#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dnr n SER 887 N 0.00 1.95 -4.55 1.61 3.41 -1.26 -4.90 113.62 109.88 2dnr n SER 887 Ca 0.00 -0.52 -0.42 0.00 -0.26 0.00 0.00 58.87 57.67 2dnr n SER 887 Cb 0.00 -1.49 -0.07 0.00 -0.26 0.00 0.00 64.21 62.38 2dnr n SER 887 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2dnr s SER 888 N 11.56 6.35 0.00 4.04 1.04 -1.26 -4.99 113.70 130.44 2dnr s SER 888 Ca 1.03 -0.05 0.00 0.00 0.48 0.00 0.00 55.95 57.41 2dnr s SER 888 Cb -0.32 -2.29 0.00 0.00 0.10 0.00 0.00 66.02 63.51 2dnr s SER 888 CO 0.28 -0.57 0.00 0.61 0.98 0.00 0.00 173.24 174.54 2dnr n GLY 889 N 4.80 1.24 3.51 7.32 0.00 -1.26 -5.18 105.19 115.62 2dnr n GLY 889 Ca -0.03 -0.84 -0.16 0.00 0.00 0.00 0.00 46.02 44.99 2dnr n GLY 889 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dnr s SER 890 N 0.00 -0.62 0.06 1.61 0.15 -1.26 -4.95 113.70 108.69 2dnr s SER 890 Ca 0.00 0.89 -0.26 0.00 0.70 0.00 0.00 55.95 57.28 2dnr s SER 890 Cb 0.00 0.84 0.09 0.00 -1.71 0.00 0.00 66.02 65.24 2dnr s SER 890 CO 0.00 -0.44 1.19 -0.94 1.20 0.00 0.00 173.24 174.26 2dnr s SER 891 N -0.58 0.00 0.00 5.45 1.04 -1.26 -4.77 113.70 113.58 2dnr s SER 891 Ca -0.07 -0.37 0.00 0.00 0.48 0.00 0.00 55.95 55.99 2dnr s SER 891 Cb -0.02 0.28 0.00 0.00 0.10 0.00 0.00 66.02 66.38 2dnr s SER 891 CO 0.06 -0.55 0.37 0.61 0.98 0.00 0.00 173.24 174.70 2dnr n GLY 892 N -0.81 -2.73 0.00 7.32 0.00 -1.25 -4.37 105.19 103.35 2dnr n GLY 892 Ca 0.01 0.59 0.00 0.00 0.00 0.00 0.00 46.02 46.61 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 -0.81 0.00 3.30 -0.02 0.00 -1.26 -3.79 105.19 102.61 2dnr n GLY 893 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 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 0.00 3.36 0.01 2.61 2.01 -1.26 -1.79 115.64 120.58 2dnr s THR 894 Ca 0.00 -0.54 0.07 0.00 0.31 0.00 0.00 61.69 61.53 2dnr s THR 894 Cb 0.00 -2.55 -0.03 0.00 0.01 0.00 0.00 72.50 69.93 2dnr s THR 894 CO 0.00 0.39 -0.20 0.68 -0.69 0.00 0.00 174.62 174.80 2dnr s VAL 895 N 1.47 2.59 0.09 3.82 -7.23 -0.59 -3.25 120.40 117.29 2dnr s VAL 895 Ca 0.05 -1.11 -0.14 0.00 -1.81 0.00 0.00 61.98 58.98 2dnr s VAL 895 Cb -0.14 -2.02 -0.06 0.00 0.56 0.00 0.00 36.38 34.71 2dnr s VAL 895 CO -0.03 0.45 0.48 -0.76 -0.31 0.00 0.00 175.10 174.93 2dnr s LEU 896 N -1.08 4.40 -0.06 1.32 1.02 0.11 -0.69 118.68 123.70 2dnr s LEU 896 Ca 0.12 1.01 -0.02 0.00 0.02 0.00 0.00 54.13 55.26 2dnr s LEU 896 Cb -0.10 -2.99 0.04 0.00 0.02 0.00 0.00 46.19 43.15 2dnr s LEU 896 CO 0.02 0.19 0.12 -0.69 0.02 0.00 0.00 176.35 176.01 2dnr s VAL 897 N -1.31 -0.09 0.15 -1.59 1.01 0.16 -0.89 120.40 117.84 2dnr s VAL 897 Ca 0.32 0.24 0.06 0.00 0.00 0.00 0.00 61.98 62.60 2dnr s VAL 897 Cb -0.16 -0.21 -0.04 0.00 0.00 0.00 0.00 36.38 35.97 2dnr s VAL 897 CO 0.18 0.10 -0.13 -0.55 0.00 0.00 0.00 175.10 174.70 2dnr s SER 898 N 1.43 2.05 0.31 3.32 0.15 -0.56 -0.94 113.70 119.46 2dnr s SER 898 Ca -0.06 -0.94 0.09 0.00 0.70 0.00 0.00 55.95 55.74 2dnr s SER 898 Cb -0.12 -0.06 -0.06 0.00 -1.71 0.00 0.00 66.02 64.07 2dnr s SER 898 CO -0.05 -0.23 -0.11 0.27 1.20 0.00 0.00 173.24 174.33 2dnr s ILE 899 N -2.81 2.13 -0.43 6.45 -4.36 -1.26 -0.20 121.20 120.73 2dnr s ILE 899 Ca 0.15 -2.22 -0.16 0.00 -0.26 0.00 0.00 60.65 58.16 2dnr s ILE 899 Cb -0.01 -2.52 0.03 0.00 1.25 0.00 0.00 42.46 41.21 2dnr s ILE 899 CO 0.03 -0.27 0.37 -0.54 0.24 0.00 0.00 174.94 174.76 2dnr s LYS 900 N -3.62 3.01 -0.03 0.37 1.02 0.15 -4.97 119.74 115.67 2dnr s LYS 900 Ca 0.31 -0.99 -0.00 0.00 0.02 0.00 0.00 55.97 55.30 2dnr s LYS 900 Cb 0.01 -4.01 0.03 0.00 -0.52 0.00 0.00 37.83 33.35 2dnr s LYS 900 CO 0.15 -0.84 0.02 -1.12 -0.92 0.00 0.00 175.35 172.64 2dnr s SER 901 N 1.90 0.32 -0.05 2.83 0.01 -1.26 -4.51 113.70 112.93 2dnr s SER 901 Ca 0.07 0.02 -0.25 0.00 1.31 0.00 0.00 55.95 57.11 2dnr s SER 901 Cb -0.19 -0.13 -0.24 0.00 0.21 0.00 0.00 66.02 65.67 2dnr s SER 901 CO 0.11 -0.13 1.02 -1.28 0.41 0.00 0.00 173.24 173.36 2dnr h SER 902 N 7.42 0.22 -4.01 2.44 0.87 -1.98 -3.45 113.55 115.05 2dnr h SER 902 Ca -0.41 -0.79 -0.48 0.00 -1.23 0.00 0.00 61.79 58.88 2dnr h SER 902 Cb 1.12 -0.07 0.03 0.00 -0.44 0.00 0.00 62.40 63.05 2dnr h SER 902 CO 0.44 0.97 0.42 -0.76 -0.53 0.00 0.00 176.83 177.38 2dnr s LEU 903 N -8.49 3.99 0.17 2.23 1.43 -1.26 -4.94 118.68 111.81 2dnr s LEU 903 Ca -0.16 2.07 0.25 0.00 -1.03 0.00 0.00 54.13 55.26 2dnr s LEU 903 Cb 0.01 -4.34 0.91 0.00 0.03 0.00 0.00 46.19 42.79 2dnr s LEU 903 CO 0.74 -0.72 1.75 -0.81 0.23 0.00 0.00 176.35 177.54 2dnr n PRO 904 N -0.53 0.17 -0.64 1.29 -0.04 -1.26 -2.80 135.00 131.19 2dnr n PRO 904 Ca 0.07 0.25 0.09 0.00 -0.04 0.00 0.00 63.50 63.87 2dnr n PRO 904 Cb 0.50 -1.75 0.37 0.00 -0.04 0.00 0.00 33.50 32.58 2dnr n PRO 904 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2dnr n GLU 905 N -2.06 3.83 -0.01 0.54 0.28 -1.26 -4.26 120.64 117.70 2dnr n GLU 905 Ca 0.05 -2.89 -0.01 0.00 -0.16 0.00 0.00 57.16 54.14 2dnr n GLU 905 Cb 0.33 -1.93 -0.01 0.00 1.43 0.00 0.00 31.44 31.26 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 1.12 4.03 -0.34 -1.84 5.03 -1.12 -4.65 115.26 117.48 2dnr n ASN 906 Ca 0.26 -0.01 0.34 0.00 0.87 0.00 0.00 54.58 56.04 2dnr n ASN 906 Cb 0.92 0.13 0.52 0.00 -1.02 0.00 0.00 39.78 40.33 2dnr n ASN 906 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 2dnr n ASN 907 N -2.42 0.00 -4.74 6.41 3.02 -1.22 -4.35 115.26 111.95 2dnr n ASN 907 Ca -0.04 0.80 -0.41 0.00 -0.03 0.00 0.00 54.58 54.90 2dnr n ASN 907 Cb 0.55 -0.31 -0.03 0.00 -0.61 0.00 0.00 39.78 39.38 2dnr n ASN 907 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2dnr s PHE 908 N -4.48 3.22 -0.20 3.10 0.08 -1.26 -4.85 117.98 113.59 2dnr s PHE 908 Ca -0.03 1.26 -0.29 0.00 0.12 0.00 0.00 56.93 57.99 2dnr s PHE 908 Cb 0.17 -3.62 -0.00 0.00 -0.57 0.00 0.00 43.02 39.00 2dnr s PHE 908 CO 0.56 -1.87 1.15 -0.06 -0.10 0.00 0.00 175.22 174.91 2dnr s PHE 909 N -0.16 3.09 0.53 0.36 0.40 -1.26 -5.03 117.98 115.91 2dnr s PHE 909 Ca 0.55 1.24 -0.07 0.00 -0.60 0.00 0.00 56.93 58.05 2dnr s PHE 909 Cb -0.37 -3.39 -0.04 0.00 0.51 0.00 0.00 43.02 39.73 2dnr s PHE 909 CO 0.41 -1.09 0.86 -0.51 0.70 0.00 0.00 175.22 175.60 2dnr s ASP 910 N 1.59 6.24 0.33 1.36 1.01 -1.26 -4.82 116.67 121.12 2dnr s ASP 910 Ca 0.49 1.07 0.12 0.00 0.71 0.00 0.00 52.55 54.95 2dnr s ASP 910 Cb -0.18 -2.30 1.01 0.00 1.01 0.00 0.00 42.92 42.45 2dnr s ASP 910 CO 0.10 -0.68 1.68 -2.24 0.21 0.00 0.00 175.17 174.24 2dnr h ASP 911 N 0.05 0.50 -0.00 0.27 2.03 -1.99 0.13 116.42 117.42 2dnr h ASP 911 Ca -0.46 0.18 -0.00 0.00 -0.73 0.00 0.00 57.03 56.02 2dnr h ASP 911 Cb 1.20 0.13 -0.00 0.00 -0.83 0.00 0.00 39.33 39.83 2dnr h ASP 911 CO 0.62 -0.09 0.00 0.00 -1.03 0.00 0.00 179.24 178.74 2dnr h ALA 912 N 1.82 0.00 -0.51 4.15 0.00 -1.98 0.28 119.26 123.02 2dnr h ALA 912 Ca 0.70 -0.13 0.05 0.00 0.00 0.00 0.00 54.91 55.53 2dnr h ALA 912 Cb 1.53 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 19.27 2dnr h ALA 912 CO -0.58 -0.37 0.25 -0.07 0.00 0.00 0.00 179.25 178.48 2dnr h LEU 913 N -0.26 0.34 0.52 0.00 3.38 -1.19 0.24 115.31 118.33 2dnr h LEU 913 Ca 0.00 0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 2dnr h LEU 913 Cb 0.27 -0.02 0.01 0.00 0.09 0.00 0.00 40.66 41.00 2dnr h LEU 913 CO 0.00 0.23 -0.25 0.40 0.09 0.00 0.00 178.44 178.91 2dnr h ILE 914 N 0.48 0.03 -0.51 1.22 2.04 -1.00 -2.23 117.51 117.54 2dnr h ILE 914 Ca 0.23 -0.49 0.10 0.00 1.00 0.00 0.00 64.86 65.70 2dnr h ILE 914 Cb 0.16 0.05 -0.10 0.00 -0.74 0.00 0.00 36.82 36.20 2dnr h ILE 914 CO -0.18 0.01 -0.18 -0.78 0.00 0.00 0.00 178.15 177.02 2dnr h ASP 915 N -1.18 -0.64 -0.94 1.72 3.58 -0.40 0.60 116.42 119.16 2dnr h ASP 915 Ca -0.07 0.17 0.07 0.00 0.42 0.00 0.00 57.03 57.62 2dnr h ASP 915 Cb 0.55 0.38 -0.07 0.00 1.72 0.00 0.00 39.33 41.91 2dnr h ASP 915 CO 0.12 -0.21 0.59 -0.33 -2.88 0.00 0.00 179.24 176.53 2dnr h GLU 916 N -0.06 1.03 0.16 0.28 4.39 -0.61 -2.55 114.58 117.22 2dnr h GLU 916 Ca 0.24 -0.06 -0.01 0.00 0.34 0.00 0.00 59.36 59.87 2dnr h GLU 916 Cb 0.43 -0.23 0.00 0.00 -0.10 0.00 0.00 28.75 28.85 2dnr h GLU 916 CO -0.56 0.68 -0.08 -0.07 -1.16 0.00 0.00 179.01 177.83 2dnr h LEU 917 N 1.06 -0.20 -0.43 1.33 3.38 -0.28 -3.02 115.31 117.15 2dnr h LEU 917 Ca 0.42 0.01 0.04 0.00 0.09 0.00 0.00 57.88 58.43 2dnr h LEU 917 Cb 0.21 0.05 -0.05 0.00 0.09 0.00 0.00 40.66 40.96 2dnr h LEU 917 CO -0.19 -0.14 -0.26 0.18 0.09 0.00 0.00 178.44 178.13 2dnr n LEU 918 N -5.19 -0.46 -0.11 1.67 4.77 -0.50 0.24 117.00 117.42 2dnr n LEU 918 Ca -0.09 1.08 -0.06 0.00 -0.03 0.00 0.00 56.01 56.92 2dnr n LEU 918 Cb 0.12 -0.26 0.01 0.00 -2.33 0.00 0.00 43.42 40.96 2dnr n LEU 918 CO 0.34 -0.78 0.72 1.56 -1.33 0.00 0.00 177.39 177.89 2dnr h GLN 919 N 0.00 -0.13 -0.98 3.23 1.08 -1.59 0.10 115.11 116.82 2dnr h GLN 919 Ca 0.07 0.01 0.22 0.00 -1.45 0.00 0.00 58.65 57.49 2dnr h GLN 919 Cb 0.18 0.03 -0.12 0.00 -0.05 0.00 0.00 27.48 27.52 2dnr h GLN 919 CO -0.41 -0.09 0.57 1.96 -0.95 0.00 0.00 178.83 179.91 2dnr h GLN 920 N -0.14 0.61 -0.16 1.46 1.08 -0.08 -0.10 115.11 117.78 2dnr h GLN 920 Ca 0.19 -0.04 -0.15 0.00 -1.45 0.00 0.00 58.65 57.20 2dnr h GLN 920 Cb 0.43 -0.14 0.00 0.00 -0.05 0.00 0.00 27.48 27.73 2dnr h GLN 920 CO -0.47 0.40 -0.48 0.74 -0.95 0.00 0.00 178.83 178.07 2dnr h PHE 921 N 0.63 0.80 -0.98 2.96 0.04 0.11 -3.18 116.94 117.31 2dnr h PHE 921 Ca 0.60 -0.32 0.21 0.00 2.80 0.00 0.00 57.97 61.26 2dnr h PHE 921 Cb 1.05 -0.14 -0.09 0.00 2.20 0.00 0.00 35.95 38.97 2dnr h PHE 921 CO -0.03 1.09 0.62 0.00 -0.60 0.00 0.00 178.31 179.40 2dnr h ALA 922 N 0.55 1.91 -0.15 2.45 0.00 0.99 0.22 119.26 125.23 2dnr h ALA 922 Ca -0.01 0.06 0.04 0.00 0.00 0.00 0.00 54.91 55.00 2dnr h ALA 922 Cb 1.10 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 2dnr h ALA 922 CO 0.10 -0.27 0.69 0.77 0.00 0.00 0.00 179.25 180.54 2dnr h SER 923 N 0.60 0.00 0.00 0.00 0.02 -1.37 -3.16 113.55 109.64 2dnr h SER 923 Ca 0.56 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.51 2dnr h SER 923 Cb 1.08 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.62 2dnr h SER 923 CO -0.31 0.00 -0.09 0.49 -1.14 0.00 0.00 176.83 175.78 2dnr n PHE 924 N -2.86 -0.47 -4.19 3.45 3.01 0.48 -5.11 117.46 111.76 2dnr n PHE 924 Ca 0.02 0.08 -0.19 0.00 1.01 0.00 0.00 57.45 58.38 2dnr n PHE 924 Cb 0.76 0.12 -0.12 0.00 -0.01 0.00 0.00 39.48 40.23 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 -4.29 0.93 -0.16 1.37 0.00 0.47 -4.98 107.32 100.65 2dnr s GLY 925 Ca 0.00 -1.08 -0.21 0.00 0.00 0.00 0.00 44.72 43.43 2dnr s GLY 925 CO 0.00 -1.11 0.63 1.85 0.00 0.00 0.00 173.10 174.47 2dnr s GLU 926 N -1.95 4.27 0.45 2.90 2.56 -1.26 -2.55 118.70 123.11 2dnr s GLU 926 Ca 0.01 0.66 -0.21 0.00 0.00 0.00 0.00 54.97 55.43 2dnr s GLU 926 Cb -0.09 -3.54 -0.10 0.00 2.00 0.00 0.00 34.13 32.40 2dnr s GLU 926 CO 0.02 -0.14 0.97 0.08 -0.56 0.00 0.00 175.26 175.63 2dnr s VAL 927 N 1.58 4.27 0.00 3.70 1.01 -1.26 -3.29 120.40 126.41 2dnr s VAL 927 Ca 0.30 1.39 0.00 0.00 0.00 0.00 0.00 61.98 63.68 2dnr s VAL 927 Cb -0.16 -3.57 0.00 0.00 0.00 0.00 0.00 36.38 32.65 2dnr s VAL 927 CO 0.12 -0.33 0.00 2.30 0.00 0.00 0.00 175.10 177.19 2dnr n ILE 928 N -0.77 0.00 -3.92 2.22 -5.35 -1.22 -4.89 119.36 105.42 2dnr n ILE 928 Ca 0.07 0.00 -0.10 0.00 -0.27 0.00 0.00 62.75 62.45 2dnr n ILE 928 Cb 0.54 -0.40 -0.12 0.00 -1.74 0.00 0.00 39.64 37.92 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 -4.50 1.99 0.01 7.28 2.96 -1.26 -5.06 118.68 120.11 2dnr s LEU 929 Ca 0.00 -0.24 0.02 0.00 -0.22 0.00 0.00 54.13 53.69 2dnr s LEU 929 Cb 0.00 0.20 -0.01 0.00 0.50 0.00 0.00 46.19 46.88 2dnr s LEU 929 CO 0.00 -0.21 -0.08 -0.63 -1.32 0.00 0.00 176.35 174.12 2dnr s ILE 930 N -0.91 0.59 -0.04 6.68 1.01 -1.26 0.21 121.20 127.48 2dnr s ILE 930 Ca -0.10 -0.55 0.01 0.00 0.00 0.00 0.00 60.65 60.00 2dnr s ILE 930 Cb -0.06 -0.54 0.02 0.00 0.01 0.00 0.00 42.46 41.89 2dnr s ILE 930 CO -0.00 0.01 -0.02 0.00 0.00 0.00 0.00 174.94 174.92 2dnr s ARG 931 N -0.61 0.63 -0.21 2.79 3.03 -0.27 -4.98 118.95 119.33 2dnr s ARG 931 Ca -0.01 -0.02 -0.18 0.00 2.03 0.00 0.00 55.73 57.55 2dnr s ARG 931 Cb -0.05 -0.73 -0.03 0.00 -1.03 0.00 0.00 34.95 33.11 2dnr s ARG 931 CO 0.00 -0.12 0.51 -0.06 -1.13 0.00 0.00 175.30 174.50 2dnr s PHE 932 N 1.06 3.35 0.42 5.89 0.08 -1.26 -0.99 117.98 126.53 2dnr s PHE 932 Ca -0.09 0.74 -0.07 0.00 0.12 0.00 0.00 56.93 57.63 2dnr s PHE 932 Cb -0.14 -2.67 -0.05 0.00 -0.57 0.00 0.00 43.02 39.59 2dnr s PHE 932 CO -0.01 -0.13 0.74 0.08 -0.10 0.00 0.00 175.22 175.80 2dnr s VAL 933 N 1.73 4.89 0.19 -0.44 1.01 0.43 -4.94 120.40 123.26 2dnr s VAL 933 Ca 0.23 0.31 -0.05 0.00 0.00 0.00 0.00 61.98 62.48 2dnr s VAL 933 Cb -0.15 -3.79 0.31 0.00 0.00 0.00 0.00 36.38 32.74 2dnr s VAL 933 CO 0.09 -0.63 1.05 -0.62 0.00 0.00 0.00 175.10 174.99 2dnr n GLU 934 N -1.67 -0.06 0.00 2.72 1.02 -1.26 -3.06 120.64 118.33 2dnr n GLU 934 Ca 0.01 1.05 0.00 0.00 -0.02 0.00 0.00 57.16 58.20 2dnr n GLU 934 Cb 0.55 -1.57 0.00 0.00 -0.02 0.00 0.00 31.44 30.39 2dnr n GLU 934 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 2dnr n ASP 935 N -5.08 3.22 -4.94 1.62 5.68 -1.26 -5.05 116.55 110.75 2dnr n ASP 935 Ca 0.11 0.00 -0.20 0.00 -0.50 0.00 0.00 54.79 54.20 2dnr n ASP 935 Cb 0.35 0.38 0.05 0.00 -1.14 0.00 0.00 41.12 40.76 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 -1.58 2.40 -0.21 0.11 2.20 -1.17 -4.89 119.74 116.59 2dnr s LYS 936 Ca 0.00 -1.13 -0.03 0.00 -0.36 0.00 0.00 55.97 54.45 2dnr s LYS 936 Cb 0.00 -2.56 0.07 0.00 -1.51 0.00 0.00 37.83 33.83 2dnr s LYS 936 CO 0.00 -0.77 0.06 1.41 -0.36 0.00 0.00 175.35 175.68 2dnr s MET 937 N -4.71 0.57 0.04 4.03 -2.45 -0.12 0.16 119.30 116.82 2dnr s MET 937 Ca 0.59 -0.48 -0.10 0.00 -1.25 0.00 0.00 55.69 54.45 2dnr s MET 937 Cb -0.08 -2.00 -0.05 0.00 1.25 0.00 0.00 34.83 33.94 2dnr s MET 937 CO 0.38 -0.71 0.36 -1.58 1.05 0.00 0.00 175.02 174.52 2dnr s TRP 938 N 1.87 3.62 -0.01 4.11 0.52 -0.16 0.38 118.94 129.27 2dnr s TRP 938 Ca 0.01 0.78 0.05 0.00 0.02 0.00 0.00 56.10 56.96 2dnr s TRP 938 Cb -0.17 -2.15 -0.01 0.00 -1.15 0.00 0.00 33.47 29.99 2dnr s TRP 938 CO -0.12 0.58 -0.15 0.08 0.02 0.00 0.00 176.95 177.35 2dnr s VAL 939 N -1.29 1.16 0.20 4.03 1.01 0.14 -1.12 120.40 124.53 2dnr s VAL 939 Ca 0.29 -0.63 0.02 0.00 0.00 0.00 0.00 61.98 61.66 2dnr s VAL 939 Cb -0.14 -0.97 -0.04 0.00 0.00 0.00 0.00 36.38 35.23 2dnr s VAL 939 CO 0.16 0.33 0.36 -0.89 0.00 0.00 0.00 175.10 175.05 2dnr s THR 940 N -0.35 5.26 0.04 3.92 2.01 0.13 -1.55 115.64 125.10 2dnr s THR 940 Ca 0.06 -0.63 0.02 0.00 0.31 0.00 0.00 61.69 61.45 2dnr s THR 940 Cb -0.06 -3.77 -0.02 0.00 0.01 0.00 0.00 72.50 68.66 2dnr s THR 940 CO -0.01 -0.21 -0.07 -0.36 -0.69 0.00 0.00 174.62 173.28 2dnr s PHE 941 N -1.88 0.64 0.16 4.92 0.40 -0.74 -3.45 117.98 118.04 2dnr s PHE 941 Ca 0.36 -0.50 -0.20 0.00 -0.60 0.00 0.00 56.93 55.99 2dnr s PHE 941 Cb -0.10 -0.39 0.07 0.00 0.51 0.00 0.00 43.02 43.10 2dnr s PHE 941 CO 0.29 -0.09 1.64 1.25 0.70 0.00 0.00 175.22 179.01 2dnr h LEU 942 N 4.53 -0.67-10.02 -0.37 5.85 -1.90 -3.44 115.31 109.29 2dnr h LEU 942 Ca -0.35 0.14 -0.60 0.00 0.84 0.00 0.00 57.88 57.91 2dnr h LEU 942 Cb 1.20 0.35 -0.09 0.00 0.37 0.00 0.00 40.66 42.49 2dnr h LEU 942 CO 0.41 -0.24 -0.46 -1.61 -0.34 0.00 0.00 178.44 176.20 2dnr s GLU 943 N -6.13 2.21 -0.15 1.25 2.02 -1.26 -5.03 118.70 111.61 2dnr s GLU 943 Ca -0.14 -2.03 -0.20 0.00 0.02 0.00 0.00 54.97 52.62 2dnr s GLU 943 Cb 0.13 -1.89 -0.24 0.00 0.10 0.00 0.00 34.13 32.24 2dnr s GLU 943 CO 0.69 -0.29 0.44 0.78 0.02 0.00 0.00 175.26 176.90 2dnr h GLY 944 N 1.27 0.12 1.32 -1.39 0.00 -1.76 -3.35 103.07 99.28 2dnr h GLY 944 Ca -0.42 -0.30 0.08 0.00 0.00 0.00 0.00 47.33 46.70 2dnr h GLY 944 CO 0.69 0.26 0.26 1.76 0.00 0.00 0.00 176.54 179.51 2dnr h SER 945 N -0.69 0.00 0.47 0.19 0.02 -1.91 0.15 113.55 111.78 2dnr h SER 945 Ca -0.28 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 60.60 2dnr h SER 945 Cb 1.46 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.99 2dnr h SER 945 CO -0.06 0.00 -0.32 0.77 -1.14 0.00 0.00 176.83 176.07 2dnr h SER 946 N 0.00 0.00 1.28 3.07 4.64 -1.95 -2.10 113.55 118.49 2dnr h SER 946 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 2dnr h SER 946 Cb 0.65 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.74 2dnr h SER 946 CO -0.00 0.32 0.00 0.00 -0.87 0.00 0.00 176.83 176.28 2dnr n ALA 947 N -2.39 2.25 0.03 5.18 0.00 0.53 -3.02 120.51 123.09 2dnr n ALA 947 Ca -0.02 -0.04 -0.11 0.00 0.00 0.00 0.00 53.44 53.27 2dnr n ALA 947 Cb 0.39 -1.46 -0.13 0.00 0.00 0.00 0.00 19.45 18.25 2dnr n ALA 947 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2dnr h LEU 948 N 0.00 0.12 -0.01 0.00 3.38 -1.33 -3.35 115.31 114.12 2dnr h LEU 948 Ca 0.00 -0.19 -0.20 0.00 0.09 0.00 0.00 57.88 57.58 2dnr h LEU 948 Cb 0.64 -0.04 0.02 0.00 0.09 0.00 0.00 40.66 41.37 2dnr h LEU 948 CO 0.00 1.16 -0.78 0.78 0.09 0.00 0.00 178.44 179.69 2dnr h ASN 949 N 0.02 0.71 0.00 -0.43 2.35 -1.52 -3.12 115.58 113.59 2dnr h ASN 949 Ca -0.19 -0.74 0.00 0.00 -0.55 0.00 0.00 56.30 54.82 2dnr h ASN 949 Cb 1.94 -0.22 0.00 0.00 0.05 0.00 0.00 38.32 40.09 2dnr h ASN 949 CO 0.12 1.35 0.13 1.62 -1.65 0.00 0.00 177.43 179.00 2dnr h VAL 950 N 0.14 0.00 -0.40 2.81 3.04 -1.68 -1.50 116.25 118.65 2dnr h VAL 950 Ca -0.09 0.00 0.12 0.00 -1.01 0.00 0.00 66.70 65.71 2dnr h VAL 950 Cb 1.46 0.48 -0.02 0.00 -2.01 0.00 0.00 31.29 31.21 2dnr h VAL 950 CO 0.15 0.00 0.31 -0.07 -1.01 0.00 0.00 177.57 176.95 2dnr h LEU 951 N 0.00 0.00 -2.27 3.16 3.38 -1.67 0.52 115.31 118.42 2dnr h LEU 951 Ca 0.00 0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.01 2dnr h LEU 951 Cb 0.25 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 2dnr h LEU 951 CO 0.00 0.00 0.23 0.28 0.09 0.00 0.00 178.44 179.04 2dnr h SER 952 N 0.00 0.00 -0.07 -0.43 0.02 -1.51 0.41 113.55 111.98 2dnr h SER 952 Ca 0.19 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.14 2dnr h SER 952 Cb 0.80 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.34 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 -3.42 0.40 -4.65 5.07 4.77 0.17 -4.77 117.00 114.57 2dnr n LEU 953 Ca 0.00 -0.19 -0.43 0.00 -0.03 0.00 0.00 56.01 55.37 2dnr n LEU 953 Cb 0.33 -0.05 -0.02 0.00 -2.33 0.00 0.00 43.42 41.35 2dnr n LEU 953 CO 0.22 0.10 1.28 0.21 -1.33 0.00 0.00 177.39 177.87 2dnr s ASN 954 N -1.09 6.70 0.00 -1.43 2.47 0.14 -2.52 114.94 119.21 2dnr s ASN 954 Ca 0.09 1.95 0.00 0.00 0.42 0.00 0.00 52.86 55.32 2dnr s ASN 954 Cb 0.04 -2.53 0.00 0.00 -1.45 0.00 0.00 41.25 37.31 2dnr s ASN 954 CO 0.06 -0.93 0.00 0.61 -3.72 0.00 0.00 177.10 173.12 2dnr n GLY 955 N 4.06 3.03 3.57 1.21 0.00 -0.11 -4.88 105.19 112.07 2dnr n GLY 955 Ca 0.16 0.00 -0.57 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 -0.92 0.57 -3.41 1.61 0.00 -1.05 -4.21 118.16 110.75 2dnr n LYS 956 Ca 0.00 0.21 -0.38 0.00 0.00 0.00 0.00 58.31 58.14 2dnr n LYS 956 Cb 0.00 -1.78 -0.06 0.00 0.00 0.00 0.00 35.03 33.19 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 0.65 4.19 0.08 1.64 2.12 -1.26 -2.77 118.70 123.35 2dnr s GLU 957 Ca 0.90 0.37 -0.10 0.00 0.36 0.00 0.00 54.97 56.50 2dnr s GLU 957 Cb -1.14 -3.36 0.01 0.00 0.26 0.00 0.00 34.13 29.90 2dnr s GLU 957 CO 0.55 0.35 0.22 -1.17 -0.54 0.00 0.00 175.26 174.67 2dnr s LEU 958 N 0.04 1.25 -1.66 2.70 2.96 -1.02 -4.91 118.68 118.04 2dnr s LEU 958 Ca 0.23 -0.51 -0.08 0.00 -0.22 0.00 0.00 54.13 53.56 2dnr s LEU 958 Cb -0.15 1.13 0.08 0.00 0.50 0.00 0.00 46.19 47.75 2dnr s LEU 958 CO 0.10 -0.69 0.20 0.18 -1.32 0.00 0.00 176.35 174.82 2dnr n LEU 959 N 0.15 -0.93 -4.12 -0.68 4.77 -1.26 0.12 117.00 115.05 2dnr n LEU 959 Ca -0.16 -1.27 -0.33 0.00 -0.03 0.00 0.00 56.01 54.22 2dnr n LEU 959 Cb 0.61 -1.60 -0.02 0.00 -2.33 0.00 0.00 43.42 40.09 2dnr n LEU 959 CO 0.22 0.35 -0.05 0.59 -1.33 0.00 0.00 177.39 177.17 2dnr n ASN 960 N -2.75 -2.95 -3.50 -1.43 3.02 -1.26 -4.94 115.26 101.45 2dnr n ASN 960 Ca -0.18 -0.97 -0.08 0.00 -0.03 0.00 0.00 54.58 53.31 2dnr n ASN 960 Cb 0.62 -3.00 -0.08 0.00 -0.61 0.00 0.00 39.78 36.70 2dnr n ASN 960 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 2dnr s ARG 961 N -6.81 0.34 0.01 3.52 0.52 0.32 -5.05 118.95 111.80 2dnr s ARG 961 Ca 0.58 0.82 -0.30 0.00 -0.52 0.00 0.00 55.73 56.31 2dnr s ARG 961 Cb -0.31 -0.01 -0.06 0.00 0.52 0.00 0.00 34.95 35.09 2dnr s ARG 961 CO 0.90 -0.44 1.52 0.99 0.02 0.00 0.00 175.30 178.30 2dnr s THR 962 N 2.60 3.50 -0.02 0.02 2.01 -1.26 -2.44 115.64 120.05 2dnr s THR 962 Ca 0.06 0.85 0.01 0.00 0.31 0.00 0.00 61.69 62.91 2dnr s THR 962 Cb -0.14 -3.55 -0.04 0.00 0.01 0.00 0.00 72.50 68.79 2dnr s THR 962 CO -0.14 -0.02 0.01 -0.63 -0.69 0.00 0.00 174.62 173.15 2dnr s ILE 963 N 2.82 4.27 -0.14 1.82 1.01 -1.11 -0.68 121.20 129.19 2dnr s ILE 963 Ca 0.68 -0.50 -0.00 0.00 0.00 0.00 0.00 60.65 60.83 2dnr s ILE 963 Cb -0.34 -2.89 0.03 0.00 0.01 0.00 0.00 42.46 39.27 2dnr s ILE 963 CO 0.28 0.42 -0.07 -0.89 0.00 0.00 0.00 174.94 174.69 2dnr s THR 964 N -1.06 1.09 -0.00 2.92 2.01 0.72 -0.94 115.64 120.38 2dnr s THR 964 Ca 0.19 -0.47 -0.05 0.00 0.31 0.00 0.00 61.69 61.66 2dnr s THR 964 Cb -0.12 -1.18 -0.04 0.00 0.01 0.00 0.00 72.50 71.17 2dnr s THR 964 CO 0.09 0.25 0.23 -0.63 -0.69 0.00 0.00 174.62 173.87 2dnr s ILE 965 N 1.66 5.37 -0.23 1.82 1.01 -1.26 -1.49 121.20 128.07 2dnr s ILE 965 Ca 0.03 0.03 -0.13 0.00 0.00 0.00 0.00 60.65 60.58 2dnr s ILE 965 Cb -0.14 -3.55 0.07 0.00 0.01 0.00 0.00 42.46 38.85 2dnr s ILE 965 CO -0.08 0.35 0.55 0.00 0.00 0.00 0.00 174.94 175.77 2dnr s ALA 966 N -1.31 -1.48 0.78 9.38 0.00 -0.06 -4.85 121.76 124.22 2dnr s ALA 966 Ca 0.27 1.99 -0.12 0.00 0.00 0.00 0.00 51.96 54.10 2dnr s ALA 966 Cb -0.13 -1.20 0.07 0.00 0.00 0.00 0.00 23.12 21.86 2dnr s ALA 966 CO 0.17 -0.35 1.14 -0.51 0.00 0.00 0.00 175.76 176.21 2dnr s LEU 967 N 1.57 3.11 0.20 0.00 1.43 -1.26 0.05 118.68 123.78 2dnr s LEU 967 Ca -0.10 2.09 -0.08 0.00 -1.03 0.00 0.00 54.13 55.02 2dnr s LEU 967 Cb -0.07 -4.56 -0.07 0.00 0.03 0.00 0.00 46.19 41.53 2dnr s LEU 967 CO -0.17 -2.34 0.48 -0.75 0.23 0.00 0.00 176.35 173.81 2dnr s LYS 968 N -4.45 3.73 0.35 1.70 2.47 -1.20 -4.75 119.74 117.58 2dnr s LYS 968 Ca 0.67 0.13 -0.25 0.00 -1.56 0.00 0.00 55.97 54.96 2dnr s LYS 968 Cb -0.22 -2.73 -0.13 0.00 -1.46 0.00 0.00 37.83 33.29 2dnr s LYS 968 CO 0.51 0.38 0.78 -1.13 0.16 0.00 0.00 175.35 176.05 2dnr n SER 969 N -0.05 0.20 -4.19 1.43 3.41 -1.26 -4.89 113.62 108.27 2dnr n SER 969 Ca -0.01 1.05 -0.35 0.00 -0.26 0.00 0.00 58.87 59.31 2dnr n SER 969 Cb 0.52 -1.19 0.10 0.00 -0.26 0.00 0.00 64.21 63.38 2dnr n SER 969 CO 0.00 0.00 0.00 -2.65 -0.16 0.00 0.00 175.04 172.23 2dnr n PRO 970 N 0.61 -0.58 -3.75 4.33 -0.02 -1.26 -3.41 135.00 130.92 2dnr n PRO 970 Ca 0.11 -0.15 -0.25 0.00 -2.02 0.00 0.00 63.50 61.18 2dnr n PRO 970 Cb 0.35 -1.44 0.05 0.00 -0.02 0.00 0.00 33.50 32.44 2dnr n PRO 970 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2dnr n SER 971 N 0.65 -3.96 -2.41 2.55 2.88 -1.26 -4.99 113.62 107.09 2dnr n SER 971 Ca 0.01 -0.72 0.00 0.00 -1.33 0.00 0.00 58.87 56.83 2dnr n SER 971 Cb 0.62 -4.29 0.00 0.00 -0.75 0.00 0.00 64.21 59.79 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 -1.68 0.68 3.64 0.46 0.00 -1.22 -4.95 105.19 102.13 2dnr n GLY 972 Ca -0.08 -1.43 -0.43 0.00 0.00 0.00 0.00 46.02 44.08 2dnr n GLY 972 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dnr s PRO 973 N 0.00 4.06 -0.21 1.61 0.04 -1.26 -4.84 135.00 134.41 2dnr s PRO 973 Ca 0.00 1.47 -0.14 0.00 0.04 0.00 0.00 61.00 62.37 2dnr s PRO 973 Cb 0.00 -3.83 -0.04 0.00 0.04 0.00 0.00 34.50 30.66 2dnr s PRO 973 CO 0.00 -0.93 0.30 -1.12 0.04 0.00 0.00 177.00 175.29 2dnr s SER 974 N 2.47 6.32 -1.72 6.66 0.01 -1.26 -3.91 113.70 122.26 2dnr s SER 974 Ca 0.56 0.36 -0.17 0.00 1.31 0.00 0.00 55.95 58.01 2dnr s SER 974 Cb -0.19 -2.18 0.17 0.00 0.21 0.00 0.00 66.02 64.03 2dnr s SER 974 CO 0.19 -0.00 0.43 -1.54 0.41 0.00 0.00 173.24 172.74 2dnr n SER 975 N 4.29 -1.11 0.00 2.44 3.41 -1.26 -5.07 113.62 116.32 2dnr n SER 975 Ca -0.11 -1.19 0.00 0.00 -0.26 0.00 0.00 58.87 57.30 2dnr n SER 975 Cb 0.51 -1.52 0.00 0.00 -0.26 0.00 0.00 64.21 62.95 2dnr n SER 975 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49