01 -0.01 -1.58 121.20 129.10 3hmy s ILE 1283Ca 0.14 1.04 -0.31 0.00 0.00 0.00 0.00 60.65 61.52 3hmy s ILE 1283Cb -0.21 -3.83 -0.10 0.00 0.01 0.00 0.00 42.46 38.33 3hmy s ILE 1283CO 0.04 0.43 1.62 -0.76 0.00 0.00 0.00 174.94 176.27 3hmy s LEU 1284N -0.17 4.37 0.33 2.97 2.01 -0.56 -0.69 118.68 126.93 3hmy s LEU 1284Ca 0.27 2.60 0.04 0.00 0.01 0.00 0.00 54.13 57.05 3hmy s LEU 1284Cb -0.17 -3.58 -0.02 0.00 0.01 0.00 0.00 46.19 42.43 3hmy s LEU 1284CO 0.14 -0.87 0.33 0.27 1.01 0.00 0.00 176.35 177.23 3hmy s ILE 1285N 1.75 0.00 -0.07 -0.59 -5.25 -0.27 -1.99 121.20 114.77 3hmy s ILE 1285Ca 0.72 -1.89 0.02 0.00 -0.99 0.00 0.00 60.65 58.51 3hmy s ILE 1285Cb -0.43 -2.54 0.02 0.00 2.95 0.00 0.00 42.46 42.46 3hmy s ILE 1285CO 0.32 0.00 -0.11 0.00 -1.79 0.00 0.00 174.94 173.36 3hmy s ALA 1286N -3.37 1.23 -0.10 2.27 0.00 0.15 -0.47 121.76 121.47 3hmy s ALA 1286Ca 0.38 -0.41 -0.14 0.00 0.00 0.00 0.00 51.96 51.79 3hmy s ALA 1286Cb 0.02 -0.61 0.03 0.00 0.00 0.00 0.00 23.12 22.57 3hmy s ALA 1286CO 0.25 0.03 0.36 0.45 0.00 0.00 0.00 175.76 176.85 3hmy s SER 1287N 0.83 -0.34 0.00 0.00 0.15 -0.73 -1.35 113.70 112.26 3hmy s SER 1287Ca -0.12 0.56 0.29 0.00 0.70 0.00 0.00 55.95 57.39 3hmy s SER 1287Cb -0.15 0.63 1.36 0.00 -1.71 0.00 0.00 66.02 66.14 3hmy s SER 1287CO 0.02 -0.23 1.97 0.59 1.20 0.00 0.00 173.24 176.79 3hmy n ASN 1288N 2.39 0.06 -0.35 5.45 3.02 -1.26 -1.12 115.26 123.45 3hmy n ASN 1288Ca -0.16 0.05 0.10 0.00 -0.03 0.00 0.00 54.58 54.54 3hmy n ASN 1288Cb 0.57 -0.33 0.28 0.00 -0.61 0.00 0.00 39.78 39.69 3hmy n ASN 1288CO 0.00 0.00 0.00 -0.25 -2.62 0.00 0.00 177.26 174.39 3hmy h TRP 1289N 0.05 1.07 -0.38 3.10 7.01 -1.95 -1.87 115.95 122.98 3hmy h TRP 1289Ca 0.00 0.03 0.06 0.00 2.11 0.00 0.00 58.89 61.10 3hmy h TRP 1289Cb 0.38 -0.33 -0.02 0.00 -2.10 0.00 0.00 29.16 27.09 3hmy h TRP 1289CO 0.00 0.32 0.26 1.88 -2.79 0.00 0.00 178.44 178.11 3hmy h TYR 1290N 0.85 0.24 0.00 2.65 0.05 -1.94 -2.06 116.97 116.76 3hmy h TYR 1290Ca 0.53 0.01 0.00 0.00 0.05 0.00 0.00 58.73 59.32 3hmy h TYR 1290Cb 0.71 -0.08 0.00 0.00 1.01 0.00 0.00 36.73 38.37 3hmy h TYR 1290CO -0.01 0.13 0.00 1.19 -1.05 0.00 0.00 178.16 178.42 3hmy n PHE 1291N -4.47 0.54 -0.30 4.88 3.72 -0.70 -1.22 117.46 119.90 3hmy n PHE 1291Ca 0.05 0.26 0.10 0.00 -0.05 0.00 0.00 57.45 57.81 3hmy n PHE 1291Cb 0.27 -0.91 0.28 0.00 -0.94 0.00 0.00 39.48 38.18 3hmy n PHE 1291CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 3hmy n ASN 1292N -2.03 3.71 -0.81 4.37 5.15 -0.78 -4.37 115.26 120.49 3hmy n ASN 1292Ca 0.00 -2.00 0.01 0.00 -0.60 0.00 0.00 54.58 52.00 3hmy n ASN 1292Cb 0.08 -0.42 0.01 0.00 -0.53 0.00 0.00 39.78 38.91 3hmy n ASN 1292CO 0.00 0.00 0.00 1.41 1.40 0.00 0.00 177.26 180.07 3hmy n HIS 1293N 1.39 0.00 0.03 1.20 8.25 -0.36 -4.90 115.22 120.83 3hmy n HIS 1293Ca 0.21 -0.16 0.01 0.00 -0.26 0.00 0.00 57.72 57.53 3hmy n HIS 1293Cb 0.58 -0.07 0.08 0.00 1.12 0.00 0.00 29.99 31.69 3hmy n HIS 1293CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 3hmy n LEU 1294N 0.16 0.07 -0.10 2.41 4.77 -1.14 -1.60 117.00 121.57 3hmy n LEU 1294Ca 0.02 0.53 0.11 0.00 -0.03 0.00 0.00 56.01 56.64 3hmy n LEU 1294Cb 0.84 -0.54 0.13 0.00 -2.33 0.00 0.00 43.42 41.52 3hmy n LEU 1294CO -0.01 -0.55 0.32 0.29 -1.33 0.00 0.00 177.39 176.11 3hmy n LYS 1295N -1.60 0.30 -1.67 3.23 5.02 -1.26 -4.88 118.16 117.30 3hmy n LYS 1295Ca -0.00 -0.21 -0.37 0.00 -2.02 0.00 0.00 58.31 55.71 3hmy n LYS 1295Cb 0.01 -1.50 0.07 0.00 -0.02 0.00 0.00 35.03 33.59 3hmy n LYS 1295CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 3hmy n ASP 1296N -1.17 1.76 -0.07 4.39 8.00 -0.62 -4.92 116.55 123.91 3hmy n ASP 1296Ca 0.07 0.81 -0.11 0.00 0.71 0.00 0.00 54.79 56.27 3hmy n ASP 1296Cb 0.35 -1.52 -0.04 0.00 -0.02 0.00 0.00 41.12 39.89 3hmy n ASP 1296CO 0.00 0.00 0.00 0.07 -0.39 0.00 0.00 177.20 176.88 3hmy h LYS 1297N 0.42 0.35 -5.55 -1.24 2.10 -1.93 -3.42 116.57 107.31 3hmy h LYS 1297Ca -0.50 -0.07 -0.67 0.00 -2.00 0.00 0.00 60.65 57.41 3hmy h LYS 1297Cb 1.34 -0.05 -0.32 0.00 -0.90 0.00 0.00 32.23 32.30 3hmy h LYS 1297CO 0.52 0.42 -0.88 0.42 -2.00 0.00 0.00 179.45 177.94 3hmy s ILE 1298N -5.46 1.96 -0.01 0.07 -1.09 -1.26 -5.03 121.20 110.38 3hmy s ILE 1298Ca -0.14 -0.99 0.01 0.00 -2.23 0.00 0.00 60.65 57.30 3hmy s ILE 1298Cb 0.08 -1.68 0.00 0.00 -1.58 0.00 0.00 42.46 39.28 3hmy s ILE 1298CO 0.72 0.54 -0.01 -0.22 -1.23 0.00 0.00 174.94 174.74 3hmy s LEU 1299N 0.15 1.85 0.00 2.97 2.96 -1.26 -5.04 118.68 120.31 3hmy s LEU 1299Ca -0.12 -0.03 0.12 0.00 -0.22 0.00 0.00 54.13 53.88 3hmy s LEU 1299Cb -0.16 -0.11 0.63 0.00 0.50 0.00 0.00 46.19 47.05 3hmy s LEU 1299CO 0.06 -0.00 1.23 0.61 -1.32 0.00 0.00 176.35 176.93 3hmy n GLY 1300N 3.23 -0.57 1.17 7.98 0.00 -1.26 -2.72 105.19 113.02 3hmy n GLY 1300Ca -0.15 -0.06 0.11 0.00 0.00 0.00 0.00 46.02 45.92 3hmy n GLY 1300CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hmy s ASP 1302N -1.19 6.49 -0.00 0.00 1.01 -1.10 -4.47 116.67 117.40 3hmy s ASP 1302Ca 0.42 0.58 0.05 0.00 0.71 0.00 0.00 52.55 54.31 3hmy s ASP 1302Cb 0.23 -2.20 -0.01 0.00 1.01 0.00 0.00 42.92 41.94 3hmy s ASP 1302CO 0.31 0.10 -0.16 0.26 0.21 0.00 0.00 175.17 175.89 3hmy s TRP 1303N 0.40 1.42 -0.06 4.23 0.52 -0.35 -1.52 118.94 123.58 3hmy s TRP 1303Ca 0.18 -0.28 -0.13 0.00 0.02 0.00 0.00 56.10 55.89 3hmy s TRP 1303Cb -0.13 -0.90 -0.05 0.00 -1.15 0.00 0.00 33.47 31.23 3hmy s TRP 1303CO 0.05 -0.01 0.33 0.71 0.02 0.00 0.00 176.95 178.05 3hmy s TYR 1304N -0.45 3.65 -0.35 -1.98 2.02 0.65 -0.15 117.35 120.74 3hmy s TYR 1304Ca 0.06 0.82 -0.04 0.00 -0.37 0.00 0.00 57.07 57.53 3hmy s TYR 1304Cb -0.06 -2.22 0.07 0.00 -0.40 0.00 0.00 41.96 39.34 3hmy s TYR 1304CO -0.00 0.60 0.11 -0.06 -1.57 0.00 0.00 175.55 174.63 3hmy s PHE 1305N -0.79 3.36 -0.36 2.71 0.40 -1.26 -1.90 117.98 120.13 3hmy s PHE 1305Ca 0.21 -1.86 -0.11 0.00 -0.60 0.00 0.00 56.93 54.57 3hmy s PHE 1305Cb -0.15 -2.55 0.02 0.00 0.51 0.00 0.00 43.02 40.84 3hmy s PHE 1305CO 0.10 -0.83 0.21 0.08 0.70 0.00 0.00 175.22 175.47 3hmy s VAL 1306N 1.28 4.72 0.15 -0.44 1.01 0.79 -0.76 120.40 127.16 3hmy s VAL 1306Ca 0.00 -0.69 -0.04 0.00 0.00 0.00 0.00 61.98 61.26 3hmy s VAL 1306Cb -0.21 -3.57 -0.05 0.00 0.00 0.00 0.00 36.38 32.55 3hmy s VAL 1306CO -0.00 -0.16 0.37 -2.16 0.00 0.00 0.00 175.10 173.14 3hmy s PRO 1307N 1.60 3.59 0.44 2.72 0.04 -1.26 -0.29 135.00 141.82 3hmy s PRO 1307Ca 0.03 -0.16 -0.25 0.00 0.04 0.00 0.00 61.00 60.66 3hmy s PRO 1307Cb -0.19 -2.86 -0.08 0.00 0.04 0.00 0.00 34.50 31.42 3hmy s PRO 1307CO 0.07 0.46 1.35 0.95 0.04 0.00 0.00 177.00 179.87 3hmy s THR 1308N -1.69 2.40 -0.12 1.26 -4.23 -1.26 -5.00 115.64 106.99 3hmy s THR 1308Ca 0.40 0.35 -0.11 0.00 -1.18 0.00 0.00 61.69 61.15 3hmy s THR 1308Cb -0.12 -3.20 0.03 0.00 1.34 0.00 0.00 72.50 70.55 3hmy s THR 1308CO 0.26 0.04 0.32 -0.62 -0.54 0.00 0.00 174.62 174.08 3hmy s ASP 1309N -0.70 -0.34 0.10 3.99 -1.08 -1.26 -5.02 116.67 112.37 3hmy s ASP 1309Ca 0.60 0.65 0.12 0.00 -0.52 0.00 0.00 52.55 53.39 3hmy s ASP 1309Cb -0.40 0.65 0.54 0.00 -1.46 0.00 0.00 42.92 42.25 3hmy s ASP 1309CO 0.51 -0.11 1.36 -1.84 0.52 0.00 0.00 175.17 175.61 3hmy n GLU 1310N 2.97 0.05 0.00 4.34 0.28 -1.26 -1.22 120.64 125.81 3hmy n GLU 1310Ca -0.13 0.44 0.15 0.00 -0.16 0.00 0.00 57.16 57.46 3hmy n GLU 1310Cb 0.58 -1.64 0.71 0.00 1.43 0.00 0.00 31.44 32.52 3hmy n GLU 1310CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3hmy n GLY 1311N -0.81 -0.88 2.84 -1.84 0.00 -1.26 -4.66 105.19 98.59 3hmy n GLY 1311Ca 0.01 -0.26 -0.13 0.00 0.00 0.00 0.00 46.02 45.64 3hmy n GLY 1311CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3hmy s TRP 1312N -2.29 -0.59 -0.08 1.61 -0.11 -0.36 -0.41 118.94 116.71 3hmy s TRP 1312Ca 0.35 0.57 0.03 0.00 1.22 0.00 0.00 56.10 58.27 3hmy s TRP 1312Cb 0.21 -0.15 0.00 0.00 -1.50 0.00 0.00 33.47 32.04 3hmy s TRP 1312CO 0.43 -0.67 -0.18 0.99 -4.62 0.00 0.00 176.95 172.89 3hmy s THR 1313N 2.45 1.60 0.24 5.86 2.01 -1.26 -4.51 115.64 122.03 3hmy s THR 1313Ca 0.10 -0.76 -0.30 0.00 0.31 0.00 0.00 61.69 61.05 3hmy s THR 1313Cb -0.16 -1.40 -0.09 0.00 0.01 0.00 0.00 72.50 70.86 3hmy s THR 1313CO -0.14 0.46 1.26 0.20 -0.69 0.00 0.00 174.62 175.71 3hmy s ASN 1314N 0.42 6.95 0.00 3.53 0.01 -1.26 -4.94 114.94 119.65 3hmy s ASN 1314Ca -0.15 2.42 0.17 0.00 -0.71 0.00 0.00 52.86 54.59 3hmy s ASN 1314Cb -0.16 -2.62 0.99 0.00 0.41 0.00 0.00 41.25 39.87 3hmy s ASN 1314CO 0.06 -0.45 1.40 0.47 -1.51 0.00 0.00 177.10 177.07