#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cqp s SER 912 N 0.00 -0.55 0.98 1.61 1.04 -1.26 -5.16 113.70 110.37 2cqp s SER 912 Ca 0.00 1.17 -0.14 0.00 0.48 0.00 0.00 55.95 57.46 2cqp s SER 912 Cb 0.00 1.56 0.05 0.00 0.10 0.00 0.00 66.02 67.73 2cqp s SER 912 CO 0.00 -0.23 0.34 -1.54 0.98 0.00 0.00 173.24 172.79 2cqp n SER 913 N 5.26 -2.15 -0.93 7.02 3.41 -1.26 -5.02 113.62 119.96 2cqp n SER 913 Ca -0.11 0.25 0.00 0.00 -0.26 0.00 0.00 58.87 58.75 2cqp n SER 913 Cb 0.50 -1.17 0.00 0.00 -0.26 0.00 0.00 64.21 63.29 2cqp n SER 913 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2cqp n GLY 914 N 1.59 0.61 3.27 5.00 0.00 -1.26 -4.77 105.19 109.63 2cqp n GLY 914 Ca 0.06 -1.35 -0.19 0.00 0.00 0.00 0.00 46.02 44.53 2cqp n GLY 914 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2cqp n SER 915 N 0.00 -4.97 -4.08 1.61 7.64 -1.26 -5.02 113.62 107.54 2cqp n SER 915 Ca 0.00 -0.48 -0.09 0.00 1.01 0.00 0.00 58.87 59.31 2cqp n SER 915 Cb 0.00 -4.44 -0.10 0.00 -1.01 0.00 0.00 64.21 58.66 2cqp n SER 915 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2cqp s SER 916 N -3.48 0.61 0.00 6.43 1.04 -1.26 -5.17 113.70 111.87 2cqp s SER 916 Ca 0.40 -0.85 0.00 0.00 0.48 0.00 0.00 55.95 55.98 2cqp s SER 916 Cb -0.17 0.14 0.00 0.00 0.10 0.00 0.00 66.02 66.09 2cqp s SER 916 CO 0.63 -0.47 0.00 0.61 0.98 0.00 0.00 173.24 174.99 2cqp n GLY 917 N 0.53 3.94 3.30 7.32 0.00 -1.26 -5.11 105.19 113.91 2cqp n GLY 917 Ca -0.17 -2.08 -0.37 0.00 0.00 0.00 0.00 46.02 43.41 2cqp n GLY 917 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cqp s ALA 918 N -2.00 2.99 0.14 4.61 0.00 -1.26 -5.10 121.76 121.15 2cqp s ALA 918 Ca 0.00 -1.52 -0.05 0.00 0.00 0.00 0.00 51.96 50.39 2cqp s ALA 918 Cb 0.00 -2.08 -0.06 0.00 0.00 0.00 0.00 23.12 20.98 2cqp s ALA 918 CO 0.00 -0.99 0.38 -1.12 0.00 0.00 0.00 175.76 174.03 2cqp s SER 919 N 1.44 6.49 -1.02 0.00 0.01 -1.26 -5.01 113.70 114.35 2cqp s SER 919 Ca 0.01 0.60 -0.23 0.00 1.31 0.00 0.00 55.95 57.64 2cqp s SER 919 Cb -0.18 -2.09 0.02 0.00 0.21 0.00 0.00 66.02 63.99 2cqp s SER 919 CO 0.01 0.05 1.61 -0.44 0.41 0.00 0.00 173.24 174.88 2cqp s SER 920 N -2.43 6.16 0.79 2.44 0.01 -1.26 -4.97 113.70 114.44 2cqp s SER 920 Ca 0.41 -1.35 -0.15 0.00 1.31 0.00 0.00 55.95 56.17 2cqp s SER 920 Cb -0.12 -2.57 0.01 0.00 0.21 0.00 0.00 66.02 63.55 2cqp s SER 920 CO 0.25 -1.82 0.71 0.61 0.41 0.00 0.00 173.24 173.39 2cqp n GLY 921 N 6.73 -1.16 3.09 3.44 0.00 -1.26 -5.00 105.19 111.04 2cqp n GLY 921 Ca 0.36 -0.48 -0.12 0.00 0.00 0.00 0.00 46.02 45.78 2cqp n GLY 921 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cqp s LYS 922 N -3.33 0.61 1.16 1.61 -0.14 -1.26 -4.41 119.74 113.98 2cqp s LYS 922 Ca 0.66 -0.93 -0.18 0.00 -1.36 0.00 0.00 55.97 54.16 2cqp s LYS 922 Cb -0.30 -0.23 0.27 0.00 -1.68 0.00 0.00 37.83 35.88 2cqp s LYS 922 CO 0.57 0.02 1.11 -1.25 -0.76 0.00 0.00 175.35 175.04 2cqp s PRO 923 N -2.30 -0.91 0.00 -1.68 0.04 -1.26 -4.34 135.00 124.54 2cqp s PRO 923 Ca -0.03 0.05 0.00 0.00 0.04 0.00 0.00 61.00 61.05 2cqp s PRO 923 Cb -0.05 -1.62 0.00 0.00 0.04 0.00 0.00 34.50 32.87 2cqp s PRO 923 CO -0.01 -3.53 0.00 0.41 0.04 0.00 0.00 177.00 173.91 2cqp n GLY 924 N -0.97 0.74 2.45 0.56 0.00 -1.26 -5.01 105.19 101.70 2cqp n GLY 924 Ca 0.11 -1.90 -0.21 0.00 0.00 0.00 0.00 46.02 44.03 2cqp n GLY 924 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2cqp n PRO 925 N 0.00 -2.51 -3.43 1.61 -0.04 -1.26 -5.00 135.00 124.37 2cqp n PRO 925 Ca 0.00 -1.22 -0.39 0.00 -0.04 0.00 0.00 63.50 61.85 2cqp n PRO 925 Cb 0.00 -1.15 -0.09 0.00 -0.04 0.00 0.00 33.50 32.22 2cqp n PRO 925 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 2cqp s THR 926 N -2.38 5.20 -0.23 0.52 2.01 0.09 -4.84 115.64 116.01 2cqp s THR 926 Ca 0.50 0.38 -0.14 0.00 0.31 0.00 0.00 61.69 62.74 2cqp s THR 926 Cb -0.05 -3.69 -0.04 0.00 0.01 0.00 0.00 72.50 68.73 2cqp s THR 926 CO 0.38 0.12 0.34 -0.63 -0.69 0.00 0.00 174.62 174.14 2cqp s ILE 927 N 2.01 5.23 0.01 1.82 -1.09 -1.26 -0.18 121.20 127.74 2cqp s ILE 927 Ca 0.13 0.55 0.01 0.00 -2.23 0.00 0.00 60.65 59.11 2cqp s ILE 927 Cb -0.16 -3.67 -0.04 0.00 -1.58 0.00 0.00 42.46 37.01 2cqp s ILE 927 CO 0.11 0.25 0.04 -0.63 -1.23 0.00 0.00 174.94 173.47 2cqp s ILE 928 N 1.45 4.38 -0.11 2.92 1.01 0.71 -0.84 121.20 130.73 2cqp s ILE 928 Ca 0.15 -0.59 -0.00 0.00 0.00 0.00 0.00 60.65 60.22 2cqp s ILE 928 Cb -0.15 -3.00 -0.02 0.00 0.01 0.00 0.00 42.46 39.30 2cqp s ILE 928 CO 0.08 0.32 -0.09 -0.54 0.00 0.00 0.00 174.94 174.70 2cqp s LYS 929 N -1.77 3.14 -0.16 2.79 1.02 -0.69 -2.05 119.74 122.02 2cqp s LYS 929 Ca 0.22 -0.61 -0.01 0.00 0.02 0.00 0.00 55.97 55.59 2cqp s LYS 929 Cb -0.12 -2.65 -0.01 0.00 -0.52 0.00 0.00 37.83 34.54 2cqp s LYS 929 CO 0.13 0.41 -0.12 0.08 -0.92 0.00 0.00 175.35 174.93 2cqp s VAL 930 N -0.13 2.98 0.31 3.17 1.01 0.12 -1.73 120.40 126.13 2cqp s VAL 930 Ca 0.00 -0.66 0.04 0.00 0.00 0.00 0.00 61.98 61.36 2cqp s VAL 930 Cb -0.13 -2.28 -0.06 0.00 0.00 0.00 0.00 36.38 33.91 2cqp s VAL 930 CO 0.03 0.50 0.04 -1.58 0.00 0.00 0.00 175.10 174.09 2cqp s GLN 931 N 0.78 1.62 -0.92 2.72 0.74 -0.10 -1.93 119.66 122.56 2cqp s GLN 931 Ca -0.05 -1.88 -0.02 0.00 0.05 0.00 0.00 55.36 53.46 2cqp s GLN 931 Cb -0.15 -0.89 -0.02 0.00 1.10 0.00 0.00 33.01 33.04 2cqp s GLN 931 CO 0.01 -0.15 0.78 -1.71 -0.55 0.00 0.00 175.29 173.67 2cqp n ASN 932 N -0.66 -3.52 -4.19 6.67 5.15 -1.21 -0.49 115.26 117.02 2cqp n ASN 932 Ca -0.03 -0.53 -0.33 0.00 -0.60 0.00 0.00 54.58 53.09 2cqp n ASN 932 Cb 0.66 -4.28 -0.16 0.00 -0.53 0.00 0.00 39.78 35.48 2cqp n ASN 932 CO 0.00 0.00 0.00 -0.04 1.40 0.00 0.00 177.26 178.62 2cqp s MET 933 N -4.71 3.10 0.84 1.20 -1.94 -0.98 -3.83 119.30 112.99 2cqp s MET 933 Ca 0.15 -0.78 -0.11 0.00 -1.71 0.00 0.00 55.69 53.23 2cqp s MET 933 Cb -0.02 -2.64 0.10 0.00 2.01 0.00 0.00 34.83 34.28 2cqp s MET 933 CO 0.59 -0.14 1.09 -1.25 -0.01 0.00 0.00 175.02 175.31 2cqp s PRO 934 N 1.17 1.67 0.26 2.03 0.04 -1.26 -3.73 135.00 135.17 2cqp s PRO 934 Ca 0.02 0.96 -0.02 0.00 0.04 0.00 0.00 61.00 61.99 2cqp s PRO 934 Cb -0.14 -1.85 0.44 0.00 0.04 0.00 0.00 34.50 33.00 2cqp s PRO 934 CO -0.07 -1.99 1.83 0.74 0.04 0.00 0.00 177.00 177.54 2cqp h PHE 935 N -1.37 0.99 -1.17 0.56 0.04 -2.00 -1.25 116.94 112.73 2cqp h PHE 935 Ca -0.47 0.03 0.35 0.00 2.80 0.00 0.00 57.97 60.68 2cqp h PHE 935 Cb 1.26 -0.31 -0.11 0.00 2.20 0.00 0.00 35.95 38.99 2cqp h PHE 935 CO 0.49 0.42 0.75 1.79 -0.60 0.00 0.00 178.31 181.16 2cqp h THR 936 N 0.91 0.32 -2.50 -1.55 1.35 -2.01 -3.41 112.91 106.02 2cqp h THR 936 Ca 0.43 -0.08 -0.60 0.00 -0.55 0.00 0.00 66.41 65.61 2cqp h THR 936 Cb 0.37 0.06 0.12 0.00 -1.73 0.00 0.00 68.15 66.97 2cqp h THR 936 CO -0.24 0.04 -0.04 0.52 -0.25 0.00 0.00 175.52 175.55 2cqp n VAL 937 N -4.68 2.07 -4.08 6.82 0.31 -0.48 -4.99 118.33 113.30 2cqp n VAL 937 Ca 0.31 -0.50 -0.15 0.00 -0.01 0.00 0.00 64.34 63.99 2cqp n VAL 937 Cb 1.15 -0.86 -0.04 0.00 -0.91 0.00 0.00 33.84 33.18 2cqp n VAL 937 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 2cqp s SER 938 N -0.74 0.97 0.17 4.52 0.01 -1.26 -5.03 113.70 112.34 2cqp s SER 938 Ca 0.61 -1.51 -0.11 0.00 1.31 0.00 0.00 55.95 56.25 2cqp s SER 938 Cb -0.65 0.68 0.07 0.00 0.21 0.00 0.00 66.02 66.33 2cqp s SER 938 CO 0.58 -1.34 1.70 0.40 0.41 0.00 0.00 173.24 175.00 2cqp h ILE 939 N 2.08 1.24 -0.34 1.44 2.04 -1.99 -0.20 117.51 121.79 2cqp h ILE 939 Ca -0.28 -0.83 -0.02 0.00 1.00 0.00 0.00 64.86 64.73 2cqp h ILE 939 Cb 1.24 0.64 -0.02 0.00 -0.74 0.00 0.00 36.82 37.95 2cqp h ILE 939 CO 0.39 0.31 0.14 -0.78 0.00 0.00 0.00 178.15 178.21 2cqp h ASP 940 N 0.85 0.46 -0.49 1.72 3.58 -1.99 -0.76 116.42 119.79 2cqp h ASP 940 Ca 0.19 -0.15 -0.06 0.00 0.42 0.00 0.00 57.03 57.43 2cqp h ASP 940 Cb 0.29 -0.12 -0.02 0.00 1.72 0.00 0.00 39.33 41.20 2cqp h ASP 940 CO -0.01 0.49 0.08 -0.33 -2.88 0.00 0.00 179.24 176.59 2cqp h GLU 941 N 0.40 0.82 -0.13 0.28 4.39 -1.92 -1.96 114.58 116.46 2cqp h GLU 941 Ca 0.11 -0.22 -0.00 0.00 0.34 0.00 0.00 59.36 59.59 2cqp h GLU 941 Cb 0.16 -0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 28.71 2cqp h GLU 941 CO -0.01 0.82 0.07 0.82 -1.16 0.00 0.00 179.01 179.55 2cqp h ILE 942 N 0.70 1.08 -0.82 3.13 2.04 -0.88 0.25 117.51 123.00 2cqp h ILE 942 Ca 0.15 -0.22 0.02 0.00 1.00 0.00 0.00 64.86 65.82 2cqp h ILE 942 Cb 0.40 0.99 -0.05 0.00 -0.74 0.00 0.00 36.82 37.42 2cqp h ILE 942 CO 0.01 0.07 0.53 -0.07 0.00 0.00 0.00 178.15 178.70 2cqp h LEU 943 N 0.12 0.89 -0.76 1.44 3.38 -1.07 -1.72 115.31 117.59 2cqp h LEU 943 Ca 0.05 -0.01 -0.13 0.00 0.09 0.00 0.00 57.88 57.87 2cqp h LEU 943 Cb 0.05 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 2cqp h LEU 943 CO -0.01 0.63 -0.60 -0.78 0.09 0.00 0.00 178.44 177.77 2cqp h ASP 944 N 1.05 0.08 -0.57 -0.43 3.58 -1.09 -3.00 116.42 116.03 2cqp h ASP 944 Ca 0.32 -0.04 -0.07 0.00 0.42 0.00 0.00 57.03 57.65 2cqp h ASP 944 Cb -0.04 -0.02 -0.03 0.00 1.72 0.00 0.00 39.33 40.97 2cqp h ASP 944 CO -0.10 0.66 0.09 0.15 -2.88 0.00 0.00 179.24 177.16 2cqp h PHE 945 N 0.05 1.04 -0.32 0.28 3.04 0.34 -2.06 116.94 119.31 2cqp h PHE 945 Ca -0.01 -0.14 0.00 0.00 3.98 0.00 0.00 57.97 61.81 2cqp h PHE 945 Cb 1.07 -0.29 0.00 0.00 2.56 0.00 0.00 35.95 39.29 2cqp h PHE 945 CO 0.01 0.89 0.00 1.19 -2.02 0.00 0.00 178.31 178.38 2cqp n PHE 946 N -4.22 0.63 -1.16 0.41 3.01 -0.79 -4.96 117.46 110.38 2cqp n PHE 946 Ca 0.04 -0.27 -0.36 0.00 1.01 0.00 0.00 57.45 57.87 2cqp n PHE 946 Cb 0.28 -0.09 0.07 0.00 -0.01 0.00 0.00 39.48 39.73 2cqp n PHE 946 CO 0.00 0.00 0.00 0.98 1.01 0.00 0.00 176.76 178.75 2cqp n TYR 947 N 0.45 -1.49 0.00 1.38 9.36 -0.78 -2.33 117.16 123.74 2cqp n TYR 947 Ca 0.12 0.30 0.00 0.00 3.32 0.00 0.00 57.90 61.65 2cqp n TYR 947 Cb 0.42 -1.83 0.00 0.00 -0.63 0.00 0.00 39.34 37.30 2cqp n TYR 947 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2cqp n GLY 948 N 1.87 2.15 3.81 2.98 0.00 -1.26 -4.98 105.19 109.76 2cqp n GLY 948 Ca 0.08 -0.24 -0.37 0.00 0.00 0.00 0.00 46.02 45.49 2cqp n GLY 948 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2cqp s TYR 949 N -0.69 3.60 -1.17 1.61 2.02 -0.99 -5.00 117.35 116.73 2cqp s TYR 949 Ca 0.00 0.74 -0.22 0.00 -0.37 0.00 0.00 57.07 57.23 2cqp s TYR 949 Cb 0.00 -2.23 -0.02 0.00 -0.40 0.00 0.00 41.96 39.31 2cqp s TYR 949 CO 0.00 0.51 1.84 -0.65 -1.57 0.00 0.00 175.55 175.68 2cqp s GLN 950 N -0.49 3.05 0.17 -0.62 1.11 -1.26 -4.95 119.66 116.67 2cqp s GLN 950 Ca 0.19 -1.31 -0.30 0.00 0.01 0.00 0.00 55.36 53.95 2cqp s GLN 950 Cb -0.14 -5.32 -0.07 0.00 -1.01 0.00 0.00 33.01 26.46 2cqp s GLN 950 CO 0.08 -3.24 1.10 0.08 0.01 0.00 0.00 175.29 173.32 2cqp s VAL 951 N 8.34 3.89 0.20 1.09 1.01 -1.26 -4.75 120.40 128.91 2cqp s VAL 951 Ca 0.62 1.61 -0.31 0.00 0.00 0.00 0.00 61.98 63.90 2cqp s VAL 951 Cb 0.00 -4.03 -0.11 0.00 0.00 0.00 0.00 36.38 32.24 2cqp s VAL 951 CO 0.08 0.27 1.63 -0.63 0.00 0.00 0.00 175.10 176.45 2cqp s ILE 952 N -0.17 2.31 0.15 2.22 1.01 -1.21 -4.95 121.20 120.57 2cqp s ILE 952 Ca 0.50 0.23 -0.31 0.00 0.00 0.00 0.00 60.65 61.07 2cqp s ILE 952 Cb -0.29 -3.15 -0.08 0.00 0.01 0.00 0.00 42.46 38.95 2cqp s ILE 952 CO 0.35 0.02 1.33 -2.16 0.00 0.00 0.00 174.94 174.48 2cqp s PRO 953 N 0.86 4.36 0.00 2.79 0.04 -1.26 -2.69 135.00 139.11 2cqp s PRO 953 Ca 0.70 2.04 0.00 0.00 0.04 0.00 0.00 61.00 63.79 2cqp s PRO 953 Cb -0.47 -3.23 0.00 0.00 0.04 0.00 0.00 34.50 30.85 2cqp s PRO 953 CO 0.34 -0.33 0.00 0.41 0.04 0.00 0.00 177.00 177.46 2cqp n GLY 954 N 2.89 1.04 0.06 0.56 0.00 -1.26 -4.93 105.19 103.55 2cqp n GLY 954 Ca 0.09 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.05 2cqp n GLY 954 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2cqp h SER 955 N 0.00 0.00 0.00 1.61 0.02 -1.87 -3.44 113.55 109.87 2cqp h SER 955 Ca 0.00 -0.34 -0.36 0.00 -0.84 0.00 0.00 61.79 60.25 2cqp h SER 955 Cb 0.00 0.00 -0.08 0.00 0.14 0.00 0.00 62.40 62.46 2cqp h SER 955 CO 0.00 0.70 1.53 0.52 -1.14 0.00 0.00 176.83 178.44 2cqp n VAL 956 N -4.71 0.00 -4.73 2.27 0.31 -1.25 -4.64 118.33 105.58 2cqp n VAL 956 Ca -0.04 -0.17 -0.33 0.00 -0.01 0.00 0.00 64.34 63.78 2cqp n VAL 956 Cb 0.18 -0.24 -0.13 0.00 -0.91 0.00 0.00 33.84 32.75 2cqp n VAL 956 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2cqp s LEU 958 N -0.41 4.34 -0.13 0.00 1.43 -1.26 -1.60 118.68 121.06 2cqp s LEU 958 Ca 0.05 0.41 -0.13 0.00 -1.03 0.00 0.00 54.13 53.44 2cqp s LEU 958 Cb -0.12 -2.08 -0.05 0.00 0.03 0.00 0.00 46.19 43.97 2cqp s LEU 958 CO 0.02 0.34 0.28 -0.75 0.23 0.00 0.00 176.35 176.47 2cqp s LYS 959 N -0.64 4.06 0.48 1.70 2.47 -0.83 -5.01 119.74 121.97 2cqp s LYS 959 Ca 0.13 0.09 0.04 0.00 -1.56 0.00 0.00 55.97 54.67 2cqp s LYS 959 Cb -0.12 -3.35 -0.03 0.00 -1.46 0.00 0.00 37.83 32.87 2cqp s LYS 959 CO 0.02 0.41 0.06 0.71 0.16 0.00 0.00 175.35 176.71 2cqp s TYR 960 N -0.04 2.07 0.43 4.03 2.02 -1.26 -0.23 117.35 124.37 2cqp s TYR 960 Ca 0.17 -0.84 0.05 0.00 -0.37 0.00 0.00 57.07 56.08 2cqp s TYR 960 Cb -0.13 -1.71 0.05 0.00 -0.40 0.00 0.00 41.96 39.76 2cqp s TYR 960 CO 0.05 0.21 0.39 0.27 -1.57 0.00 0.00 175.55 174.90 2cqp n ASN 961 N -1.24 2.21 0.10 2.29 0.23 0.14 -4.66 115.26 114.34 2cqp n ASN 961 Ca -0.12 -2.42 0.17 0.00 -0.53 0.00 0.00 54.58 51.67 2cqp n ASN 961 Cb 0.67 -0.10 0.70 0.00 -2.08 0.00 0.00 39.78 38.97 2cqp n ASN 961 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 2cqp h GLU 962 N 0.00 0.00 0.12 -3.83 -0.00 -2.02 -0.57 114.58 108.28 2cqp h GLU 962 Ca -0.26 0.00 -0.27 0.00 -0.00 0.00 0.00 59.36 58.83 2cqp h GLU 962 Cb 0.99 0.00 0.01 0.00 -0.00 0.00 0.00 28.75 29.75 2cqp h GLU 962 CO 0.40 0.00 -1.21 0.87 -0.00 0.00 0.00 179.01 179.07 2cqp h LYS 963 N 0.00 0.32 0.00 1.06 1.57 -2.05 -3.48 116.57 114.00 2cqp h LYS 963 Ca 0.16 -0.50 0.00 0.00 -1.87 0.00 0.00 60.65 58.43 2cqp h LYS 963 Cb 0.67 0.18 0.00 0.00 0.08 0.00 0.00 32.23 33.16 2cqp h LYS 963 CO -0.00 1.22 0.00 0.41 -0.57 0.00 0.00 179.45 180.51 2cqp n GLY 964 N 1.44 1.80 3.76 3.86 0.00 -0.22 -5.12 105.19 110.70 2cqp n GLY 964 Ca -0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.61 2cqp n GLY 964 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2cqp s MET 965 N 0.00 2.31 0.07 1.61 -1.94 -1.26 -4.46 119.30 115.62 2cqp s MET 965 Ca 0.00 1.32 -0.31 0.00 -1.71 0.00 0.00 55.69 54.99 2cqp s MET 965 Cb 0.00 -1.89 -0.07 0.00 2.01 0.00 0.00 34.83 34.88 2cqp s MET 965 CO 0.00 -1.62 1.40 -1.25 -0.01 0.00 0.00 175.02 173.53 2cqp s PRO 966 N -4.54 4.31 -0.26 2.03 0.04 -1.26 -0.68 135.00 134.64 2cqp s PRO 966 Ca 0.65 2.03 0.00 0.00 0.04 0.00 0.00 61.00 63.72 2cqp s PRO 966 Cb -0.20 -3.39 0.25 0.00 0.04 0.00 0.00 34.50 31.20 2cqp s PRO 966 CO 0.51 -0.49 1.74 0.25 0.04 0.00 0.00 177.00 179.05 2cqp n THR 967 N 4.24 2.40 -4.26 1.26 -2.24 0.68 -4.84 114.28 111.51 2cqp n THR 967 Ca 0.12 -1.27 -0.34 0.00 -2.27 0.00 0.00 64.05 60.30 2cqp n THR 967 Cb 0.43 -1.08 -0.06 0.00 -2.10 0.00 0.00 70.33 67.52 2cqp n THR 967 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2cqp n GLY 968 N 0.11 -0.28 3.03 3.38 0.00 -1.24 -4.85 105.19 105.33 2cqp n GLY 968 Ca 0.28 0.14 -0.10 0.00 0.00 0.00 0.00 46.02 46.33 2cqp n GLY 968 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2cqp s GLU 969 N -7.06 0.35 0.02 1.61 2.02 -1.26 -2.33 118.70 112.05 2cqp s GLU 969 Ca 0.36 -0.42 -0.14 0.00 0.02 0.00 0.00 54.97 54.78 2cqp s GLU 969 Cb -0.20 0.14 0.02 0.00 0.10 0.00 0.00 34.13 34.19 2cqp s GLU 969 CO 0.96 -0.07 0.31 0.00 0.02 0.00 0.00 175.26 176.48 2cqp s ALA 970 N -1.21 -0.73 0.01 5.21 0.00 -0.81 -1.97 121.76 122.24 2cqp s ALA 970 Ca -0.13 0.15 0.04 0.00 0.00 0.00 0.00 51.96 52.02 2cqp s ALA 970 Cb -0.08 0.22 -0.01 0.00 0.00 0.00 0.00 23.12 23.25 2cqp s ALA 970 CO 0.00 -0.35 -0.13 -1.64 0.00 0.00 0.00 175.76 173.65 2cqp s MET 971 N -2.04 0.97 0.09 0.00 -1.94 -0.63 0.12 119.30 115.87 2cqp s MET 971 Ca -0.09 -0.54 -0.01 0.00 -1.71 0.00 0.00 55.69 53.35 2cqp s MET 971 Cb -0.03 -0.94 -0.04 0.00 2.01 0.00 0.00 34.83 35.83 2cqp s MET 971 CO -0.00 0.25 0.01 0.14 -0.01 0.00 0.00 175.02 175.41 2cqp s VAL 972 N -0.48 0.19 0.12 -6.03 -7.23 -0.87 -1.47 120.40 104.62 2cqp s VAL 972 Ca 0.03 -1.86 0.09 0.00 -1.81 0.00 0.00 61.98 58.43 2cqp s VAL 972 Cb -0.06 -1.78 -0.04 0.00 0.56 0.00 0.00 36.38 35.07 2cqp s VAL 972 CO 0.00 -0.74 -0.22 0.00 -0.31 0.00 0.00 175.10 173.83 2cqp s ALA 973 N -3.97 1.95 0.00 1.32 0.00 -1.26 -0.21 121.76 119.60 2cqp s ALA 973 Ca 0.15 -1.32 0.04 0.00 0.00 0.00 0.00 51.96 50.83 2cqp s ALA 973 Cb 0.08 -0.27 -0.01 0.00 0.00 0.00 0.00 23.12 22.92 2cqp s ALA 973 CO -0.04 0.38 -0.13 -0.06 0.00 0.00 0.00 175.76 175.91 2cqp s PHE 974 N -1.24 1.19 0.20 0.00 0.40 0.75 -3.35 117.98 115.91 2cqp s PHE 974 Ca 0.09 -0.25 -0.01 0.00 -0.60 0.00 0.00 56.93 56.16 2cqp s PHE 974 Cb -0.10 -0.75 0.13 0.00 0.51 0.00 0.00 43.02 42.81 2cqp s PHE 974 CO 0.05 -0.01 1.49 0.93 0.70 0.00 0.00 175.22 178.38 2cqp h GLU 975 N 5.61 0.41 -5.88 0.44 4.39 -1.89 0.30 114.58 117.97 2cqp h GLU 975 Ca -0.35 -0.30 -0.68 0.00 0.34 0.00 0.00 59.36 58.38 2cqp h GLU 975 Cb 1.17 0.05 -0.27 0.00 -0.10 0.00 0.00 28.75 29.59 2cqp h GLU 975 CO 0.48 0.91 -0.81 -1.54 -1.16 0.00 0.00 179.01 176.89 2cqp s SER 976 N -6.94 3.66 0.20 1.42 1.04 -1.26 -4.81 113.70 107.02 2cqp s SER 976 Ca -0.06 -0.36 -0.09 0.00 0.48 0.00 0.00 55.95 55.92 2cqp s SER 976 Cb 0.11 -1.10 0.14 0.00 0.10 0.00 0.00 66.02 65.28 2cqp s SER 976 CO 0.83 0.25 1.80 -0.09 0.98 0.00 0.00 173.24 177.01 2cqp h ARG 977 N 6.05 1.07 -0.75 4.02 9.65 -1.98 -2.33 114.38 130.11 2cqp h ARG 977 Ca -0.34 -0.15 0.05 0.00 -1.10 0.00 0.00 59.98 58.44 2cqp h ARG 977 Cb 1.18 -0.20 -0.06 0.00 -1.39 0.00 0.00 29.97 29.51 2cqp h ARG 977 CO 0.51 0.83 0.45 0.22 2.80 0.00 0.00 179.97 184.78 2cqp h ASP 978 N 1.05 0.70 -0.16 -3.80 1.82 -1.99 -1.49 116.42 112.54 2cqp h ASP 978 Ca 0.26 0.02 -0.01 0.00 -0.39 0.00 0.00 57.03 56.91 2cqp h ASP 978 Cb 0.10 -0.13 -0.01 0.00 0.68 0.00 0.00 39.33 39.98 2cqp h ASP 978 CO -0.03 0.45 0.06 -0.33 -1.61 0.00 0.00 179.24 177.78 2cqp h GLU 979 N 0.83 0.25 -0.27 0.28 3.07 -1.90 -0.06 114.58 116.78 2cqp h GLU 979 Ca 0.33 -0.05 0.05 0.00 -0.50 0.00 0.00 59.36 59.19 2cqp h GLU 979 Cb 0.15 -0.04 -0.05 0.00 -0.84 0.00 0.00 28.75 27.97 2cqp h GLU 979 CO -0.16 0.36 -0.05 0.00 -1.40 0.00 0.00 179.01 177.76 2cqp h ALA 980 N 0.88 0.20 -0.48 3.43 0.00 -1.00 0.16 119.26 122.45 2cqp h ALA 980 Ca 0.05 0.10 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 2cqp h ALA 980 Cb 0.21 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 2cqp h ALA 980 CO -0.00 -0.45 0.12 1.15 0.00 0.00 0.00 179.25 180.06 2cqp h THR 981 N 0.03 1.24 -0.80 0.00 2.02 -1.21 -1.93 112.91 112.26 2cqp h THR 981 Ca 0.13 -0.84 -0.01 0.00 0.77 0.00 0.00 66.41 66.46 2cqp h THR 981 Cb 0.19 0.86 -0.04 0.00 -1.74 0.00 0.00 68.15 67.43 2cqp h THR 981 CO -0.26 0.30 0.45 0.00 0.37 0.00 0.00 175.52 176.38 2cqp h ALA 982 N 0.98 1.29 -0.26 6.16 0.00 -0.50 -0.57 119.26 126.37 2cqp h ALA 982 Ca 0.15 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 2cqp h ALA 982 Cb 0.33 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2cqp h ALA 982 CO 0.00 0.59 -0.03 0.00 0.00 0.00 0.00 179.25 179.81 2cqp h ALA 983 N 1.38 0.35 -0.38 0.00 0.00 -0.47 -0.52 119.26 119.63 2cqp h ALA 983 Ca 0.28 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 2cqp h ALA 983 Cb 0.01 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 2cqp h ALA 983 CO -0.05 0.13 0.15 0.28 0.00 0.00 0.00 179.25 179.75 2cqp h VAL 984 N 0.24 1.20 -0.28 0.00 2.07 -1.07 0.77 116.25 119.16 2cqp h VAL 984 Ca 0.07 -0.61 -0.02 0.00 0.82 0.00 0.00 66.70 66.95 2cqp h VAL 984 Cb 0.48 0.88 -0.01 0.00 -1.52 0.00 0.00 31.29 31.13 2cqp h VAL 984 CO 0.02 0.22 0.08 0.40 0.02 0.00 0.00 177.57 178.31 2cqp h ILE 985 N 0.47 1.21 0.00 4.57 2.04 -1.09 1.91 117.51 126.62 2cqp h ILE 985 Ca 0.13 -0.67 -0.04 0.00 1.00 0.00 0.00 64.86 65.27 2cqp h ILE 985 Cb 0.20 1.11 -0.01 0.00 -0.74 0.00 0.00 36.82 37.38 2cqp h ILE 985 CO -0.01 0.22 -0.20 0.44 0.00 0.00 0.00 178.15 178.60 2cqp h ASP 986 N 0.30 0.00 -0.12 1.72 3.32 -0.99 -3.12 116.42 117.53 2cqp h ASP 986 Ca 0.09 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.11 2cqp h ASP 986 Cb 0.26 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.79 2cqp h ASP 986 CO -0.00 0.20 -0.11 0.18 -1.72 0.00 0.00 179.24 177.79 2cqp n LEU 987 N -3.25 3.08 -4.74 1.55 4.77 0.27 -5.00 117.00 113.68 2cqp n LEU 987 Ca 0.01 -3.36 -0.41 0.00 -0.03 0.00 0.00 56.01 52.23 2cqp n LEU 987 Cb 0.50 -0.51 -0.05 0.00 -2.33 0.00 0.00 43.42 41.03 2cqp n LEU 987 CO 0.34 0.94 0.63 0.21 -1.33 0.00 0.00 177.39 178.18 2cqp s ASN 988 N -2.68 7.50 -1.48 -1.43 3.84 0.64 -3.79 114.94 117.55 2cqp s ASN 988 Ca 0.38 1.78 -0.07 0.00 0.21 0.00 0.00 52.86 55.16 2cqp s ASN 988 Cb 0.33 -2.58 0.05 0.00 -0.55 0.00 0.00 41.25 38.51 2cqp s ASN 988 CO 0.02 0.01 0.71 -0.67 -2.79 0.00 0.00 177.10 174.37 2cqp n ASP 989 N 2.42 -2.30 -4.71 -4.21 2.03 -0.93 -4.91 116.55 103.94 2cqp n ASP 989 Ca 0.00 -0.90 -0.41 0.00 0.52 0.00 0.00 54.79 54.00 2cqp n ASP 989 Cb 0.49 -3.45 -0.04 0.00 -0.72 0.00 0.00 41.12 37.40 2cqp n ASP 989 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 2cqp s ARG 990 N -6.52 4.49 -1.05 -0.67 1.81 -1.18 -4.71 118.95 111.13 2cqp s ARG 990 Ca 0.32 1.15 -0.24 0.00 -1.72 0.00 0.00 55.73 55.25 2cqp s ARG 990 Cb -0.17 -3.46 -0.07 0.00 -0.45 0.00 0.00 34.95 30.80 2cqp s ARG 990 CO 0.86 -0.01 1.94 -1.25 -0.68 0.00 0.00 175.30 176.16 2cqp s PRO 991 N 0.97 2.52 0.01 3.54 0.04 -1.26 -1.00 135.00 139.81 2cqp s PRO 991 Ca 0.45 -0.74 -0.24 0.00 0.04 0.00 0.00 61.00 60.51 2cqp s PRO 991 Cb -0.19 -5.15 -0.05 0.00 0.04 0.00 0.00 34.50 29.14 2cqp s PRO 991 CO 0.23 -3.70 0.73 0.42 0.04 0.00 0.00 177.00 174.71 2cqp s ILE 992 N 10.61 4.85 0.00 0.56 1.01 0.10 -4.78 121.20 133.55 2cqp s ILE 992 Ca 0.69 1.53 0.00 0.00 0.00 0.00 0.00 60.65 62.87 2cqp s ILE 992 Cb -0.04 -4.07 0.00 0.00 0.01 0.00 0.00 42.46 38.36 2cqp s ILE 992 CO 0.07 0.34 0.00 0.61 0.00 0.00 0.00 174.94 175.95 2cqp n GLY 993 N 2.60 0.28 0.00 6.18 0.00 -1.26 -0.06 105.19 112.94 2cqp n GLY 993 Ca -0.03 0.55 0.00 0.00 0.00 0.00 0.00 46.02 46.54 2cqp n GLY 993 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2cqp n SER 994 N 3.19 0.28 -4.15 1.61 7.64 -1.26 -5.08 113.62 115.84 2cqp n SER 994 Ca 0.00 -1.01 -0.13 0.00 1.01 0.00 0.00 58.87 58.73 2cqp n SER 994 Cb 0.00 0.00 -0.11 0.00 -1.01 0.00 0.00 64.21 63.09 2cqp n SER 994 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2cqp s ARG 995 N -0.01 0.79 0.06 1.43 0.52 0.91 -5.12 118.95 117.52 2cqp s ARG 995 Ca 0.00 -1.13 -0.23 0.00 -0.52 0.00 0.00 55.73 53.86 2cqp s ARG 995 Cb 0.00 -0.42 -0.06 0.00 0.52 0.00 0.00 34.95 34.99 2cqp s ARG 995 CO 0.00 0.05 0.68 0.15 0.02 0.00 0.00 175.30 176.21 2cqp s LYS 996 N -2.81 4.40 0.09 3.54 1.02 -1.26 0.00 119.74 124.73 2cqp s LYS 996 Ca 0.04 0.93 -0.04 0.00 0.02 0.00 0.00 55.97 56.92 2cqp s LYS 996 Cb -0.02 -3.31 -0.05 0.00 -0.52 0.00 0.00 37.83 33.92 2cqp s LYS 996 CO -0.01 0.43 0.31 0.14 -0.92 0.00 0.00 175.35 175.30 2cqp s VAL 997 N -0.50 5.25 -0.14 3.17 -7.23 -0.17 -4.66 120.40 116.12 2cqp s VAL 997 Ca 0.34 -0.04 -0.01 0.00 -1.81 0.00 0.00 61.98 60.46 2cqp s VAL 997 Cb -0.20 -3.61 -0.01 0.00 0.56 0.00 0.00 36.38 33.11 2cqp s VAL 997 CO 0.21 0.15 -0.11 -0.75 -0.31 0.00 0.00 175.10 174.28 2cqp s LYS 998 N -2.39 3.40 -0.08 4.82 2.36 0.36 -2.20 119.74 126.01 2cqp s LYS 998 Ca 0.36 -0.67 0.01 0.00 -2.55 0.00 0.00 55.97 53.12 2cqp s LYS 998 Cb -0.13 -2.70 -0.03 0.00 -1.05 0.00 0.00 37.83 33.92 2cqp s LYS 998 CO 0.23 0.15 -0.08 -0.51 1.55 0.00 0.00 175.35 176.70 2cqp s LEU 999 N 0.52 3.10 0.02 5.43 1.43 -1.26 -0.93 118.68 126.99 2cqp s LEU 999 Ca -0.08 -0.07 0.03 0.00 -1.03 0.00 0.00 54.13 52.98 2cqp s LEU 999 Cb -0.15 -1.68 -0.01 0.00 0.03 0.00 0.00 46.19 44.38 2cqp s LEU 999 CO 0.04 0.34 -0.08 -0.69 0.23 0.00 0.00 176.35 176.18 2cqp s VAL 1000N -0.65 0.61 0.22 -1.59 1.01 -0.70 -4.97 120.40 114.33 2cqp s VAL 1000Ca 0.10 -0.65 -0.26 0.00 0.00 0.00 0.00 61.98 61.17 2cqp s VAL 1000Cb -0.11 -0.58 -0.09 0.00 0.00 0.00 0.00 36.38 35.60 2cqp s VAL 1000CO 0.02 -0.05 0.83 -0.76 0.00 0.00 0.00 175.10 175.14 2cqp s LEU 1001N -0.77 4.52 1.06 3.92 1.43 -1.26 -1.71 118.68 125.86 2cqp s LEU 1001Ca -0.02 1.71 -0.21 0.00 -1.03 0.00 0.00 54.13 54.59 2cqp s LEU 1001Cb -0.06 -3.54 -0.01 0.00 0.03 0.00 0.00 46.19 42.61 2cqp s LEU 1001CO 0.00 0.12 -0.47 0.61 0.23 0.00 0.00 176.35 176.84 2cqp n GLY 1002N 1.24 -2.76 0.38 -3.19 0.00 -0.02 -4.92 105.19 95.92 2cqp n GLY 1002Ca -0.03 -0.59 0.04 0.00 0.00 0.00 0.00 46.02 45.44 2cqp n GLY 1002CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2cqp n SER 1003N 0.27 2.57 -4.74 1.61 3.41 -1.26 -5.01 113.62 110.47 2cqp n SER 1003Ca 0.00 -2.07 -0.27 0.00 -0.26 0.00 0.00 58.87 56.28 2cqp n SER 1003Cb 0.65 -0.16 -0.07 0.00 -0.26 0.00 0.00 64.21 64.37 2cqp n SER 1003CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2cqp s GLY 1004N -1.09 2.48 1.09 5.00 0.00 -1.26 -4.56 107.32 108.99 2cqp s GLY 1004Ca 0.15 -1.76 -0.15 0.00 0.00 0.00 0.00 44.72 42.95 2cqp s GLY 1004CO 0.09 -1.99 1.10 2.56 0.00 0.00 0.00 173.10 174.85 2cqp s PRO 1005N -3.92 -0.35 -0.18 2.90 0.04 -1.26 -5.02 135.00 127.22 2cqp s PRO 1005Ca 0.34 0.25 -0.14 0.00 0.04 0.00 0.00 61.00 61.48 2cqp s PRO 1005Cb 0.04 -1.67 -0.08 0.00 0.04 0.00 0.00 34.50 32.83 2cqp s PRO 1005CO 0.18 -3.19 -0.17 0.43 0.04 0.00 0.00 177.00 174.30 2cqp n SER 1006N -4.45 1.87 -4.69 6.66 7.64 -1.26 -4.92 113.62 114.46 2cqp n SER 1006Ca 0.08 0.49 -0.35 0.00 1.01 0.00 0.00 58.87 60.10 2cqp n SER 1006Cb 0.58 -0.85 -0.09 0.00 -1.01 0.00 0.00 64.21 62.84 2cqp n SER 1006CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2cqp s SER 1007N -6.20 5.93 0.00 6.43 1.04 -1.26 -5.05 113.70 114.59 2cqp s SER 1007Ca -0.24 0.17 0.06 0.00 0.48 0.00 0.00 55.95 56.41 2cqp s SER 1007Cb 0.05 -2.02 0.04 0.00 0.10 0.00 0.00 66.02 64.19 2cqp s SER 1007CO 0.37 0.19 0.68 0.61 0.98 0.00 0.00 173.24 176.07