#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cqp n SER 912 N 0.00 1.16 -3.46 1.61 7.64 -1.26 -5.05 113.62 114.26 2cqp n SER 912 Ca 0.00 0.00 -0.22 0.00 1.01 0.00 0.00 58.87 59.66 2cqp n SER 912 Cb 0.00 0.00 0.08 0.00 -1.01 0.00 0.00 64.21 63.28 2cqp n SER 912 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2cqp n SER 913 N -2.57 -5.39 0.00 6.43 2.88 -1.26 -4.63 113.62 109.08 2cqp n SER 913 Ca 0.00 -0.54 0.00 0.00 -1.33 0.00 0.00 58.87 57.00 2cqp n SER 913 Cb 0.34 -4.89 0.00 0.00 -0.75 0.00 0.00 64.21 58.91 2cqp n SER 913 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2cqp n GLY 914 N -1.79 1.65 3.03 0.46 0.00 -1.26 -4.86 105.19 102.41 2cqp n GLY 914 Ca -0.05 -0.54 -0.36 0.00 0.00 0.00 0.00 46.02 45.07 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 4.62 -5.70 -4.72 1.61 7.64 -1.26 -4.88 113.62 110.94 2cqp n SER 915 Ca 0.00 0.18 -0.40 0.00 1.01 0.00 0.00 58.87 59.66 2cqp n SER 915 Cb 0.00 -0.78 -0.05 0.00 -1.01 0.00 0.00 64.21 62.38 2cqp n SER 915 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2cqp s SER 916 N -1.06 7.02 0.00 6.43 0.01 -1.26 -4.99 113.70 119.84 2cqp s SER 916 Ca 0.41 1.22 0.00 0.00 1.31 0.00 0.00 55.95 58.89 2cqp s SER 916 Cb -0.17 -2.42 0.00 0.00 0.21 0.00 0.00 66.02 63.64 2cqp s SER 916 CO 0.81 -0.09 0.00 0.61 0.41 0.00 0.00 173.24 174.98 2cqp n GLY 917 N 3.00 3.56 4.02 3.44 0.00 -1.26 -5.16 105.19 112.78 2cqp n GLY 917 Ca -0.01 -1.08 -0.19 0.00 0.00 0.00 0.00 46.02 44.74 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 4.50 0.00 4.61 0.00 -1.26 -5.04 121.76 122.57 2cqp s ALA 918 Ca 0.00 -1.86 0.00 0.00 0.00 0.00 0.00 51.96 50.10 2cqp s ALA 918 Cb 0.00 -1.62 0.00 0.00 0.00 0.00 0.00 23.12 21.50 2cqp s ALA 918 CO 0.00 -0.66 0.00 -1.13 0.00 0.00 0.00 175.76 173.97 2cqp n SER 919 N -2.13 0.16 -3.43 0.00 3.41 -1.26 -5.06 113.62 105.31 2cqp n SER 919 Ca 0.12 0.00 -0.18 0.00 -0.26 0.00 0.00 58.87 58.54 2cqp n SER 919 Cb 0.60 0.00 0.09 0.00 -0.26 0.00 0.00 64.21 64.64 2cqp n SER 919 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2cqp n SER 920 N -2.85 -3.13 0.00 4.04 2.88 -1.25 -4.71 113.62 108.60 2cqp n SER 920 Ca 0.00 -0.59 0.00 0.00 -1.33 0.00 0.00 58.87 56.95 2cqp n SER 920 Cb 0.38 -5.03 0.00 0.00 -0.75 0.00 0.00 64.21 58.81 2cqp n SER 920 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2cqp n GLY 921 N -1.35 2.78 3.44 0.46 0.00 -1.26 -4.74 105.19 104.52 2cqp n GLY 921 Ca -0.21 0.07 -0.16 0.00 0.00 0.00 0.00 46.02 45.72 2cqp n GLY 921 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2cqp s LYS 922 N 0.00 1.03 1.06 1.61 0.00 -1.26 -5.06 119.74 117.13 2cqp s LYS 922 Ca 0.00 -0.02 -0.14 0.00 0.00 0.00 0.00 55.97 55.81 2cqp s LYS 922 Cb 0.00 0.48 0.22 0.00 0.00 0.00 0.00 37.83 38.53 2cqp s LYS 922 CO 0.00 -0.35 1.10 -1.25 0.00 0.00 0.00 175.35 174.85 2cqp s PRO 923 N -1.85 -0.08 1.37 1.78 0.04 -1.26 -4.89 135.00 130.11 2cqp s PRO 923 Ca -0.08 0.35 0.00 0.00 0.04 0.00 0.00 61.00 61.31 2cqp s PRO 923 Cb -0.01 -1.69 0.00 0.00 0.04 0.00 0.00 34.50 32.84 2cqp s PRO 923 CO 0.03 -3.04 0.00 0.41 0.04 0.00 0.00 177.00 174.45 2cqp n GLY 924 N -1.02 -1.36 3.68 0.56 0.00 -1.26 -4.95 105.19 100.84 2cqp n GLY 924 Ca 0.07 -1.54 -0.29 0.00 0.00 0.00 0.00 46.02 44.27 2cqp n GLY 924 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2cqp s PRO 925 N 0.00 0.52 -0.11 1.61 0.04 -1.26 -5.00 135.00 130.79 2cqp s PRO 925 Ca 0.00 0.56 -0.18 0.00 0.04 0.00 0.00 61.00 61.42 2cqp s PRO 925 Cb 0.00 -1.74 -0.04 0.00 0.04 0.00 0.00 34.50 32.75 2cqp s PRO 925 CO 0.00 -2.68 0.46 0.99 0.04 0.00 0.00 177.00 175.81 2cqp s THR 926 N -2.96 5.18 -0.22 1.26 2.01 0.77 -4.81 115.64 116.88 2cqp s THR 926 Ca 0.65 0.91 -0.08 0.00 0.31 0.00 0.00 61.69 63.48 2cqp s THR 926 Cb -0.18 -3.79 -0.04 0.00 0.01 0.00 0.00 72.50 68.49 2cqp s THR 926 CO 0.58 0.35 0.08 -0.63 -0.69 0.00 0.00 174.62 174.31 2cqp s ILE 927 N 0.49 4.73 0.03 1.82 -1.09 -1.26 0.32 121.20 126.24 2cqp s ILE 927 Ca 0.25 -0.04 0.01 0.00 -2.23 0.00 0.00 60.65 58.64 2cqp s ILE 927 Cb -0.15 -3.17 -0.04 0.00 -1.58 0.00 0.00 42.46 37.52 2cqp s ILE 927 CO 0.10 0.39 0.06 -0.63 -1.23 0.00 0.00 174.94 173.63 2cqp s ILE 928 N 0.95 4.53 -0.17 2.92 1.01 0.10 -0.08 121.20 130.45 2cqp s ILE 928 Ca 0.05 -0.60 -0.02 0.00 0.00 0.00 0.00 60.65 60.07 2cqp s ILE 928 Cb -0.14 -3.11 -0.01 0.00 0.01 0.00 0.00 42.46 39.21 2cqp s ILE 928 CO 0.03 0.26 -0.09 -0.54 0.00 0.00 0.00 174.94 174.60 2cqp s LYS 929 N -1.98 3.39 -0.21 2.79 1.02 -0.75 -1.97 119.74 122.03 2cqp s LYS 929 Ca 0.25 -0.65 -0.06 0.00 0.02 0.00 0.00 55.97 55.53 2cqp s LYS 929 Cb -0.12 -2.81 -0.03 0.00 -0.52 0.00 0.00 37.83 34.35 2cqp s LYS 929 CO 0.17 0.03 0.04 0.08 -0.92 0.00 0.00 175.35 174.74 2cqp s VAL 930 N 0.86 4.26 0.32 3.17 1.01 0.56 -1.77 120.40 128.81 2cqp s VAL 930 Ca -0.02 -0.21 0.03 0.00 0.00 0.00 0.00 61.98 61.78 2cqp s VAL 930 Cb -0.15 -2.94 -0.05 0.00 0.00 0.00 0.00 36.38 33.24 2cqp s VAL 930 CO 0.01 0.41 0.08 -1.58 0.00 0.00 0.00 175.10 174.02 2cqp s GLN 931 N 1.04 1.63 -1.08 2.72 0.74 -0.59 -1.90 119.66 122.22 2cqp s GLN 931 Ca 0.03 -1.92 -0.01 0.00 0.05 0.00 0.00 55.36 53.51 2cqp s GLN 931 Cb -0.14 -0.65 0.00 0.00 1.10 0.00 0.00 33.01 33.32 2cqp s GLN 931 CO 0.02 -0.27 0.91 -1.71 -0.55 0.00 0.00 175.29 173.69 2cqp n ASN 932 N -0.74 -2.29 -4.30 6.67 4.05 -1.22 -1.16 115.26 116.27 2cqp n ASN 932 Ca -0.02 -0.55 -0.33 0.00 0.45 0.00 0.00 54.58 54.13 2cqp n ASN 932 Cb 0.66 -4.64 -0.15 0.00 1.23 0.00 0.00 39.78 36.88 2cqp n ASN 932 CO 0.00 0.00 0.00 -0.04 -3.05 0.00 0.00 177.26 174.17 2cqp s MET 933 N -5.28 3.26 0.93 1.20 -1.94 -1.03 -3.91 119.30 112.52 2cqp s MET 933 Ca 0.03 -0.74 -0.12 0.00 -1.71 0.00 0.00 55.69 53.16 2cqp s MET 933 Cb -0.02 -2.61 0.15 0.00 2.01 0.00 0.00 34.83 34.36 2cqp s MET 933 CO 0.65 0.08 1.09 -1.25 -0.01 0.00 0.00 175.02 175.59 2cqp s PRO 934 N 0.65 1.00 0.24 2.03 0.04 -1.26 -4.00 135.00 133.71 2cqp s PRO 934 Ca -0.08 0.73 -0.06 0.00 0.04 0.00 0.00 61.00 61.62 2cqp s PRO 934 Cb -0.16 -1.79 0.25 0.00 0.04 0.00 0.00 34.50 32.85 2cqp s PRO 934 CO 0.02 -2.39 1.92 0.74 0.04 0.00 0.00 177.00 177.33 2cqp h PHE 935 N -1.65 1.20 -0.92 0.56 0.04 -1.99 -1.74 116.94 112.44 2cqp h PHE 935 Ca -0.51 0.03 0.27 0.00 2.80 0.00 0.00 57.97 60.55 2cqp h PHE 935 Cb 1.30 -0.40 -0.04 0.00 2.20 0.00 0.00 35.95 39.01 2cqp h PHE 935 CO 0.38 0.74 0.80 1.79 -0.60 0.00 0.00 178.31 181.42 2cqp h THR 936 N 1.28 0.31 -2.86 -1.55 1.35 -2.01 -3.41 112.91 106.02 2cqp h THR 936 Ca 0.36 0.00 -0.57 0.00 -0.55 0.00 0.00 66.41 65.65 2cqp h THR 936 Cb -0.12 0.41 0.09 0.00 -1.73 0.00 0.00 68.15 66.79 2cqp h THR 936 CO -0.09 0.00 0.64 0.52 -0.25 0.00 0.00 175.52 176.35 2cqp n VAL 937 N -3.85 1.11 -4.14 6.82 0.31 -0.66 -4.99 118.33 112.93 2cqp n VAL 937 Ca 0.19 -0.28 -0.12 0.00 -0.01 0.00 0.00 64.34 64.13 2cqp n VAL 937 Cb 1.11 -1.57 -0.08 0.00 -0.91 0.00 0.00 33.84 32.38 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 0.24 0.30 0.24 4.52 0.01 -1.26 -5.03 113.70 112.72 2cqp s SER 938 Ca 0.66 -1.31 -0.06 0.00 1.31 0.00 0.00 55.95 56.54 2cqp s SER 938 Cb -0.61 0.48 0.31 0.00 0.21 0.00 0.00 66.02 66.41 2cqp s SER 938 CO 0.51 -0.98 1.85 0.40 0.41 0.00 0.00 173.24 175.43 2cqp h ILE 939 N 2.43 1.04 -0.33 1.44 2.04 -1.98 0.17 117.51 122.32 2cqp h ILE 939 Ca -0.32 -0.32 -0.02 0.00 1.00 0.00 0.00 64.86 65.21 2cqp h ILE 939 Cb 1.25 0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 37.33 2cqp h ILE 939 CO 0.45 0.17 0.13 -0.78 0.00 0.00 0.00 178.15 178.13 2cqp h ASP 940 N 0.94 0.45 -0.40 1.72 3.58 -1.99 -0.33 116.42 120.38 2cqp h ASP 940 Ca 0.36 -0.16 -0.05 0.00 0.42 0.00 0.00 57.03 57.60 2cqp h ASP 940 Cb 0.16 -0.12 -0.02 0.00 1.72 0.00 0.00 39.33 41.08 2cqp h ASP 940 CO -0.17 0.48 0.05 -0.33 -2.88 0.00 0.00 179.24 176.39 2cqp h GLU 941 N 0.38 0.67 -0.02 0.28 4.39 -1.81 -2.16 114.58 116.31 2cqp h GLU 941 Ca 0.11 -0.19 -0.00 0.00 0.34 0.00 0.00 59.36 59.62 2cqp h GLU 941 Cb 0.17 -0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 28.75 2cqp h GLU 941 CO -0.01 0.73 0.01 0.82 -1.16 0.00 0.00 179.01 179.41 2cqp h ILE 942 N 0.52 1.05 -0.86 3.13 2.04 -0.55 0.11 117.51 122.95 2cqp h ILE 942 Ca 0.12 -0.14 0.07 0.00 1.00 0.00 0.00 64.86 65.91 2cqp h ILE 942 Cb 0.40 1.10 -0.06 0.00 -0.74 0.00 0.00 36.82 37.52 2cqp h ILE 942 CO 0.01 0.04 0.53 -0.07 0.00 0.00 0.00 178.15 178.66 2cqp h LEU 943 N -0.02 0.81 -0.78 1.44 3.38 -1.02 -0.98 115.31 118.14 2cqp h LEU 943 Ca 0.01 0.02 -0.13 0.00 0.09 0.00 0.00 57.88 57.87 2cqp h LEU 943 Cb 0.05 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 2cqp h LEU 943 CO -0.00 0.50 -0.57 -0.78 0.09 0.00 0.00 178.44 177.69 2cqp h ASP 944 N 0.94 0.14 -0.11 -0.43 3.58 -1.11 -2.91 116.42 116.51 2cqp h ASP 944 Ca 0.38 -0.08 -0.08 0.00 0.42 0.00 0.00 57.03 57.68 2cqp h ASP 944 Cb 0.22 -0.04 -0.02 0.00 1.72 0.00 0.00 39.33 41.22 2cqp h ASP 944 CO -0.19 0.68 -0.16 0.15 -2.88 0.00 0.00 179.24 176.84 2cqp h PHE 945 N 0.10 0.52 -0.46 0.28 3.04 0.52 -2.11 116.94 118.83 2cqp h PHE 945 Ca -0.00 -0.09 0.00 0.00 3.98 0.00 0.00 57.97 61.86 2cqp h PHE 945 Cb 1.03 -0.14 0.00 0.00 2.56 0.00 0.00 35.95 39.40 2cqp h PHE 945 CO 0.01 0.62 0.00 1.19 -2.02 0.00 0.00 178.31 178.11 2cqp n PHE 946 N -4.18 0.88 -1.48 0.41 3.72 -0.71 -4.97 117.46 111.13 2cqp n PHE 946 Ca 0.00 -0.38 -0.38 0.00 -0.05 0.00 0.00 57.45 56.65 2cqp n PHE 946 Cb 0.34 -0.11 0.04 0.00 -0.94 0.00 0.00 39.48 38.82 2cqp n PHE 946 CO 0.00 0.00 0.00 0.98 -0.05 0.00 0.00 176.76 177.69 2cqp n TYR 947 N 0.79 -0.40 0.00 1.38 9.36 -0.79 -2.29 117.16 125.21 2cqp n TYR 947 Ca 0.17 0.43 0.00 0.00 3.32 0.00 0.00 57.90 61.82 2cqp n TYR 947 Cb 0.55 -1.99 0.00 0.00 -0.63 0.00 0.00 39.34 37.28 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 1.67 2.67 3.78 2.98 0.00 -1.26 -5.00 105.19 110.03 2cqp n GLY 948 Ca 0.12 -0.16 -0.36 0.00 0.00 0.00 0.00 46.02 45.62 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 -1.52 3.42 -0.91 1.61 2.02 -0.97 -5.02 117.35 115.98 2cqp s TYR 949 Ca 0.00 0.36 -0.24 0.00 -0.37 0.00 0.00 57.07 56.82 2cqp s TYR 949 Cb 0.00 -1.94 -0.05 0.00 -0.40 0.00 0.00 41.96 39.57 2cqp s TYR 949 CO 0.00 0.55 1.96 -0.65 -1.57 0.00 0.00 175.55 175.83 2cqp s GLN 950 N -0.66 2.53 -0.19 -0.62 -0.21 -1.26 -4.94 119.66 114.32 2cqp s GLN 950 Ca 0.12 -0.31 -0.24 0.00 0.02 0.00 0.00 55.36 54.95 2cqp s GLN 950 Cb -0.12 -5.06 -0.02 0.00 1.00 0.00 0.00 33.01 28.81 2cqp s GLN 950 CO 0.02 -3.43 0.79 0.08 -2.12 0.00 0.00 175.29 170.64 2cqp s VAL 951 N 10.22 4.90 0.11 1.09 1.01 -1.26 -4.69 120.40 131.78 2cqp s VAL 951 Ca 0.70 1.53 -0.35 0.00 0.00 0.00 0.00 61.98 63.86 2cqp s VAL 951 Cb -0.07 -4.10 -0.15 0.00 0.00 0.00 0.00 36.38 32.07 2cqp s VAL 951 CO -0.00 0.03 1.47 -0.38 0.00 0.00 0.00 175.10 176.22 2cqp n ILE 952 N 4.80 0.02 -2.18 2.22 5.41 -1.18 -4.89 119.36 123.57 2cqp n ILE 952 Ca 0.03 -0.00 -0.42 0.00 1.00 0.00 0.00 62.75 63.36 2cqp n ILE 952 Cb 0.49 -1.19 -0.03 0.00 -0.71 0.00 0.00 39.64 38.20 2cqp n ILE 952 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 2cqp s PRO 953 N 0.85 4.27 0.00 0.38 0.04 -1.26 -2.48 135.00 136.81 2cqp s PRO 953 Ca 0.82 2.02 0.00 0.00 0.04 0.00 0.00 61.00 63.89 2cqp s PRO 953 Cb -0.82 -3.55 0.00 0.00 0.04 0.00 0.00 34.50 30.17 2cqp s PRO 953 CO 0.43 -0.58 0.00 0.41 0.04 0.00 0.00 177.00 177.30 2cqp n GLY 954 N 3.68 1.23 0.07 0.56 0.00 -1.26 -4.92 105.19 104.55 2cqp n GLY 954 Ca 0.13 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.03 2cqp n GLY 954 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2cqp h SER 955 N 0.00 0.09 -0.37 1.61 4.64 -1.83 -3.43 113.55 114.27 2cqp h SER 955 Ca 0.00 -0.35 -0.67 0.00 -0.47 0.00 0.00 61.79 60.30 2cqp h SER 955 Cb 0.00 -0.03 -0.04 0.00 -0.31 0.00 0.00 62.40 62.02 2cqp h SER 955 CO 0.00 0.42 1.45 0.52 -0.87 0.00 0.00 176.83 178.35 2cqp n VAL 956 N -4.86 0.04 -4.08 0.95 0.31 -1.23 -4.47 118.33 104.99 2cqp n VAL 956 Ca -0.07 -0.11 -0.33 0.00 -0.01 0.00 0.00 64.34 63.82 2cqp n VAL 956 Cb 0.20 -0.91 -0.16 0.00 -0.91 0.00 0.00 33.84 32.06 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 1.28 4.22 -0.18 0.00 1.43 -1.26 -0.69 118.68 123.48 2cqp s LEU 958 Ca 0.03 0.79 -0.12 0.00 -1.03 0.00 0.00 54.13 53.80 2cqp s LEU 958 Cb -0.14 -2.75 -0.05 0.00 0.03 0.00 0.00 46.19 43.28 2cqp s LEU 958 CO -0.10 -0.11 0.21 -0.75 0.23 0.00 0.00 176.35 175.83 2cqp s LYS 959 N 1.15 4.20 0.30 1.70 2.20 -0.85 -5.02 119.74 123.43 2cqp s LYS 959 Ca 0.26 -0.06 0.02 0.00 -0.36 0.00 0.00 55.97 55.84 2cqp s LYS 959 Cb -0.15 -3.42 0.02 0.00 -1.51 0.00 0.00 37.83 32.77 2cqp s LYS 959 CO 0.11 0.28 0.17 0.66 -0.36 0.00 0.00 175.35 176.21 2cqp n TYR 960 N 3.50 -0.63 -3.59 4.03 4.01 -1.26 -1.44 117.16 121.77 2cqp n TYR 960 Ca -0.14 -1.30 -0.18 0.00 -0.16 0.00 0.00 57.90 56.12 2cqp n TYR 960 Cb 0.52 -0.23 0.01 0.00 -0.31 0.00 0.00 39.34 39.33 2cqp n TYR 960 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 2cqp n ASN 961 N -1.74 2.08 -0.03 7.72 0.23 0.20 -4.69 115.26 119.02 2cqp n ASN 961 Ca -0.04 -2.30 0.03 0.00 -0.53 0.00 0.00 54.58 51.74 2cqp n ASN 961 Cb 0.35 -0.10 0.39 0.00 -2.08 0.00 0.00 39.78 38.34 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 0.61 -0.23 -3.83 4.11 -2.02 -1.86 114.58 111.36 2cqp h GLU 962 Ca -0.24 -0.04 -0.14 0.00 0.07 0.00 0.00 59.36 59.02 2cqp h GLU 962 Cb 0.91 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 30.02 2cqp h GLU 962 CO 0.37 0.41 -0.43 0.87 0.07 0.00 0.00 179.01 180.30 2cqp h LYS 963 N 0.62 0.55 0.00 1.06 1.79 -2.05 -3.47 116.57 115.07 2cqp h LYS 963 Ca 0.17 -0.29 0.00 0.00 -2.18 0.00 0.00 60.65 58.35 2cqp h LYS 963 Cb -0.06 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 30.60 2cqp h LYS 963 CO -0.04 0.87 0.00 0.41 -1.08 0.00 0.00 179.45 179.62 2cqp n GLY 964 N 0.02 1.07 3.87 3.86 0.00 -0.70 -5.12 105.19 108.19 2cqp n GLY 964 Ca -0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.69 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 3.79 0.06 1.61 -1.94 -1.26 -4.68 119.30 116.87 2cqp s MET 965 Ca 0.00 0.62 -0.31 0.00 -1.71 0.00 0.00 55.69 54.30 2cqp s MET 965 Cb 0.00 -2.28 -0.07 0.00 2.01 0.00 0.00 34.83 34.50 2cqp s MET 965 CO 0.00 -0.18 1.41 -1.25 -0.01 0.00 0.00 175.02 174.98 2cqp s PRO 966 N -4.15 4.30 -0.13 2.03 0.04 -1.26 -0.63 135.00 135.19 2cqp s PRO 966 Ca 0.54 2.03 0.02 0.00 0.04 0.00 0.00 61.00 63.63 2cqp s PRO 966 Cb -0.10 -3.42 0.23 0.00 0.04 0.00 0.00 34.50 31.24 2cqp s PRO 966 CO 0.35 -0.51 1.20 0.25 0.04 0.00 0.00 177.00 178.33 2cqp n THR 967 N 4.32 1.52 -3.93 1.26 -2.24 -0.52 -4.84 114.28 109.85 2cqp n THR 967 Ca 0.12 -0.58 -0.32 0.00 -2.27 0.00 0.00 64.05 61.01 2cqp n THR 967 Cb 0.43 -0.73 -0.01 0.00 -2.10 0.00 0.00 70.33 67.91 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 0.02 -0.47 2.96 3.38 0.00 -1.26 -4.87 105.19 104.96 2cqp n GLY 968 Ca 0.17 0.13 -0.12 0.00 0.00 0.00 0.00 46.02 46.20 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 -6.62 0.28 -0.00 1.61 2.02 -1.26 -2.47 118.70 112.25 2cqp s GLU 969 Ca 0.64 -0.39 -0.16 0.00 0.02 0.00 0.00 54.97 55.08 2cqp s GLU 969 Cb -0.34 -0.09 0.03 0.00 0.10 0.00 0.00 34.13 33.82 2cqp s GLU 969 CO 0.79 0.01 0.35 0.00 0.02 0.00 0.00 175.26 176.43 2cqp s ALA 970 N -0.78 -0.86 0.02 5.21 0.00 -0.80 -2.00 121.76 122.55 2cqp s ALA 970 Ca -0.07 0.35 0.08 0.00 0.00 0.00 0.00 51.96 52.32 2cqp s ALA 970 Cb -0.06 0.13 -0.02 0.00 0.00 0.00 0.00 23.12 23.17 2cqp s ALA 970 CO -0.00 -0.31 -0.23 -1.64 0.00 0.00 0.00 175.76 173.58 2cqp s MET 971 N -1.60 1.68 0.16 0.00 -1.94 0.14 -0.32 119.30 117.42 2cqp s MET 971 Ca -0.11 -0.93 0.02 0.00 -1.71 0.00 0.00 55.69 52.95 2cqp s MET 971 Cb -0.04 -1.74 -0.05 0.00 2.01 0.00 0.00 34.83 35.02 2cqp s MET 971 CO 0.03 0.46 -0.00 0.14 -0.01 0.00 0.00 175.02 175.64 2cqp s VAL 972 N -0.69 0.64 0.05 -6.03 -7.23 -0.83 -0.14 120.40 106.18 2cqp s VAL 972 Ca 0.09 -1.97 0.06 0.00 -1.81 0.00 0.00 61.98 58.35 2cqp s VAL 972 Cb -0.09 -2.08 -0.02 0.00 0.56 0.00 0.00 36.38 34.75 2cqp s VAL 972 CO 0.01 -0.51 -0.16 0.00 -0.31 0.00 0.00 175.10 174.13 2cqp s ALA 973 N -3.68 1.36 -0.01 1.32 0.00 -1.26 -0.73 121.76 118.76 2cqp s ALA 973 Ca 0.23 -0.95 0.04 0.00 0.00 0.00 0.00 51.96 51.28 2cqp s ALA 973 Cb 0.06 -0.21 -0.01 0.00 0.00 0.00 0.00 23.12 22.96 2cqp s ALA 973 CO 0.03 0.26 -0.13 -0.06 0.00 0.00 0.00 175.76 175.86 2cqp s PHE 974 N -0.94 1.19 0.17 0.00 0.40 0.15 -3.10 117.98 115.84 2cqp s PHE 974 Ca 0.03 -0.23 -0.03 0.00 -0.60 0.00 0.00 56.93 56.09 2cqp s PHE 974 Cb -0.09 -0.77 0.03 0.00 0.51 0.00 0.00 43.02 42.71 2cqp s PHE 974 CO 0.02 -0.03 1.42 0.93 0.70 0.00 0.00 175.22 178.26 2cqp h GLU 975 N 5.87 0.48 -5.20 0.44 4.39 -1.87 0.22 114.58 118.91 2cqp h GLU 975 Ca -0.34 -0.38 -0.63 0.00 0.34 0.00 0.00 59.36 58.36 2cqp h GLU 975 Cb 1.17 0.08 -0.19 0.00 -0.10 0.00 0.00 28.75 29.70 2cqp h GLU 975 CO 0.49 1.01 -0.60 -1.12 -1.16 0.00 0.00 179.01 177.63 2cqp s SER 976 N -6.99 5.34 0.08 1.42 0.01 -1.26 -4.76 113.70 107.54 2cqp s SER 976 Ca -0.07 -0.03 -0.21 0.00 1.31 0.00 0.00 55.95 56.96 2cqp s SER 976 Cb 0.10 -1.92 -0.11 0.00 0.21 0.00 0.00 66.02 64.31 2cqp s SER 976 CO 0.85 0.12 1.58 -0.09 0.41 0.00 0.00 173.24 176.11 2cqp h ARG 977 N 7.06 0.26 -0.63 12.44 2.43 -1.95 -2.29 114.38 131.70 2cqp h ARG 977 Ca -0.36 -0.06 0.08 0.00 -0.81 0.00 0.00 59.98 58.83 2cqp h ARG 977 Cb 1.17 -0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 30.65 2cqp h ARG 977 CO 0.66 0.39 0.42 -0.44 -1.51 0.00 0.00 179.97 179.48 2cqp h ASP 978 N 0.08 0.50 -0.12 -3.80 3.32 -1.99 -2.08 116.42 112.32 2cqp h ASP 978 Ca 0.05 0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.08 2cqp h ASP 978 Cb 0.24 -0.10 -0.00 0.00 0.22 0.00 0.00 39.33 39.68 2cqp h ASP 978 CO -0.00 0.31 -0.04 -0.33 -1.72 0.00 0.00 179.24 177.46 2cqp h GLU 979 N 0.56 0.25 -0.52 3.56 4.39 -1.91 -1.82 114.58 119.08 2cqp h GLU 979 Ca 0.28 -0.10 0.08 0.00 0.34 0.00 0.00 59.36 59.96 2cqp h GLU 979 Cb 0.38 -0.01 -0.06 0.00 -0.10 0.00 0.00 28.75 28.95 2cqp h GLU 979 CO -0.09 0.56 0.17 0.00 -1.16 0.00 0.00 179.01 178.49 2cqp h ALA 980 N 0.68 0.63 -0.46 3.43 0.00 -0.83 0.17 119.26 122.89 2cqp h ALA 980 Ca 0.03 0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 2cqp h ALA 980 Cb 0.47 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 2cqp h ALA 980 CO 0.01 -0.23 0.12 1.15 0.00 0.00 0.00 179.25 180.31 2cqp h THR 981 N 0.34 1.23 -0.32 0.00 2.02 -1.41 -1.40 112.91 113.37 2cqp h THR 981 Ca 0.25 -0.80 -0.01 0.00 0.77 0.00 0.00 66.41 66.63 2cqp h THR 981 Cb 0.30 0.88 -0.01 0.00 -1.74 0.00 0.00 68.15 67.57 2cqp h THR 981 CO -0.27 0.28 0.16 0.00 0.37 0.00 0.00 175.52 176.06 2cqp h ALA 982 N 0.98 0.41 -0.85 6.16 0.00 -0.68 -0.47 119.26 124.82 2cqp h ALA 982 Ca 0.14 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 2cqp h ALA 982 Cb 0.30 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 2cqp h ALA 982 CO -0.00 -0.03 0.46 0.00 0.00 0.00 0.00 179.25 179.68 2cqp h ALA 983 N 1.01 1.09 -0.03 0.00 0.00 -0.59 -0.67 119.26 120.07 2cqp h ALA 983 Ca 0.11 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 2cqp h ALA 983 Cb 0.12 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 2cqp h ALA 983 CO -0.01 0.60 0.00 0.28 0.00 0.00 0.00 179.25 180.12 2cqp h VAL 984 N 1.18 1.24 -0.43 0.00 2.07 -1.02 0.46 116.25 119.76 2cqp h VAL 984 Ca 0.30 -0.73 0.02 0.00 0.82 0.00 0.00 66.70 67.11 2cqp h VAL 984 Cb 0.04 1.69 -0.03 0.00 -1.52 0.00 0.00 31.29 31.47 2cqp h VAL 984 CO -0.05 0.19 0.26 0.40 0.02 0.00 0.00 177.57 178.40 2cqp h ILE 985 N -0.25 1.05 0.00 4.57 2.04 -0.94 1.90 117.51 125.88 2cqp h ILE 985 Ca 0.01 -0.18 -0.11 0.00 1.00 0.00 0.00 64.86 65.57 2cqp h ILE 985 Cb 0.31 0.48 -0.02 0.00 -0.74 0.00 0.00 36.82 36.86 2cqp h ILE 985 CO 0.00 0.10 -0.54 0.44 0.00 0.00 0.00 178.15 178.14 2cqp h ASP 986 N 0.52 0.00 -0.35 1.72 3.32 -1.10 -3.12 116.42 117.41 2cqp h ASP 986 Ca 0.17 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 57.06 2cqp h ASP 986 Cb 0.00 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 39.46 2cqp h ASP 986 CO -0.08 0.54 -0.05 0.18 -1.72 0.00 0.00 179.24 178.12 2cqp n LEU 987 N -3.60 4.12 -4.71 1.55 4.77 0.16 -4.97 117.00 114.33 2cqp n LEU 987 Ca -0.00 -3.65 -0.39 0.00 -0.03 0.00 0.00 56.01 51.94 2cqp n LEU 987 Cb 0.61 -0.62 -0.06 0.00 -2.33 0.00 0.00 43.42 41.02 2cqp n LEU 987 CO 0.40 1.16 0.26 0.21 -1.33 0.00 0.00 177.39 178.09 2cqp s ASN 988 N -2.43 6.75 -1.32 -1.43 3.84 0.64 -4.08 114.94 116.91 2cqp s ASN 988 Ca 0.44 0.90 -0.07 0.00 0.21 0.00 0.00 52.86 54.35 2cqp s ASN 988 Cb 0.40 -2.33 0.01 0.00 -0.55 0.00 0.00 41.25 38.78 2cqp s ASN 988 CO 0.01 -0.08 1.13 -0.67 -2.79 0.00 0.00 177.10 174.71 2cqp n ASP 989 N 3.94 -5.21 -4.74 -4.21 -0.08 -0.80 -4.96 116.55 100.49 2cqp n ASP 989 Ca -0.05 -0.57 -0.39 0.00 -1.51 0.00 0.00 54.79 52.27 2cqp n ASP 989 Cb 0.51 -5.04 -0.05 0.00 2.34 0.00 0.00 41.12 38.89 2cqp n ASP 989 CO 0.00 0.00 0.00 -0.13 0.12 0.00 0.00 177.20 177.19 2cqp s ARG 990 N -6.07 4.43 -1.03 -0.67 0.52 -1.19 -4.71 118.95 110.22 2cqp s ARG 990 Ca 0.43 0.91 -0.24 0.00 -0.52 0.00 0.00 55.73 56.32 2cqp s ARG 990 Cb -0.19 -3.38 -0.07 0.00 0.52 0.00 0.00 34.95 31.83 2cqp s ARG 990 CO 0.73 0.25 1.94 -1.25 0.02 0.00 0.00 175.30 176.99 2cqp s PRO 991 N 0.15 2.52 0.03 3.54 0.04 -1.26 -1.11 135.00 138.90 2cqp s PRO 991 Ca 0.36 -0.67 -0.24 0.00 0.04 0.00 0.00 61.00 60.49 2cqp s PRO 991 Cb -0.19 -5.14 -0.05 0.00 0.04 0.00 0.00 34.50 29.16 2cqp s PRO 991 CO 0.20 -3.66 0.73 0.42 0.04 0.00 0.00 177.00 174.73 2cqp s ILE 992 N 10.54 4.78 0.00 0.56 1.01 0.19 -4.78 121.20 133.51 2cqp s ILE 992 Ca 0.69 1.54 0.00 0.00 0.00 0.00 0.00 60.65 62.88 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 0.05 0.37 0.00 0.61 0.00 0.00 0.00 174.94 175.98 2cqp n GLY 993 N 2.43 0.29 0.00 6.18 0.00 -1.26 -0.09 105.19 112.74 2cqp n GLY 993 Ca -0.03 0.57 0.00 0.00 0.00 0.00 0.00 46.02 46.56 2cqp n GLY 993 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2cqp n SER 994 N 3.64 0.30 -4.22 1.61 3.41 -1.26 -5.08 113.62 112.02 2cqp n SER 994 Ca 0.00 -0.81 -0.13 0.00 -0.26 0.00 0.00 58.87 57.68 2cqp n SER 994 Cb 0.00 0.10 -0.10 0.00 -0.26 0.00 0.00 64.21 63.95 2cqp n SER 994 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2cqp s ARG 995 N -0.10 1.00 0.14 4.33 0.52 0.87 -5.13 118.95 120.59 2cqp s ARG 995 Ca 0.00 -1.44 -0.18 0.00 -0.52 0.00 0.00 55.73 53.59 2cqp s ARG 995 Cb 0.00 -0.37 -0.07 0.00 0.52 0.00 0.00 34.95 35.03 2cqp s ARG 995 CO 0.00 -0.02 0.60 0.15 0.02 0.00 0.00 175.30 176.05 2cqp s LYS 996 N -3.83 4.14 0.09 3.54 1.02 -1.26 0.56 119.74 124.01 2cqp s LYS 996 Ca 0.17 0.69 0.03 0.00 0.02 0.00 0.00 55.97 56.88 2cqp s LYS 996 Cb 0.05 -3.04 -0.04 0.00 -0.52 0.00 0.00 37.83 34.27 2cqp s LYS 996 CO -0.00 0.52 0.12 0.14 -0.92 0.00 0.00 175.35 175.21 2cqp s VAL 997 N -1.34 4.69 -0.12 3.17 -7.23 -0.27 -4.61 120.40 114.69 2cqp s VAL 997 Ca 0.36 -0.76 0.01 0.00 -1.81 0.00 0.00 61.98 59.78 2cqp s VAL 997 Cb -0.17 -3.29 -0.01 0.00 0.56 0.00 0.00 36.38 33.46 2cqp s VAL 997 CO 0.20 0.08 -0.16 -0.75 -0.31 0.00 0.00 175.10 174.16 2cqp s LYS 998 N -2.56 3.29 -0.13 4.82 2.47 -0.31 -1.90 119.74 125.42 2cqp s LYS 998 Ca 0.31 -0.74 -0.01 0.00 -1.56 0.00 0.00 55.97 53.97 2cqp s LYS 998 Cb -0.12 -2.54 -0.02 0.00 -1.46 0.00 0.00 37.83 33.69 2cqp s LYS 998 CO 0.23 0.20 -0.10 -0.51 0.16 0.00 0.00 175.35 175.34 2cqp s LEU 999 N 0.35 2.92 0.09 5.43 1.43 -1.26 -1.54 118.68 126.11 2cqp s LEU 999 Ca -0.13 -0.23 0.09 0.00 -1.03 0.00 0.00 54.13 52.82 2cqp s LEU 999 Cb -0.16 -1.67 -0.03 0.00 0.03 0.00 0.00 46.19 44.36 2cqp s LEU 999 CO 0.07 0.20 -0.22 -0.69 0.23 0.00 0.00 176.35 175.93 2cqp s VAL 1000N 0.18 1.81 -0.12 -1.59 1.01 -0.73 -4.95 120.40 116.01 2cqp s VAL 1000Ca -0.05 -1.51 -0.19 0.00 0.00 0.00 0.00 61.98 60.22 2cqp s VAL 1000Cb -0.15 -1.62 -0.04 0.00 0.00 0.00 0.00 36.38 34.57 2cqp s VAL 1000CO 0.04 0.03 0.51 -0.76 0.00 0.00 0.00 175.10 174.92 2cqp s LEU 1001N -1.78 4.27 0.11 3.92 1.43 -1.26 -1.81 118.68 123.57 2cqp s LEU 1001Ca 0.08 0.86 -0.19 0.00 -1.03 0.00 0.00 54.13 53.85 2cqp s LEU 1001Cb -0.10 -2.75 -0.06 0.00 0.03 0.00 0.00 46.19 43.31 2cqp s LEU 1001CO 0.04 -0.03 1.70 1.23 0.23 0.00 0.00 176.35 179.52 2cqp h GLY 1002N 6.82 0.37 -5.84 -3.19 0.00 -0.87 -3.42 103.07 96.95 2cqp h GLY 1002Ca -0.40 -0.18 -0.66 0.00 0.00 0.00 0.00 47.33 46.09 2cqp h GLY 1002CO 0.75 0.17 -0.79 -0.45 0.00 0.00 0.00 176.54 176.22 2cqp s SER 1003N -5.56 3.78 0.00 0.19 0.15 -1.26 -4.86 113.70 106.13 2cqp s SER 1003Ca -0.13 -0.42 0.00 0.00 0.70 0.00 0.00 55.95 56.09 2cqp s SER 1003Cb 0.08 -1.58 0.00 0.00 -1.71 0.00 0.00 66.02 62.81 2cqp s SER 1003CO 0.71 0.11 0.00 0.61 1.20 0.00 0.00 173.24 175.87 2cqp n GLY 1004N 3.90 0.64 0.07 9.45 0.00 -1.26 -4.90 105.19 113.08 2cqp n GLY 1004Ca -0.19 -2.15 -0.13 0.00 0.00 0.00 0.00 46.02 43.56 2cqp n GLY 1004CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2cqp h PRO 1005N 2.79 -0.04 -4.69 1.61 0.13 -1.92 -3.34 132.00 126.53 2cqp h PRO 1005Ca 0.00 0.00 -0.72 0.00 -0.87 0.00 0.00 66.00 64.41 2cqp h PRO 1005Cb 0.00 0.01 -0.20 0.00 0.13 0.00 0.00 31.00 30.94 2cqp h PRO 1005CO 0.00 0.43 0.63 -1.12 -0.23 0.00 0.00 178.00 177.71 2cqp s SER 1006N -5.63 6.67 -1.27 1.44 0.01 -1.26 -4.60 113.70 109.06 2cqp s SER 1006Ca -0.16 -2.24 -0.10 0.00 1.31 0.00 0.00 55.95 54.76 2cqp s SER 1006Cb 0.02 -2.35 0.10 0.00 0.21 0.00 0.00 66.02 64.00 2cqp s SER 1006CO 0.65 -0.92 0.26 -1.54 0.41 0.00 0.00 173.24 172.10 2cqp n SER 1007N 5.81 -0.49 0.00 2.44 3.41 -1.26 -5.05 113.62 118.48 2cqp n SER 1007Ca 0.21 -0.92 0.00 0.00 -0.26 0.00 0.00 58.87 57.91 2cqp n SER 1007Cb 0.48 -1.16 0.00 0.00 -0.26 0.00 0.00 64.21 63.28 2cqp n SER 1007CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49