#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rqb s PRO 892 N 0.00 0.31 0.31 1.61 0.04 -1.26 -5.10 135.00 130.92 2rqb s PRO 892 Ca 0.00 -0.02 -0.15 0.00 0.04 0.00 0.00 61.00 60.87 2rqb s PRO 892 Cb 0.00 -1.77 0.02 0.00 0.04 0.00 0.00 34.50 32.79 2rqb s PRO 892 CO 0.00 -2.70 0.66 -0.51 0.04 0.00 0.00 177.00 174.49 2rqb s LEU 893 N -6.25 0.09 0.00 -3.56 1.02 -1.26 -5.18 118.68 103.54 2rqb s LEU 893 Ca 0.69 -0.94 0.00 0.00 0.02 0.00 0.00 54.13 53.90 2rqb s LEU 893 Cb -0.10 2.40 0.00 0.00 0.02 0.00 0.00 46.19 48.51 2rqb s LEU 893 CO 0.54 -1.40 0.00 0.61 0.02 0.00 0.00 176.35 176.12 2rqb n GLY 894 N -0.47 3.32 0.67 -3.19 0.00 -1.26 -4.52 105.19 99.73 2rqb n GLY 894 Ca -0.04 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.91 2rqb n GLY 894 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2rqb n SER 895 N 0.00 0.00 -4.02 1.61 3.41 -1.26 -5.09 113.62 108.27 2rqb n SER 895 Ca 0.00 0.00 -0.36 0.00 -0.26 0.00 0.00 58.87 58.25 2rqb n SER 895 Cb 0.00 0.00 0.04 0.00 -0.26 0.00 0.00 64.21 63.99 2rqb n SER 895 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 2rqb n TYR 896 N -1.77 -4.47 -3.60 7.33 4.01 -1.26 -5.01 117.16 112.40 2rqb n TYR 896 Ca 0.00 0.08 -0.04 0.00 -0.16 0.00 0.00 57.90 57.78 2rqb n TYR 896 Cb 0.00 -1.43 -0.02 0.00 -0.31 0.00 0.00 39.34 37.57 2rqb n TYR 896 CO 0.00 0.00 0.00 0.21 -0.46 0.00 0.00 176.86 176.61 2rqb s LYS 897 N -2.06 0.28 -0.56 -0.72 2.20 -1.26 -4.97 119.74 112.64 2rqb s LYS 897 Ca 0.40 -0.09 0.00 0.00 -0.36 0.00 0.00 55.97 55.92 2rqb s LYS 897 Cb -0.13 0.13 0.00 0.00 -1.51 0.00 0.00 37.83 36.31 2rqb s LYS 897 CO 0.80 -0.12 0.00 -1.71 -0.36 0.00 0.00 175.35 173.96 2rqb n ASN 898 N -0.03 -2.77 -4.19 1.43 4.05 -1.26 -5.02 115.26 107.47 2rqb n ASN 898 Ca 0.01 0.03 -0.32 0.00 0.45 0.00 0.00 54.58 54.75 2rqb n ASN 898 Cb 0.58 -1.79 -0.16 0.00 1.23 0.00 0.00 39.78 39.63 2rqb n ASN 898 CO 0.00 0.00 0.00 0.21 -3.05 0.00 0.00 177.26 174.42 2rqb s ASN 899 N -2.78 3.17 0.00 1.20 2.47 -1.26 -3.77 114.94 113.97 2rqb s ASN 899 Ca 0.00 -0.58 0.24 0.00 0.42 0.00 0.00 52.86 52.94 2rqb s ASN 899 Cb 0.00 -1.45 1.43 0.00 -1.45 0.00 0.00 41.25 39.78 2rqb s ASN 899 CO 0.00 0.10 1.80 -0.81 -3.72 0.00 0.00 177.10 174.47 2rqb n PRO 900 N 3.96 0.75 0.09 0.43 -0.04 -1.26 -2.45 135.00 136.48 2rqb n PRO 900 Ca -0.20 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.26 2rqb n PRO 900 Cb 0.52 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.44 2rqb n PRO 900 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2rqb h SER 901 N 0.00 0.00 1.00 3.54 0.87 -1.93 -2.03 113.55 115.00 2rqb h SER 901 Ca 0.00 0.00 -0.13 0.00 -1.23 0.00 0.00 61.79 60.43 2rqb h SER 901 Cb 0.00 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 61.94 2rqb h SER 901 CO 0.00 0.60 -1.06 -0.07 -0.53 0.00 0.00 176.83 175.77 2rqb h LEU 902 N 0.00 0.00 -9.98 2.23 3.38 -1.86 -3.46 115.31 105.62 2rqb h LEU 902 Ca -0.07 0.00 -0.58 0.00 0.09 0.00 0.00 57.88 57.32 2rqb h LEU 902 Cb 1.52 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.23 2rqb h LEU 902 CO 0.07 0.50 -0.48 0.27 0.09 0.00 0.00 178.44 178.88 2rqb s ILE 903 N -2.98 5.34 0.07 1.22 -4.36 -1.22 0.15 121.20 119.42 2rqb s ILE 903 Ca -0.00 -0.55 -0.06 0.00 -0.26 0.00 0.00 60.65 59.78 2rqb s ILE 903 Cb 0.08 -3.68 -0.02 0.00 1.25 0.00 0.00 42.46 40.10 2rqb s ILE 903 CO 0.79 0.02 0.11 -0.89 0.24 0.00 0.00 174.94 175.20 2rqb s THR 904 N -1.63 0.17 -0.12 8.37 2.01 -1.04 -3.35 115.64 120.04 2rqb s THR 904 Ca 0.35 -1.40 -0.07 0.00 0.31 0.00 0.00 61.69 60.88 2rqb s THR 904 Cb -0.12 -1.39 -0.04 0.00 0.01 0.00 0.00 72.50 70.96 2rqb s THR 904 CO 0.28 -0.77 0.13 -0.36 -0.69 0.00 0.00 174.62 173.20 2rqb s PHE 905 N -3.83 3.54 0.36 4.92 0.08 0.10 -2.56 117.98 120.60 2rqb s PHE 905 Ca 0.05 0.48 0.04 0.00 0.12 0.00 0.00 56.93 57.62 2rqb s PHE 905 Cb 0.06 -1.95 -0.03 0.00 -0.57 0.00 0.00 43.02 40.53 2rqb s PHE 905 CO -0.10 0.67 0.17 -0.51 -0.10 0.00 0.00 175.22 175.35 2rqb s LEU 906 N -0.89 1.85 -0.23 -0.37 1.43 -0.50 -1.83 118.68 118.15 2rqb s LEU 906 Ca 0.14 -1.66 -0.18 0.00 -1.03 0.00 0.00 54.13 51.40 2rqb s LEU 906 Cb -0.12 0.12 -0.03 0.00 0.03 0.00 0.00 46.19 46.20 2rqb s LEU 906 CO 0.03 -0.95 0.52 0.00 0.23 0.00 0.00 176.35 176.18 2rqb h LYS 908 N 7.68 -0.68 -0.30 0.00 3.64 -1.31 0.38 116.57 125.99 2rqb h LYS 908 Ca -0.32 0.05 0.05 0.00 -1.27 0.00 0.00 60.65 59.16 2rqb h LYS 908 Cb 1.15 0.15 -0.08 0.00 -0.41 0.00 0.00 32.23 33.04 2rqb h LYS 908 CO 0.73 -0.45 -0.46 -0.91 -2.27 0.00 0.00 179.45 176.09 2rqb h ASN 909 N -0.70 -1.51 0.00 4.20 4.21 -1.94 -3.40 115.58 116.43 2rqb h ASN 909 Ca 0.00 0.21 0.00 0.00 1.21 0.00 0.00 56.30 57.72 2rqb h ASN 909 Cb 0.69 0.63 0.00 0.00 -1.12 0.00 0.00 38.32 38.52 2rqb h ASN 909 CO -0.18 -0.41 0.00 0.00 -1.29 0.00 0.00 177.43 175.55 2rqb n SER 911 N 0.00 0.00 -4.78 0.00 7.64 0.13 -4.76 113.62 111.85 2rqb n SER 911 Ca 0.00 0.00 -0.37 0.00 1.01 0.00 0.00 58.87 59.51 2rqb n SER 911 Cb 0.00 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.14 2rqb n SER 911 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 2rqb s VAL 912 N 0.00 5.19 -0.37 0.44 -7.23 -1.26 -4.55 120.40 112.62 2rqb s VAL 912 Ca 0.00 0.72 -0.28 0.00 -1.81 0.00 0.00 61.98 60.61 2rqb s VAL 912 Cb 0.00 -3.68 -0.04 0.00 0.56 0.00 0.00 36.38 33.22 2rqb s VAL 912 CO 0.00 0.47 2.06 -0.22 -0.31 0.00 0.00 175.10 177.10 2rqb s LEU 913 N -0.20 3.43 -0.04 1.32 1.98 -1.26 -2.70 118.68 121.21 2rqb s LEU 913 Ca 0.21 1.29 0.01 0.00 -2.89 0.00 0.00 54.13 52.75 2rqb s LEU 913 Cb -0.15 -3.16 -0.26 0.00 0.66 0.00 0.00 46.19 43.28 2rqb s LEU 913 CO 0.09 -2.13 0.69 0.00 -1.89 0.00 0.00 176.35 173.11 2rqb h ALA 914 N 15.25 0.45 -1.13 5.97 0.00 -1.70 -3.49 119.26 134.61 2rqb h ALA 914 Ca -0.33 -1.27 0.32 0.00 0.00 0.00 0.00 54.91 53.63 2rqb h ALA 914 Cb 1.21 0.43 -0.20 0.00 0.00 0.00 0.00 17.79 19.23 2rqb h ALA 914 CO 1.06 1.31 0.95 0.00 0.00 0.00 0.00 179.25 182.58 2rqb s SER 916 N -2.13 5.46 0.17 0.00 0.15 -1.26 0.01 113.70 116.10 2rqb s SER 916 Ca 0.12 -0.34 -0.14 0.00 0.70 0.00 0.00 55.95 56.29 2rqb s SER 916 Cb -0.00 -1.24 0.11 0.00 -1.71 0.00 0.00 66.02 63.18 2rqb s SER 916 CO -0.03 -0.18 1.79 1.23 1.20 0.00 0.00 173.24 177.25 2rqb h GLY 917 N 1.37 0.66 2.00 9.45 0.00 -1.51 0.76 103.07 115.80 2rqb h GLY 917 Ca -0.47 -0.17 0.00 0.00 0.00 0.00 0.00 47.33 46.69 2rqb h GLY 917 CO 0.60 0.12 0.00 1.05 0.00 0.00 0.00 176.54 178.31 2rqb h GLU 918 N 0.49 0.00 -0.70 4.80 -0.00 -1.64 0.26 114.58 117.79 2rqb h GLU 918 Ca 0.20 0.00 -0.33 0.00 -0.00 0.00 0.00 59.36 59.23 2rqb h GLU 918 Cb 0.10 0.00 -0.20 0.00 -0.00 0.00 0.00 28.75 28.65 2rqb h GLU 918 CO -0.13 0.00 0.31 -3.47 -0.00 0.00 0.00 179.01 175.71 2rqb n ASP 919 N -2.67 3.41 -4.19 3.06 4.64 0.24 -4.94 116.55 116.09 2rqb n ASP 919 Ca -0.01 -3.60 -0.14 0.00 -1.38 0.00 0.00 54.79 49.66 2rqb n ASP 919 Cb 0.12 -0.74 -0.11 0.00 -1.04 0.00 0.00 41.12 39.36 2rqb n ASP 919 CO 0.00 0.00 0.00 -0.63 -0.82 0.00 0.00 177.20 175.75 2rqb s ILE 920 N -3.23 0.96 0.44 5.18 -1.09 0.08 -4.65 121.20 118.88 2rqb s ILE 920 Ca 0.52 -1.76 0.06 0.00 -2.23 0.00 0.00 60.65 57.23 2rqb s ILE 920 Cb 0.44 -1.49 -0.06 0.00 -1.58 0.00 0.00 42.46 39.77 2rqb s ILE 920 CO 0.07 -0.63 0.02 -1.00 -1.23 0.00 0.00 174.94 172.16 2rqb s HIS 921 N -2.75 2.36 0.13 3.97 3.76 -1.19 -4.71 115.29 116.86 2rqb s HIS 921 Ca 0.08 -0.74 0.06 0.00 -0.15 0.00 0.00 55.06 54.32 2rqb s HIS 921 Cb -0.01 -1.75 -0.04 0.00 1.11 0.00 0.00 32.58 31.90 2rqb s HIS 921 CO -0.00 0.38 -0.14 0.08 -0.85 0.00 0.00 174.74 174.21 2rqb s VAL 922 N -2.75 1.40 -0.18 -0.90 1.01 -1.26 -3.51 120.40 114.21 2rqb s VAL 922 Ca 0.28 -1.81 -0.01 0.00 0.00 0.00 0.00 61.98 60.44 2rqb s VAL 922 Cb 0.08 -1.63 0.05 0.00 0.00 0.00 0.00 36.38 34.88 2rqb s VAL 922 CO 0.15 -0.45 -0.01 -0.63 0.00 0.00 0.00 175.10 174.16 2rqb s ILE 923 N -2.29 0.82 -1.36 2.22 -1.09 0.19 -1.62 121.20 118.07 2rqb s ILE 923 Ca 0.11 -0.59 0.00 0.00 -2.23 0.00 0.00 60.65 57.94 2rqb s ILE 923 Cb -0.04 -1.15 0.00 0.00 -1.58 0.00 0.00 42.46 39.68 2rqb s ILE 923 CO 0.03 -0.04 0.00 -0.62 -1.23 0.00 0.00 174.94 173.08 2rqb n GLU 924 N 4.96 -1.66 -2.11 2.79 1.02 -1.26 -0.39 120.64 123.99 2rqb n GLU 924 Ca -0.10 0.76 -0.10 0.00 -0.02 0.00 0.00 57.16 57.71 2rqb n GLU 924 Cb 0.47 -5.17 -0.02 0.00 -0.02 0.00 0.00 31.44 26.70 2rqb n GLU 924 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2rqb n LYS 925 N -2.32 -2.05 0.00 3.49 4.01 -1.26 -4.65 118.16 115.38 2rqb n LYS 925 Ca -0.15 0.50 0.00 0.00 -0.51 0.00 0.00 58.31 58.14 2rqb n LYS 925 Cb 0.53 -4.96 0.00 0.00 -0.51 0.00 0.00 35.03 30.09 2rqb n LYS 925 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2rqb n MET 926 N -2.42 0.00 -5.11 1.97 0.00 0.48 -5.05 117.12 106.99 2rqb n MET 926 Ca -0.11 0.00 -0.32 0.00 0.00 0.00 0.00 57.70 57.27 2rqb n MET 926 Cb 0.51 -0.85 -0.15 0.00 0.00 0.00 0.00 33.22 32.72 2rqb n MET 926 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 175.97 174.96 2rqb s HIS 927 N -1.74 2.55 -0.40 3.17 3.76 0.06 -4.99 115.29 117.70 2rqb s HIS 927 Ca 0.00 -0.54 -0.11 0.00 -0.15 0.00 0.00 55.06 54.26 2rqb s HIS 927 Cb 0.00 -1.63 0.05 0.00 1.11 0.00 0.00 32.58 32.11 2rqb s HIS 927 CO 0.00 -0.10 0.25 -1.01 -0.85 0.00 0.00 174.74 173.04 2rqb s HIS 928 N -0.28 3.28 -0.19 1.40 3.76 -1.26 0.53 115.29 122.53 2rqb s HIS 928 Ca 0.00 -1.15 -0.08 0.00 -0.15 0.00 0.00 55.06 53.68 2rqb s HIS 928 Cb -0.13 -2.72 -0.04 0.00 1.11 0.00 0.00 32.58 30.79 2rqb s HIS 928 CO 0.03 -0.74 0.09 0.14 -0.85 0.00 0.00 174.74 173.40 2rqb s VAL 929 N 1.52 5.03 -0.72 -0.90 -7.23 -1.23 -3.87 120.40 113.01 2rqb s VAL 929 Ca 0.03 0.05 -0.18 0.00 -1.81 0.00 0.00 61.98 60.07 2rqb s VAL 929 Cb -0.21 -3.28 0.13 0.00 0.56 0.00 0.00 36.38 33.58 2rqb s VAL 929 CO 0.05 0.45 0.82 0.21 -0.31 0.00 0.00 175.10 176.32 2rqb s ASN 930 N 0.36 6.40 -0.16 4.85 3.84 -0.01 -3.16 114.94 127.05 2rqb s ASN 930 Ca 0.05 -1.81 -0.04 0.00 0.21 0.00 0.00 52.86 51.27 2rqb s ASN 930 Cb -0.12 -2.31 -0.08 0.00 -0.55 0.00 0.00 41.25 38.19 2rqb s ASN 930 CO -0.01 -1.01 2.94 0.23 -2.79 0.00 0.00 177.10 176.47 2rqb n MET 931 N 5.95 1.92 -3.97 0.43 2.81 -1.26 -4.07 117.12 118.92 2rqb n MET 931 Ca 0.03 -1.25 -0.35 0.00 -1.81 0.00 0.00 57.70 54.31 2rqb n MET 931 Cb 0.45 -1.83 -0.12 0.00 -0.71 0.00 0.00 33.22 31.01 2rqb n MET 931 CO 0.00 0.00 0.00 0.99 1.51 0.00 0.00 175.97 178.47 2rqb s THR 932 N -0.41 4.22 0.00 2.03 2.01 -1.26 -4.99 115.64 117.24 2rqb s THR 932 Ca 0.49 -0.22 -0.20 0.00 0.31 0.00 0.00 61.69 62.08 2rqb s THR 932 Cb 0.27 -2.93 -0.22 0.00 0.01 0.00 0.00 72.50 69.64 2rqb s THR 932 CO -0.06 0.40 1.13 1.55 -0.69 0.00 0.00 174.62 176.95 2rqb h PRO 933 N 7.59 0.39 -0.63 4.92 0.13 -1.99 -3.20 132.00 139.20 2rqb h PRO 933 Ca -0.37 -0.37 0.10 0.00 -0.87 0.00 0.00 66.00 64.49 2rqb h PRO 933 Cb 1.18 0.10 -0.04 0.00 0.13 0.00 0.00 31.00 32.36 2rqb h PRO 933 CO 0.61 1.04 0.42 1.05 -0.23 0.00 0.00 178.00 180.89 2rqb h GLU 934 N -0.12 0.41 0.00 0.86 4.11 -1.97 0.31 114.58 118.18 2rqb h GLU 934 Ca -0.05 -0.02 -0.00 0.00 0.07 0.00 0.00 59.36 59.35 2rqb h GLU 934 Cb 1.18 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 30.34 2rqb h GLU 934 CO 0.10 0.27 -0.01 0.35 0.07 0.00 0.00 179.01 179.79 2rqb h PHE 935 N 0.43 0.00 0.00 2.06 3.57 -1.83 -0.11 116.94 121.06 2rqb h PHE 935 Ca 0.29 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.79 2rqb h PHE 935 Cb 0.57 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.31 2rqb h PHE 935 CO -0.00 0.01 0.00 1.57 -2.23 0.00 0.00 178.31 177.66 2rqb h LYS 936 N 0.00 0.00 -0.30 1.11 2.10 -0.46 0.20 116.57 119.22 2rqb h LYS 936 Ca -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2rqb h LYS 936 Cb 0.13 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.46 2rqb h LYS 936 CO 0.00 0.00 0.00 0.39 -2.00 0.00 0.00 179.45 177.84 2rqb n GLU 937 N -2.73 2.16 -0.00 0.07 1.02 -0.05 -4.15 120.64 116.95 2rqb n GLU 937 Ca -0.01 -1.99 0.04 0.00 -0.02 0.00 0.00 57.16 55.19 2rqb n GLU 937 Cb 0.14 -1.39 -0.05 0.00 -0.02 0.00 0.00 31.44 30.12 2rqb n GLU 937 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2rqb n LEU 938 N 1.07 0.43 -4.19 -4.62 4.77 0.59 -5.00 117.00 110.06 2rqb n LEU 938 Ca 0.15 -0.49 -0.18 0.00 -0.03 0.00 0.00 56.01 55.45 2rqb n LEU 938 Cb 0.49 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.46 2rqb n LEU 938 CO 0.12 0.11 -0.46 -0.72 -1.33 0.00 0.00 177.39 175.11 2rqb s TYR 939 N -1.90 1.28 -0.01 -1.77 -0.85 -0.63 -3.78 117.35 109.68 2rqb s TYR 939 Ca 0.03 -0.48 0.05 0.00 -0.52 0.00 0.00 57.07 56.15 2rqb s TYR 939 Cb 0.07 -0.71 -0.01 0.00 0.38 0.00 0.00 41.96 41.69 2rqb s TYR 939 CO 0.39 0.08 -0.16 0.42 -1.52 0.00 0.00 175.55 174.75 2rqb s ILE 940 N -1.46 1.30 -0.25 -3.49 1.01 0.82 -4.83 121.20 114.29 2rqb s ILE 940 Ca 0.01 -0.70 -0.11 0.00 0.00 0.00 0.00 60.65 59.85 2rqb s ILE 940 Cb -0.09 -1.08 -0.05 0.00 0.01 0.00 0.00 42.46 41.25 2rqb s ILE 940 CO 0.02 0.37 0.16 -0.69 0.00 0.00 0.00 174.94 174.80 2rqb s VAL 941 N -0.39 5.33 -0.25 2.92 1.01 -1.26 -0.49 120.40 127.27 2rqb s VAL 941 Ca 0.06 0.17 -0.10 0.00 0.00 0.00 0.00 61.98 62.11 2rqb s VAL 941 Cb -0.06 -3.49 -0.05 0.00 0.00 0.00 0.00 36.38 32.78 2rqb s VAL 941 CO -0.01 0.33 0.15 -0.13 0.00 0.00 0.00 175.10 175.44 2rqb s ARG 942 N 1.20 3.96 -0.64 2.72 3.00 -1.04 -4.97 118.95 123.18 2rqb s ARG 942 Ca 0.07 -0.33 -0.34 0.00 0.00 0.00 0.00 55.73 55.14 2rqb s ARG 942 Cb -0.14 -3.51 -0.16 0.00 0.00 0.00 0.00 34.95 31.14 2rqb s ARG 942 CO 0.06 -0.04 2.41 -1.91 0.00 0.00 0.00 175.30 175.82 2rqb n GLU 943 N 4.56 0.48 -3.50 3.54 2.13 -1.26 -4.08 120.64 122.52 2rqb n GLU 943 Ca -0.15 0.08 -0.03 0.00 0.66 0.00 0.00 57.16 57.72 2rqb n GLU 943 Cb 0.52 -2.11 -0.05 0.00 0.27 0.00 0.00 31.44 30.07 2rqb n GLU 943 CO 0.00 0.00 0.00 1.21 -0.41 0.00 0.00 177.13 177.93 2rqb s ASN 944 N 8.56 -0.80 0.00 4.31 2.47 -1.26 -5.00 114.94 123.22 2rqb s ASN 944 Ca 1.19 1.10 0.26 0.00 0.42 0.00 0.00 52.86 55.83 2rqb s ASN 944 Cb -1.00 1.88 0.76 0.00 -1.45 0.00 0.00 41.25 41.44 2rqb s ASN 944 CO 0.48 -0.24 1.58 2.29 -3.72 0.00 0.00 177.10 177.49 2rqb n LYS 945 N 5.42 0.22 0.13 0.43 2.85 -1.26 -3.57 118.16 122.37 2rqb n LYS 945 Ca -0.08 -0.11 0.10 0.00 -1.05 0.00 0.00 58.31 57.17 2rqb n LYS 945 Cb 0.50 -1.50 0.48 0.00 -0.65 0.00 0.00 35.03 33.86 2rqb n LYS 945 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2rqb n ALA 946 N -1.29 1.21 -0.07 0.58 0.00 -1.26 -2.97 120.51 116.71 2rqb n ALA 946 Ca 0.08 0.14 -0.10 0.00 0.00 0.00 0.00 53.44 53.55 2rqb n ALA 946 Cb 0.33 -1.29 -0.03 0.00 0.00 0.00 0.00 19.45 18.46 2rqb n ALA 946 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2rqb n LEU 947 N -2.13 1.71 -4.79 0.00 7.99 -1.23 -4.99 117.00 113.56 2rqb n LEU 947 Ca -0.00 0.28 -0.36 0.00 -0.01 0.00 0.00 56.01 55.92 2rqb n LEU 947 Cb 0.08 -0.65 -0.05 0.00 -0.11 0.00 0.00 43.42 42.69 2rqb n LEU 947 CO 0.11 -0.20 0.70 0.00 -1.51 0.00 0.00 177.39 176.49 2rqb s GLN 948 N -2.64 4.23 0.33 3.23 1.03 -1.16 -4.98 119.66 119.70 2rqb s GLN 948 Ca -0.24 1.38 0.06 0.00 0.04 0.00 0.00 55.36 56.60 2rqb s GLN 948 Cb 0.05 -2.48 -0.02 0.00 0.03 0.00 0.00 33.01 30.58 2rqb s GLN 948 CO 0.35 -0.06 0.23 1.63 -2.54 0.00 0.00 175.29 174.89 2rqb n LYS 949 N -0.13 0.44 0.00 9.60 5.02 -1.26 -4.69 118.16 127.14 2rqb n LYS 949 Ca 0.05 -3.14 0.00 0.00 -2.02 0.00 0.00 58.31 53.20 2rqb n LYS 949 Cb 0.51 2.34 0.00 0.00 -0.02 0.00 0.00 35.03 37.86 2rqb n LYS 949 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2rqb n LYS 950 N -0.66 0.00 -1.53 1.97 5.02 -1.26 -4.49 118.16 117.21 2rqb n LYS 950 Ca 0.04 0.00 -0.30 0.00 -2.02 0.00 0.00 58.31 56.03 2rqb n LYS 950 Cb 0.57 -0.09 -0.12 0.00 -0.02 0.00 0.00 35.03 35.36 2rqb n LYS 950 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2rqb n ALA 952 N 12.49 -2.66 -0.03 0.00 0.00 -1.26 -5.04 120.51 124.02 2rqb n ALA 952 Ca 0.55 -0.56 -0.01 0.00 0.00 0.00 0.00 53.44 53.42 2rqb n ALA 952 Cb 0.27 0.08 -0.08 0.00 0.00 0.00 0.00 19.45 19.73 2rqb n ALA 952 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2rqb n ASP 953 N -0.79 2.70 -4.13 0.00 9.92 -1.26 -4.86 116.55 118.14 2rqb n ASP 953 Ca 0.04 0.00 -0.37 0.00 -0.53 0.00 0.00 54.79 53.93 2rqb n ASP 953 Cb 0.41 0.99 -0.10 0.00 -0.64 0.00 0.00 41.12 41.79 2rqb n ASP 953 CO 0.00 0.00 0.00 -0.31 0.13 0.00 0.00 177.20 177.02 2rqb s TYR 954 N -2.40 3.50 0.25 1.24 2.02 -1.26 -4.89 117.35 115.81 2rqb s TYR 954 Ca -0.04 -2.46 -0.30 0.00 -0.37 0.00 0.00 57.07 53.90 2rqb s TYR 954 Cb 0.04 -3.27 -0.10 0.00 -0.40 0.00 0.00 41.96 38.23 2rqb s TYR 954 CO 0.39 -0.92 1.37 -1.14 -1.57 0.00 0.00 175.55 173.68 2rqb s GLN 955 N 0.66 4.32 0.24 -0.62 2.00 -1.21 -4.68 119.66 120.38 2rqb s GLN 955 Ca 0.12 2.21 0.10 0.00 -2.00 0.00 0.00 55.36 55.79 2rqb s GLN 955 Cb -0.22 -3.12 -0.04 0.00 0.80 0.00 0.00 33.01 30.42 2rqb s GLN 955 CO -0.04 -0.32 -0.08 0.42 -0.50 0.00 0.00 175.29 174.78 2rqb s ILE 956 N -0.24 3.16 -0.11 -2.34 -1.09 -1.26 0.18 121.20 119.51 2rqb s ILE 956 Ca 0.56 -1.93 0.17 0.00 -2.23 0.00 0.00 60.65 57.23 2rqb s ILE 956 Cb -0.40 -2.64 -0.25 0.00 -1.58 0.00 0.00 42.46 37.59 2rqb s ILE 956 CO 0.44 -0.29 0.22 0.59 -1.23 0.00 0.00 174.94 174.67 2rqb n ASN 957 N -0.51 0.64 0.00 3.58 5.03 -0.78 -4.68 115.26 118.53 2rqb n ASN 957 Ca -0.08 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.37 2rqb n ASN 957 Cb 0.58 1.36 0.00 0.00 -1.02 0.00 0.00 39.78 40.70 2rqb n ASN 957 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2rqb n GLY 958 N 1.69 -0.49 3.26 7.41 0.00 -1.26 -4.69 105.19 111.10 2rqb n GLY 958 Ca -0.17 -0.47 -0.31 0.00 0.00 0.00 0.00 46.02 45.06 2rqb n GLY 958 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2rqb s GLU 959 N -1.98 2.50 -0.16 1.61 2.12 -1.26 -3.11 118.70 118.42 2rqb s GLU 959 Ca 0.00 -0.89 -0.16 0.00 0.36 0.00 0.00 54.97 54.28 2rqb s GLU 959 Cb 0.00 -2.12 -0.04 0.00 0.26 0.00 0.00 34.13 32.23 2rqb s GLU 959 CO 0.00 0.38 0.41 0.96 -0.54 0.00 0.00 175.26 176.46 2rqb s ILE 960 N -0.16 5.22 -0.01 -3.70 -4.36 -1.21 -2.48 121.20 114.50 2rqb s ILE 960 Ca -0.03 0.77 0.04 0.00 -0.26 0.00 0.00 60.65 61.16 2rqb s ILE 960 Cb -0.14 -3.74 -0.01 0.00 1.25 0.00 0.00 42.46 39.82 2rqb s ILE 960 CO 0.04 0.31 -0.12 0.27 0.24 0.00 0.00 174.94 175.68 2rqb s ILE 961 N 0.86 0.93 0.68 8.37 -4.36 0.36 0.25 121.20 128.29 2rqb s ILE 961 Ca 0.21 -0.51 -0.11 0.00 -0.26 0.00 0.00 60.65 59.98 2rqb s ILE 961 Cb -0.14 -0.78 0.17 0.00 1.25 0.00 0.00 42.46 42.96 2rqb s ILE 961 CO 0.08 0.26 0.38 0.00 0.24 0.00 0.00 174.94 175.90 2rqb h LYS 963 N 0.00 0.04 -0.37 0.00 1.79 -1.92 -1.72 116.57 114.39 2rqb h LYS 963 Ca -0.17 -0.01 0.05 0.00 -2.18 0.00 0.00 60.65 58.34 2rqb h LYS 963 Cb 0.58 -0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 31.21 2rqb h LYS 963 CO 0.10 0.14 0.25 0.00 -1.08 0.00 0.00 179.45 178.87 2rqb n GLY 965 N -1.53 0.94 3.53 0.00 0.00 -0.64 -5.11 105.19 102.38 2rqb n GLY 965 Ca 0.04 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.68 2rqb n GLY 965 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2rqb s GLN 966 N 0.11 3.70 -0.83 1.61 2.00 -1.26 -4.74 119.66 120.26 2rqb s GLN 966 Ca 0.00 -0.49 -0.22 0.00 -2.00 0.00 0.00 55.36 52.66 2rqb s GLN 966 Cb 0.00 -3.62 -0.20 0.00 0.80 0.00 0.00 33.01 29.99 2rqb s GLN 966 CO 0.00 -0.28 2.39 0.00 -0.50 0.00 0.00 175.29 176.90 2rqb n ALA 967 N 5.04 0.65 0.02 1.58 0.00 -1.26 -0.85 120.51 125.68 2rqb n ALA 967 Ca -0.14 -0.94 -0.05 0.00 0.00 0.00 0.00 53.44 52.31 2rqb n ALA 967 Cb 0.51 -2.83 0.15 0.00 0.00 0.00 0.00 19.45 17.28 2rqb n ALA 967 CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.50 176.01 2rqb h TRP 968 N 13.47 0.55 0.00 0.00 6.55 -0.54 -3.43 115.95 132.55 2rqb h TRP 968 Ca -0.04 -0.15 0.00 0.00 0.95 0.00 0.00 58.89 59.65 2rqb h TRP 968 Cb 1.15 -0.12 0.00 0.00 -0.86 0.00 0.00 29.16 29.32 2rqb h TRP 968 CO 1.18 0.78 0.00 0.41 -1.05 0.00 0.00 178.44 179.75 2rqb n GLY 969 N -0.15 -0.37 3.24 1.49 0.00 -1.07 0.62 105.19 108.97 2rqb n GLY 969 Ca -0.01 0.31 -0.13 0.00 0.00 0.00 0.00 46.02 46.19 2rqb n GLY 969 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2rqb s THR 970 N 0.00 0.07 -0.80 2.61 -4.23 0.54 -3.29 115.64 110.54 2rqb s THR 970 Ca 0.00 -0.54 -0.17 0.00 -1.18 0.00 0.00 61.69 59.81 2rqb s THR 970 Cb 0.00 -0.72 0.16 0.00 1.34 0.00 0.00 72.50 73.28 2rqb s THR 970 CO 0.00 -0.30 0.86 -0.32 -0.54 0.00 0.00 174.62 174.33 2rqb s MET 971 N -1.71 3.46 0.43 3.99 1.75 -1.18 0.22 119.30 126.26 2rqb s MET 971 Ca -0.11 -1.96 -0.17 0.00 -1.25 0.00 0.00 55.69 52.20 2rqb s MET 971 Cb -0.04 -4.55 -0.09 0.00 2.84 0.00 0.00 34.83 32.99 2rqb s MET 971 CO 0.02 -1.51 0.90 -1.64 -0.65 0.00 0.00 175.02 172.14 2rqb s MET 972 N 1.59 4.05 0.10 4.11 -1.94 -0.45 -1.87 119.30 124.89 2rqb s MET 972 Ca 0.21 0.91 0.08 0.00 -1.71 0.00 0.00 55.69 55.18 2rqb s MET 972 Cb -0.12 -2.24 -0.03 0.00 2.01 0.00 0.00 34.83 34.45 2rqb s MET 972 CO -0.05 -0.07 -0.20 0.08 -0.01 0.00 0.00 175.02 174.76 2rqb s VAL 973 N -2.30 1.66 -0.25 -6.03 1.01 0.48 -0.57 120.40 114.39 2rqb s VAL 973 Ca 0.58 -1.53 -0.03 0.00 0.00 0.00 0.00 61.98 60.99 2rqb s VAL 973 Cb -0.10 -1.52 0.10 0.00 0.00 0.00 0.00 36.38 34.86 2rqb s VAL 973 CO 0.22 -0.08 0.17 -2.28 0.00 0.00 0.00 175.10 173.13 2rqb s HIS 974 N -1.20 0.03 -1.83 5.22 5.04 -0.94 -3.28 115.29 118.34 2rqb s HIS 974 Ca 0.06 -0.45 0.00 0.00 -1.54 0.00 0.00 55.06 53.13 2rqb s HIS 974 Cb -0.10 -0.68 0.00 0.00 0.04 0.00 0.00 32.58 31.84 2rqb s HIS 974 CO 0.04 -0.75 0.00 1.63 -2.34 0.00 0.00 174.74 173.32 2rqb n LYS 975 N 5.28 -1.34 -0.07 2.88 5.02 -1.26 -0.38 118.16 128.29 2rqb n LYS 975 Ca -0.05 1.07 0.00 0.00 -2.02 0.00 0.00 58.31 57.30 2rqb n LYS 975 Cb 0.45 -5.42 0.00 0.00 -0.02 0.00 0.00 35.03 30.04 2rqb n LYS 975 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2rqb n GLY 976 N -0.81 0.56 3.87 0.72 0.00 -1.26 -4.99 105.19 103.28 2rqb n GLY 976 Ca -0.19 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.52 2rqb n GLY 976 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2rqb s LEU 977 N 0.00 3.03 -0.27 0.99 1.98 0.49 -5.05 118.68 119.86 2rqb s LEU 977 Ca 0.00 1.30 -0.05 0.00 -2.89 0.00 0.00 54.13 52.49 2rqb s LEU 977 Cb 0.00 -4.19 0.01 0.00 0.66 0.00 0.00 46.19 42.67 2rqb s LEU 977 CO 0.00 -1.20 0.02 1.51 -1.89 0.00 0.00 176.35 174.79 2rqb s ASP 978 N -4.21 4.78 -0.33 3.68 1.47 -1.26 -2.20 116.67 118.59 2rqb s ASP 978 Ca 0.57 -0.67 -0.01 0.00 1.18 0.00 0.00 52.55 53.61 2rqb s ASP 978 Cb -0.11 -1.80 0.11 0.00 -0.34 0.00 0.00 42.92 40.78 2rqb s ASP 978 CO 0.53 -0.14 0.15 -0.76 0.68 0.00 0.00 175.17 175.64 2rqb s LEU 979 N 1.46 1.51 -0.25 2.11 1.02 0.26 -4.89 118.68 119.90 2rqb s LEU 979 Ca 0.03 -1.81 -0.29 0.00 0.02 0.00 0.00 54.13 52.08 2rqb s LEU 979 Cb -0.16 -0.63 -0.01 0.00 0.02 0.00 0.00 46.19 45.41 2rqb s LEU 979 CO -0.00 -0.38 1.33 -2.16 0.02 0.00 0.00 176.35 175.16 2rqb s PRO 980 N 1.45 4.00 -0.50 1.29 0.04 -1.26 -1.34 135.00 138.67 2rqb s PRO 980 Ca 0.13 1.42 -0.17 0.00 0.04 0.00 0.00 61.00 62.41 2rqb s PRO 980 Cb -0.19 -3.86 0.07 0.00 0.04 0.00 0.00 34.50 30.56 2rqb s PRO 980 CO -0.19 -1.02 0.52 0.00 0.04 0.00 0.00 177.00 176.36 2rqb s LEU 982 N 2.13 3.09 -0.11 0.00 1.02 -1.25 -0.33 118.68 123.23 2rqb s LEU 982 Ca 0.09 0.58 0.00 0.00 0.02 0.00 0.00 54.13 54.82 2rqb s LEU 982 Cb -0.23 -3.35 0.02 0.00 0.02 0.00 0.00 46.19 42.66 2rqb s LEU 982 CO 0.08 -1.25 -0.10 -0.54 0.02 0.00 0.00 176.35 174.57 2rqb s LYS 983 N -5.06 1.67 0.57 1.70 1.02 0.20 -4.88 119.74 114.97 2rqb s LYS 983 Ca 0.56 -0.33 0.36 0.00 0.02 0.00 0.00 55.97 56.58 2rqb s LYS 983 Cb -0.11 -1.61 1.96 0.00 -0.52 0.00 0.00 37.83 37.55 2rqb s LYS 983 CO 0.45 -0.19 2.10 0.82 -0.92 0.00 0.00 175.35 177.60 2rqb h ILE 984 N 6.11 0.00 0.00 2.17 2.04 -1.83 0.46 117.51 126.46 2rqb h ILE 984 Ca -0.31 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.55 2rqb h ILE 984 Cb 1.14 0.80 0.00 0.00 -0.74 0.00 0.00 36.82 38.02 2rqb h ILE 984 CO 0.44 0.00 0.00 -2.11 0.00 0.00 0.00 178.15 176.48 2rqb n ARG 985 N -2.81 0.23 0.00 2.37 1.85 0.10 -2.04 116.66 116.36 2rqb n ARG 985 Ca -0.02 0.12 0.00 0.00 -1.00 0.00 0.00 57.85 56.94 2rqb n ARG 985 Cb 0.12 -1.50 0.00 0.00 -1.05 0.00 0.00 32.46 30.03 2rqb n ARG 985 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 2rqb n ASN 986 N -1.32 0.71 -3.63 2.89 3.02 0.16 -5.00 115.26 112.09 2rqb n ASN 986 Ca 0.08 -0.95 -0.21 0.00 -0.03 0.00 0.00 54.58 53.48 2rqb n ASN 986 Cb 0.16 0.07 -0.04 0.00 -0.61 0.00 0.00 39.78 39.35 2rqb n ASN 986 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 2rqb n PHE 987 N -0.07 0.65 -4.15 3.10 3.01 -0.87 -1.04 117.46 118.10 2rqb n PHE 987 Ca 0.00 -1.66 -0.10 0.00 1.01 0.00 0.00 57.45 56.71 2rqb n PHE 987 Cb 0.05 -0.18 -0.10 0.00 -0.01 0.00 0.00 39.48 39.24 2rqb n PHE 987 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 2rqb s VAL 988 N -2.26 0.49 -0.17 -4.37 1.01 -0.44 -4.47 120.40 110.19 2rqb s VAL 988 Ca 0.02 -1.90 0.00 0.00 0.00 0.00 0.00 61.98 60.11 2rqb s VAL 988 Cb 0.00 -1.71 0.03 0.00 0.00 0.00 0.00 36.38 34.70 2rqb s VAL 988 CO 0.02 -0.83 -0.10 -0.69 0.00 0.00 0.00 175.10 173.50 2rqb s VAL 989 N -3.76 1.43 -0.18 2.92 1.01 -0.22 -1.41 120.40 120.19 2rqb s VAL 989 Ca 0.13 -0.73 -0.02 0.00 0.00 0.00 0.00 61.98 61.36 2rqb s VAL 989 Cb 0.06 -1.47 -0.01 0.00 0.00 0.00 0.00 36.38 34.96 2rqb s VAL 989 CO -0.05 0.27 -0.10 -0.69 0.00 0.00 0.00 175.10 174.53 2rqb s VAL 990 N 1.51 3.07 0.14 2.92 1.01 -1.06 0.35 120.40 128.34 2rqb s VAL 990 Ca 0.02 -0.62 -0.27 0.00 0.00 0.00 0.00 61.98 61.10 2rqb s VAL 990 Cb -0.15 -2.34 -0.07 0.00 0.00 0.00 0.00 36.38 33.82 2rqb s VAL 990 CO -0.09 0.48 0.85 -0.36 0.00 0.00 0.00 175.10 175.99 2rqb s PHE 991 N 0.97 3.86 -0.04 5.22 0.08 -1.02 -2.51 117.98 124.55 2rqb s PHE 991 Ca -0.01 1.70 -0.07 0.00 0.12 0.00 0.00 56.93 58.67 2rqb s PHE 991 Cb -0.15 -2.89 -0.29 0.00 -0.57 0.00 0.00 43.02 39.12 2rqb s PHE 991 CO -0.01 0.38 0.70 -0.22 -0.10 0.00 0.00 175.22 175.96 2rqb h LYS 992 N 4.89 0.31 -0.94 0.44 3.64 0.10 -3.36 116.57 121.65 2rqb h LYS 992 Ca -0.45 -0.54 0.15 0.00 -1.27 0.00 0.00 60.65 58.54 2rqb h LYS 992 Cb 1.21 0.20 -0.15 0.00 -0.41 0.00 0.00 32.23 33.07 2rqb h LYS 992 CO 0.69 1.20 -0.38 -0.91 -2.27 0.00 0.00 179.45 177.77 2rqb h ASN 993 N 0.09 -1.41 -4.68 4.20 -0.26 -1.93 -3.41 115.58 108.18 2rqb h ASN 993 Ca -0.32 0.30 -0.25 0.00 -0.56 0.00 0.00 56.30 55.47 2rqb h ASN 993 Cb 2.06 0.74 -0.18 0.00 -1.06 0.00 0.00 38.32 39.88 2rqb h ASN 993 CO 0.16 -0.29 -0.72 0.21 -1.06 0.00 0.00 177.43 175.73 2rqb s ASN 994 N -5.33 1.02 -0.78 5.81 2.47 -1.26 -4.65 114.94 112.22 2rqb s ASN 994 Ca -0.14 -0.77 -0.25 0.00 0.42 0.00 0.00 52.86 52.12 2rqb s ASN 994 Cb 0.20 0.06 -0.06 0.00 -1.45 0.00 0.00 41.25 40.00 2rqb s ASN 994 CO 0.71 -0.33 2.05 -0.55 -3.72 0.00 0.00 177.10 175.27 2rqb s SER 995 N -2.29 4.87 0.05 -4.21 0.15 -1.26 -4.49 113.70 106.52 2rqb s SER 995 Ca 0.01 -0.15 -0.17 0.00 0.70 0.00 0.00 55.95 56.34 2rqb s SER 995 Cb -0.03 -2.55 0.03 0.00 -1.71 0.00 0.00 66.02 61.77 2rqb s SER 995 CO -0.02 -2.89 0.39 -0.89 1.20 0.00 0.00 173.24 171.03 2rqb s THR 996 N 10.93 0.06 -0.17 6.45 2.01 -1.26 -5.07 115.64 128.59 2rqb s THR 996 Ca 0.76 -0.52 -0.02 0.00 0.31 0.00 0.00 61.69 62.22 2rqb s THR 996 Cb -0.10 -0.98 0.05 0.00 0.01 0.00 0.00 72.50 71.48 2rqb s THR 996 CO 0.08 -0.29 0.01 -0.75 -0.69 0.00 0.00 174.62 172.99 2rqb s LYS 997 N -2.64 0.80 -0.17 4.92 2.20 -1.26 -2.44 119.74 121.15 2rqb s LYS 997 Ca -0.04 -0.36 -0.06 0.00 -0.36 0.00 0.00 55.97 55.15 2rqb s LYS 997 Cb -0.00 -1.91 -0.03 0.00 -1.51 0.00 0.00 37.83 34.37 2rqb s LYS 997 CO -0.04 -0.55 0.02 0.15 -0.36 0.00 0.00 175.35 174.58 2rqb s LYS 998 N 1.83 3.84 -0.35 4.03 3.01 0.16 -4.99 119.74 127.26 2rqb s LYS 998 Ca 0.00 -0.42 -0.08 0.00 -1.01 0.00 0.00 55.97 54.46 2rqb s LYS 998 Cb -0.16 -3.09 0.03 0.00 -1.01 0.00 0.00 37.83 33.60 2rqb s LYS 998 CO -0.07 0.25 0.15 -1.14 0.51 0.00 0.00 175.35 175.05 2rqb s GLN 999 N 0.38 2.79 0.07 1.68 0.74 -1.26 -1.06 119.66 123.00 2rqb s GLN 999 Ca -0.00 -1.08 0.01 0.00 0.05 0.00 0.00 55.36 54.34 2rqb s GLN 999 Cb -0.13 -3.57 0.01 0.00 1.10 0.00 0.00 33.01 30.42 2rqb s GLN 999 CO 0.01 -0.64 0.08 0.66 -0.55 0.00 0.00 175.29 174.85 2rqb n TYR 1000N 4.90 -2.49 0.00 1.67 4.01 -1.26 -5.03 117.16 118.96 2rqb n TYR 1000Ca -0.12 -0.26 0.00 0.00 -0.16 0.00 0.00 57.90 57.36 2rqb n TYR 1000Cb 0.46 -0.06 0.00 0.00 -0.31 0.00 0.00 39.34 39.43 2rqb n TYR 1000CO 0.00 0.00 0.00 0.36 -0.46 0.00 0.00 176.86 176.76 2rqb n LYS 1001N -1.01 0.00 -4.45 -0.72 2.85 -1.26 -4.20 118.16 109.37 2rqb n LYS 1001Ca 0.01 0.00 -0.24 0.00 -1.05 0.00 0.00 58.31 57.03 2rqb n LYS 1001Cb 0.07 -0.43 -0.10 0.00 -0.65 0.00 0.00 35.03 33.92 2rqb n LYS 1001CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 2rqb s LYS 1002N -1.95 1.62 0.45 -1.58 1.02 -1.26 0.02 119.74 118.06 2rqb s LYS 1002Ca 0.00 -1.70 0.24 0.00 0.02 0.00 0.00 55.97 54.53 2rqb s LYS 1002Cb 0.00 -1.76 0.99 0.00 -0.52 0.00 0.00 37.83 36.55 2rqb s LYS 1002CO 0.00 0.34 1.86 -1.49 -0.92 0.00 0.00 175.35 175.14 2rqb h TRP 1003N 2.51 0.00 0.00 3.18 4.06 -1.97 -1.89 115.95 121.85 2rqb h TRP 1003Ca -0.41 0.00 -0.00 0.00 2.06 0.00 0.00 58.89 60.53 2rqb h TRP 1003Cb 1.25 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 29.41 2rqb h TRP 1003CO 0.78 0.23 -0.01 -0.24 -3.56 0.00 0.00 178.44 175.63 2rqb h VAL 1004N 0.00 0.15 0.00 1.49 3.04 -1.98 0.16 116.25 119.11 2rqb h VAL 1004Ca -0.00 -0.08 -0.12 0.00 -1.01 0.00 0.00 66.70 65.48 2rqb h VAL 1004Cb 0.68 1.07 -0.02 0.00 -2.01 0.00 0.00 31.29 31.01 2rqb h VAL 1004CO 0.03 0.01 -0.59 -0.33 -1.01 0.00 0.00 177.57 175.68 2rqb h GLU 1005N 0.00 0.00 -6.08 4.17 4.39 -1.75 -3.44 114.58 111.87 2rqb h GLU 1005Ca -0.00 0.00 -0.58 0.00 0.34 0.00 0.00 59.36 59.12 2rqb h GLU 1005Cb 0.07 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.72 2rqb h GLU 1005CO 0.00 0.59 1.43 -1.17 -1.16 0.00 0.00 179.01 178.70 2rqb s LEU 1006N -6.69 3.67 0.00 1.33 2.96 0.55 -4.80 118.68 115.69 2rqb s LEU 1006Ca 0.02 2.05 0.23 0.00 -0.22 0.00 0.00 54.13 56.21 2rqb s LEU 1006Cb 0.09 -3.52 1.15 0.00 0.50 0.00 0.00 46.19 44.41 2rqb s LEU 1006CO 0.75 -1.75 1.74 -0.81 -1.32 0.00 0.00 176.35 174.96 2rqb n PRO 1007N 8.47 0.33 -3.11 0.98 -0.04 -1.26 -4.72 135.00 135.64 2rqb n PRO 1007Ca 0.27 0.07 -0.39 0.00 -0.04 0.00 0.00 63.50 63.41 2rqb n PRO 1007Cb 0.44 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.35 2rqb n PRO 1007CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2rqb s ILE 1008N -2.56 4.89 0.58 0.52 1.09 -1.26 -4.84 121.20 119.62 2rqb s ILE 1008Ca 0.22 1.39 -0.18 0.00 -1.10 0.00 0.00 60.65 60.98 2rqb s ILE 1008Cb 0.15 -4.00 -0.04 0.00 -1.06 0.00 0.00 42.46 37.51 2rqb s ILE 1008CO 0.35 0.37 1.12 0.28 -0.10 0.00 0.00 174.94 176.95 2rqb s THR 1009N 0.06 3.22 0.22 2.92 -1.32 -1.25 -4.95 115.64 114.55 2rqb s THR 1009Ca 0.34 0.69 0.05 0.00 -1.21 0.00 0.00 61.69 61.56 2rqb s THR 1009Cb -0.19 -3.23 -0.05 0.00 -1.51 0.00 0.00 72.50 67.52 2rqb s THR 1009CO 0.19 -0.24 -0.06 -0.36 -2.21 0.00 0.00 174.62 171.94 2rqb s PHE 1010N -1.99 1.61 0.00 9.09 0.40 -1.26 -4.44 117.98 121.39 2rqb s PHE 1010Ca 0.70 -0.77 0.00 0.00 -0.60 0.00 0.00 56.93 56.26 2rqb s PHE 1010Cb -0.22 -0.87 0.00 0.00 0.51 0.00 0.00 43.02 42.44 2rqb s PHE 1010CO 0.32 0.13 0.00 -0.35 0.70 0.00 0.00 175.22 176.02 2rqb n PRO 1011N -0.40 0.51 -3.38 0.24 -0.04 -1.26 -5.02 135.00 125.66 2rqb n PRO 1011Ca -0.07 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.26 2rqb n PRO 1011Cb 0.62 0.00 -0.09 0.00 -0.04 0.00 0.00 33.50 34.00 2rqb n PRO 1011CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2rqb s ASN 1012N -1.25 1.00 -0.17 3.54 -0.87 -1.26 -4.18 114.94 111.75 2rqb s ASN 1012Ca 0.00 -0.38 0.01 0.00 -1.57 0.00 0.00 52.86 50.92 2rqb s ASN 1012Cb 0.00 0.78 0.01 0.00 -0.02 0.00 0.00 41.25 42.02 2rqb s ASN 1012CO 0.00 -0.35 -0.19 -0.22 -2.57 0.00 0.00 177.10 173.76 2rqb s LEU 1013N 2.44 2.20 -0.29 0.60 0.20 -0.64 -4.90 118.68 118.30 2rqb s LEU 1013Ca 0.10 -0.60 -0.01 0.00 0.69 0.00 0.00 54.13 54.31 2rqb s LEU 1013Cb -0.14 -1.49 0.05 0.00 -0.43 0.00 0.00 46.19 44.18 2rqb s LEU 1013CO -0.26 0.04 -0.02 -1.81 -0.29 0.00 0.00 176.35 174.01 2rqb s ASP 1014N 1.08 4.82 0.26 3.68 1.11 -1.26 -4.31 116.67 122.05 2rqb s ASP 1014Ca -0.00 -1.28 0.03 0.00 0.18 0.00 0.00 52.55 51.48 2rqb s ASP 1014Cb -0.14 -1.69 0.68 0.00 1.07 0.00 0.00 42.92 42.84 2rqb s ASP 1014CO -0.07 -0.25 1.30 0.00 1.18 0.00 0.00 175.17 177.33 2rqb n TYR 1015N 4.60 0.57 -0.35 4.23 0.18 -1.26 0.11 117.16 125.24 2rqb n TYR 1015Ca -0.13 1.00 0.06 0.00 1.88 0.00 0.00 57.90 60.70 2rqb n TYR 1015Cb 0.43 -1.15 0.13 0.00 -0.38 0.00 0.00 39.34 38.37 2rqb n TYR 1015CO 0.00 0.00 0.00 0.45 -2.08 0.00 0.00 176.86 175.23 2rqb n SER 1016N -5.15 -0.36 -0.35 9.48 2.88 -1.26 0.75 113.62 119.61 2rqb n SER 1016Ca 0.21 1.65 0.03 0.00 -1.33 0.00 0.00 58.87 59.44 2rqb n SER 1016Cb 0.68 -0.50 0.10 0.00 -0.75 0.00 0.00 64.21 63.75 2rqb n SER 1016CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2rqb n GLU 1017N -5.56 -0.13 -3.23 -1.46 1.02 0.30 -2.28 120.64 109.30 2rqb n GLU 1017Ca 0.15 1.46 -0.46 0.00 -0.02 0.00 0.00 57.16 58.29 2rqb n GLU 1017Cb 0.48 -2.18 -0.02 0.00 -0.02 0.00 0.00 31.44 29.70 2rqb n GLU 1017CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2rqb h LEU 1020N 2.47 0.00 -1.61 0.00 -0.00 -1.89 -3.30 115.31 110.98 2rqb h LEU 1020Ca 0.39 -0.06 0.07 0.00 -0.00 0.00 0.00 57.88 58.29 2rqb h LEU 1020Cb 0.94 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.59 2rqb h LEU 1020CO 0.99 0.59 0.56 -0.26 -0.00 0.00 0.00 178.44 180.33 2rqb h PHE 1021N -1.00 0.00 0.00 1.13 0.04 -2.02 -3.41 116.94 111.68 2rqb h PHE 1021Ca -0.01 0.00 -0.71 0.00 2.80 0.00 0.00 57.97 60.05 2rqb h PHE 1021Cb 0.18 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 38.28 2rqb h PHE 1021CO -0.03 0.00 1.35 0.45 -0.60 0.00 0.00 178.31 179.48 2rqb n SER 1022N -3.14 0.66 -0.35 2.17 2.88 -1.25 -4.73 113.62 109.87 2rqb n SER 1022Ca 0.04 0.59 0.06 0.00 -1.33 0.00 0.00 58.87 58.23 2rqb n SER 1022Cb 0.67 -0.88 0.10 0.00 -0.75 0.00 0.00 64.21 63.35 2rqb n SER 1022CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 2rqb n ASP 1023N 7.76 1.52 -4.45 -3.46 -0.08 -1.26 -5.07 116.55 111.51 2rqb n ASP 1023Ca 0.55 -2.81 -0.29 0.00 -1.51 0.00 0.00 54.79 50.73 2rqb n ASP 1023Cb -0.03 -0.37 0.15 0.00 2.34 0.00 0.00 41.12 43.21 2rqb n ASP 1023CO 0.00 0.00 0.00 -1.61 0.12 0.00 0.00 177.20 175.71 2rqb s GLU 1024N -1.92 1.10 0.00 -0.67 2.02 -1.26 -5.28 118.70 112.70 2rqb s GLU 1024Ca 0.24 -0.16 0.00 0.00 0.02 0.00 0.00 54.97 55.07 2rqb s GLU 1024Cb 0.22 -1.88 0.00 0.00 0.10 0.00 0.00 34.13 32.57 2rqb s GLU 1024CO -0.00 -2.14 0.01 -0.25 0.02 0.00 0.00 175.26 172.90