#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dnr h SER 887 N 0.00 0.55 -3.30 1.61 4.64 -2.10 -3.40 113.55 111.55 2dnr h SER 887 Ca 0.00 -0.62 -0.73 0.00 -0.47 0.00 0.00 61.79 59.97 2dnr h SER 887 Cb 0.00 -0.16 -0.26 0.00 -0.31 0.00 0.00 62.40 61.67 2dnr h SER 887 CO 0.00 1.07 -0.36 -0.44 -0.87 0.00 0.00 176.83 176.23 2dnr s SER 888 N -6.54 5.89 -0.26 4.97 0.01 -1.26 -5.04 113.70 111.48 2dnr s SER 888 Ca -0.13 -1.62 -0.37 0.00 1.31 0.00 0.00 55.95 55.13 2dnr s SER 888 Cb 0.05 -2.09 -0.14 0.00 0.21 0.00 0.00 66.02 64.06 2dnr s SER 888 CO 0.81 -0.67 1.91 0.61 0.41 0.00 0.00 173.24 176.30 2dnr n GLY 889 N 5.05 0.90 3.60 3.44 0.00 -1.26 -4.80 105.19 112.12 2dnr n GLY 889 Ca -0.11 0.92 -0.49 0.00 0.00 0.00 0.00 46.02 46.34 2dnr n GLY 889 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2dnr n SER 890 N 6.93 2.90 -3.51 1.61 3.41 -1.26 -4.89 113.62 118.80 2dnr n SER 890 Ca 0.30 0.71 -0.04 0.00 -0.26 0.00 0.00 58.87 59.57 2dnr n SER 890 Cb 0.19 -1.33 0.00 0.00 -0.26 0.00 0.00 64.21 62.81 2dnr n SER 890 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2dnr s SER 891 N 5.60 -0.10 0.00 4.04 0.01 -1.26 -5.00 113.70 117.00 2dnr s SER 891 Ca 1.00 -0.63 0.00 0.00 1.31 0.00 0.00 55.95 57.63 2dnr s SER 891 Cb -0.74 0.57 0.00 0.00 0.21 0.00 0.00 66.02 66.06 2dnr s SER 891 CO 0.50 -1.10 0.00 0.61 0.41 0.00 0.00 173.24 173.67 2dnr n GLY 892 N -0.55 -1.83 2.03 3.44 0.00 -1.26 -4.59 105.19 102.43 2dnr n GLY 892 Ca -0.05 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.96 2dnr n GLY 892 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dnr n GLY 893 N 0.00 0.38 3.67 -0.02 0.00 -1.26 -2.61 105.19 105.34 2dnr n GLY 893 Ca 0.00 -0.08 -0.42 0.00 0.00 0.00 0.00 46.02 45.52 2dnr n GLY 893 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2dnr s THR 894 N 0.06 4.80 0.03 2.61 2.01 -1.26 -2.41 115.64 121.48 2dnr s THR 894 Ca 0.04 1.85 0.08 0.00 0.31 0.00 0.00 61.69 63.97 2dnr s THR 894 Cb 0.20 -4.23 -0.03 0.00 0.01 0.00 0.00 72.50 68.45 2dnr s THR 894 CO -0.06 -0.04 -0.21 0.68 -0.69 0.00 0.00 174.62 174.30 2dnr s VAL 895 N 2.45 2.55 -0.02 3.82 -7.23 0.43 -3.77 120.40 118.64 2dnr s VAL 895 Ca 0.42 -1.21 -0.16 0.00 -1.81 0.00 0.00 61.98 59.23 2dnr s VAL 895 Cb -0.16 -2.03 -0.05 0.00 0.56 0.00 0.00 36.38 34.69 2dnr s VAL 895 CO 0.12 0.39 0.43 -0.76 -0.31 0.00 0.00 175.10 174.96 2dnr s LEU 896 N -1.26 4.44 -0.02 1.32 1.02 0.11 -0.27 118.68 124.03 2dnr s LEU 896 Ca 0.13 0.94 -0.00 0.00 0.02 0.00 0.00 54.13 55.22 2dnr s LEU 896 Cb -0.10 -2.62 0.03 0.00 0.02 0.00 0.00 46.19 43.52 2dnr s LEU 896 CO 0.03 0.26 0.03 -0.69 0.02 0.00 0.00 176.35 176.00 2dnr s VAL 897 N -0.74 -0.05 0.13 -1.59 1.01 -0.17 -0.52 120.40 118.47 2dnr s VAL 897 Ca 0.24 0.19 0.05 0.00 0.00 0.00 0.00 61.98 62.46 2dnr s VAL 897 Cb -0.16 -0.08 -0.04 0.00 0.00 0.00 0.00 36.38 36.10 2dnr s VAL 897 CO 0.13 0.08 -0.12 -0.55 0.00 0.00 0.00 175.10 174.64 2dnr s SER 898 N 0.95 1.85 -0.05 3.32 0.15 -0.23 -1.06 113.70 118.64 2dnr s SER 898 Ca -0.08 -0.87 0.06 0.00 0.70 0.00 0.00 55.95 55.76 2dnr s SER 898 Cb -0.11 -0.04 -0.01 0.00 -1.71 0.00 0.00 66.02 64.15 2dnr s SER 898 CO -0.03 -0.22 -0.22 0.27 1.20 0.00 0.00 173.24 174.24 2dnr s ILE 899 N -2.53 1.82 -0.23 6.45 -4.36 -1.26 -0.29 121.20 120.81 2dnr s ILE 899 Ca 0.11 -0.94 -0.29 0.00 -0.26 0.00 0.00 60.65 59.27 2dnr s ILE 899 Cb -0.02 -1.54 0.01 0.00 1.25 0.00 0.00 42.46 42.15 2dnr s ILE 899 CO 0.02 0.51 1.05 -0.75 0.24 0.00 0.00 174.94 176.01 2dnr s LYS 900 N -0.13 4.26 0.31 0.37 2.47 0.10 -4.90 119.74 122.22 2dnr s LYS 900 Ca -0.02 1.37 0.03 0.00 -1.56 0.00 0.00 55.97 55.80 2dnr s LYS 900 Cb -0.12 -3.65 -0.04 0.00 -1.46 0.00 0.00 37.83 32.56 2dnr s LYS 900 CO 0.03 -0.64 0.17 -1.54 0.16 0.00 0.00 175.35 173.53 2dnr s SER 901 N 1.25 1.60 -0.12 1.43 1.04 -1.26 -4.30 113.70 113.33 2dnr s SER 901 Ca 0.45 -1.58 -0.01 0.00 0.48 0.00 0.00 55.95 55.28 2dnr s SER 901 Cb -0.15 0.41 -0.07 0.00 0.10 0.00 0.00 66.02 66.30 2dnr s SER 901 CO 0.07 -0.90 -0.13 -0.24 0.98 0.00 0.00 173.24 173.02 2dnr n SER 902 N -0.99 2.37 -4.87 7.02 2.88 -1.26 -5.02 113.62 113.75 2dnr n SER 902 Ca 0.01 0.01 -0.31 0.00 -1.33 0.00 0.00 58.87 57.25 2dnr n SER 902 Cb 0.65 -0.25 -0.04 0.00 -0.75 0.00 0.00 64.21 63.81 2dnr n SER 902 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2dnr s LEU 903 N -6.03 3.96 0.31 2.46 1.43 -1.26 -4.98 118.68 114.56 2dnr s LEU 903 Ca -0.17 1.12 0.26 0.00 -1.03 0.00 0.00 54.13 54.31 2dnr s LEU 903 Cb 0.05 -3.96 0.81 0.00 0.03 0.00 0.00 46.19 43.12 2dnr s LEU 903 CO 0.26 -0.29 1.75 1.55 0.23 0.00 0.00 176.35 179.86 2dnr h PRO 904 N 1.74 0.00 -0.62 1.29 0.13 -2.03 -3.04 132.00 129.46 2dnr h PRO 904 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2dnr h PRO 904 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2dnr h PRO 904 CO 0.65 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.57 2dnr n GLU 905 N -2.52 4.32 -0.01 0.86 0.28 -1.26 -4.22 120.64 118.09 2dnr n GLU 905 Ca 0.04 -2.97 -0.01 0.00 -0.16 0.00 0.00 57.16 54.06 2dnr n GLU 905 Cb 0.39 -2.09 -0.01 0.00 1.43 0.00 0.00 31.44 31.16 2dnr n GLU 905 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 2dnr n ASN 906 N 0.85 4.18 -0.32 -1.84 5.03 -1.15 -4.65 115.26 117.36 2dnr n ASN 906 Ca 0.26 -0.01 0.33 0.00 0.87 0.00 0.00 54.58 56.04 2dnr n ASN 906 Cb 1.05 0.25 0.52 0.00 -1.02 0.00 0.00 39.78 40.57 2dnr n ASN 906 CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 2dnr h ASN 907 N 0.00 0.00 -2.89 6.41 7.08 -1.73 -3.38 115.58 121.07 2dnr h ASN 907 Ca -0.05 0.00 -0.54 0.00 -3.08 0.00 0.00 56.30 52.62 2dnr h ASN 907 Cb 1.09 0.00 -0.00 0.00 -2.08 0.00 0.00 38.32 37.33 2dnr h ASN 907 CO -0.00 0.00 0.85 -0.36 -2.08 0.00 0.00 177.43 175.84 2dnr s PHE 908 N -4.53 2.81 0.23 4.14 0.08 -1.26 -4.79 117.98 114.66 2dnr s PHE 908 Ca -0.03 0.80 -0.31 0.00 0.12 0.00 0.00 56.93 57.51 2dnr s PHE 908 Cb 0.17 -3.66 -0.11 0.00 -0.57 0.00 0.00 43.02 38.84 2dnr s PHE 908 CO 0.56 -2.47 1.64 -0.06 -0.10 0.00 0.00 175.22 174.79 2dnr s PHE 909 N 2.54 2.88 0.38 0.36 0.40 -1.26 -5.00 117.98 118.29 2dnr s PHE 909 Ca 0.64 0.58 0.05 0.00 -0.60 0.00 0.00 56.93 57.60 2dnr s PHE 909 Cb -0.31 -4.06 -0.00 0.00 0.51 0.00 0.00 43.02 39.16 2dnr s PHE 909 CO 0.26 -3.82 0.55 0.34 0.70 0.00 0.00 175.22 173.25 2dnr s ASP 910 N 0.88 5.87 0.20 1.36 2.15 -1.26 -4.90 116.67 120.97 2dnr s ASP 910 Ca 0.69 -0.07 -0.15 0.00 0.43 0.00 0.00 52.55 53.45 2dnr s ASP 910 Cb -0.48 -1.25 0.20 0.00 -0.30 0.00 0.00 42.92 41.10 2dnr s ASP 910 CO 0.38 -0.57 1.64 -0.78 -0.17 0.00 0.00 175.17 175.67 2dnr h ASP 911 N 0.70 -0.54 -0.25 -0.34 3.58 -1.99 0.30 116.42 117.88 2dnr h ASP 911 Ca -0.45 0.17 0.04 0.00 0.42 0.00 0.00 57.03 57.21 2dnr h ASP 911 Cb 1.26 0.36 -0.03 0.00 1.72 0.00 0.00 39.33 42.63 2dnr h ASP 911 CO 0.53 -0.19 0.04 0.00 -2.88 0.00 0.00 179.24 176.74 2dnr h ALA 912 N 1.56 0.25 -0.13 -0.78 0.00 -1.98 0.30 119.26 118.48 2dnr h ALA 912 Ca 0.27 0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.27 2dnr h ALA 912 Cb 0.42 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 2dnr h ALA 912 CO -0.59 -0.38 -0.06 -0.07 0.00 0.00 0.00 179.25 178.14 2dnr h LEU 913 N 0.12 -0.21 0.51 0.00 3.38 -1.58 -0.34 115.31 117.20 2dnr h LEU 913 Ca 0.12 0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.11 2dnr h LEU 913 Cb 0.13 0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.00 2dnr h LEU 913 CO -0.17 -0.08 -0.24 0.40 0.09 0.00 0.00 178.44 178.44 2dnr h ILE 914 N -0.05 0.00 -0.83 1.22 2.04 -0.69 -1.43 117.51 117.77 2dnr h ILE 914 Ca 0.07 -0.12 0.11 0.00 1.00 0.00 0.00 64.86 65.92 2dnr h ILE 914 Cb 0.16 0.00 -0.13 0.00 -0.74 0.00 0.00 36.82 36.11 2dnr h ILE 914 CO -0.16 0.00 -0.45 -0.78 0.00 0.00 0.00 178.15 176.76 2dnr h ASP 915 N -0.80 -1.63 -0.51 1.72 3.58 -0.42 0.25 116.42 118.60 2dnr h ASP 915 Ca -0.07 0.29 0.08 0.00 0.42 0.00 0.00 57.03 57.75 2dnr h ASP 915 Cb 0.52 0.77 -0.06 0.00 1.72 0.00 0.00 39.33 42.28 2dnr h ASP 915 CO 0.11 -0.29 0.15 -0.33 -2.88 0.00 0.00 179.24 176.00 2dnr h GLU 916 N -0.09 0.30 0.15 0.28 4.39 -1.10 -2.63 114.58 115.88 2dnr h GLU 916 Ca 0.24 -0.02 0.02 0.00 0.34 0.00 0.00 59.36 59.93 2dnr h GLU 916 Cb 0.54 -0.07 -0.04 0.00 -0.10 0.00 0.00 28.75 29.08 2dnr h GLU 916 CO -0.86 0.20 -0.34 -0.07 -1.16 0.00 0.00 179.01 176.78 2dnr h LEU 917 N 0.31 -0.99 -0.68 1.33 3.38 0.55 -2.74 115.31 116.47 2dnr h LEU 917 Ca 0.25 0.11 0.06 0.00 0.09 0.00 0.00 57.88 58.40 2dnr h LEU 917 Cb 0.31 0.37 -0.08 0.00 0.09 0.00 0.00 40.66 41.35 2dnr h LEU 917 CO -0.29 -0.44 -0.40 0.18 0.09 0.00 0.00 178.44 177.59 2dnr n LEU 918 N -5.43 -0.72 -0.08 1.67 4.77 -0.14 0.70 117.00 117.76 2dnr n LEU 918 Ca -0.07 1.25 -0.06 0.00 -0.03 0.00 0.00 56.01 57.09 2dnr n LEU 918 Cb 0.34 -0.18 -0.00 0.00 -2.33 0.00 0.00 43.42 41.26 2dnr n LEU 918 CO 0.23 -1.00 0.76 1.56 -1.33 0.00 0.00 177.39 177.60 2dnr h GLN 919 N 0.00 -0.09 -1.00 3.23 4.20 -1.50 -0.53 115.11 119.42 2dnr h GLN 919 Ca 0.11 0.01 0.16 0.00 0.06 0.00 0.00 58.65 58.99 2dnr h GLN 919 Cb 0.28 0.02 -0.10 0.00 0.30 0.00 0.00 27.48 27.98 2dnr h GLN 919 CO -0.64 -0.06 0.62 1.96 -0.67 0.00 0.00 178.83 180.04 2dnr h GLN 920 N -0.09 0.83 -0.31 1.46 1.08 0.56 -1.06 115.11 117.58 2dnr h GLN 920 Ca 0.16 -0.05 -0.06 0.00 -1.45 0.00 0.00 58.65 57.25 2dnr h GLN 920 Cb 0.34 -0.19 -0.01 0.00 -0.05 0.00 0.00 27.48 27.57 2dnr h GLN 920 CO -0.38 0.55 -0.04 0.74 -0.95 0.00 0.00 178.83 178.75 2dnr h PHE 921 N 0.85 0.64 -0.97 2.96 0.04 0.63 -2.87 116.94 118.22 2dnr h PHE 921 Ca 0.55 -0.12 0.25 0.00 2.80 0.00 0.00 57.97 61.44 2dnr h PHE 921 Cb 0.74 -0.16 -0.06 0.00 2.20 0.00 0.00 35.95 38.67 2dnr h PHE 921 CO -0.01 0.73 0.65 0.00 -0.60 0.00 0.00 178.31 179.09 2dnr h ALA 922 N 0.82 2.46 -1.44 2.45 0.00 0.15 0.98 119.26 124.68 2dnr h ALA 922 Ca 0.08 0.01 0.46 0.00 0.00 0.00 0.00 54.91 55.46 2dnr h ALA 922 Cb 0.50 0.02 -0.12 0.00 0.00 0.00 0.00 17.79 18.20 2dnr h ALA 922 CO 0.02 -0.78 0.96 1.03 0.00 0.00 0.00 179.25 180.48 2dnr h SER 923 N 0.26 0.18 0.00 0.00 0.87 -1.26 -3.17 113.55 110.45 2dnr h SER 923 Ca 0.50 0.11 0.00 0.00 -1.23 0.00 0.00 61.79 61.17 2dnr h SER 923 Cb 1.50 0.10 0.00 0.00 -0.44 0.00 0.00 62.40 63.56 2dnr h SER 923 CO -0.15 -0.15 -0.82 0.49 -0.53 0.00 0.00 176.83 175.67 2dnr n PHE 924 N -4.54 -0.00 -4.64 2.24 3.01 -0.24 -5.08 117.46 108.21 2dnr n PHE 924 Ca 0.38 0.00 -0.23 0.00 1.01 0.00 0.00 57.45 58.62 2dnr n PHE 924 Cb 1.54 0.00 -0.15 0.00 -0.01 0.00 0.00 39.48 40.87 2dnr n PHE 924 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 2dnr s GLY 925 N -4.83 0.79 -0.70 1.37 0.00 0.17 -4.95 107.32 99.17 2dnr s GLY 925 Ca 0.00 -0.73 -0.24 0.00 0.00 0.00 0.00 44.72 43.76 2dnr s GLY 925 CO 0.00 -0.64 1.07 1.85 0.00 0.00 0.00 173.10 175.39 2dnr s GLU 926 N -0.59 3.16 0.41 2.90 2.12 -1.26 -2.13 118.70 123.32 2dnr s GLU 926 Ca 0.05 -0.70 -0.24 0.00 0.36 0.00 0.00 54.97 54.45 2dnr s GLU 926 Cb -0.07 -4.26 -0.11 0.00 0.26 0.00 0.00 34.13 29.95 2dnr s GLU 926 CO -0.00 -1.92 0.92 0.28 -0.54 0.00 0.00 175.26 173.99 2dnr n VAL 927 N 6.07 2.32 0.00 3.70 0.31 -1.26 -3.94 118.33 125.52 2dnr n VAL 927 Ca -0.00 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.83 2dnr n VAL 927 Cb 0.47 -1.01 0.00 0.00 -0.91 0.00 0.00 33.84 32.38 2dnr n VAL 927 CO 0.00 0.00 0.00 2.30 -1.32 0.00 0.00 176.83 177.81 2dnr n ILE 928 N -0.53 0.00 -4.11 2.52 -5.35 -1.23 -4.93 119.36 105.73 2dnr n ILE 928 Ca 0.10 0.00 -0.14 0.00 -0.27 0.00 0.00 62.75 62.44 2dnr n ILE 928 Cb 0.39 -0.98 -0.12 0.00 -1.74 0.00 0.00 39.64 37.18 2dnr n ILE 928 CO 0.00 0.00 0.00 -0.22 -1.76 0.00 0.00 176.55 174.57 2dnr s LEU 929 N -5.48 2.17 -0.02 7.28 2.96 -1.26 -5.06 118.68 119.28 2dnr s LEU 929 Ca 0.00 -0.40 0.03 0.00 -0.22 0.00 0.00 54.13 53.55 2dnr s LEU 929 Cb 0.00 -0.23 -0.00 0.00 0.50 0.00 0.00 46.19 46.46 2dnr s LEU 929 CO 0.00 -0.10 -0.12 -0.63 -1.32 0.00 0.00 176.35 174.18 2dnr s ILE 930 N -0.94 1.01 -0.12 6.68 1.01 -1.26 -0.03 121.20 127.55 2dnr s ILE 930 Ca -0.05 -0.51 0.01 0.00 0.00 0.00 0.00 60.65 60.09 2dnr s ILE 930 Cb -0.07 -0.87 0.02 0.00 0.01 0.00 0.00 42.46 41.55 2dnr s ILE 930 CO 0.00 0.30 -0.13 -0.60 0.00 0.00 0.00 174.94 174.51 2dnr s ARG 931 N -0.06 2.10 -0.18 2.79 6.06 0.92 -4.97 118.95 125.60 2dnr s ARG 931 Ca 0.00 -0.50 -0.21 0.00 -2.50 0.00 0.00 55.73 52.52 2dnr s ARG 931 Cb -0.08 -1.90 -0.02 0.00 0.06 0.00 0.00 34.95 33.01 2dnr s ARG 931 CO 0.00 -0.17 0.66 -0.06 -2.50 0.00 0.00 175.30 173.23 2dnr s PHE 932 N 1.32 3.40 0.33 5.12 0.08 -1.26 0.99 117.98 127.97 2dnr s PHE 932 Ca 0.00 0.99 -0.03 0.00 0.12 0.00 0.00 56.93 58.01 2dnr s PHE 932 Cb -0.14 -2.82 -0.04 0.00 -0.57 0.00 0.00 43.02 39.45 2dnr s PHE 932 CO -0.07 -0.16 0.58 0.08 -0.10 0.00 0.00 175.22 175.55 2dnr s VAL 933 N 1.83 5.05 0.12 -0.44 1.01 0.38 -4.89 120.40 123.46 2dnr s VAL 933 Ca 0.30 -0.15 -0.12 0.00 0.00 0.00 0.00 61.98 62.01 2dnr s VAL 933 Cb -0.16 -3.80 0.08 0.00 0.00 0.00 0.00 36.38 32.50 2dnr s VAL 933 CO 0.11 -0.48 0.87 -0.62 0.00 0.00 0.00 175.10 174.98 2dnr n GLU 934 N -1.45 -0.17 0.00 2.72 -0.58 -1.26 -2.93 120.64 116.97 2dnr n GLU 934 Ca -0.03 0.86 0.00 0.00 -0.42 0.00 0.00 57.16 57.57 2dnr n GLU 934 Cb 0.55 -1.27 0.00 0.00 -0.57 0.00 0.00 31.44 30.15 2dnr n GLU 934 CO 0.00 0.00 0.00 -0.40 -0.48 0.00 0.00 177.13 176.25 2dnr n ASP 935 N -4.79 4.53 -4.94 1.62 5.68 -1.26 -5.04 116.55 112.36 2dnr n ASP 935 Ca 0.04 0.00 -0.20 0.00 -0.50 0.00 0.00 54.79 54.13 2dnr n ASP 935 Cb 0.20 0.63 0.05 0.00 -1.14 0.00 0.00 41.12 40.86 2dnr n ASP 935 CO 0.00 0.00 0.00 -0.75 -1.33 0.00 0.00 177.20 175.12 2dnr s LYS 936 N -1.87 2.40 -0.25 0.11 2.20 -1.15 -4.90 119.74 116.28 2dnr s LYS 936 Ca 0.00 -1.14 -0.02 0.00 -0.36 0.00 0.00 55.97 54.45 2dnr s LYS 936 Cb 0.00 -2.56 0.08 0.00 -1.51 0.00 0.00 37.83 33.84 2dnr s LYS 936 CO 0.00 -0.77 0.05 1.41 -0.36 0.00 0.00 175.35 175.68 2dnr s MET 937 N -4.71 0.80 0.19 4.03 -2.45 -0.22 0.14 119.30 117.09 2dnr s MET 937 Ca 0.59 -0.76 -0.22 0.00 -1.25 0.00 0.00 55.69 54.06 2dnr s MET 937 Cb -0.08 -2.11 -0.08 0.00 1.25 0.00 0.00 34.83 33.80 2dnr s MET 937 CO 0.38 -0.78 0.74 -1.58 1.05 0.00 0.00 175.02 174.83 2dnr s TRP 938 N 1.70 3.76 -0.05 4.11 0.52 0.28 -0.99 118.94 128.26 2dnr s TRP 938 Ca 0.03 1.48 0.01 0.00 0.02 0.00 0.00 56.10 57.64 2dnr s TRP 938 Cb -0.17 -2.67 0.02 0.00 -1.15 0.00 0.00 33.47 29.49 2dnr s TRP 938 CO -0.15 0.42 -0.07 0.08 0.02 0.00 0.00 176.95 177.25 2dnr s VAL 939 N -1.36 0.73 0.28 4.03 1.01 0.63 -0.06 120.40 125.66 2dnr s VAL 939 Ca 0.39 -0.23 -0.05 0.00 0.00 0.00 0.00 61.98 62.09 2dnr s VAL 939 Cb -0.19 -0.71 -0.05 0.00 0.00 0.00 0.00 36.38 35.42 2dnr s VAL 939 CO 0.23 0.27 0.54 -0.89 0.00 0.00 0.00 175.10 175.24 2dnr s THR 940 N 0.84 5.03 0.03 3.92 2.01 0.96 -0.43 115.64 128.01 2dnr s THR 940 Ca -0.12 0.06 0.03 0.00 0.31 0.00 0.00 61.69 61.97 2dnr s THR 940 Cb -0.15 -3.72 -0.02 0.00 0.01 0.00 0.00 72.50 68.62 2dnr s THR 940 CO 0.01 -0.29 -0.09 -0.36 -0.69 0.00 0.00 174.62 173.20 2dnr s PHE 941 N -2.04 0.80 0.12 4.92 0.40 -1.01 -3.47 117.98 117.70 2dnr s PHE 941 Ca 0.44 -0.38 -0.22 0.00 -0.60 0.00 0.00 56.93 56.17 2dnr s PHE 941 Cb -0.11 -0.48 -0.05 0.00 0.51 0.00 0.00 43.02 42.89 2dnr s PHE 941 CO 0.29 -0.03 1.23 -0.11 0.70 0.00 0.00 175.22 177.31 2dnr n LEU 942 N 1.85 -0.76 -4.31 -0.37 7.94 -1.25 -4.52 117.00 115.58 2dnr n LEU 942 Ca -0.20 1.41 -0.22 0.00 -1.11 0.00 0.00 56.01 55.89 2dnr n LEU 942 Cb 0.55 -0.23 -0.12 0.00 0.53 0.00 0.00 43.42 44.16 2dnr n LEU 942 CO 0.22 -1.11 -0.49 -1.61 -1.11 0.00 0.00 177.39 173.30 2dnr s GLU 943 N -5.06 1.19 0.17 1.96 2.02 -1.26 -4.94 118.70 112.78 2dnr s GLU 943 Ca -0.09 -1.31 -0.18 0.00 0.02 0.00 0.00 54.97 53.42 2dnr s GLU 943 Cb 0.08 -1.29 0.11 0.00 0.10 0.00 0.00 34.13 33.13 2dnr s GLU 943 CO 0.45 0.27 1.64 0.78 0.02 0.00 0.00 175.26 178.42 2dnr h GLY 944 N 3.54 0.19 -0.33 -1.39 0.00 -1.74 -0.89 103.07 102.45 2dnr h GLY 944 Ca -0.43 0.21 0.24 0.00 0.00 0.00 0.00 47.33 47.35 2dnr h GLY 944 CO 0.47 -0.19 0.37 1.48 0.00 0.00 0.00 176.54 178.68 2dnr h SER 945 N -0.07 0.25 -0.42 0.19 4.64 -1.94 0.79 113.55 116.99 2dnr h SER 945 Ca 0.21 0.17 0.10 0.00 -0.47 0.00 0.00 61.79 61.80 2dnr h SER 945 Cb 0.39 0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 62.63 2dnr h SER 945 CO -0.47 -0.07 0.30 0.28 -0.87 0.00 0.00 176.83 175.99 2dnr h SER 946 N 0.33 0.09 1.47 4.97 0.02 -1.53 0.27 113.55 119.16 2dnr h SER 946 Ca 0.58 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.54 2dnr h SER 946 Cb 1.17 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.69 2dnr h SER 946 CO -0.58 0.05 -0.21 0.00 -1.14 0.00 0.00 176.83 174.96 2dnr h ALA 947 N 1.79 0.88 0.00 3.77 0.00 0.63 -2.91 119.26 123.42 2dnr h ALA 947 Ca 0.20 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 55.02 2dnr h ALA 947 Cb 0.67 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 2dnr h ALA 947 CO -0.02 0.00 -0.65 -0.07 0.00 0.00 0.00 179.25 178.51 2dnr h LEU 948 N 0.00 0.00 0.05 0.00 3.38 0.06 -3.32 115.31 115.48 2dnr h LEU 948 Ca 0.00 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.72 2dnr h LEU 948 Cb 0.84 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.57 2dnr h LEU 948 CO 0.00 0.36 -1.36 0.78 0.09 0.00 0.00 178.44 178.31 2dnr h ASN 949 N 0.00 0.18 -0.20 -0.43 2.35 -1.44 -3.34 115.58 112.70 2dnr h ASN 949 Ca -0.03 -0.71 0.06 0.00 -0.55 0.00 0.00 56.30 55.06 2dnr h ASN 949 Cb 1.31 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 39.61 2dnr h ASN 949 CO 0.04 1.57 0.48 1.62 -1.65 0.00 0.00 177.43 179.48 2dnr h VAL 950 N -0.62 0.13 -0.46 2.81 3.04 -1.66 -0.24 116.25 119.25 2dnr h VAL 950 Ca -0.33 0.00 0.13 0.00 -1.01 0.00 0.00 66.70 65.49 2dnr h VAL 950 Cb 1.54 0.57 -0.02 0.00 -2.01 0.00 0.00 31.29 31.37 2dnr h VAL 950 CO -0.07 0.00 0.58 -0.07 -1.01 0.00 0.00 177.57 177.00 2dnr h LEU 951 N 0.00 0.00 -1.26 3.16 3.38 -1.69 0.21 115.31 119.11 2dnr h LEU 951 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2dnr h LEU 951 Cb 1.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.79 2dnr h LEU 951 CO -0.00 0.00 0.18 0.28 0.09 0.00 0.00 178.44 178.99 2dnr h SER 952 N 0.00 0.00 -0.36 -0.43 0.02 -1.31 0.40 113.55 111.87 2dnr h SER 952 Ca 0.22 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.17 2dnr h SER 952 Cb 1.38 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.92 2dnr h SER 952 CO -0.00 0.00 0.00 0.18 -1.14 0.00 0.00 176.83 175.87 2dnr n LEU 953 N -2.24 3.33 -4.66 5.07 4.77 0.72 -4.83 117.00 119.14 2dnr n LEU 953 Ca -0.01 -1.68 -0.42 0.00 -0.03 0.00 0.00 56.01 53.86 2dnr n LEU 953 Cb 0.21 -0.51 -0.03 0.00 -2.33 0.00 0.00 43.42 40.76 2dnr n LEU 953 CO 0.08 0.50 1.28 0.54 -1.33 0.00 0.00 177.39 178.46 2dnr s ASN 954 N -0.61 6.75 0.00 -1.43 4.22 0.14 -2.61 114.94 121.39 2dnr s ASN 954 Ca 0.31 2.12 0.00 0.00 -2.14 0.00 0.00 52.86 53.14 2dnr s ASN 954 Cb 0.21 -2.54 0.00 0.00 1.28 0.00 0.00 41.25 40.21 2dnr s ASN 954 CO 0.12 -0.86 0.00 0.61 -2.04 0.00 0.00 177.10 174.93 2dnr n GLY 955 N 3.96 2.78 3.25 0.45 0.00 -0.40 -4.90 105.19 110.32 2dnr n GLY 955 Ca 0.16 0.00 -0.56 0.00 0.00 0.00 0.00 46.02 45.62 2dnr n GLY 955 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2dnr n LYS 956 N -0.54 0.00 -3.44 1.61 0.00 -1.07 -3.94 118.16 110.78 2dnr n LYS 956 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 58.31 57.93 2dnr n LYS 956 Cb 0.00 -1.37 -0.08 0.00 0.00 0.00 0.00 35.03 33.59 2dnr n LYS 956 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.40 175.40 2dnr s GLU 957 N 0.72 4.16 0.07 1.64 2.12 -1.26 -2.20 118.70 123.96 2dnr s GLU 957 Ca 0.86 0.12 0.03 0.00 0.36 0.00 0.00 54.97 56.34 2dnr s GLU 957 Cb -1.21 -3.53 -0.03 0.00 0.26 0.00 0.00 34.13 29.62 2dnr s GLU 957 CO 0.58 -0.01 -0.09 -1.17 -0.54 0.00 0.00 175.26 174.03 2dnr s LEU 958 N 1.22 2.35 -1.55 2.70 2.96 -1.08 -4.85 118.68 120.44 2dnr s LEU 958 Ca 0.17 -0.72 -0.02 0.00 -0.22 0.00 0.00 54.13 53.34 2dnr s LEU 958 Cb -0.14 -0.23 0.02 0.00 0.50 0.00 0.00 46.19 46.33 2dnr s LEU 958 CO 0.07 -0.25 0.12 0.18 -1.32 0.00 0.00 176.35 175.15 2dnr n LEU 959 N 0.89 -1.19 -4.18 -0.68 4.77 -1.26 0.96 117.00 116.32 2dnr n LEU 959 Ca -0.19 -1.23 -0.35 0.00 -0.03 0.00 0.00 56.01 54.21 2dnr n LEU 959 Cb 0.57 -1.71 -0.02 0.00 -2.33 0.00 0.00 43.42 39.93 2dnr n LEU 959 CO 0.24 0.44 -0.01 -0.46 -1.33 0.00 0.00 177.39 176.27 2dnr n ASN 960 N -2.88 -3.51 -3.41 -1.43 0.23 -1.26 -4.92 115.26 98.08 2dnr n ASN 960 Ca -0.29 -0.98 -0.16 0.00 -0.53 0.00 0.00 54.58 52.63 2dnr n ASN 960 Cb 0.68 -2.93 -0.10 0.00 -2.08 0.00 0.00 39.78 35.34 2dnr n ASN 960 CO 0.00 0.00 0.00 -0.13 -0.93 0.00 0.00 177.26 176.20 2dnr s ARG 961 N -6.88 0.29 0.03 -3.83 0.52 0.27 -5.06 118.95 104.29 2dnr s ARG 961 Ca 0.72 0.10 -0.31 0.00 -0.52 0.00 0.00 55.73 55.73 2dnr s ARG 961 Cb -0.39 -0.78 -0.10 0.00 0.52 0.00 0.00 34.95 34.21 2dnr s ARG 961 CO 0.91 -0.84 1.94 2.41 0.02 0.00 0.00 175.30 179.74 2dnr n THR 962 N 5.33 0.67 -4.11 0.02 -1.04 -1.26 -2.62 114.28 111.26 2dnr n THR 962 Ca -0.03 -0.12 -0.34 0.00 -2.04 0.00 0.00 64.05 61.52 2dnr n THR 962 Cb 0.48 -2.20 -0.07 0.00 -1.82 0.00 0.00 70.33 66.72 2dnr n THR 962 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 2dnr s ILE 963 N 4.11 4.80 -0.13 12.58 1.01 -0.93 0.03 121.20 142.67 2dnr s ILE 963 Ca 0.89 -0.26 -0.00 0.00 0.00 0.00 0.00 60.65 61.28 2dnr s ILE 963 Cb -0.49 -3.14 0.02 0.00 0.01 0.00 0.00 42.46 38.86 2dnr s ILE 963 CO 0.43 0.45 -0.11 -0.89 0.00 0.00 0.00 174.94 174.82 2dnr s THR 964 N -1.11 1.28 -0.10 2.92 2.01 0.61 -1.27 115.64 119.98 2dnr s THR 964 Ca 0.20 -0.45 -0.04 0.00 0.31 0.00 0.00 61.69 61.71 2dnr s THR 964 Cb -0.12 -1.25 -0.04 0.00 0.01 0.00 0.00 72.50 71.11 2dnr s THR 964 CO 0.10 0.41 0.07 -0.63 -0.69 0.00 0.00 174.62 173.87 2dnr s ILE 965 N 1.61 4.86 -0.14 1.82 1.01 -1.26 -1.06 121.20 128.04 2dnr s ILE 965 Ca 0.05 -0.05 -0.11 0.00 0.00 0.00 0.00 60.65 60.53 2dnr s ILE 965 Cb -0.13 -3.09 0.04 0.00 0.01 0.00 0.00 42.46 39.30 2dnr s ILE 965 CO -0.09 0.60 0.35 0.00 0.00 0.00 0.00 174.94 175.80 2dnr s ALA 966 N -0.96 -0.88 0.57 9.38 0.00 0.32 -4.84 121.76 125.35 2dnr s ALA 966 Ca 0.15 1.10 -0.17 0.00 0.00 0.00 0.00 51.96 53.04 2dnr s ALA 966 Cb -0.12 -0.65 -0.04 0.00 0.00 0.00 0.00 23.12 22.31 2dnr s ALA 966 CO 0.04 -0.19 1.06 -0.51 0.00 0.00 0.00 175.76 176.16 2dnr s LEU 967 N 0.52 3.58 0.29 0.00 1.43 -1.26 0.10 118.68 123.34 2dnr s LEU 967 Ca -0.03 1.88 -0.15 0.00 -1.03 0.00 0.00 54.13 54.80 2dnr s LEU 967 Cb -0.04 -4.54 -0.09 0.00 0.03 0.00 0.00 46.19 41.55 2dnr s LEU 967 CO -0.03 -1.13 0.70 -0.75 0.23 0.00 0.00 176.35 175.37 2dnr s LYS 968 N -3.86 4.00 0.46 1.70 2.47 -1.25 -4.82 119.74 118.45 2dnr s LYS 968 Ca 0.65 0.62 -0.25 0.00 -1.56 0.00 0.00 55.97 55.44 2dnr s LYS 968 Cb -0.17 -2.53 -0.08 0.00 -1.46 0.00 0.00 37.83 33.59 2dnr s LYS 968 CO 0.33 0.22 1.35 -1.13 0.16 0.00 0.00 175.35 176.28 2dnr n SER 969 N -0.18 2.88 -0.21 1.43 3.41 -1.26 -4.90 113.62 114.79 2dnr n SER 969 Ca 0.02 1.08 -0.01 0.00 -0.26 0.00 0.00 58.87 59.71 2dnr n SER 969 Cb 0.53 -1.56 0.06 0.00 -0.26 0.00 0.00 64.21 62.98 2dnr n SER 969 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 2dnr h PRO 970 N 2.02 -0.02 -6.90 4.33 0.11 -1.96 -3.42 132.00 126.17 2dnr h PRO 970 Ca -0.50 0.00 -0.56 0.00 0.11 0.00 0.00 66.00 65.06 2dnr h PRO 970 Cb 1.29 0.00 0.18 0.00 0.11 0.00 0.00 31.00 32.58 2dnr h PRO 970 CO 0.60 -0.01 0.05 0.45 -0.21 0.00 0.00 178.00 178.88 2dnr n SER 971 N -5.44 0.34 -2.74 -2.05 2.88 -1.26 -4.89 113.62 100.46 2dnr n SER 971 Ca 0.07 0.68 -0.07 0.00 -1.33 0.00 0.00 58.87 58.23 2dnr n SER 971 Cb 0.34 -1.38 0.04 0.00 -0.75 0.00 0.00 64.21 62.46 2dnr n SER 971 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dnr n GLY 972 N 1.18 -0.35 3.17 0.46 0.00 -1.26 -5.13 105.19 103.26 2dnr n GLY 972 Ca 0.13 0.35 -0.35 0.00 0.00 0.00 0.00 46.02 46.14 2dnr n GLY 972 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2dnr n PRO 973 N 1.92 -0.33 -0.06 1.61 -0.02 -1.26 -4.96 135.00 131.90 2dnr n PRO 973 Ca 0.10 -0.08 -0.08 0.00 -2.02 0.00 0.00 63.50 61.42 2dnr n PRO 973 Cb 0.63 -1.37 -0.06 0.00 -0.02 0.00 0.00 33.50 32.67 2dnr n PRO 973 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 2dnr h SER 974 N -1.34 0.00 -0.60 2.55 0.02 -2.06 -3.45 113.55 108.67 2dnr h SER 974 Ca -0.44 -0.45 -0.81 0.00 -0.84 0.00 0.00 61.79 59.24 2dnr h SER 974 Cb 1.32 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.85 2dnr h SER 974 CO 0.28 0.81 0.90 -1.54 -1.14 0.00 0.00 176.83 176.14 2dnr n SER 975 N -4.67 1.00 0.00 3.07 3.41 -1.26 -5.37 113.62 109.81 2dnr n SER 975 Ca -0.07 0.97 0.00 0.00 -0.26 0.00 0.00 58.87 59.50 2dnr n SER 975 Cb 0.27 -0.86 0.00 0.00 -0.26 0.00 0.00 64.21 63.36 2dnr n SER 975 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49