#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 3.79 0.20 1.61 0.04 -1.26 -5.06 135.00 134.32 2rqb s PRO 892 Ca 0.00 1.35 -0.16 0.00 0.04 0.00 0.00 61.00 62.24 2rqb s PRO 892 Cb 0.00 -2.09 0.02 0.00 0.04 0.00 0.00 34.50 32.46 2rqb s PRO 892 CO 0.00 -0.44 0.48 -0.51 0.04 0.00 0.00 177.00 176.58 2rqb s LEU 893 N -3.51 0.25 0.00 -3.56 1.02 -1.26 -5.16 118.68 106.46 2rqb s LEU 893 Ca 0.67 -0.60 0.00 0.00 0.02 0.00 0.00 54.13 54.22 2rqb s LEU 893 Cb -0.16 1.96 0.00 0.00 0.02 0.00 0.00 46.19 48.01 2rqb s LEU 893 CO 0.20 -1.04 0.00 0.61 0.02 0.00 0.00 176.35 176.14 2rqb n GLY 894 N -0.33 0.27 3.62 -3.19 0.00 -1.26 -5.19 105.19 99.12 2rqb n GLY 894 Ca -0.09 0.69 0.01 0.00 0.00 0.00 0.00 46.02 46.63 2rqb n GLY 894 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2rqb s SER 895 N 0.00 -0.07 0.78 1.61 0.01 -1.26 -5.17 113.70 109.59 2rqb s SER 895 Ca 0.00 -0.13 -0.12 0.00 1.31 0.00 0.00 55.95 57.01 2rqb s SER 895 Cb 0.00 0.18 0.06 0.00 0.21 0.00 0.00 66.02 66.47 2rqb s SER 895 CO 0.00 -0.32 1.15 -0.31 0.41 0.00 0.00 173.24 174.17 2rqb s TYR 896 N -2.47 3.06 -0.04 2.43 2.02 -1.26 -5.01 117.35 116.07 2rqb s TYR 896 Ca 0.13 0.83 0.09 0.00 -0.37 0.00 0.00 57.07 57.75 2rqb s TYR 896 Cb 0.04 -3.37 0.16 0.00 -0.40 0.00 0.00 41.96 38.39 2rqb s TYR 896 CO -0.04 -1.60 1.08 1.63 -1.57 0.00 0.00 175.55 175.05 2rqb n LYS 897 N -3.22 0.41 -0.49 -0.62 5.02 -1.26 -4.76 118.16 113.24 2rqb n LYS 897 Ca 0.08 -1.68 0.04 0.00 -2.02 0.00 0.00 58.31 54.73 2rqb n LYS 897 Cb 0.60 -0.73 0.23 0.00 -0.02 0.00 0.00 35.03 35.10 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 -0.34 3.58 -4.48 4.39 2.85 -1.26 -4.73 115.26 115.27 2rqb n ASN 898 Ca 0.06 -2.49 -0.35 0.00 -0.11 0.00 0.00 54.58 51.69 2rqb n ASN 898 Cb 0.75 -0.58 -0.12 0.00 1.24 0.00 0.00 39.78 41.07 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 -0.48 4.98 0.00 1.20 2.47 -1.26 -3.27 114.94 118.57 2rqb s ASN 899 Ca 0.31 -0.15 0.22 0.00 0.42 0.00 0.00 52.86 53.66 2rqb s ASN 899 Cb 0.23 -1.85 1.33 0.00 -1.45 0.00 0.00 41.25 39.51 2rqb s ASN 899 CO 0.10 0.09 1.72 -0.81 -3.72 0.00 0.00 177.10 174.48 2rqb n PRO 900 N 4.09 0.75 0.08 0.43 -0.04 -1.26 -2.45 135.00 136.60 2rqb n PRO 900 Ca -0.17 0.00 -0.00 0.00 -0.04 0.00 0.00 63.50 63.29 2rqb n PRO 900 Cb 0.52 -1.46 -0.04 0.00 -0.04 0.00 0.00 33.50 32.47 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 0.87 3.54 0.87 -1.93 -2.33 113.55 114.58 2rqb h SER 901 Ca 0.00 0.00 -0.11 0.00 -1.23 0.00 0.00 61.79 60.45 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 0.63 -1.21 -0.07 -0.53 0.00 0.00 176.83 175.66 2rqb h LEU 902 N 0.00 0.00-10.17 2.23 3.38 -1.86 -3.47 115.31 105.42 2rqb h LEU 902 Ca -0.08 0.00 -0.48 0.00 0.09 0.00 0.00 57.88 57.41 2rqb h LEU 902 Cb 1.55 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.29 2rqb h LEU 902 CO 0.07 0.40 -0.39 0.27 0.09 0.00 0.00 178.44 178.89 2rqb s ILE 903 N -3.05 5.24 0.09 1.22 -4.36 -1.21 -0.44 121.20 118.69 2rqb s ILE 903 Ca -0.02 -0.81 -0.11 0.00 -0.26 0.00 0.00 60.65 59.46 2rqb s ILE 903 Cb 0.09 -3.83 0.01 0.00 1.25 0.00 0.00 42.46 39.97 2rqb s ILE 903 CO 0.80 -0.32 0.25 -0.89 0.24 0.00 0.00 174.94 175.02 2rqb s THR 904 N -1.99 0.12 -0.12 8.37 2.01 -1.08 -3.59 115.64 119.35 2rqb s THR 904 Ca 0.35 -0.98 -0.06 0.00 0.31 0.00 0.00 61.69 61.31 2rqb s THR 904 Cb -0.10 -1.26 -0.04 0.00 0.01 0.00 0.00 72.50 71.12 2rqb s THR 904 CO 0.30 -0.54 0.13 -0.36 -0.69 0.00 0.00 174.62 173.46 2rqb s PHE 905 N -3.73 3.55 0.35 4.92 0.08 0.66 -2.17 117.98 121.64 2rqb s PHE 905 Ca 0.04 0.49 0.04 0.00 0.12 0.00 0.00 56.93 57.62 2rqb s PHE 905 Cb 0.04 -1.93 -0.03 0.00 -0.57 0.00 0.00 43.02 40.53 2rqb s PHE 905 CO -0.11 0.71 0.16 -0.51 -0.10 0.00 0.00 175.22 175.37 2rqb s LEU 906 N -1.00 1.83 -0.23 -0.37 1.43 -0.52 -1.67 118.68 118.15 2rqb s LEU 906 Ca 0.15 -1.63 -0.19 0.00 -1.03 0.00 0.00 54.13 51.43 2rqb s LEU 906 Cb -0.12 0.11 -0.03 0.00 0.03 0.00 0.00 46.19 46.19 2rqb s LEU 906 CO 0.04 -0.92 0.57 0.00 0.23 0.00 0.00 176.35 176.27 2rqb h LYS 908 N 7.69 -0.80 -0.56 0.00 3.64 -1.23 0.46 116.57 125.78 2rqb h LYS 908 Ca -0.30 0.05 0.08 0.00 -1.27 0.00 0.00 60.65 59.21 2rqb h LYS 908 Cb 1.14 0.18 -0.10 0.00 -0.41 0.00 0.00 32.23 33.04 2rqb h LYS 908 CO 0.75 -0.53 -0.48 -0.91 -2.27 0.00 0.00 179.45 176.01 2rqb h ASN 909 N -0.83 -1.65 0.00 4.20 4.21 -1.94 -3.40 115.58 116.18 2rqb h ASN 909 Ca -0.03 0.25 0.00 0.00 1.21 0.00 0.00 56.30 57.73 2rqb h ASN 909 Cb 0.77 0.72 0.00 0.00 -1.12 0.00 0.00 38.32 38.70 2rqb h ASN 909 CO -0.18 -0.35 0.00 0.00 -1.29 0.00 0.00 177.43 175.61 2rqb n SER 911 N 0.00 0.00 -4.75 0.00 3.41 0.16 -4.75 113.62 107.69 2rqb n SER 911 Ca 0.00 0.00 -0.37 0.00 -0.26 0.00 0.00 58.87 58.24 2rqb n SER 911 Cb 0.00 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 63.88 2rqb n SER 911 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 2rqb s VAL 912 N 0.00 5.24 -0.32 -3.33 -7.23 -1.26 -4.53 120.40 108.97 2rqb s VAL 912 Ca 0.00 0.70 -0.27 0.00 -1.81 0.00 0.00 61.98 60.60 2rqb s VAL 912 Cb 0.00 -3.69 -0.06 0.00 0.56 0.00 0.00 36.38 33.19 2rqb s VAL 912 CO 0.00 0.40 2.28 -0.22 -0.31 0.00 0.00 175.10 177.26 2rqb s LEU 913 N 0.26 3.42 -0.02 1.32 1.98 -1.26 -2.73 118.68 121.66 2rqb s LEU 913 Ca 0.20 1.59 -0.02 0.00 -2.89 0.00 0.00 54.13 53.01 2rqb s LEU 913 Cb -0.14 -3.15 -0.27 0.00 0.66 0.00 0.00 46.19 43.29 2rqb s LEU 913 CO 0.07 -2.30 0.78 0.00 -1.89 0.00 0.00 176.35 173.01 2rqb h ALA 914 N 16.70 0.34 -1.23 5.97 0.00 -1.65 -3.49 119.26 135.89 2rqb h ALA 914 Ca -0.35 -1.18 0.35 0.00 0.00 0.00 0.00 54.91 53.74 2rqb h ALA 914 Cb 1.25 0.35 -0.14 0.00 0.00 0.00 0.00 17.79 19.25 2rqb h ALA 914 CO 1.03 1.20 0.91 0.00 0.00 0.00 0.00 179.25 182.40 2rqb s SER 916 N -2.83 5.37 0.17 0.00 0.01 -1.26 -0.24 113.70 114.91 2rqb s SER 916 Ca 0.14 -0.23 -0.15 0.00 1.31 0.00 0.00 55.95 57.02 2rqb s SER 916 Cb 0.05 -1.34 0.11 0.00 0.21 0.00 0.00 66.02 65.05 2rqb s SER 916 CO -0.05 0.04 1.71 1.23 0.41 0.00 0.00 173.24 176.57 2rqb h GLY 917 N 2.14 0.43 2.00 3.44 0.00 -1.58 0.13 103.07 109.64 2rqb h GLY 917 Ca -0.48 0.02 -0.02 0.00 0.00 0.00 0.00 47.33 46.85 2rqb h GLY 917 CO 0.62 -0.08 -0.09 1.05 0.00 0.00 0.00 176.54 178.04 2rqb h GLU 918 N 0.14 0.00 -1.10 4.80 -0.00 -1.70 -1.07 114.58 115.65 2rqb h GLU 918 Ca 0.20 0.00 -0.36 0.00 -0.00 0.00 0.00 59.36 59.20 2rqb h GLU 918 Cb 0.27 0.00 -0.19 0.00 -0.00 0.00 0.00 28.75 28.82 2rqb h GLU 918 CO -0.30 0.09 0.46 -3.47 -0.00 0.00 0.00 179.01 175.79 2rqb n ASP 919 N -3.83 4.41 -4.09 3.06 2.03 0.43 -4.85 116.55 113.71 2rqb n ASP 919 Ca -0.02 -3.09 -0.16 0.00 0.52 0.00 0.00 54.79 52.04 2rqb n ASP 919 Cb 0.19 -0.80 -0.12 0.00 -0.72 0.00 0.00 41.12 39.66 2rqb n ASP 919 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 2rqb s ILE 920 N -2.35 0.77 0.20 5.18 -1.09 -0.41 -4.59 121.20 118.90 2rqb s ILE 920 Ca 0.37 -0.99 0.08 0.00 -2.23 0.00 0.00 60.65 57.88 2rqb s ILE 920 Cb 0.31 -0.76 -0.04 0.00 -1.58 0.00 0.00 42.46 40.39 2rqb s ILE 920 CO 0.05 -0.20 0.00 -1.00 -1.23 0.00 0.00 174.94 172.56 2rqb s HIS 921 N -1.07 2.80 0.19 3.97 3.76 -1.17 -4.71 115.29 119.06 2rqb s HIS 921 Ca -0.04 -0.16 0.09 0.00 -0.15 0.00 0.00 55.06 54.79 2rqb s HIS 921 Cb -0.08 -1.32 -0.04 0.00 1.11 0.00 0.00 32.58 32.24 2rqb s HIS 921 CO 0.01 0.54 -0.17 0.08 -0.85 0.00 0.00 174.74 174.35 2rqb s VAL 922 N -1.90 1.90 -0.15 -0.90 1.01 -1.26 -3.21 120.40 115.89 2rqb s VAL 922 Ca 0.28 -2.08 -0.02 0.00 0.00 0.00 0.00 61.98 60.17 2rqb s VAL 922 Cb -0.08 -1.97 0.04 0.00 0.00 0.00 0.00 36.38 34.36 2rqb s VAL 922 CO 0.19 -0.41 -0.01 -0.63 0.00 0.00 0.00 175.10 174.25 2rqb s ILE 923 N -2.39 0.68 -1.24 2.22 -1.09 0.64 -0.67 121.20 119.34 2rqb s ILE 923 Ca 0.20 -0.38 0.00 0.00 -2.23 0.00 0.00 60.65 58.24 2rqb s ILE 923 Cb -0.04 -0.97 0.00 0.00 -1.58 0.00 0.00 42.46 39.87 2rqb s ILE 923 CO 0.08 0.05 0.00 -0.62 -1.23 0.00 0.00 174.94 173.22 2rqb n GLU 924 N 5.02 -1.84 -2.63 2.79 1.02 -1.26 -0.32 120.64 123.43 2rqb n GLU 924 Ca -0.09 0.70 -0.11 0.00 -0.02 0.00 0.00 57.16 57.63 2rqb n GLU 924 Cb 0.48 -5.17 -0.01 0.00 -0.02 0.00 0.00 31.44 26.73 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 -2.47 -2.59 0.00 3.49 4.01 -1.26 -4.63 118.16 114.71 2rqb n LYS 925 Ca -0.15 0.40 0.00 0.00 -0.51 0.00 0.00 58.31 58.06 2rqb n LYS 925 Cb 0.55 -4.99 0.00 0.00 -0.51 0.00 0.00 35.03 30.08 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 -2.87 0.00 -3.68 1.97 0.00 0.57 -5.04 117.12 108.06 2rqb n MET 926 Ca -0.08 0.00 -0.37 0.00 0.00 0.00 0.00 57.70 57.25 2rqb n MET 926 Cb 0.57 -0.54 -0.11 0.00 0.00 0.00 0.00 33.22 33.13 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 -1.52 3.21 -0.52 3.17 3.76 0.57 -4.96 115.29 119.00 2rqb s HIS 927 Ca 0.00 -0.00 -0.16 0.00 -0.15 0.00 0.00 55.06 54.75 2rqb s HIS 927 Cb 0.00 -2.30 0.10 0.00 1.11 0.00 0.00 32.58 31.49 2rqb s HIS 927 CO 0.00 -0.14 0.49 -3.38 -0.85 0.00 0.00 174.74 170.85 2rqb s HIS 928 N 1.48 3.21 -0.09 1.40 -3.43 -1.26 -0.26 115.29 116.34 2rqb s HIS 928 Ca 0.07 -1.07 0.01 0.00 -0.80 0.00 0.00 55.06 53.27 2rqb s HIS 928 Cb -0.15 -3.56 -0.02 0.00 -1.43 0.00 0.00 32.58 27.42 2rqb s HIS 928 CO 0.07 -0.96 -0.12 0.14 -2.00 0.00 0.00 174.74 171.87 2rqb s VAL 929 N 1.78 3.17 -0.63 -5.38 -7.23 -1.20 -4.01 120.40 106.89 2rqb s VAL 929 Ca 0.05 -0.65 -0.13 0.00 -1.81 0.00 0.00 61.98 59.43 2rqb s VAL 929 Cb -0.27 -2.29 0.16 0.00 0.56 0.00 0.00 36.38 34.55 2rqb s VAL 929 CO 0.05 0.56 0.56 0.21 -0.31 0.00 0.00 175.10 176.18 2rqb s ASN 930 N -0.25 6.25 -0.16 4.85 2.47 -0.01 -3.06 114.94 125.03 2rqb s ASN 930 Ca 0.02 -2.19 -0.04 0.00 0.42 0.00 0.00 52.86 51.07 2rqb s ASN 930 Cb -0.13 -2.15 -0.07 0.00 -1.45 0.00 0.00 41.25 37.45 2rqb s ASN 930 CO 0.03 -0.70 2.89 0.23 -3.72 0.00 0.00 177.10 175.82 2rqb n MET 931 N 4.64 1.88 -3.80 0.43 2.81 -1.26 -4.08 117.12 117.74 2rqb n MET 931 Ca -0.02 -1.23 -0.36 0.00 -1.81 0.00 0.00 57.70 54.28 2rqb n MET 931 Cb 0.42 -1.79 -0.11 0.00 -0.71 0.00 0.00 33.22 31.03 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 -0.46 4.82 0.02 2.03 2.01 -1.26 -4.99 115.64 117.81 2rqb s THR 932 Ca 0.47 -0.01 -0.19 0.00 0.31 0.00 0.00 61.69 62.27 2rqb s THR 932 Cb 0.26 -3.23 -0.22 0.00 0.01 0.00 0.00 72.50 69.33 2rqb s THR 932 CO -0.06 0.36 1.14 1.55 -0.69 0.00 0.00 174.62 176.93 2rqb h PRO 933 N 7.63 0.44 0.00 4.92 0.13 -1.99 -3.12 132.00 140.01 2rqb h PRO 933 Ca -0.37 -0.43 -0.00 0.00 -0.87 0.00 0.00 66.00 64.33 2rqb h PRO 933 Cb 1.17 0.11 -0.00 0.00 0.13 0.00 0.00 31.00 32.41 2rqb h PRO 933 CO 0.63 1.08 -0.02 1.05 -0.23 0.00 0.00 178.00 180.51 2rqb h GLU 934 N -0.04 0.00 0.00 0.86 4.11 -1.98 0.81 114.58 118.34 2rqb h GLU 934 Ca -0.06 0.00 -0.04 0.00 0.07 0.00 0.00 59.36 59.33 2rqb h GLU 934 Cb 1.24 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.49 2rqb h GLU 934 CO 0.11 0.02 -0.17 0.35 0.07 0.00 0.00 179.01 179.39 2rqb h PHE 935 N 0.00 0.00 0.00 2.06 3.57 -1.82 -2.63 116.94 118.12 2rqb h PHE 935 Ca -0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 2rqb h PHE 935 Cb 0.06 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.80 2rqb h PHE 935 CO 0.00 0.17 0.00 0.36 -2.23 0.00 0.00 178.31 176.61 2rqb n LYS 936 N -3.26 0.15 -0.09 1.11 2.85 0.28 -0.26 118.16 118.94 2rqb n LYS 936 Ca 0.01 0.52 0.10 0.00 -1.05 0.00 0.00 58.31 57.89 2rqb n LYS 936 Cb 0.45 -1.88 0.14 0.00 -0.65 0.00 0.00 35.03 33.09 2rqb n LYS 936 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 2rqb n GLU 937 N -2.19 2.14 -0.02 -1.58 -0.58 -0.99 -4.16 120.64 113.26 2rqb n GLU 937 Ca 0.00 -1.96 0.03 0.00 -0.42 0.00 0.00 57.16 54.81 2rqb n GLU 937 Cb 0.13 -1.43 -0.09 0.00 -0.57 0.00 0.00 31.44 29.48 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 1.24 0.00 -4.49 -4.62 4.77 0.64 -5.00 117.00 109.54 2rqb n LEU 938 Ca 0.15 0.00 -0.29 0.00 -0.03 0.00 0.00 56.01 55.84 2rqb n LEU 938 Cb 0.54 0.07 -0.11 0.00 -2.33 0.00 0.00 43.42 41.59 2rqb n LEU 938 CO 0.14 0.07 -0.48 -0.72 -1.33 0.00 0.00 177.39 175.06 2rqb s TYR 939 N -2.70 2.52 -0.03 -1.77 -0.85 -0.61 -3.96 117.35 109.95 2rqb s TYR 939 Ca -0.05 -0.27 0.03 0.00 -0.52 0.00 0.00 57.07 56.27 2rqb s TYR 939 Cb 0.07 -1.31 -0.00 0.00 0.38 0.00 0.00 41.96 41.09 2rqb s TYR 939 CO 0.50 0.42 -0.12 0.42 -1.52 0.00 0.00 175.55 175.24 2rqb s ILE 940 N -1.29 1.00 -0.09 -3.49 1.01 0.68 -4.82 121.20 114.19 2rqb s ILE 940 Ca 0.19 -0.49 -0.16 0.00 0.00 0.00 0.00 60.65 60.19 2rqb s ILE 940 Cb -0.10 -0.87 -0.05 0.00 0.01 0.00 0.00 42.46 41.45 2rqb s ILE 940 CO 0.11 0.30 0.40 -0.69 0.00 0.00 0.00 174.94 175.05 2rqb s VAL 941 N 0.06 5.18 -0.19 2.92 1.01 -1.26 -0.69 120.40 127.42 2rqb s VAL 941 Ca -0.02 0.79 -0.02 0.00 0.00 0.00 0.00 61.98 62.73 2rqb s VAL 941 Cb -0.09 -3.72 -0.00 0.00 0.00 0.00 0.00 36.38 32.57 2rqb s VAL 941 CO 0.01 0.43 -0.11 -0.13 0.00 0.00 0.00 175.10 175.29 2rqb s ARG 942 N 0.04 3.26 -0.63 2.72 3.00 -1.11 -5.01 118.95 121.21 2rqb s ARG 942 Ca 0.22 -0.70 -0.33 0.00 0.00 0.00 0.00 55.73 54.92 2rqb s ARG 942 Cb -0.15 -2.79 -0.15 0.00 0.00 0.00 0.00 34.95 31.85 2rqb s ARG 942 CO 0.09 -0.11 2.41 -1.91 0.00 0.00 0.00 175.30 175.77 2rqb n GLU 943 N 4.47 0.52 -3.66 3.54 2.13 -1.26 -4.16 120.64 122.22 2rqb n GLU 943 Ca -0.19 0.08 -0.08 0.00 0.66 0.00 0.00 57.16 57.64 2rqb n GLU 943 Cb 0.51 -2.17 -0.09 0.00 0.27 0.00 0.00 31.44 29.96 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 8.68 -0.42 0.00 4.31 2.47 -1.26 -5.00 114.94 123.71 2rqb s ASN 944 Ca 1.18 1.07 0.25 0.00 0.42 0.00 0.00 52.86 55.78 2rqb s ASN 944 Cb -0.97 1.39 0.58 0.00 -1.45 0.00 0.00 41.25 40.80 2rqb s ASN 944 CO 0.47 -0.23 1.46 2.29 -3.72 0.00 0.00 177.10 177.38 2rqb n LYS 945 N 5.21 0.21 0.13 0.43 2.85 -1.26 -3.70 118.16 122.03 2rqb n LYS 945 Ca -0.11 -0.12 0.10 0.00 -1.05 0.00 0.00 58.31 57.12 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 1.20 -0.55 0.58 0.00 -1.26 -3.75 120.51 115.43 2rqb n ALA 946 Ca 0.07 0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.65 2rqb n ALA 946 Cb 0.34 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 18.50 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 -2.12 0.00 -4.41 0.00 7.99 -1.24 -5.04 117.00 112.18 2rqb n LEU 947 Ca -0.00 0.00 -0.32 0.00 -0.01 0.00 0.00 56.01 55.68 2rqb n LEU 947 Cb 0.08 -0.13 0.17 0.00 -0.11 0.00 0.00 43.42 43.43 2rqb n LEU 947 CO 0.11 -0.23 -0.05 0.00 -1.51 0.00 0.00 177.39 175.71 2rqb n GLN 948 N -1.83 -1.20 -2.06 3.23 -0.00 -1.25 -5.02 117.38 109.25 2rqb n GLN 948 Ca 0.00 -0.32 -0.03 0.00 -0.00 0.00 0.00 57.00 56.65 2rqb n GLN 948 Cb 0.00 -1.92 -0.00 0.00 -0.00 0.00 0.00 30.24 28.32 2rqb n GLN 948 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69 2rqb n LYS 949 N -2.75 0.20 -2.95 2.61 5.02 -1.26 -4.77 118.16 114.25 2rqb n LYS 949 Ca 0.04 -0.66 -0.43 0.00 -2.02 0.00 0.00 58.31 55.25 2rqb n LYS 949 Cb 0.57 0.67 0.01 0.00 -0.02 0.00 0.00 35.03 36.25 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 -0.14 4.54 -3.75 1.97 5.02 -1.26 -4.58 118.16 119.96 2rqb n LYS 950 Ca -0.00 -4.53 -0.25 0.00 -2.02 0.00 0.00 58.31 51.51 2rqb n LYS 950 Cb 0.14 -2.52 0.00 0.00 -0.02 0.00 0.00 35.03 32.63 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 -1.80 2.45 -0.08 0.00 0.00 -1.26 -4.56 120.51 115.26 2rqb n ALA 952 Ca 0.01 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.39 2rqb n ALA 952 Cb 0.64 0.30 -0.01 0.00 0.00 0.00 0.00 19.45 20.38 2rqb n ALA 952 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2rqb h ASP 953 N 0.00 -0.33 -2.83 0.00 3.32 -1.97 -3.35 116.42 111.26 2rqb h ASP 953 Ca 0.00 0.10 -0.59 0.00 0.02 0.00 0.00 57.03 56.55 2rqb h ASP 953 Cb 0.60 0.20 -0.39 0.00 0.22 0.00 0.00 39.33 39.96 2rqb h ASP 953 CO 0.00 -0.12 -0.83 -0.31 -1.72 0.00 0.00 179.24 176.26 2rqb s TYR 954 N -6.20 1.24 0.20 4.55 2.02 -1.26 -4.87 117.35 113.04 2rqb s TYR 954 Ca -0.14 -2.03 -0.30 0.00 -0.37 0.00 0.00 57.07 54.24 2rqb s TYR 954 Cb 0.12 -1.26 -0.08 0.00 -0.40 0.00 0.00 41.96 40.35 2rqb s TYR 954 CO 0.70 -0.81 1.15 -1.14 -1.57 0.00 0.00 175.55 173.88 2rqb s GLN 955 N 0.61 4.54 0.24 -0.62 2.00 -1.21 -4.74 119.66 120.48 2rqb s GLN 955 Ca 0.21 1.83 0.10 0.00 -2.00 0.00 0.00 55.36 55.49 2rqb s GLN 955 Cb -0.18 -3.24 -0.04 0.00 0.80 0.00 0.00 33.01 30.35 2rqb s GLN 955 CO -0.03 0.01 -0.08 0.42 -0.50 0.00 0.00 175.29 175.11 2rqb s ILE 956 N -0.34 3.11 -0.06 -2.34 -1.09 -1.26 0.19 121.20 119.41 2rqb s ILE 956 Ca 0.50 -1.97 0.13 0.00 -2.23 0.00 0.00 60.65 57.08 2rqb s ILE 956 Cb -0.32 -2.62 -0.19 0.00 -1.58 0.00 0.00 42.46 37.75 2rqb s ILE 956 CO 0.37 -0.30 0.20 0.59 -1.23 0.00 0.00 174.94 174.57 2rqb n ASN 957 N -0.54 1.82 0.00 3.58 5.03 -0.88 -4.65 115.26 119.62 2rqb n ASN 957 Ca -0.07 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.38 2rqb n ASN 957 Cb 0.58 1.30 0.00 0.00 -1.02 0.00 0.00 39.78 40.65 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 1.91 -0.53 3.05 7.41 0.00 -1.26 -4.71 105.19 111.06 2rqb n GLY 958 Ca -0.10 -0.34 -0.24 0.00 0.00 0.00 0.00 46.02 45.34 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 -1.47 1.59 0.04 1.61 2.12 -1.26 -3.15 118.70 118.19 2rqb s GLU 959 Ca 0.00 -0.44 -0.22 0.00 0.36 0.00 0.00 54.97 54.66 2rqb s GLU 959 Cb 0.00 -1.36 -0.06 0.00 0.26 0.00 0.00 34.13 32.98 2rqb s GLU 959 CO 0.00 0.10 0.66 0.96 -0.54 0.00 0.00 175.26 176.44 2rqb s ILE 960 N 0.42 4.76 0.02 -3.70 -4.36 -1.16 -2.75 121.20 114.43 2rqb s ILE 960 Ca -0.10 1.41 0.01 0.00 -0.26 0.00 0.00 60.65 61.72 2rqb s ILE 960 Cb -0.13 -4.01 -0.01 0.00 1.25 0.00 0.00 42.46 39.56 2rqb s ILE 960 CO 0.03 0.44 -0.05 0.27 0.24 0.00 0.00 174.94 175.86 2rqb s ILE 961 N -0.41 0.35 0.67 8.37 -4.36 0.13 -0.42 121.20 125.53 2rqb s ILE 961 Ca 0.33 -0.60 -0.11 0.00 -0.26 0.00 0.00 60.65 60.02 2rqb s ILE 961 Cb -0.20 -0.38 0.17 0.00 1.25 0.00 0.00 42.46 43.30 2rqb s ILE 961 CO 0.20 -0.17 0.48 0.00 0.24 0.00 0.00 174.94 175.69 2rqb h LYS 963 N 0.00 -0.11 -0.66 0.00 1.79 -1.92 -1.87 116.57 113.80 2rqb h LYS 963 Ca -0.20 0.01 0.10 0.00 -2.18 0.00 0.00 60.65 58.38 2rqb h LYS 963 Cb 0.64 0.03 -0.04 0.00 -1.58 0.00 0.00 32.23 31.27 2rqb h LYS 963 CO 0.12 0.01 0.44 0.00 -1.08 0.00 0.00 179.45 178.95 2rqb n GLY 965 N -1.50 0.98 3.58 0.00 0.00 -0.70 -5.11 105.19 102.43 2rqb n GLY 965 Ca 0.11 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.74 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 0.04 3.84 -0.83 1.61 2.00 -1.26 -4.75 119.66 120.32 2rqb s GLN 966 Ca 0.00 -0.40 -0.21 0.00 -2.00 0.00 0.00 55.36 52.75 2rqb s GLN 966 Cb 0.00 -3.70 -0.20 0.00 0.80 0.00 0.00 33.01 29.92 2rqb s GLN 966 CO 0.00 -0.25 2.37 0.00 -0.50 0.00 0.00 175.29 176.91 2rqb n ALA 967 N 5.08 0.63 -0.07 1.58 0.00 -1.26 -1.03 120.51 125.44 2rqb n ALA 967 Ca -0.14 -1.05 -0.05 0.00 0.00 0.00 0.00 53.44 52.20 2rqb n ALA 967 Cb 0.51 -2.92 0.16 0.00 0.00 0.00 0.00 19.45 17.20 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 13.14 0.76 0.00 0.00 6.55 -1.07 -3.43 115.95 131.90 2rqb h TRP 968 Ca -0.03 -0.14 0.00 0.00 0.95 0.00 0.00 58.89 59.67 2rqb h TRP 968 Cb 1.11 -0.20 0.00 0.00 -0.86 0.00 0.00 29.16 29.21 2rqb h TRP 968 CO 1.19 0.79 0.00 0.41 -1.05 0.00 0.00 178.44 179.78 2rqb n GLY 969 N -0.46 -0.51 3.08 1.49 0.00 -1.09 0.55 105.19 108.24 2rqb n GLY 969 Ca 0.01 0.20 -0.10 0.00 0.00 0.00 0.00 46.02 46.13 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 0.10 -0.77 2.61 -4.23 0.84 -2.96 115.64 111.23 2rqb s THR 970 Ca 0.00 -0.86 -0.18 0.00 -1.18 0.00 0.00 61.69 59.48 2rqb s THR 970 Cb 0.00 -0.51 0.14 0.00 1.34 0.00 0.00 72.50 73.47 2rqb s THR 970 CO 0.00 -0.47 0.87 -0.32 -0.54 0.00 0.00 174.62 174.16 2rqb s MET 971 N -1.72 3.38 0.45 3.99 1.75 -1.19 0.02 119.30 125.99 2rqb s MET 971 Ca -0.13 -1.76 -0.15 0.00 -1.25 0.00 0.00 55.69 52.40 2rqb s MET 971 Cb -0.07 -4.53 -0.08 0.00 2.84 0.00 0.00 34.83 32.99 2rqb s MET 971 CO -0.01 -1.57 0.90 -1.64 -0.65 0.00 0.00 175.02 172.06 2rqb s MET 972 N 2.07 3.95 0.09 4.11 -1.94 -0.39 -2.08 119.30 125.11 2rqb s MET 972 Ca 0.21 0.83 0.08 0.00 -1.71 0.00 0.00 55.69 55.10 2rqb s MET 972 Cb -0.14 -2.24 -0.03 0.00 2.01 0.00 0.00 34.83 34.43 2rqb s MET 972 CO -0.03 -0.13 -0.21 0.08 -0.01 0.00 0.00 175.02 174.72 2rqb s VAL 973 N -2.43 1.73 -0.28 -6.03 1.01 0.52 -0.77 120.40 114.15 2rqb s VAL 973 Ca 0.57 -1.50 -0.04 0.00 0.00 0.00 0.00 61.98 61.01 2rqb s VAL 973 Cb -0.10 -1.56 0.10 0.00 0.00 0.00 0.00 36.38 34.82 2rqb s VAL 973 CO 0.27 -0.01 0.13 -2.28 0.00 0.00 0.00 175.10 173.20 2rqb s HIS 974 N -1.10 0.30 -2.01 5.22 5.04 -0.86 -3.36 115.29 118.53 2rqb s HIS 974 Ca 0.07 -0.82 0.00 0.00 -1.54 0.00 0.00 55.06 52.77 2rqb s HIS 974 Cb -0.10 -0.88 0.00 0.00 0.04 0.00 0.00 32.58 31.64 2rqb s HIS 974 CO 0.04 -0.80 0.00 1.63 -2.34 0.00 0.00 174.74 173.27 2rqb n LYS 975 N 5.25 -1.55 -0.00 2.88 5.02 -1.26 0.02 118.16 128.53 2rqb n LYS 975 Ca -0.06 1.13 0.00 0.00 -2.02 0.00 0.00 58.31 57.36 2rqb n LYS 975 Cb 0.43 -5.64 0.00 0.00 -0.02 0.00 0.00 35.03 29.80 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 -0.69 0.48 3.87 0.72 0.00 -1.26 -5.05 105.19 103.25 2rqb n GLY 976 Ca -0.23 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.49 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 -0.28 0.99 1.98 0.10 -5.05 118.68 119.45 2rqb s LEU 977 Ca 0.00 1.29 -0.06 0.00 -2.89 0.00 0.00 54.13 52.47 2rqb s LEU 977 Cb 0.00 -4.18 0.01 0.00 0.66 0.00 0.00 46.19 42.68 2rqb s LEU 977 CO 0.00 -1.20 0.05 -1.81 -1.89 0.00 0.00 176.35 171.50 2rqb s ASP 978 N -4.23 4.94 -0.34 3.68 1.01 -1.26 -2.02 116.67 118.45 2rqb s ASP 978 Ca 0.57 -0.67 -0.01 0.00 0.71 0.00 0.00 52.55 53.15 2rqb s ASP 978 Cb -0.11 -1.84 0.11 0.00 1.01 0.00 0.00 42.92 42.09 2rqb s ASP 978 CO 0.53 -0.16 0.15 -0.76 0.21 0.00 0.00 175.17 175.14 2rqb s LEU 979 N 1.48 1.79 -0.24 1.23 1.02 0.05 -4.87 118.68 119.15 2rqb s LEU 979 Ca 0.03 -1.87 -0.29 0.00 0.02 0.00 0.00 54.13 52.02 2rqb s LEU 979 Cb -0.17 -0.72 -0.01 0.00 0.02 0.00 0.00 46.19 45.32 2rqb s LEU 979 CO 0.01 -0.37 1.32 -2.16 0.02 0.00 0.00 176.35 175.17 2rqb s PRO 980 N 1.36 4.03 -0.47 1.29 0.04 -1.26 -1.27 135.00 138.73 2rqb s PRO 980 Ca 0.13 1.45 -0.16 0.00 0.04 0.00 0.00 61.00 62.45 2rqb s PRO 980 Cb -0.19 -3.85 0.06 0.00 0.04 0.00 0.00 34.50 30.55 2rqb s PRO 980 CO -0.18 -0.98 0.43 0.00 0.04 0.00 0.00 177.00 176.31 2rqb s LEU 982 N 1.87 3.24 -0.10 0.00 1.02 -1.26 -0.12 118.68 123.33 2rqb s LEU 982 Ca 0.07 0.49 0.01 0.00 0.02 0.00 0.00 54.13 54.72 2rqb s LEU 982 Cb -0.22 -3.30 0.02 0.00 0.02 0.00 0.00 46.19 42.71 2rqb s LEU 982 CO 0.09 -1.11 -0.11 -0.54 0.02 0.00 0.00 176.35 174.70 2rqb s LYS 983 N -4.93 1.78 0.64 1.70 1.02 0.19 -4.88 119.74 115.26 2rqb s LYS 983 Ca 0.54 -0.39 0.41 0.00 0.02 0.00 0.00 55.97 56.56 2rqb s LYS 983 Cb -0.10 -1.63 2.25 0.00 -0.52 0.00 0.00 37.83 37.82 2rqb s LYS 983 CO 0.43 -0.14 2.27 0.82 -0.92 0.00 0.00 175.35 177.81 2rqb h ILE 984 N 6.06 0.00 0.00 2.17 2.04 -1.84 0.38 117.51 126.32 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 1.16 0.92 0.00 0.00 -0.74 0.00 0.00 36.82 38.16 2rqb h ILE 984 CO 0.46 0.00 0.00 -2.11 0.00 0.00 0.00 178.15 176.50 2rqb n ARG 985 N -2.98 0.23 0.00 2.37 1.85 0.11 -1.89 116.66 116.35 2rqb n ARG 985 Ca -0.03 0.13 0.00 0.00 -1.00 0.00 0.00 57.85 56.95 2rqb n ARG 985 Cb 0.10 -1.50 0.00 0.00 -1.05 0.00 0.00 32.46 30.01 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 -1.31 0.72 -3.66 2.89 3.02 0.13 -5.00 115.26 112.05 2rqb n ASN 986 Ca 0.08 -0.95 -0.21 0.00 -0.03 0.00 0.00 54.58 53.47 2rqb n ASN 986 Cb 0.15 0.06 -0.05 0.00 -0.61 0.00 0.00 39.78 39.34 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 -0.06 0.66 -4.12 3.10 3.01 -0.79 -0.87 117.46 118.37 2rqb n PHE 987 Ca 0.00 -1.70 -0.09 0.00 1.01 0.00 0.00 57.45 56.67 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 -2.30 0.21 -0.15 -4.37 1.01 -0.49 -4.48 120.40 109.84 2rqb s VAL 988 Ca 0.03 -1.86 0.02 0.00 0.00 0.00 0.00 61.98 60.16 2rqb s VAL 988 Cb 0.00 -1.77 0.01 0.00 0.00 0.00 0.00 36.38 34.63 2rqb s VAL 988 CO 0.02 -0.75 -0.20 -0.69 0.00 0.00 0.00 175.10 173.48 2rqb s VAL 989 N -3.95 1.95 -0.26 2.92 1.01 -0.22 -1.44 120.40 120.42 2rqb s VAL 989 Ca 0.15 -0.90 -0.03 0.00 0.00 0.00 0.00 61.98 61.20 2rqb s VAL 989 Cb 0.08 -1.74 0.02 0.00 0.00 0.00 0.00 36.38 34.73 2rqb s VAL 989 CO -0.04 0.53 -0.02 -0.69 0.00 0.00 0.00 175.10 174.87 2rqb s VAL 990 N 1.01 3.25 -0.27 2.92 1.01 -0.92 -0.07 120.40 127.32 2rqb s VAL 990 Ca -0.03 -0.86 -0.25 0.00 0.00 0.00 0.00 61.98 60.85 2rqb s VAL 990 Cb -0.15 -2.63 -0.00 0.00 0.00 0.00 0.00 36.38 33.60 2rqb s VAL 990 CO -0.05 0.20 0.83 -0.36 0.00 0.00 0.00 175.10 175.72 2rqb s PHE 991 N 1.40 3.26 -0.75 5.22 0.08 0.19 -2.64 117.98 124.74 2rqb s PHE 991 Ca 0.02 1.03 0.25 0.00 0.12 0.00 0.00 56.93 58.35 2rqb s PHE 991 Cb -0.16 -3.16 0.60 0.00 -0.57 0.00 0.00 43.02 39.72 2rqb s PHE 991 CO -0.02 -0.49 1.53 1.17 -0.10 0.00 0.00 175.22 177.31 2rqb n LYS 992 N 6.15 0.21 -0.14 0.44 4.81 0.41 -2.14 118.16 127.91 2rqb n LYS 992 Ca 0.05 0.10 -0.28 0.00 -0.87 0.00 0.00 58.31 57.32 2rqb n LYS 992 Cb 0.48 -1.68 -0.09 0.00 0.02 0.00 0.00 35.03 33.76 2rqb n LYS 992 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 2rqb n ASN 993 N -2.01 1.96 0.00 3.14 5.03 -1.26 -4.27 115.26 117.84 2rqb n ASN 993 Ca 0.05 0.34 0.07 0.00 0.87 0.00 0.00 54.58 55.91 2rqb n ASN 993 Cb 0.41 -0.81 0.34 0.00 -1.02 0.00 0.00 39.78 38.70 2rqb n ASN 993 CO 0.00 0.00 0.00 -3.20 -1.83 0.00 0.00 177.26 172.23 2rqb n ASN 994 N -4.27 0.00 -3.74 6.41 5.15 -1.26 -4.87 115.26 112.68 2rqb n ASN 994 Ca -0.51 0.36 -0.24 0.00 -0.60 0.00 0.00 54.58 53.59 2rqb n ASN 994 Cb 0.85 -0.43 0.02 0.00 -0.53 0.00 0.00 39.78 39.70 2rqb n ASN 994 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 2rqb n SER 995 N -1.43 -1.88 -3.31 1.20 7.64 -0.91 -4.96 113.62 109.97 2rqb n SER 995 Ca 0.05 -0.90 -0.09 0.00 1.01 0.00 0.00 58.87 58.94 2rqb n SER 995 Cb 0.16 -3.73 -0.00 0.00 -1.01 0.00 0.00 64.21 59.63 2rqb n SER 995 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2rqb s THR 996 N -3.70 0.00 -0.11 0.44 2.01 -0.93 -5.02 115.64 108.33 2rqb s THR 996 Ca 0.10 -1.12 -0.01 0.00 0.31 0.00 0.00 61.69 60.96 2rqb s THR 996 Cb -0.03 -2.56 0.03 0.00 0.01 0.00 0.00 72.50 69.95 2rqb s THR 996 CO 0.84 0.00 -0.00 -0.75 -0.69 0.00 0.00 174.62 174.01 2rqb s LYS 997 N -2.98 0.78 0.18 4.92 2.20 -1.26 0.57 119.74 124.14 2rqb s LYS 997 Ca 0.17 -0.07 0.07 0.00 -0.36 0.00 0.00 55.97 55.78 2rqb s LYS 997 Cb -0.04 -1.33 -0.04 0.00 -1.51 0.00 0.00 37.83 34.91 2rqb s LYS 997 CO 0.11 -0.37 0.05 0.15 -0.36 0.00 0.00 175.35 174.93 2rqb s LYS 998 N 1.90 2.55 -0.29 4.03 3.01 0.89 -4.99 119.74 126.85 2rqb s LYS 998 Ca 0.04 -1.07 0.03 0.00 -1.01 0.00 0.00 55.97 53.95 2rqb s LYS 998 Cb -0.13 -2.43 0.08 0.00 -1.01 0.00 0.00 37.83 34.34 2rqb s LYS 998 CO -0.06 0.45 -0.02 -1.14 0.51 0.00 0.00 175.35 175.08 2rqb s GLN 999 N -3.10 1.72 0.18 1.68 0.74 -1.26 -1.05 119.66 118.56 2rqb s GLN 999 Ca 0.29 -1.47 0.00 0.00 0.05 0.00 0.00 55.36 54.24 2rqb s GLN 999 Cb -0.09 -2.89 0.03 0.00 1.10 0.00 0.00 33.01 31.16 2rqb s GLN 999 CO 0.20 -0.75 0.25 0.66 -0.55 0.00 0.00 175.29 175.10 2rqb n TYR 1000N 4.44 -3.17 0.00 1.67 4.02 -1.26 -5.03 117.16 117.82 2rqb n TYR 1000Ca -0.06 -0.47 0.00 0.00 -0.01 0.00 0.00 57.90 57.36 2rqb n TYR 1000Cb 0.42 -0.18 0.00 0.00 -0.02 0.00 0.00 39.34 39.57 2rqb n TYR 1000CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 176.86 176.21 2rqb n LYS 1001N -1.44 0.00 -4.33 -0.72 2.85 -1.26 -4.21 118.16 109.05 2rqb n LYS 1001Ca 0.04 0.00 -0.24 0.00 -1.05 0.00 0.00 58.31 57.06 2rqb n LYS 1001Cb 0.15 -0.37 -0.08 0.00 -0.65 0.00 0.00 35.03 34.08 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 -1.98 2.09 0.20 -1.58 1.02 -1.26 0.10 119.74 118.32 2rqb s LYS 1002Ca 0.00 -1.71 0.25 0.00 0.02 0.00 0.00 55.97 54.53 2rqb s LYS 1002Cb 0.00 -1.95 0.90 0.00 -0.52 0.00 0.00 37.83 36.26 2rqb s LYS 1002CO 0.00 0.16 1.75 0.91 -0.92 0.00 0.00 175.35 177.26 2rqb n TRP 1003N -0.94 0.77 0.07 3.18 7.02 -1.26 -2.54 117.44 123.74 2rqb n TRP 1003Ca -0.04 0.25 -0.12 0.00 -1.02 0.00 0.00 57.50 56.57 2rqb n TRP 1003Cb 0.62 -0.91 -0.03 0.00 -2.42 0.00 0.00 31.31 28.56 2rqb n TRP 1003CO 0.00 0.00 0.00 -0.24 -2.02 0.00 0.00 177.69 175.43 2rqb h VAL 1004N 0.00 1.43 0.00 -0.99 3.04 -1.98 -2.94 116.25 114.81 2rqb h VAL 1004Ca 0.00 -2.51 0.00 0.00 -1.01 0.00 0.00 66.70 63.18 2rqb h VAL 1004Cb 0.56 2.44 0.00 0.00 -2.01 0.00 0.00 31.29 32.29 2rqb h VAL 1004CO 0.00 0.74 0.00 -0.33 -1.01 0.00 0.00 177.57 176.97 2rqb h GLU 1005N 0.19 0.00 -6.31 4.17 4.39 -1.90 -3.41 114.58 111.71 2rqb h GLU 1005Ca -0.07 0.00 -0.57 0.00 0.34 0.00 0.00 59.36 59.07 2rqb h GLU 1005Cb 1.56 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 30.17 2rqb h GLU 1005CO 0.15 0.00 1.03 -1.17 -1.16 0.00 0.00 179.01 177.87 2rqb s LEU 1006N -5.92 3.92 0.00 1.33 2.96 -1.11 -4.85 118.68 115.00 2rqb s LEU 1006Ca -0.02 1.43 0.23 0.00 -0.22 0.00 0.00 54.13 55.55 2rqb s LEU 1006Cb 0.11 -3.54 1.38 0.00 0.50 0.00 0.00 46.19 44.64 2rqb s LEU 1006CO 0.43 -1.13 1.76 -0.81 -1.32 0.00 0.00 176.35 175.29 2rqb n PRO 1007N 7.40 0.75 -3.12 0.98 -0.04 -1.26 -4.74 135.00 134.97 2rqb n PRO 1007Ca 0.16 0.00 -0.39 0.00 -0.04 0.00 0.00 63.50 63.23 2rqb n PRO 1007Cb 0.46 -1.48 -0.05 0.00 -0.04 0.00 0.00 33.50 32.38 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 4.79 -0.03 0.52 1.09 -1.26 -4.83 121.20 119.48 2rqb s ILE 1008Ca 0.35 1.41 -0.29 0.00 -1.10 0.00 0.00 60.65 61.02 2rqb s ILE 1008Cb 0.16 -4.01 -0.03 0.00 -1.06 0.00 0.00 42.46 37.53 2rqb s ILE 1008CO 0.27 0.42 0.94 -0.89 -0.10 0.00 0.00 174.94 175.58 2rqb s THR 1009N -0.31 4.88 0.34 2.92 2.01 -1.20 -5.00 115.64 119.27 2rqb s THR 1009Ca 0.34 1.96 0.07 0.00 0.31 0.00 0.00 61.69 64.36 2rqb s THR 1009Cb -0.19 -4.27 -0.01 0.00 0.01 0.00 0.00 72.50 68.03 2rqb s THR 1009CO 0.20 0.15 0.47 -0.36 -0.69 0.00 0.00 174.62 174.39 2rqb s PHE 1010N 1.15 3.08 0.00 4.92 0.40 -1.26 -4.56 117.98 121.71 2rqb s PHE 1010Ca 0.49 -0.24 0.00 0.00 -0.60 0.00 0.00 56.93 56.58 2rqb s PHE 1010Cb -0.20 -2.02 0.00 0.00 0.51 0.00 0.00 43.02 41.31 2rqb s PHE 1010CO 0.25 -0.04 0.00 -0.35 0.70 0.00 0.00 175.22 175.78 2rqb n PRO 1011N -1.64 0.53 -3.40 0.24 -0.04 -1.26 -5.06 135.00 124.37 2rqb n PRO 1011Ca 0.01 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.33 2rqb n PRO 1011Cb 0.58 0.00 -0.10 0.00 -0.04 0.00 0.00 33.50 33.94 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 0.89 -0.19 3.54 0.01 -1.26 -4.45 114.94 112.24 2rqb s ASN 1012Ca 0.00 -0.15 0.01 0.00 -0.71 0.00 0.00 52.86 52.01 2rqb s ASN 1012Cb 0.00 0.76 0.02 0.00 0.41 0.00 0.00 41.25 42.44 2rqb s ASN 1012CO 0.00 -0.33 -0.19 -0.22 -1.51 0.00 0.00 177.10 174.85 2rqb s LEU 1013N 2.44 2.23 0.36 0.60 0.20 0.15 -4.90 118.68 119.76 2rqb s LEU 1013Ca 0.10 -0.70 0.07 0.00 0.69 0.00 0.00 54.13 54.29 2rqb s LEU 1013Cb -0.15 -1.49 -0.00 0.00 -0.43 0.00 0.00 46.19 44.12 2rqb s LEU 1013CO -0.19 -0.01 0.50 -0.62 -0.29 0.00 0.00 176.35 175.74 2rqb s ASP 1014N 1.28 5.84 -0.10 3.68 3.68 -1.26 -4.06 116.67 125.72 2rqb s ASP 1014Ca 0.04 -0.28 -0.06 0.00 2.13 0.00 0.00 52.55 54.38 2rqb s ASP 1014Cb -0.13 -1.02 -0.27 0.00 -1.45 0.00 0.00 42.92 40.04 2rqb s ASP 1014CO -0.12 -0.54 0.46 1.88 0.13 0.00 0.00 175.17 176.97 2rqb h TYR 1015N 0.82 0.51 -1.20 -5.34 0.05 -1.94 -3.34 116.97 106.53 2rqb h TYR 1015Ca -0.44 -0.37 0.35 0.00 0.05 0.00 0.00 58.73 58.32 2rqb h TYR 1015Cb 1.26 -0.02 -0.05 0.00 1.01 0.00 0.00 36.73 38.94 2rqb h TYR 1015CO 0.42 1.71 0.99 1.03 -1.05 0.00 0.00 178.16 181.26 2rqb h SER 1016N 0.08 0.00 -0.67 3.88 0.87 -2.05 0.28 113.55 115.93 2rqb h SER 1016Ca -0.40 0.00 0.14 0.00 -1.23 0.00 0.00 61.79 60.31 2rqb h SER 1016Cb 2.05 0.00 -0.12 0.00 -0.44 0.00 0.00 62.40 63.89 2rqb h SER 1016CO 0.11 0.00 -0.04 -0.33 -0.53 0.00 0.00 176.83 176.04 2rqb h GLU 1017N 0.00 0.08 -5.29 2.24 4.39 -2.00 -3.36 114.58 110.63 2rqb h GLU 1017Ca 0.57 -0.00 -0.61 0.00 0.34 0.00 0.00 59.36 59.66 2rqb h GLU 1017Cb 2.54 -0.02 -0.12 0.00 -0.10 0.00 0.00 28.75 31.05 2rqb h GLU 1017CO -0.01 0.05 -0.35 0.00 -1.16 0.00 0.00 179.01 177.55 2rqb n LEU 1020N -0.11 2.73 0.00 0.00 4.77 -1.26 -4.20 117.00 118.93 2rqb n LEU 1020Ca 0.30 -0.13 0.06 0.00 -0.03 0.00 0.00 56.01 56.22 2rqb n LEU 1020Cb 0.42 -0.79 0.31 0.00 -2.33 0.00 0.00 43.42 41.03 2rqb n LEU 1020CO 0.33 0.90 0.68 0.49 -1.33 0.00 0.00 177.39 178.46 2rqb n PHE 1021N -3.22 0.00 -1.14 -1.77 3.72 -1.26 -3.30 117.46 110.50 2rqb n PHE 1021Ca -0.45 0.00 -0.19 0.00 -0.05 0.00 0.00 57.45 56.77 2rqb n PHE 1021Cb 1.00 -0.35 -0.05 0.00 -0.94 0.00 0.00 39.48 39.15 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 -1.35 6.11 0.20 4.37 2.88 -1.26 -4.39 113.62 120.18 2rqb n SER 1022Ca 0.05 -2.94 0.06 0.00 -1.33 0.00 0.00 58.87 54.71 2rqb n SER 1022Cb 0.12 -1.22 0.42 0.00 -0.75 0.00 0.00 64.21 62.78 2rqb n SER 1022CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 2rqb h ASP 1023N 2.41 0.00 -1.63 -3.46 3.32 -1.87 -3.44 116.42 111.74 2rqb h ASP 1023Ca 0.29 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 57.19 2rqb h ASP 1023Cb 0.97 0.00 0.09 0.00 0.22 0.00 0.00 39.33 40.60 2rqb h ASP 1023CO 0.63 0.33 -0.07 -0.62 -1.72 0.00 0.00 179.24 177.79 2rqb n GLU 1024N -3.77 -1.45 0.00 3.56 -0.58 -1.26 -5.22 120.64 111.92 2rqb n GLU 1024Ca -0.01 -0.58 0.02 0.00 -0.42 0.00 0.00 57.16 56.17 2rqb n GLU 1024Cb 0.42 -1.05 0.14 0.00 -0.57 0.00 0.00 31.44 30.37 2rqb n GLU 1024CO 0.00 0.00 0.00 -0.40 -0.48 0.00 0.00 177.13 176.25