#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 2.42 0.23 1.61 0.04 -1.26 -5.08 135.00 132.96 2rqb s PRO 892 Ca 0.00 0.76 -0.01 0.00 0.04 0.00 0.00 61.00 61.79 2rqb s PRO 892 Cb 0.00 -1.95 0.01 0.00 0.04 0.00 0.00 34.50 32.60 2rqb s PRO 892 CO 0.00 -1.41 0.32 1.28 0.04 0.00 0.00 177.00 177.23 2rqb n LEU 893 N -3.31 0.00 0.00 -3.56 4.77 -1.26 -5.17 117.00 108.47 2rqb n LEU 893 Ca 0.07 -1.87 0.00 0.00 -0.03 0.00 0.00 56.01 54.18 2rqb n LEU 893 Cb 0.55 1.68 0.00 0.00 -2.33 0.00 0.00 43.42 43.32 2rqb n LEU 893 CO 0.56 -0.43 0.00 0.61 -1.33 0.00 0.00 177.39 176.80 2rqb n GLY 894 N -0.38 0.58 3.67 -0.72 0.00 -1.26 -5.19 105.19 101.90 2rqb n GLY 894 Ca 0.00 0.64 -0.00 0.00 0.00 0.00 0.00 46.02 46.66 2rqb n GLY 894 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2rqb s SER 895 N 0.00 -0.10 0.58 1.61 0.15 -1.26 -5.18 113.70 109.50 2rqb s SER 895 Ca 0.00 -0.24 -0.03 0.00 0.70 0.00 0.00 55.95 56.38 2rqb s SER 895 Cb 0.00 0.29 0.02 0.00 -1.71 0.00 0.00 66.02 64.62 2rqb s SER 895 CO 0.00 -0.53 0.85 -0.31 1.20 0.00 0.00 173.24 174.45 2rqb s TYR 896 N -2.74 3.09 -0.04 3.44 2.02 -1.26 -5.02 117.35 116.84 2rqb s TYR 896 Ca 0.14 0.38 0.18 0.00 -0.37 0.00 0.00 57.07 57.40 2rqb s TYR 896 Cb 0.02 -2.75 0.34 0.00 -0.40 0.00 0.00 41.96 39.17 2rqb s TYR 896 CO -0.01 -0.86 1.14 1.63 -1.57 0.00 0.00 175.55 175.87 2rqb n LYS 897 N -2.50 0.30 -0.64 -0.62 5.02 -1.26 -4.79 118.16 113.66 2rqb n LYS 897 Ca 0.05 -2.03 0.00 0.00 -2.02 0.00 0.00 58.31 54.32 2rqb n LYS 897 Cb 0.59 -0.41 0.24 0.00 -0.02 0.00 0.00 35.03 35.42 2rqb n LYS 897 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2rqb n ASN 898 N 0.07 4.01 -4.39 4.39 2.85 -1.26 -4.73 115.26 116.19 2rqb n ASN 898 Ca 0.07 -2.71 -0.34 0.00 -0.11 0.00 0.00 54.58 51.50 2rqb n ASN 898 Cb 0.97 -0.65 -0.14 0.00 1.24 0.00 0.00 39.78 41.21 2rqb n ASN 898 CO 0.00 0.00 0.00 0.21 -2.11 0.00 0.00 177.26 175.36 2rqb s ASN 899 N -0.51 4.31 0.00 1.20 2.47 -1.26 -3.29 114.94 117.85 2rqb s ASN 899 Ca 0.36 -0.28 0.24 0.00 0.42 0.00 0.00 52.86 53.60 2rqb s ASN 899 Cb 0.28 -1.69 1.42 0.00 -1.45 0.00 0.00 41.25 39.81 2rqb s ASN 899 CO 0.10 0.12 1.80 -0.81 -3.72 0.00 0.00 177.10 174.59 2rqb n PRO 900 N 3.82 0.73 0.08 0.43 -0.04 -1.26 -2.45 135.00 136.31 2rqb n PRO 900 Ca -0.18 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.28 2rqb n PRO 900 Cb 0.52 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.43 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 1.07 3.54 0.87 -1.93 -2.27 113.55 114.83 2rqb h SER 901 Ca 0.00 0.00 -0.08 0.00 -1.23 0.00 0.00 61.79 60.48 2rqb h SER 901 Cb 0.01 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 61.96 2rqb h SER 901 CO 0.00 0.66 -0.97 -0.07 -0.53 0.00 0.00 176.83 175.92 2rqb h LEU 902 N 0.00 0.00 -9.85 2.23 3.38 -1.87 -3.46 115.31 105.74 2rqb h LEU 902 Ca -0.08 0.00 -0.60 0.00 0.09 0.00 0.00 57.88 57.30 2rqb h LEU 902 Cb 1.57 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 42.26 2rqb h LEU 902 CO 0.07 0.30 -0.53 0.27 0.09 0.00 0.00 178.44 178.64 2rqb s ILE 903 N -3.12 5.02 0.10 1.22 -4.36 -1.22 0.05 121.20 118.90 2rqb s ILE 903 Ca 0.00 -0.66 -0.06 0.00 -0.26 0.00 0.00 60.65 59.67 2rqb s ILE 903 Cb 0.08 -3.50 -0.02 0.00 1.25 0.00 0.00 42.46 40.28 2rqb s ILE 903 CO 0.78 0.04 0.13 -0.89 0.24 0.00 0.00 174.94 175.24 2rqb s THR 904 N -1.57 0.14 -0.09 8.37 2.01 -1.11 -3.37 115.64 120.02 2rqb s THR 904 Ca 0.33 -1.48 -0.05 0.00 0.31 0.00 0.00 61.69 60.79 2rqb s THR 904 Cb -0.12 -1.57 -0.04 0.00 0.01 0.00 0.00 72.50 70.78 2rqb s THR 904 CO 0.26 -0.66 0.13 -0.36 -0.69 0.00 0.00 174.62 173.31 2rqb s PHE 905 N -3.92 3.54 0.33 4.92 0.08 0.11 -2.43 117.98 120.60 2rqb s PHE 905 Ca 0.10 0.45 0.04 0.00 0.12 0.00 0.00 56.93 57.64 2rqb s PHE 905 Cb 0.06 -1.90 -0.03 0.00 -0.57 0.00 0.00 43.02 40.58 2rqb s PHE 905 CO -0.07 0.69 0.18 -0.51 -0.10 0.00 0.00 175.22 175.40 2rqb s LEU 906 N -1.22 1.74 -0.23 -0.37 1.43 -0.14 -1.95 118.68 117.94 2rqb s LEU 906 Ca 0.18 -1.61 -0.19 0.00 -1.03 0.00 0.00 54.13 51.47 2rqb s LEU 906 Cb -0.12 0.21 -0.03 0.00 0.03 0.00 0.00 46.19 46.28 2rqb s LEU 906 CO 0.07 -0.93 0.56 0.00 0.23 0.00 0.00 176.35 176.29 2rqb h LYS 908 N 7.70 -0.75 -0.41 0.00 3.64 -1.45 0.39 116.57 125.68 2rqb h LYS 908 Ca -0.31 0.05 0.05 0.00 -1.27 0.00 0.00 60.65 59.18 2rqb h LYS 908 Cb 1.14 0.17 -0.08 0.00 -0.41 0.00 0.00 32.23 33.05 2rqb h LYS 908 CO 0.75 -0.50 -0.56 -0.91 -2.27 0.00 0.00 179.45 175.96 2rqb h ASN 909 N -0.78 -1.87 0.00 4.20 4.21 -1.94 -3.40 115.58 116.00 2rqb h ASN 909 Ca -0.02 0.25 0.00 0.00 1.21 0.00 0.00 56.30 57.74 2rqb h ASN 909 Cb 0.75 0.77 0.00 0.00 -1.12 0.00 0.00 38.32 38.72 2rqb h ASN 909 CO -0.22 -0.40 0.00 0.00 -1.29 0.00 0.00 177.43 175.51 2rqb n SER 911 N 0.00 0.00 -4.75 0.00 7.64 0.13 -4.75 113.62 111.89 2rqb n SER 911 Ca 0.00 0.00 -0.38 0.00 1.01 0.00 0.00 58.87 59.50 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 5.18 -0.31 0.44 -7.23 -1.26 -4.51 120.40 112.70 2rqb s VAL 912 Ca 0.00 0.82 -0.28 0.00 -1.81 0.00 0.00 61.98 60.71 2rqb s VAL 912 Cb 0.00 -3.74 -0.04 0.00 0.56 0.00 0.00 36.38 33.16 2rqb s VAL 912 CO 0.00 0.41 2.09 -0.22 -0.31 0.00 0.00 175.10 177.07 2rqb s LEU 913 N 0.14 3.45 -0.05 1.32 1.98 -1.26 -2.67 118.68 121.59 2rqb s LEU 913 Ca 0.23 1.51 0.02 0.00 -2.89 0.00 0.00 54.13 53.00 2rqb s LEU 913 Cb -0.15 -3.33 -0.25 0.00 0.66 0.00 0.00 46.19 43.12 2rqb s LEU 913 CO 0.09 -2.03 0.63 0.00 -1.89 0.00 0.00 176.35 173.16 2rqb h ALA 914 N 14.95 0.53 -1.14 5.97 0.00 -1.73 -3.49 119.26 134.35 2rqb h ALA 914 Ca -0.36 -1.34 0.33 0.00 0.00 0.00 0.00 54.91 53.54 2rqb h ALA 914 Cb 1.22 0.49 -0.19 0.00 0.00 0.00 0.00 17.79 19.31 2rqb h ALA 914 CO 1.02 1.38 0.95 0.00 0.00 0.00 0.00 179.25 182.60 2rqb s SER 916 N -2.28 5.30 0.22 0.00 0.01 -1.26 0.06 113.70 115.74 2rqb s SER 916 Ca 0.12 -0.27 -0.09 0.00 1.31 0.00 0.00 55.95 57.03 2rqb s SER 916 Cb 0.01 -1.30 0.33 0.00 0.21 0.00 0.00 66.02 65.27 2rqb s SER 916 CO -0.04 0.03 1.70 1.23 0.41 0.00 0.00 173.24 176.58 2rqb h GLY 917 N 2.10 0.83 2.00 3.44 0.00 -1.53 0.39 103.07 110.30 2rqb h GLY 917 Ca -0.47 -0.03 -0.03 0.00 0.00 0.00 0.00 47.33 46.79 2rqb h GLY 917 CO 0.61 -0.13 -0.13 1.05 0.00 0.00 0.00 176.54 177.95 2rqb h GLU 918 N 0.27 0.00 -1.05 4.80 -0.00 -1.68 -0.94 114.58 115.99 2rqb h GLU 918 Ca 0.34 0.00 -0.35 0.00 -0.00 0.00 0.00 59.36 59.35 2rqb h GLU 918 Cb 0.51 0.00 -0.20 0.00 -0.00 0.00 0.00 28.75 29.06 2rqb h GLU 918 CO -0.42 0.13 0.44 -3.47 -0.00 0.00 0.00 179.01 175.69 2rqb n ASP 919 N -4.06 3.92 -4.18 3.06 4.64 0.14 -4.86 116.55 115.20 2rqb n ASP 919 Ca -0.02 -3.07 -0.14 0.00 -1.38 0.00 0.00 54.79 50.18 2rqb n ASP 919 Cb 0.21 -0.76 -0.11 0.00 -1.04 0.00 0.00 41.12 39.43 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 -2.25 0.91 0.28 5.18 -1.09 -0.36 -4.60 121.20 119.28 2rqb s ILE 920 Ca 0.37 -1.73 0.09 0.00 -2.23 0.00 0.00 60.65 57.16 2rqb s ILE 920 Cb 0.31 -1.45 -0.06 0.00 -1.58 0.00 0.00 42.46 39.68 2rqb s ILE 920 CO 0.06 -0.63 -0.13 -1.00 -1.23 0.00 0.00 174.94 172.01 2rqb s HIS 921 N -2.73 2.14 0.27 3.97 3.76 -1.21 -4.70 115.29 116.79 2rqb s HIS 921 Ca 0.07 -0.51 0.08 0.00 -0.15 0.00 0.00 55.06 54.56 2rqb s HIS 921 Cb -0.01 -1.09 -0.05 0.00 1.11 0.00 0.00 32.58 32.53 2rqb s HIS 921 CO -0.01 0.52 -0.10 0.08 -0.85 0.00 0.00 174.74 174.38 2rqb s VAL 922 N -2.74 1.83 -0.21 -0.90 1.01 -1.26 -3.52 120.40 114.61 2rqb s VAL 922 Ca 0.29 -2.19 -0.01 0.00 0.00 0.00 0.00 61.98 60.07 2rqb s VAL 922 Cb -0.00 -2.36 0.06 0.00 0.00 0.00 0.00 36.38 34.08 2rqb s VAL 922 CO 0.13 -0.37 -0.01 -0.63 0.00 0.00 0.00 175.10 174.23 2rqb s ILE 923 N -2.90 0.99 -0.09 2.22 1.01 -0.88 -0.17 121.20 121.38 2rqb s ILE 923 Ca 0.28 -0.85 0.00 0.00 0.00 0.00 0.00 60.65 60.09 2rqb s ILE 923 Cb 0.01 -1.37 0.00 0.00 0.01 0.00 0.00 42.46 41.11 2rqb s ILE 923 CO 0.12 -0.14 0.00 -1.84 0.00 0.00 0.00 174.94 173.07 2rqb n GLU 924 N 4.88 -2.85 -4.03 2.79 0.28 -1.26 0.80 120.64 121.25 2rqb n GLU 924 Ca -0.10 0.05 -0.27 0.00 -0.16 0.00 0.00 57.16 56.68 2rqb n GLU 924 Cb 0.46 -4.53 -0.04 0.00 1.43 0.00 0.00 31.44 28.76 2rqb n GLU 924 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 2rqb n LYS 925 N -2.46 -2.89 0.00 3.44 4.01 -1.26 -4.79 118.16 114.21 2rqb n LYS 925 Ca -0.01 0.35 0.00 0.00 -0.51 0.00 0.00 58.31 58.14 2rqb n LYS 925 Cb 0.49 -4.39 0.00 0.00 -0.51 0.00 0.00 35.03 30.62 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 -4.43 0.00 -4.74 1.97 0.00 0.24 -5.08 117.12 105.07 2rqb n MET 926 Ca -0.30 0.00 -0.25 0.00 0.00 0.00 0.00 57.70 57.15 2rqb n MET 926 Cb 0.68 -0.50 -0.16 0.00 0.00 0.00 0.00 33.22 33.24 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 -1.40 1.58 -0.48 3.17 3.76 -1.09 -5.02 115.29 115.81 2rqb s HIS 927 Ca 0.00 -0.47 -0.18 0.00 -0.15 0.00 0.00 55.06 54.25 2rqb s HIS 927 Cb 0.00 -1.09 0.05 0.00 1.11 0.00 0.00 32.58 32.66 2rqb s HIS 927 CO 0.00 -0.18 0.55 -1.01 -0.85 0.00 0.00 174.74 173.25 2rqb s HIS 928 N 0.16 3.11 -0.08 1.40 3.76 -1.26 -2.08 115.29 120.30 2rqb s HIS 928 Ca -0.06 -0.54 0.01 0.00 -0.15 0.00 0.00 55.06 54.32 2rqb s HIS 928 Cb -0.12 -3.34 -0.03 0.00 1.11 0.00 0.00 32.58 30.21 2rqb s HIS 928 CO 0.02 -0.92 -0.08 0.14 -0.85 0.00 0.00 174.74 173.06 2rqb s VAL 929 N 2.38 3.61 -0.65 -0.90 -7.23 -1.23 -4.04 120.40 112.34 2rqb s VAL 929 Ca 0.13 -0.51 -0.14 0.00 -1.81 0.00 0.00 61.98 59.65 2rqb s VAL 929 Cb -0.19 -2.48 0.16 0.00 0.56 0.00 0.00 36.38 34.43 2rqb s VAL 929 CO 0.12 0.59 0.59 0.21 -0.31 0.00 0.00 175.10 176.29 2rqb s ASN 930 N -0.64 6.33 -0.18 4.85 3.84 0.48 -3.31 114.94 126.32 2rqb s ASN 930 Ca 0.10 -2.19 -0.03 0.00 0.21 0.00 0.00 52.86 50.95 2rqb s ASN 930 Cb -0.11 -2.18 -0.04 0.00 -0.55 0.00 0.00 41.25 38.37 2rqb s ASN 930 CO 0.02 -0.72 2.77 0.23 -2.79 0.00 0.00 177.10 176.61 2rqb n MET 931 N 4.66 1.85 -3.86 0.43 2.81 -1.26 -4.07 117.12 117.69 2rqb n MET 931 Ca -0.02 -1.24 -0.36 0.00 -1.81 0.00 0.00 57.70 54.27 2rqb n MET 931 Cb 0.43 -1.75 -0.11 0.00 -0.71 0.00 0.00 33.22 31.07 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 -0.66 4.57 0.01 2.03 2.01 -1.26 -4.99 115.64 117.36 2rqb s THR 932 Ca 0.44 -0.09 -0.20 0.00 0.31 0.00 0.00 61.69 62.15 2rqb s THR 932 Cb 0.25 -3.11 -0.22 0.00 0.01 0.00 0.00 72.50 69.44 2rqb s THR 932 CO -0.06 0.38 1.14 1.55 -0.69 0.00 0.00 174.62 176.93 2rqb h PRO 933 N 7.66 0.42 -0.48 4.92 0.13 -1.99 -3.21 132.00 139.45 2rqb h PRO 933 Ca -0.37 -0.41 0.03 0.00 -0.87 0.00 0.00 66.00 64.37 2rqb h PRO 933 Cb 1.18 0.11 -0.03 0.00 0.13 0.00 0.00 31.00 32.39 2rqb h PRO 933 CO 0.62 1.07 0.32 1.05 -0.23 0.00 0.00 178.00 180.82 2rqb h GLU 934 N -0.07 0.55 -0.00 0.86 4.11 -1.98 0.58 114.58 118.63 2rqb h GLU 934 Ca -0.06 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 59.34 2rqb h GLU 934 Cb 1.23 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 30.36 2rqb h GLU 934 CO 0.11 0.36 0.00 0.35 0.07 0.00 0.00 179.01 179.90 2rqb h PHE 935 N 0.56 0.00 0.00 2.06 3.57 -1.84 0.13 116.94 121.43 2rqb h PHE 935 Ca 0.19 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.69 2rqb h PHE 935 Cb 0.07 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.81 2rqb h PHE 935 CO -0.00 0.00 0.00 1.57 -2.23 0.00 0.00 178.31 177.65 2rqb h LYS 936 N 0.00 0.00 -0.35 1.11 2.10 -0.96 0.14 116.57 118.62 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 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 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 -2.52 2.28 -0.00 0.07 -0.58 0.46 -4.18 120.64 116.16 2rqb n GLU 937 Ca -0.00 -2.06 0.05 0.00 -0.42 0.00 0.00 57.16 54.73 2rqb n GLU 937 Cb 0.15 -1.40 -0.07 0.00 -0.57 0.00 0.00 31.44 29.55 2rqb n GLU 937 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 2rqb n LEU 938 N 1.08 0.13 -4.29 -4.62 4.77 0.42 -5.00 117.00 109.49 2rqb n LEU 938 Ca 0.15 -0.14 -0.23 0.00 -0.03 0.00 0.00 56.01 55.76 2rqb n LEU 938 Cb 0.50 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.47 2rqb n LEU 938 CO 0.12 0.03 -0.50 -0.72 -1.33 0.00 0.00 177.39 174.99 2rqb s TYR 939 N -2.48 1.77 -0.03 -1.77 -0.85 -0.67 -4.16 117.35 109.15 2rqb s TYR 939 Ca -0.02 -0.44 0.05 0.00 -0.52 0.00 0.00 57.07 56.15 2rqb s TYR 939 Cb 0.07 -0.94 -0.01 0.00 0.38 0.00 0.00 41.96 41.45 2rqb s TYR 939 CO 0.42 0.23 -0.19 0.42 -1.52 0.00 0.00 175.55 174.91 2rqb s ILE 940 N -1.43 1.54 -0.12 -3.49 1.01 -0.14 -4.82 121.20 113.75 2rqb s ILE 940 Ca 0.09 -0.81 -0.04 0.00 0.00 0.00 0.00 60.65 59.88 2rqb s ILE 940 Cb -0.09 -1.30 -0.04 0.00 0.01 0.00 0.00 42.46 41.05 2rqb s ILE 940 CO 0.05 0.44 0.05 -0.69 0.00 0.00 0.00 174.94 174.78 2rqb s VAL 941 N -0.26 4.71 -0.20 2.92 1.01 -1.26 -1.05 120.40 126.26 2rqb s VAL 941 Ca 0.03 -0.09 -0.02 0.00 0.00 0.00 0.00 61.98 61.89 2rqb s VAL 941 Cb -0.09 -3.03 -0.00 0.00 0.00 0.00 0.00 36.38 33.25 2rqb s VAL 941 CO 0.01 0.57 -0.09 -0.13 0.00 0.00 0.00 175.10 175.46 2rqb s ARG 942 N -0.58 3.29 -0.59 2.72 3.00 -1.21 -5.00 118.95 120.57 2rqb s ARG 942 Ca 0.11 -0.68 -0.33 0.00 0.00 0.00 0.00 55.73 54.83 2rqb s ARG 942 Cb -0.12 -2.87 -0.15 0.00 0.00 0.00 0.00 34.95 31.81 2rqb s ARG 942 CO 0.02 -0.16 2.38 -1.91 0.00 0.00 0.00 175.30 175.63 2rqb n GLU 943 N 4.64 0.59 -3.68 3.54 2.13 -1.26 -4.04 120.64 122.57 2rqb n GLU 943 Ca -0.19 0.10 -0.09 0.00 0.66 0.00 0.00 57.16 57.64 2rqb n GLU 943 Cb 0.51 -2.23 -0.10 0.00 0.27 0.00 0.00 31.44 29.89 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 8.63 -0.63 0.00 4.31 2.47 -1.26 -5.01 114.94 123.45 2rqb s ASN 944 Ca 1.17 1.07 0.23 0.00 0.42 0.00 0.00 52.86 55.75 2rqb s ASN 944 Cb -0.93 0.97 0.09 0.00 -1.45 0.00 0.00 41.25 39.92 2rqb s ASN 944 CO 0.47 -0.21 1.13 2.29 -3.72 0.00 0.00 177.10 177.06 2rqb n LYS 945 N 4.32 0.39 0.11 0.43 2.85 -1.26 -4.00 118.16 121.00 2rqb n LYS 945 Ca -0.22 -0.30 0.09 0.00 -1.05 0.00 0.00 58.31 56.83 2rqb n LYS 945 Cb 0.56 -1.49 0.43 0.00 -0.65 0.00 0.00 35.03 33.87 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 -1.05 1.22 -0.09 0.58 0.00 -1.26 -2.88 120.51 117.03 2rqb n ALA 946 Ca 0.07 0.11 -0.11 0.00 0.00 0.00 0.00 53.44 53.51 2rqb n ALA 946 Cb 0.37 -1.26 -0.04 0.00 0.00 0.00 0.00 19.45 18.52 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 -2.04 1.88 -4.78 0.00 7.99 -1.26 -4.98 117.00 113.82 2rqb n LEU 947 Ca 0.00 0.32 -0.37 0.00 -0.01 0.00 0.00 56.01 55.95 2rqb n LEU 947 Cb 0.08 -0.72 -0.03 0.00 -0.11 0.00 0.00 43.42 42.65 2rqb n LEU 947 CO 0.10 -0.18 0.79 0.00 -1.51 0.00 0.00 177.39 176.59 2rqb s GLN 948 N -2.79 3.98 0.04 3.23 1.03 -1.14 -4.94 119.66 119.07 2rqb s GLN 948 Ca -0.28 1.66 0.03 0.00 0.04 0.00 0.00 55.36 56.80 2rqb s GLN 948 Cb 0.05 -2.50 -0.02 0.00 0.03 0.00 0.00 33.01 30.57 2rqb s GLN 948 CO 0.41 -0.33 -0.09 0.15 -2.54 0.00 0.00 175.29 172.89 2rqb s LYS 949 N -2.55 0.59 0.00 9.60 -0.14 -1.26 -4.77 119.74 121.21 2rqb s LYS 949 Ca 0.60 -0.69 0.00 0.00 -1.36 0.00 0.00 55.97 54.52 2rqb s LYS 949 Cb -0.26 -0.45 0.00 0.00 -1.68 0.00 0.00 37.83 35.44 2rqb s LYS 949 CO 0.32 0.10 0.33 1.63 -0.76 0.00 0.00 175.35 176.96 2rqb n LYS 950 N 1.74 0.00 -1.53 1.68 4.01 -1.26 -4.41 118.16 118.39 2rqb n LYS 950 Ca -0.20 0.00 -0.28 0.00 -0.51 0.00 0.00 58.31 57.31 2rqb n LYS 950 Cb 0.55 -0.82 -0.12 0.00 -0.51 0.00 0.00 35.03 34.13 2rqb n LYS 950 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2rqb s ALA 952 N 9.22 -2.41 -0.20 0.00 0.00 -1.26 -5.05 121.76 122.05 2rqb s ALA 952 Ca 1.15 0.57 0.10 0.00 0.00 0.00 0.00 51.96 53.77 2rqb s ALA 952 Cb -0.60 0.50 -0.19 0.00 0.00 0.00 0.00 23.12 22.83 2rqb s ALA 952 CO 0.35 -1.09 -0.05 -0.25 0.00 0.00 0.00 175.76 174.71 2rqb n ASP 953 N -0.67 1.25 -4.18 0.00 10.43 -1.26 -4.79 116.55 117.33 2rqb n ASP 953 Ca -0.05 -0.05 -0.40 0.00 2.57 0.00 0.00 54.79 56.86 2rqb n ASP 953 Cb 0.62 0.37 -0.08 0.00 1.84 0.00 0.00 41.12 43.87 2rqb n ASP 953 CO 0.00 0.00 0.00 -0.31 -1.07 0.00 0.00 177.20 175.82 2rqb s TYR 954 N -2.45 3.51 0.30 1.24 2.02 -1.26 -4.90 117.35 115.81 2rqb s TYR 954 Ca -0.19 -2.31 -0.29 0.00 -0.37 0.00 0.00 57.07 53.91 2rqb s TYR 954 Cb 0.07 -3.42 -0.10 0.00 -0.40 0.00 0.00 41.96 38.10 2rqb s TYR 954 CO 0.65 -0.92 1.32 -1.14 -1.57 0.00 0.00 175.55 173.89 2rqb s GLN 955 N 0.43 4.36 0.22 -0.62 -0.44 -1.17 -4.65 119.66 117.80 2rqb s GLN 955 Ca 0.14 2.20 0.08 0.00 -2.50 0.00 0.00 55.36 55.27 2rqb s GLN 955 Cb -0.20 -3.09 -0.04 0.00 -1.64 0.00 0.00 33.01 28.04 2rqb s GLN 955 CO -0.04 -0.22 0.06 0.42 0.50 0.00 0.00 175.29 176.01 2rqb s ILE 956 N -0.83 3.88 -0.06 -2.34 -1.09 -1.26 0.18 121.20 119.69 2rqb s ILE 956 Ca 0.51 -1.55 0.15 0.00 -2.23 0.00 0.00 60.65 57.52 2rqb s ILE 956 Cb -0.39 -3.04 -0.22 0.00 -1.58 0.00 0.00 42.46 37.23 2rqb s ILE 956 CO 0.49 -0.26 0.25 0.59 -1.23 0.00 0.00 174.94 174.78 2rqb n ASN 957 N -0.68 1.50 0.00 3.58 3.02 -0.87 -4.64 115.26 117.18 2rqb n ASN 957 Ca -0.08 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.47 2rqb n ASN 957 Cb 0.57 1.43 0.00 0.00 -0.61 0.00 0.00 39.78 41.18 2rqb n ASN 957 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2rqb n GLY 958 N 1.79 -0.56 3.15 7.41 0.00 -1.26 -4.32 105.19 111.40 2rqb n GLY 958 Ca -0.09 -0.76 -0.33 0.00 0.00 0.00 0.00 46.02 44.84 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 -1.43 3.02 0.11 1.61 2.12 -1.26 -3.24 118.70 119.63 2rqb s GLU 959 Ca 0.00 -0.83 -0.30 0.00 0.36 0.00 0.00 54.97 54.20 2rqb s GLU 959 Cb 0.00 -2.53 -0.06 0.00 0.26 0.00 0.00 34.13 31.80 2rqb s GLU 959 CO 0.00 -0.13 0.97 0.96 -0.54 0.00 0.00 175.26 176.53 2rqb s ILE 960 N 1.10 4.49 0.03 -3.70 -4.36 -1.21 -3.36 121.20 114.19 2rqb s ILE 960 Ca 0.00 2.04 0.02 0.00 -0.26 0.00 0.00 60.65 62.45 2rqb s ILE 960 Cb -0.14 -4.30 -0.02 0.00 1.25 0.00 0.00 42.46 39.24 2rqb s ILE 960 CO -0.08 0.30 -0.07 0.27 0.24 0.00 0.00 174.94 175.60 2rqb s ILE 961 N 0.08 0.47 0.81 8.37 -4.36 -0.22 -0.34 121.20 126.00 2rqb s ILE 961 Ca 0.48 -0.91 -0.14 0.00 -0.26 0.00 0.00 60.65 59.82 2rqb s ILE 961 Cb -0.24 -0.52 0.21 0.00 1.25 0.00 0.00 42.46 43.16 2rqb s ILE 961 CO 0.30 -0.31 0.57 0.00 0.24 0.00 0.00 174.94 175.74 2rqb h LYS 963 N 0.00 -0.24 -0.93 0.00 1.79 -1.91 -1.60 116.57 113.68 2rqb h LYS 963 Ca -0.24 0.02 0.12 0.00 -2.18 0.00 0.00 60.65 58.36 2rqb h LYS 963 Cb 0.77 0.05 -0.07 0.00 -1.58 0.00 0.00 32.23 31.40 2rqb h LYS 963 CO 0.15 -0.16 0.59 0.00 -1.08 0.00 0.00 179.45 178.95 2rqb n GLY 965 N -1.40 1.66 3.65 0.00 0.00 -0.60 -5.11 105.19 103.39 2rqb n GLY 965 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.08 4.16 -0.62 1.61 2.00 -1.26 -4.71 119.66 120.75 2rqb s GLN 966 Ca 0.00 0.33 -0.29 0.00 -2.00 0.00 0.00 55.36 53.40 2rqb s GLN 966 Cb 0.00 -3.58 -0.12 0.00 0.80 0.00 0.00 33.01 30.11 2rqb s GLN 966 CO 0.00 -0.16 2.47 0.00 -0.50 0.00 0.00 175.29 177.10 2rqb n ALA 967 N 4.87 0.69 0.07 1.58 0.00 -1.26 -0.64 120.51 125.83 2rqb n ALA 967 Ca -0.06 -0.62 -0.16 0.00 0.00 0.00 0.00 53.44 52.60 2rqb n ALA 967 Cb 0.50 -2.84 -0.08 0.00 0.00 0.00 0.00 19.45 17.03 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 16.35 0.73 0.00 0.00 6.55 -1.02 -3.43 115.95 135.13 2rqb h TRP 968 Ca -0.19 -0.42 0.00 0.00 0.95 0.00 0.00 58.89 59.23 2rqb h TRP 968 Cb 1.29 -0.07 0.00 0.00 -0.86 0.00 0.00 29.16 29.52 2rqb h TRP 968 CO 1.00 1.26 0.00 0.41 -1.05 0.00 0.00 178.44 180.06 2rqb n GLY 969 N 1.12 -0.47 3.41 1.49 0.00 -1.09 0.67 105.19 110.31 2rqb n GLY 969 Ca -0.09 0.27 -0.13 0.00 0.00 0.00 0.00 46.02 46.07 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 -0.00 -0.55 2.61 -4.23 0.42 -3.35 115.64 110.54 2rqb s THR 970 Ca 0.00 0.01 -0.24 0.00 -1.18 0.00 0.00 61.69 60.27 2rqb s THR 970 Cb 0.00 -0.72 0.04 0.00 1.34 0.00 0.00 72.50 73.16 2rqb s THR 970 CO 0.00 0.00 0.96 -0.32 -0.54 0.00 0.00 174.62 174.72 2rqb s MET 971 N 0.43 3.35 0.76 3.99 1.75 -1.20 -0.14 119.30 128.24 2rqb s MET 971 Ca -0.01 -0.21 -0.10 0.00 -1.25 0.00 0.00 55.69 54.12 2rqb s MET 971 Cb -0.04 -4.05 0.07 0.00 2.84 0.00 0.00 34.83 33.65 2rqb s MET 971 CO -0.01 -1.49 1.11 -1.64 -0.65 0.00 0.00 175.02 172.34 2rqb s MET 972 N 4.02 2.14 -0.01 4.11 -1.94 -0.18 -2.05 119.30 125.39 2rqb s MET 972 Ca 0.32 0.02 -0.00 0.00 -1.71 0.00 0.00 55.69 54.32 2rqb s MET 972 Cb -0.12 -2.03 0.01 0.00 2.01 0.00 0.00 34.83 34.70 2rqb s MET 972 CO 0.20 -1.41 0.02 0.08 -0.01 0.00 0.00 175.02 173.89 2rqb s VAL 973 N -3.44 -0.02 -0.31 -6.03 1.01 0.48 -2.68 120.40 109.41 2rqb s VAL 973 Ca 0.61 0.08 0.00 0.00 0.00 0.00 0.00 61.98 62.67 2rqb s VAL 973 Cb -0.11 -0.04 0.10 0.00 0.00 0.00 0.00 36.38 36.33 2rqb s VAL 973 CO 0.48 0.03 0.09 -2.28 0.00 0.00 0.00 175.10 173.42 2rqb s HIS 974 N 0.41 2.05 -1.89 5.22 5.04 -1.16 -3.04 115.29 121.93 2rqb s HIS 974 Ca -0.03 -1.94 0.00 0.00 -1.54 0.00 0.00 55.06 51.54 2rqb s HIS 974 Cb -0.05 -1.91 0.00 0.00 0.04 0.00 0.00 32.58 30.66 2rqb s HIS 974 CO -0.01 -0.89 0.00 1.63 -2.34 0.00 0.00 174.74 173.13 2rqb n LYS 975 N 4.75 -1.48 0.00 2.88 5.02 -1.26 -0.40 118.16 127.67 2rqb n LYS 975 Ca -0.01 1.12 0.00 0.00 -2.02 0.00 0.00 58.31 57.40 2rqb n LYS 975 Cb 0.42 -5.50 0.00 0.00 -0.02 0.00 0.00 35.03 29.93 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 -0.31 1.16 3.92 0.72 0.00 -1.26 -5.03 105.19 104.39 2rqb n GLY 976 Ca -0.18 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.58 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 3.05 -0.24 0.99 2.96 0.47 -5.07 118.68 120.84 2rqb s LEU 977 Ca 0.00 0.65 0.01 0.00 -0.22 0.00 0.00 54.13 54.57 2rqb s LEU 977 Cb 0.00 -3.41 0.04 0.00 0.50 0.00 0.00 46.19 43.32 2rqb s LEU 977 CO 0.00 -1.28 -0.12 1.51 -1.32 0.00 0.00 176.35 175.14 2rqb s ASP 978 N -4.39 4.12 -0.27 3.68 -4.77 -1.26 -2.97 116.67 110.82 2rqb s ASP 978 Ca 0.56 -1.11 -0.04 0.00 -3.30 0.00 0.00 52.55 48.66 2rqb s ASP 978 Cb -0.11 -1.56 0.09 0.00 -1.09 0.00 0.00 42.92 40.25 2rqb s ASP 978 CO 0.45 -0.14 0.12 -0.76 0.70 0.00 0.00 175.17 175.54 2rqb s LEU 979 N 1.20 0.65 -0.10 2.11 1.02 -1.09 -4.95 118.68 117.50 2rqb s LEU 979 Ca -0.04 -1.17 -0.30 0.00 0.02 0.00 0.00 54.13 52.65 2rqb s LEU 979 Cb -0.18 -0.37 -0.02 0.00 0.02 0.00 0.00 46.19 45.63 2rqb s LEU 979 CO -0.07 -0.42 1.24 -2.16 0.02 0.00 0.00 176.35 174.97 2rqb s PRO 980 N 2.06 4.29 -0.49 1.29 0.04 -1.26 -1.01 135.00 139.92 2rqb s PRO 980 Ca 0.07 1.68 -0.12 0.00 0.04 0.00 0.00 61.00 62.68 2rqb s PRO 980 Cb -0.16 -3.66 0.12 0.00 0.04 0.00 0.00 34.50 30.84 2rqb s PRO 980 CO -0.30 -0.58 0.40 0.00 0.04 0.00 0.00 177.00 176.56 2rqb s LEU 982 N 1.47 2.92 -0.11 0.00 1.02 -1.26 -0.43 118.68 122.30 2rqb s LEU 982 Ca 0.04 0.98 0.00 0.00 0.02 0.00 0.00 54.13 55.18 2rqb s LEU 982 Cb -0.27 -3.74 0.02 0.00 0.02 0.00 0.00 46.19 42.22 2rqb s LEU 982 CO 0.01 -1.36 -0.10 -0.54 0.02 0.00 0.00 176.35 174.39 2rqb s LYS 983 N -5.30 1.67 0.64 1.70 1.02 0.21 -4.87 119.74 114.81 2rqb s LYS 983 Ca 0.58 -0.33 0.38 0.00 0.02 0.00 0.00 55.97 56.61 2rqb s LYS 983 Cb -0.11 -1.61 2.12 0.00 -0.52 0.00 0.00 37.83 37.71 2rqb s LYS 983 CO 0.50 -0.19 2.28 0.82 -0.92 0.00 0.00 175.35 177.83 2rqb h ILE 984 N 6.11 0.20 0.00 2.17 2.04 -1.84 0.39 117.51 126.58 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 0.96 0.00 0.00 -0.74 0.00 0.00 36.82 38.18 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 -3.36 0.21 0.00 2.37 1.85 0.47 -1.63 116.66 116.58 2rqb n ARG 985 Ca -0.02 0.14 0.00 0.00 -1.00 0.00 0.00 57.85 56.97 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 -1.30 0.77 -3.54 2.89 3.02 0.13 -4.99 115.26 112.25 2rqb n ASN 986 Ca 0.07 -1.00 -0.20 0.00 -0.03 0.00 0.00 54.58 53.43 2rqb n ASN 986 Cb 0.13 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.26 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 -0.00 0.58 -4.04 3.10 3.01 -0.64 -1.39 117.46 118.08 2rqb n PHE 987 Ca 0.00 -1.64 -0.08 0.00 1.01 0.00 0.00 57.45 56.74 2rqb n PHE 987 Cb 0.06 -0.16 -0.10 0.00 -0.01 0.00 0.00 39.48 39.27 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 -2.28 0.19 -0.16 -4.37 1.01 -0.36 -4.47 120.40 109.96 2rqb s VAL 988 Ca 0.04 -1.55 0.02 0.00 0.00 0.00 0.00 61.98 60.49 2rqb s VAL 988 Cb 0.00 -1.25 0.02 0.00 0.00 0.00 0.00 36.38 35.15 2rqb s VAL 988 CO 0.03 -0.86 -0.20 -0.69 0.00 0.00 0.00 175.10 173.38 2rqb s VAL 989 N -3.40 2.02 -0.21 2.92 1.01 -0.00 -0.96 120.40 121.77 2rqb s VAL 989 Ca 0.02 -0.93 -0.02 0.00 0.00 0.00 0.00 61.98 61.05 2rqb s VAL 989 Cb 0.04 -1.80 0.00 0.00 0.00 0.00 0.00 36.38 34.62 2rqb s VAL 989 CO -0.08 0.54 -0.10 -0.69 0.00 0.00 0.00 175.10 174.77 2rqb s VAL 990 N 1.07 2.93 0.08 2.92 1.01 -1.02 0.72 120.40 128.10 2rqb s VAL 990 Ca -0.01 -0.64 -0.27 0.00 0.00 0.00 0.00 61.98 61.05 2rqb s VAL 990 Cb -0.14 -2.31 -0.06 0.00 0.00 0.00 0.00 36.38 33.88 2rqb s VAL 990 CO -0.07 0.46 0.85 -0.36 0.00 0.00 0.00 175.10 175.98 2rqb s PHE 991 N 1.41 3.77 -0.13 5.22 0.08 -0.70 -2.75 117.98 124.89 2rqb s PHE 991 Ca 0.05 1.62 -0.19 0.00 0.12 0.00 0.00 56.93 58.54 2rqb s PHE 991 Cb -0.14 -2.92 -0.25 0.00 -0.57 0.00 0.00 43.02 39.13 2rqb s PHE 991 CO -0.07 0.25 0.51 -0.22 -0.10 0.00 0.00 175.22 175.59 2rqb h LYS 992 N 5.61 0.15 -0.95 0.44 3.64 -0.69 -3.31 116.57 121.46 2rqb h LYS 992 Ca -0.43 -0.26 0.13 0.00 -1.27 0.00 0.00 60.65 58.81 2rqb h LYS 992 Cb 1.21 0.10 -0.14 0.00 -0.41 0.00 0.00 32.23 32.98 2rqb h LYS 992 CO 0.71 1.13 -0.44 -0.91 -2.27 0.00 0.00 179.45 177.67 2rqb h ASN 993 N -0.56 -1.61 -3.67 4.20 -0.26 -1.94 -3.37 115.58 108.38 2rqb h ASN 993 Ca -0.27 0.31 -0.60 0.00 -0.56 0.00 0.00 56.30 55.17 2rqb h ASN 993 Cb 1.55 0.79 -0.32 0.00 -1.06 0.00 0.00 38.32 39.28 2rqb h ASN 993 CO -0.01 -0.28 -0.85 0.21 -1.06 0.00 0.00 177.43 175.44 2rqb s ASN 994 N -5.37 2.48 -0.91 5.81 3.04 -1.26 -5.04 114.94 113.69 2rqb s ASN 994 Ca -0.13 -0.42 -0.25 0.00 0.04 0.00 0.00 52.86 52.09 2rqb s ASN 994 Cb 0.17 -0.90 -0.19 0.00 -1.54 0.00 0.00 41.25 38.79 2rqb s ASN 994 CO 0.69 0.14 2.20 -0.24 -3.04 0.00 0.00 177.10 176.86 2rqb n SER 995 N 3.35 1.30 -3.84 -4.21 2.88 -1.26 -4.46 113.62 107.38 2rqb n SER 995 Ca -0.19 -1.95 -0.09 0.00 -1.33 0.00 0.00 58.87 55.30 2rqb n SER 995 Cb 0.53 -1.62 -0.07 0.00 -0.75 0.00 0.00 64.21 62.30 2rqb n SER 995 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 2rqb s THR 996 N 15.12 0.12 -0.14 2.46 2.01 -1.25 -5.06 115.64 128.90 2rqb s THR 996 Ca 0.85 -1.13 -0.02 0.00 0.31 0.00 0.00 61.69 61.71 2rqb s THR 996 Cb -0.11 -1.41 0.04 0.00 0.01 0.00 0.00 72.50 71.03 2rqb s THR 996 CO 0.15 -0.53 0.00 -0.75 -0.69 0.00 0.00 174.62 172.80 2rqb s LYS 997 N -3.87 0.79 -0.18 4.92 2.20 -1.26 -1.72 119.74 120.61 2rqb s LYS 997 Ca 0.07 -0.22 -0.07 0.00 -0.36 0.00 0.00 55.97 55.39 2rqb s LYS 997 Cb 0.04 -1.63 -0.04 0.00 -1.51 0.00 0.00 37.83 34.69 2rqb s LYS 997 CO -0.09 -0.46 0.05 0.15 -0.36 0.00 0.00 175.35 174.64 2rqb s LYS 998 N 1.86 3.91 -0.37 4.03 3.01 0.22 -4.98 119.74 127.42 2rqb s LYS 998 Ca 0.02 -0.38 -0.08 0.00 -1.01 0.00 0.00 55.97 54.52 2rqb s LYS 998 Cb -0.15 -3.18 0.05 0.00 -1.01 0.00 0.00 37.83 33.54 2rqb s LYS 998 CO -0.07 0.23 0.17 -1.14 0.51 0.00 0.00 175.35 175.05 2rqb s GLN 999 N 0.48 2.63 0.07 1.68 0.74 -1.26 -0.82 119.66 123.17 2rqb s GLN 999 Ca 0.02 -1.26 0.01 0.00 0.05 0.00 0.00 55.36 54.18 2rqb s GLN 999 Cb -0.13 -3.61 0.01 0.00 1.10 0.00 0.00 33.01 30.38 2rqb s GLN 999 CO 0.01 -0.77 0.09 0.66 -0.55 0.00 0.00 175.29 174.73 2rqb n TYR 1000N 4.87 -2.73 0.00 1.67 4.01 -1.26 -5.03 117.16 118.70 2rqb n TYR 1000Ca -0.11 -0.25 0.00 0.00 -0.16 0.00 0.00 57.90 57.38 2rqb n TYR 1000Cb 0.44 -0.06 0.00 0.00 -0.31 0.00 0.00 39.34 39.41 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 -1.09 0.00 -4.36 -0.72 2.85 -1.26 -4.16 118.16 109.43 2rqb n LYS 1001Ca 0.02 0.00 -0.29 0.00 -1.05 0.00 0.00 58.31 56.98 2rqb n LYS 1001Cb 0.07 -0.50 -0.12 0.00 -0.65 0.00 0.00 35.03 33.84 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 -1.77 1.69 0.23 -1.58 -0.14 -1.26 -0.40 119.74 116.51 2rqb s LYS 1002Ca 0.00 -1.22 -0.06 0.00 -1.36 0.00 0.00 55.97 53.33 2rqb s LYS 1002Cb 0.00 -2.05 0.22 0.00 -1.68 0.00 0.00 37.83 34.32 2rqb s LYS 1002CO 0.00 0.47 1.77 -1.49 -0.76 0.00 0.00 175.35 175.35 2rqb h TRP 1003N 3.83 1.09 -0.70 3.18 4.06 -1.96 -1.11 115.95 124.34 2rqb h TRP 1003Ca -0.50 -0.11 0.20 0.00 2.06 0.00 0.00 58.89 60.55 2rqb h TRP 1003Cb 1.17 -0.32 -0.03 0.00 -1.00 0.00 0.00 29.16 28.98 2rqb h TRP 1003CO 0.60 0.87 0.75 -0.24 -3.56 0.00 0.00 178.44 176.86 2rqb h VAL 1004N 1.02 0.24 -0.45 1.49 3.04 -2.01 1.21 116.25 120.79 2rqb h VAL 1004Ca 0.22 0.00 -0.14 0.00 -1.01 0.00 0.00 66.70 65.77 2rqb h VAL 1004Cb 0.30 0.40 -0.01 0.00 -2.01 0.00 0.00 31.29 29.97 2rqb h VAL 1004CO -0.01 0.00 -0.28 -0.33 -1.01 0.00 0.00 177.57 175.94 2rqb h GLU 1005N 0.00 0.98 -5.79 4.17 4.39 -1.61 -3.42 114.58 113.29 2rqb h GLU 1005Ca 0.33 -0.46 -0.62 0.00 0.34 0.00 0.00 59.36 58.96 2rqb h GLU 1005Cb 1.84 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 30.45 2rqb h GLU 1005CO -0.00 1.13 1.50 -0.11 -1.16 0.00 0.00 179.01 180.36 2rqb n LEU 1006N -4.10 1.86 0.00 1.33 7.94 0.42 -4.74 117.00 119.71 2rqb n LEU 1006Ca -0.01 0.24 0.11 0.00 -1.11 0.00 0.00 56.01 55.24 2rqb n LEU 1006Cb 0.49 -1.25 0.64 0.00 0.53 0.00 0.00 43.42 43.83 2rqb n LEU 1006CO 0.47 -0.86 0.84 -0.81 -1.11 0.00 0.00 177.39 175.92 2rqb n PRO 1007N 8.35 0.75 -3.13 1.96 -0.04 -1.26 -4.74 135.00 136.89 2rqb n PRO 1007Ca 0.44 0.00 -0.39 0.00 -0.04 0.00 0.00 63.50 63.51 2rqb n PRO 1007Cb 0.24 -1.45 -0.05 0.00 -0.04 0.00 0.00 33.50 32.20 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 -2.00 4.80 0.42 0.52 1.09 -1.26 -4.88 121.20 119.89 2rqb s ILE 1008Ca 0.32 1.39 -0.24 0.00 -1.10 0.00 0.00 60.65 61.02 2rqb s ILE 1008Cb 0.15 -4.00 -0.08 0.00 -1.06 0.00 0.00 42.46 37.47 2rqb s ILE 1008CO 0.25 0.42 1.18 0.28 -0.10 0.00 0.00 174.94 176.97 2rqb s THR 1009N -0.30 3.09 0.30 2.92 -1.32 -1.21 -4.96 115.64 114.18 2rqb s THR 1009Ca 0.33 0.89 0.07 0.00 -1.21 0.00 0.00 61.69 61.77 2rqb s THR 1009Cb -0.19 -3.48 -0.06 0.00 -1.51 0.00 0.00 72.50 67.25 2rqb s THR 1009CO 0.20 0.05 -0.04 -0.36 -2.21 0.00 0.00 174.62 172.26 2rqb s PHE 1010N -1.45 2.06 0.00 9.09 0.40 -1.26 -4.39 117.98 122.43 2rqb s PHE 1010Ca 0.59 -0.70 0.00 0.00 -0.60 0.00 0.00 56.93 56.22 2rqb s PHE 1010Cb -0.31 -1.22 0.00 0.00 0.51 0.00 0.00 43.02 42.01 2rqb s PHE 1010CO 0.38 0.30 0.00 -0.35 0.70 0.00 0.00 175.22 176.25 2rqb n PRO 1011N -0.65 0.32 -3.39 0.24 -0.04 -1.26 -5.03 135.00 125.18 2rqb n PRO 1011Ca -0.05 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.29 2rqb n PRO 1011Cb 0.64 0.00 -0.09 0.00 -0.04 0.00 0.00 33.50 34.01 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 0.70 -0.20 3.54 -0.87 -1.26 -4.26 114.94 111.34 2rqb s ASN 1012Ca 0.00 -0.02 0.00 0.00 -1.57 0.00 0.00 52.86 51.28 2rqb s ASN 1012Cb 0.00 0.85 0.02 0.00 -0.02 0.00 0.00 41.25 42.10 2rqb s ASN 1012CO 0.00 -0.32 -0.16 -0.22 -2.57 0.00 0.00 177.10 173.83 2rqb s LEU 1013N 2.46 2.47 0.00 0.60 0.20 0.75 -4.88 118.68 120.29 2rqb s LEU 1013Ca 0.11 -0.73 -0.02 0.00 0.69 0.00 0.00 54.13 54.18 2rqb s LEU 1013Cb -0.15 -1.54 0.12 0.00 -0.43 0.00 0.00 46.19 44.19 2rqb s LEU 1013CO -0.17 -0.04 0.79 0.47 -0.29 0.00 0.00 176.35 177.12 2rqb n ASP 1014N 4.62 0.89 -0.08 3.68 8.00 -1.26 -4.04 116.55 128.36 2rqb n ASP 1014Ca -0.19 -1.79 -0.10 0.00 0.71 0.00 0.00 54.79 53.42 2rqb n ASP 1014Cb 0.49 -0.53 -0.05 0.00 -0.02 0.00 0.00 41.12 41.01 2rqb n ASP 1014CO 0.00 0.00 0.00 1.88 -0.39 0.00 0.00 177.20 178.69 2rqb h TYR 1015N -0.70 0.00 -1.93 1.24 0.05 -1.95 -3.36 116.97 110.32 2rqb h TYR 1015Ca -0.26 0.00 0.56 0.00 0.05 0.00 0.00 58.73 59.08 2rqb h TYR 1015Cb 0.92 0.00 -0.08 0.00 1.01 0.00 0.00 36.73 38.58 2rqb h TYR 1015CO 0.00 0.50 1.39 0.45 -1.05 0.00 0.00 178.16 179.45 2rqb n SER 1016N -4.57 0.00 -0.33 3.88 2.88 -1.26 0.31 113.62 114.52 2rqb n SER 1016Ca -0.14 0.97 0.08 0.00 -1.33 0.00 0.00 58.87 58.45 2rqb n SER 1016Cb 0.38 -0.49 0.18 0.00 -0.75 0.00 0.00 64.21 63.53 2rqb n SER 1016CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 2rqb h GLU 1017N 0.00 0.01 -6.25 -1.46 4.39 -1.99 -3.38 114.58 105.90 2rqb h GLU 1017Ca 0.92 -0.00 -0.52 0.00 0.34 0.00 0.00 59.36 60.10 2rqb h GLU 1017Cb 3.69 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 32.33 2rqb h GLU 1017CO -0.02 0.01 -0.33 0.00 -1.16 0.00 0.00 179.01 177.51 2rqb h LEU 1020N 0.21 0.58 -1.78 0.00 3.38 -1.95 -0.91 115.31 114.84 2rqb h LEU 1020Ca -0.02 0.03 0.52 0.00 0.09 0.00 0.00 57.88 58.49 2rqb h LEU 1020Cb 1.25 -0.09 -0.07 0.00 0.09 0.00 0.00 40.66 41.83 2rqb h LEU 1020CO 0.01 0.32 1.31 0.49 0.09 0.00 0.00 178.44 180.66 2rqb n PHE 1021N -4.52 0.00 -1.43 1.13 3.72 -1.26 -4.35 117.46 110.75 2rqb n PHE 1021Ca 0.15 0.00 -0.48 0.00 -0.05 0.00 0.00 57.45 57.07 2rqb n PHE 1021Cb 0.42 -0.45 -0.10 0.00 -0.94 0.00 0.00 39.48 38.42 2rqb n PHE 1021CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2rqb n SER 1022N -3.73 1.36 -0.34 4.37 2.88 -0.35 -4.72 113.62 113.10 2rqb n SER 1022Ca 0.40 0.28 0.07 0.00 -1.33 0.00 0.00 58.87 58.29 2rqb n SER 1022Cb 1.84 -1.14 0.11 0.00 -0.75 0.00 0.00 64.21 64.28 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 10.38 1.66 -4.32 -3.46 -0.08 -1.26 -5.08 116.55 114.39 2rqb n ASP 1023Ca 0.50 -2.92 -0.30 0.00 -1.51 0.00 0.00 54.79 50.56 2rqb n ASP 1023Cb 0.16 -0.39 0.22 0.00 2.34 0.00 0.00 41.12 43.45 2rqb n ASP 1023CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 2rqb n GLU 1024N -0.96 -2.23 0.00 -0.67 1.02 -1.26 -5.30 120.64 111.23 2rqb n GLU 1024Ca 0.12 -0.63 0.05 0.00 -0.02 0.00 0.00 57.16 56.69 2rqb n GLU 1024Cb 0.69 -1.90 0.32 0.00 -0.02 0.00 0.00 31.44 30.53 2rqb n GLU 1024CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84