#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 5.02 0.64 1.61 0.01 -1.26 -5.09 113.70 114.62 2cqp s SER 912 Ca 0.00 -2.17 -0.18 0.00 1.31 0.00 0.00 55.95 54.91 2cqp s SER 912 Cb 0.00 -1.74 -0.02 0.00 0.21 0.00 0.00 66.02 64.46 2cqp s SER 912 CO 0.00 -0.46 1.16 -0.24 0.41 0.00 0.00 173.24 174.11 2cqp n SER 913 N 4.33 1.54 -0.34 2.44 2.88 -1.26 -4.77 113.62 118.44 2cqp n SER 913 Ca 0.01 0.81 0.03 0.00 -1.33 0.00 0.00 58.87 58.40 2cqp n SER 913 Cb 0.41 -1.49 -0.02 0.00 -0.75 0.00 0.00 64.21 62.36 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 1.07 -2.86 1.04 0.46 0.00 -1.26 -5.01 105.19 98.64 2cqp n GLY 914 Ca 0.15 -1.32 0.00 0.00 0.00 0.00 0.00 46.02 44.85 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 -2.38 0.76 -4.41 1.61 7.64 -1.26 -5.00 113.62 110.58 2cqp n SER 915 Ca -0.02 0.10 -0.55 0.00 1.01 0.00 0.00 58.87 59.41 2cqp n SER 915 Cb 0.15 -0.23 -0.09 0.00 -1.01 0.00 0.00 64.21 63.03 2cqp n SER 915 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2cqp n SER 916 N -3.34 1.63 -3.65 6.43 3.41 -1.26 -4.84 113.62 112.00 2cqp n SER 916 Ca 0.00 0.59 -0.02 0.00 -0.26 0.00 0.00 58.87 59.18 2cqp n SER 916 Cb 0.15 -1.11 -0.02 0.00 -0.26 0.00 0.00 64.21 62.98 2cqp n SER 916 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2cqp s GLY 917 N 6.36 -0.19 -0.07 5.00 0.00 -1.26 -5.16 107.32 112.00 2cqp s GLY 917 Ca 1.12 1.95 0.02 0.00 0.00 0.00 0.00 44.72 47.82 2cqp s GLY 917 CO 0.58 0.65 -0.13 0.00 0.00 0.00 0.00 173.10 174.20 2cqp s ALA 918 N -2.00 2.71 -0.72 3.20 0.00 -1.26 -5.07 121.76 118.62 2cqp s ALA 918 Ca 0.12 -0.94 -0.26 0.00 0.00 0.00 0.00 51.96 50.88 2cqp s ALA 918 Cb -0.01 -1.07 0.04 0.00 0.00 0.00 0.00 23.12 22.08 2cqp s ALA 918 CO -0.02 0.49 1.19 0.45 0.00 0.00 0.00 175.76 177.87 2cqp s SER 919 N -0.51 6.17 -0.77 0.00 0.15 -1.26 -4.97 113.70 112.51 2cqp s SER 919 Ca 0.07 -0.63 -0.18 0.00 0.70 0.00 0.00 55.95 55.91 2cqp s SER 919 Cb -0.12 -2.52 0.14 0.00 -1.71 0.00 0.00 66.02 61.82 2cqp s SER 919 CO 0.02 -1.71 0.88 -0.55 1.20 0.00 0.00 173.24 173.07 2cqp s SER 920 N 3.74 6.49 0.02 5.45 0.15 -1.26 -5.02 113.70 123.27 2cqp s SER 920 Ca 0.31 -1.96 -0.30 0.00 0.70 0.00 0.00 55.95 54.70 2cqp s SER 920 Cb -0.11 -2.32 -0.07 0.00 -1.71 0.00 0.00 66.02 61.82 2cqp s SER 920 CO 0.13 -0.97 1.61 -0.83 1.20 0.00 0.00 173.24 174.38 2cqp s GLY 921 N 3.25 1.61 -0.27 9.45 0.00 -1.26 -4.98 107.32 115.11 2cqp s GLY 921 Ca 0.21 1.06 -0.25 0.00 0.00 0.00 0.00 44.72 45.74 2cqp s GLY 921 CO -0.03 2.87 0.79 0.54 0.00 0.00 0.00 173.10 177.27 2cqp s LYS 922 N 3.07 0.76 1.11 2.90 1.02 -1.26 -5.07 119.74 122.28 2cqp s LYS 922 Ca 0.72 0.91 -0.16 0.00 0.02 0.00 0.00 55.97 57.46 2cqp s LYS 922 Cb -0.36 0.37 0.24 0.00 -0.52 0.00 0.00 37.83 37.56 2cqp s LYS 922 CO 0.30 -0.09 1.10 -1.25 -0.92 0.00 0.00 175.35 174.49 2cqp s PRO 923 N 0.37 -0.51 0.00 -1.68 0.04 -1.26 -4.61 135.00 127.35 2cqp s PRO 923 Ca 0.01 0.19 0.00 0.00 0.04 0.00 0.00 61.00 61.24 2cqp s PRO 923 Cb -0.05 -1.66 0.00 0.00 0.04 0.00 0.00 34.50 32.83 2cqp s PRO 923 CO -0.01 -3.29 0.00 0.41 0.04 0.00 0.00 177.00 174.15 2cqp n GLY 924 N -1.00 0.67 3.67 0.56 0.00 -1.26 -5.01 105.19 102.83 2cqp n GLY 924 Ca 0.09 -1.74 -0.29 0.00 0.00 0.00 0.00 46.02 44.09 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 -1.38 0.38 -0.31 1.61 0.04 -1.26 -4.80 135.00 129.27 2cqp s PRO 925 Ca 0.00 0.51 -0.17 0.00 0.04 0.00 0.00 61.00 61.38 2cqp s PRO 925 Cb 0.00 -1.73 -0.02 0.00 0.04 0.00 0.00 34.50 32.79 2cqp s PRO 925 CO 0.00 -2.77 0.46 0.99 0.04 0.00 0.00 177.00 175.73 2cqp s THR 926 N -2.96 5.08 -0.18 1.26 2.01 -0.13 -4.84 115.64 115.87 2cqp s THR 926 Ca 0.65 0.46 -0.19 0.00 0.31 0.00 0.00 61.69 62.93 2cqp s THR 926 Cb -0.19 -3.86 -0.03 0.00 0.01 0.00 0.00 72.50 68.43 2cqp s THR 926 CO 0.58 -0.06 0.53 -0.63 -0.69 0.00 0.00 174.62 174.35 2cqp s ILE 927 N 2.26 5.11 0.04 1.82 -1.09 -1.26 -1.17 121.20 126.91 2cqp s ILE 927 Ca 0.17 0.99 0.02 0.00 -2.23 0.00 0.00 60.65 59.60 2cqp s ILE 927 Cb -0.16 -3.85 -0.04 0.00 -1.58 0.00 0.00 42.46 36.83 2cqp s ILE 927 CO 0.12 0.20 0.08 -0.63 -1.23 0.00 0.00 174.94 173.47 2cqp s ILE 928 N 1.46 4.59 -0.13 2.92 1.01 -0.05 -0.60 121.20 130.39 2cqp s ILE 928 Ca 0.25 -0.62 -0.02 0.00 0.00 0.00 0.00 60.65 60.27 2cqp s ILE 928 Cb -0.15 -3.16 -0.02 0.00 0.01 0.00 0.00 42.46 39.14 2cqp s ILE 928 CO 0.10 0.23 -0.08 -0.54 0.00 0.00 0.00 174.94 174.65 2cqp s LYS 929 N -2.09 3.43 -0.18 2.79 1.02 -0.80 -2.13 119.74 121.77 2cqp s LYS 929 Ca 0.26 -0.59 -0.03 0.00 0.02 0.00 0.00 55.97 55.63 2cqp s LYS 929 Cb -0.12 -2.75 -0.02 0.00 -0.52 0.00 0.00 37.83 34.42 2cqp s LYS 929 CO 0.18 0.29 -0.06 0.08 -0.92 0.00 0.00 175.35 174.92 2cqp s VAL 930 N 0.19 3.46 0.31 3.17 1.01 0.74 -2.01 120.40 127.27 2cqp s VAL 930 Ca -0.05 -0.49 0.03 0.00 0.00 0.00 0.00 61.98 61.47 2cqp s VAL 930 Cb -0.14 -2.53 -0.05 0.00 0.00 0.00 0.00 36.38 33.65 2cqp s VAL 930 CO 0.04 0.46 0.09 -1.58 0.00 0.00 0.00 175.10 174.11 2cqp s GLN 931 N 0.91 1.60 -1.07 2.72 0.74 -0.67 -1.89 119.66 122.00 2cqp s GLN 931 Ca -0.01 -1.89 -0.02 0.00 0.05 0.00 0.00 55.36 53.49 2cqp s GLN 931 Cb -0.15 -0.57 0.00 0.00 1.10 0.00 0.00 33.01 33.40 2cqp s GLN 931 CO 0.01 -0.28 0.90 -1.71 -0.55 0.00 0.00 175.29 173.66 2cqp n ASN 932 N -0.70 -2.88 -4.39 6.67 4.05 -1.20 -1.02 115.26 115.79 2cqp n ASN 932 Ca -0.02 -0.52 -0.34 0.00 0.45 0.00 0.00 54.58 54.15 2cqp n ASN 932 Cb 0.66 -4.49 -0.13 0.00 1.23 0.00 0.00 39.78 37.05 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 -5.39 3.48 0.76 1.20 -1.94 -0.79 -3.90 119.30 112.72 2cqp s MET 933 Ca 0.11 -0.60 -0.11 0.00 -1.71 0.00 0.00 55.69 53.38 2cqp s MET 933 Cb -0.05 -2.89 0.05 0.00 2.01 0.00 0.00 34.83 33.95 2cqp s MET 933 CO 0.63 0.05 1.09 -1.25 -0.01 0.00 0.00 175.02 175.53 2cqp s PRO 934 N 0.83 2.31 0.45 2.03 0.04 -1.26 -3.79 135.00 135.61 2cqp s PRO 934 Ca -0.02 1.20 0.15 0.00 0.04 0.00 0.00 61.00 62.37 2cqp s PRO 934 Cb -0.15 -1.90 1.08 0.00 0.04 0.00 0.00 34.50 33.57 2cqp s PRO 934 CO 0.01 -1.60 2.01 0.74 0.04 0.00 0.00 177.00 178.20 2cqp h PHE 935 N -0.99 0.35 -0.54 0.56 0.04 -1.99 -0.63 116.94 113.74 2cqp h PHE 935 Ca -0.44 0.01 0.14 0.00 2.80 0.00 0.00 57.97 60.48 2cqp h PHE 935 Cb 1.23 -0.12 -0.03 0.00 2.20 0.00 0.00 35.95 39.24 2cqp h PHE 935 CO 0.57 0.18 0.38 1.79 -0.60 0.00 0.00 178.31 180.63 2cqp h THR 936 N 0.34 0.77 -2.56 -1.55 1.35 -2.00 -3.43 112.91 105.83 2cqp h THR 936 Ca 0.23 -0.03 -0.60 0.00 -0.55 0.00 0.00 66.41 65.46 2cqp h THR 936 Cb 0.48 0.66 0.14 0.00 -1.73 0.00 0.00 68.15 67.71 2cqp h THR 936 CO -0.06 0.02 -0.23 0.52 -0.25 0.00 0.00 175.52 175.53 2cqp n VAL 937 N -4.41 2.04 -3.96 6.82 0.31 -0.25 -4.99 118.33 113.89 2cqp n VAL 937 Ca 0.10 -0.50 -0.10 0.00 -0.01 0.00 0.00 64.34 63.83 2cqp n VAL 937 Cb 0.55 -0.72 -0.03 0.00 -0.91 0.00 0.00 33.84 32.72 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 -0.90 0.10 0.24 4.52 0.01 -1.26 -5.02 113.70 111.39 2cqp s SER 938 Ca 0.64 -1.03 -0.06 0.00 1.31 0.00 0.00 55.95 56.81 2cqp s SER 938 Cb -0.59 0.67 0.32 0.00 0.21 0.00 0.00 66.02 66.63 2cqp s SER 938 CO 0.57 -1.30 1.84 0.40 0.41 0.00 0.00 173.24 175.17 2cqp h ILE 939 N 2.14 1.02 -0.32 1.44 2.04 -1.98 0.20 117.51 122.05 2cqp h ILE 939 Ca -0.26 -0.31 -0.02 0.00 1.00 0.00 0.00 64.86 65.27 2cqp h ILE 939 Cb 1.25 0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 37.34 2cqp h ILE 939 CO 0.35 0.17 0.14 0.44 0.00 0.00 0.00 178.15 179.24 2cqp h ASP 940 N 0.91 0.44 -0.25 1.72 5.19 -1.99 0.40 116.42 122.84 2cqp h ASP 940 Ca 0.36 -0.16 -0.03 0.00 -0.62 0.00 0.00 57.03 56.58 2cqp h ASP 940 Cb 0.19 -0.11 -0.01 0.00 0.18 0.00 0.00 39.33 39.58 2cqp h ASP 940 CO -0.18 0.47 0.02 -0.33 -3.12 0.00 0.00 179.24 176.11 2cqp h GLU 941 N 0.38 0.43 -0.35 3.56 4.39 -1.81 -2.17 114.58 119.00 2cqp h GLU 941 Ca 0.11 -0.12 -0.00 0.00 0.34 0.00 0.00 59.36 59.68 2cqp h GLU 941 Cb 0.17 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 28.75 2cqp h GLU 941 CO -0.01 0.57 0.21 0.82 -1.16 0.00 0.00 179.01 179.44 2cqp h ILE 942 N 0.23 1.12 -0.84 3.13 2.04 -0.53 0.11 117.51 122.77 2cqp h ILE 942 Ca 0.07 -0.29 0.05 0.00 1.00 0.00 0.00 64.86 65.69 2cqp h ILE 942 Cb 0.36 0.68 -0.05 0.00 -0.74 0.00 0.00 36.82 37.07 2cqp h ILE 942 CO 0.01 0.12 0.53 -0.07 0.00 0.00 0.00 178.15 178.74 2cqp h LEU 943 N 0.46 0.85 -0.57 1.44 3.38 -0.86 -1.75 115.31 118.25 2cqp h LEU 943 Ca 0.13 0.01 -0.16 0.00 0.09 0.00 0.00 57.88 57.95 2cqp h LEU 943 Cb 0.02 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 2cqp h LEU 943 CO -0.02 0.57 -0.60 -0.78 0.09 0.00 0.00 178.44 177.69 2cqp h ASP 944 N 1.00 0.41 -0.61 -0.43 3.58 -1.05 -3.03 116.42 116.28 2cqp h ASP 944 Ca 0.35 -0.24 -0.02 0.00 0.42 0.00 0.00 57.03 57.54 2cqp h ASP 944 Cb 0.08 -0.12 -0.03 0.00 1.72 0.00 0.00 39.33 40.98 2cqp h ASP 944 CO -0.14 0.92 0.31 0.15 -2.88 0.00 0.00 179.24 177.60 2cqp h PHE 945 N 0.27 0.89 -0.59 0.28 3.04 0.03 -1.64 116.94 119.23 2cqp h PHE 945 Ca -0.01 -0.03 -0.15 0.00 3.98 0.00 0.00 57.97 61.77 2cqp h PHE 945 Cb 1.13 -0.28 -0.09 0.00 2.56 0.00 0.00 35.95 39.27 2cqp h PHE 945 CO 0.03 0.65 0.19 1.19 -2.02 0.00 0.00 178.31 178.35 2cqp n PHE 946 N -4.35 1.99 -0.68 0.41 3.72 -0.77 -4.98 117.46 112.80 2cqp n PHE 946 Ca 0.06 -0.95 -0.31 0.00 -0.05 0.00 0.00 57.45 56.20 2cqp n PHE 946 Cb 0.13 -0.57 0.18 0.00 -0.94 0.00 0.00 39.48 38.27 2cqp n PHE 946 CO 0.00 0.00 0.00 -0.47 -0.05 0.00 0.00 176.76 176.24 2cqp s TYR 947 N -2.52 1.59 0.00 1.38 5.04 -0.62 -3.05 117.35 119.17 2cqp s TYR 947 Ca 0.45 1.71 0.00 0.00 -2.44 0.00 0.00 57.07 56.80 2cqp s TYR 947 Cb 0.36 -3.31 0.00 0.00 0.35 0.00 0.00 41.96 39.36 2cqp s TYR 947 CO 0.11 -2.95 0.00 0.41 -1.34 0.00 0.00 175.55 171.79 2cqp n GLY 948 N 0.27 1.16 3.75 8.97 0.00 -1.26 -4.94 105.19 113.15 2cqp n GLY 948 Ca 0.11 -0.03 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.03 3.76 -1.04 1.61 2.02 -1.17 -4.95 117.35 117.54 2cqp s TYR 949 Ca 0.00 1.46 -0.25 0.00 -0.37 0.00 0.00 57.07 57.91 2cqp s TYR 949 Cb 0.00 -2.78 -0.13 0.00 -0.40 0.00 0.00 41.96 38.65 2cqp s TYR 949 CO 0.00 0.33 2.06 -0.65 -1.57 0.00 0.00 175.55 175.72 2cqp s GLN 950 N -0.25 1.97 -0.20 -0.62 -0.21 -1.26 -4.90 119.66 114.18 2cqp s GLN 950 Ca 0.37 -0.53 -0.29 0.00 0.02 0.00 0.00 55.36 54.93 2cqp s GLN 950 Cb -0.21 -5.06 -0.00 0.00 1.00 0.00 0.00 33.01 28.74 2cqp s GLN 950 CO 0.23 -4.40 1.15 0.08 -2.12 0.00 0.00 175.29 170.23 2cqp s VAL 951 N 13.22 4.48 0.13 1.09 1.01 -1.26 -4.73 120.40 134.34 2cqp s VAL 951 Ca 0.76 1.78 -0.35 0.00 0.00 0.00 0.00 61.98 64.17 2cqp s VAL 951 Cb -0.05 -4.16 -0.16 0.00 0.00 0.00 0.00 36.38 32.01 2cqp s VAL 951 CO 0.11 -0.17 1.27 -0.38 0.00 0.00 0.00 175.10 175.93 2cqp n ILE 952 N 5.37 0.43 -2.10 2.22 5.41 -1.25 -4.84 119.36 124.60 2cqp n ILE 952 Ca 0.13 -0.11 -0.43 0.00 1.00 0.00 0.00 62.75 63.34 2cqp n ILE 952 Cb 0.45 -0.86 -0.03 0.00 -0.71 0.00 0.00 39.64 38.49 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 0.08 3.54 0.00 0.38 0.04 -1.26 -2.79 135.00 134.99 2cqp s PRO 953 Ca 0.79 1.43 0.00 0.00 0.04 0.00 0.00 61.00 63.25 2cqp s PRO 953 Cb -0.89 -4.11 0.00 0.00 0.04 0.00 0.00 34.50 29.53 2cqp s PRO 953 CO 0.49 -1.61 0.00 0.41 0.04 0.00 0.00 177.00 176.33 2cqp n GLY 954 N 5.11 1.27 0.28 0.56 0.00 -1.26 -5.02 105.19 106.14 2cqp n GLY 954 Ca 0.20 -0.35 -0.18 0.00 0.00 0.00 0.00 46.02 45.69 2cqp n GLY 954 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2cqp n SER 955 N 0.78 1.68 -3.29 1.61 3.41 -1.12 -4.97 113.62 111.73 2cqp n SER 955 Ca 0.00 0.29 -0.47 0.00 -0.26 0.00 0.00 58.87 58.43 2cqp n SER 955 Cb 0.20 -0.67 -0.08 0.00 -0.26 0.00 0.00 64.21 63.40 2cqp n SER 955 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2cqp n VAL 956 N -4.13 0.00 -4.08 -3.33 0.31 -1.26 -4.69 118.33 101.15 2cqp n VAL 956 Ca -0.32 0.00 -0.32 0.00 -0.01 0.00 0.00 64.34 63.69 2cqp n VAL 956 Cb 0.67 -0.37 -0.15 0.00 -0.91 0.00 0.00 33.84 33.08 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 1.15 4.40 -0.05 0.00 1.43 -1.26 -0.70 118.68 123.64 2cqp s LEU 958 Ca -0.05 1.57 -0.13 0.00 -1.03 0.00 0.00 54.13 54.50 2cqp s LEU 958 Cb -0.18 -3.44 -0.05 0.00 0.03 0.00 0.00 46.19 42.55 2cqp s LEU 958 CO -0.07 -0.16 0.32 -0.75 0.23 0.00 0.00 176.35 175.92 2cqp s LYS 959 N 0.61 3.83 0.34 1.70 2.20 -0.55 -4.99 119.74 122.88 2cqp s LYS 959 Ca 0.46 0.23 0.04 0.00 -0.36 0.00 0.00 55.97 56.33 2cqp s LYS 959 Cb -0.21 -3.24 -0.05 0.00 -1.51 0.00 0.00 37.83 32.82 2cqp s LYS 959 CO 0.26 0.66 0.07 0.71 -0.36 0.00 0.00 175.35 176.69 2cqp s TYR 960 N -0.86 1.90 0.54 4.03 2.02 -1.26 -1.30 117.35 122.43 2cqp s TYR 960 Ca 0.20 -1.04 0.09 0.00 -0.37 0.00 0.00 57.07 55.95 2cqp s TYR 960 Cb -0.15 -1.24 0.09 0.00 -0.40 0.00 0.00 41.96 40.26 2cqp s TYR 960 CO 0.10 -0.07 0.75 0.27 -1.57 0.00 0.00 175.55 175.02 2cqp n ASN 961 N -0.82 1.99 -0.20 2.29 6.94 -0.44 -4.77 115.26 120.26 2cqp n ASN 961 Ca -0.03 -2.45 0.01 0.00 -0.02 0.00 0.00 54.58 52.09 2cqp n ASN 961 Cb 0.66 -0.39 0.11 0.00 -2.36 0.00 0.00 39.78 37.81 2cqp n ASN 961 CO 0.00 0.00 0.00 1.05 -1.03 0.00 0.00 177.26 177.28 2cqp h GLU 962 N 0.00 0.21 -0.51 -3.83 4.11 -2.02 -1.04 114.58 111.49 2cqp h GLU 962 Ca -0.26 -0.01 -0.03 0.00 0.07 0.00 0.00 59.36 59.13 2cqp h GLU 962 Cb 1.17 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 30.35 2cqp h GLU 962 CO 0.37 0.14 0.19 0.87 0.07 0.00 0.00 179.01 180.64 2cqp h LYS 963 N 0.21 0.77 0.00 1.06 1.79 -2.05 -3.47 116.57 114.89 2cqp h LYS 963 Ca 0.33 -0.15 0.00 0.00 -2.18 0.00 0.00 60.65 58.65 2cqp h LYS 963 Cb 0.51 -0.12 0.00 0.00 -1.58 0.00 0.00 32.23 31.04 2cqp h LYS 963 CO -0.45 0.70 0.00 0.41 -1.08 0.00 0.00 179.45 179.02 2cqp n GLY 964 N -0.76 1.25 3.43 3.86 0.00 -0.40 -5.13 105.19 107.44 2cqp n GLY 964 Ca 0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.70 2cqp n GLY 964 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2cqp n MET 965 N 0.00 -0.14 -2.24 1.61 2.81 -1.26 -4.28 117.12 113.62 2cqp n MET 965 Ca 0.00 0.01 -0.41 0.00 -1.81 0.00 0.00 57.70 55.49 2cqp n MET 965 Cb 0.00 -1.86 -0.03 0.00 -0.71 0.00 0.00 33.22 30.62 2cqp n MET 965 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 2cqp s PRO 966 N -3.43 4.43 -0.60 0.03 0.04 -1.26 -1.32 135.00 132.88 2cqp s PRO 966 Ca 0.59 2.05 -0.00 0.00 0.04 0.00 0.00 61.00 63.68 2cqp s PRO 966 Cb -0.24 -3.15 0.50 0.00 0.04 0.00 0.00 34.50 31.65 2cqp s PRO 966 CO 0.65 -0.13 1.98 0.25 0.04 0.00 0.00 177.00 179.79 2cqp n THR 967 N 1.68 3.49 -3.94 1.26 -2.24 -0.42 -4.82 114.28 109.29 2cqp n THR 967 Ca 0.02 -2.72 -0.34 0.00 -2.27 0.00 0.00 64.05 58.74 2cqp n THR 967 Cb 0.43 -0.98 -0.06 0.00 -2.10 0.00 0.00 70.33 67.61 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 -0.97 -0.35 2.99 3.38 0.00 -1.25 -4.87 105.19 104.12 2cqp n GLY 968 Ca 0.61 0.05 -0.11 0.00 0.00 0.00 0.00 46.02 46.58 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 -6.16 0.24 -0.04 1.61 2.02 -1.26 -1.89 118.70 113.23 2cqp s GLU 969 Ca 0.66 -0.26 -0.16 0.00 0.02 0.00 0.00 54.97 55.22 2cqp s GLU 969 Cb -0.38 0.10 0.03 0.00 0.10 0.00 0.00 34.13 33.98 2cqp s GLU 969 CO 0.80 -0.05 0.36 0.00 0.02 0.00 0.00 175.26 176.40 2cqp s ALA 970 N -0.79 -0.92 0.02 5.21 0.00 -0.79 -1.48 121.76 123.01 2cqp s ALA 970 Ca -0.09 0.55 0.08 0.00 0.00 0.00 0.00 51.96 52.50 2cqp s ALA 970 Cb -0.05 -0.03 -0.03 0.00 0.00 0.00 0.00 23.12 23.01 2cqp s ALA 970 CO 0.00 -0.26 -0.24 -1.64 0.00 0.00 0.00 175.76 173.62 2cqp s MET 971 N -1.09 1.96 0.11 0.00 -1.94 0.12 -0.18 119.30 118.27 2cqp s MET 971 Ca -0.11 -1.02 0.02 0.00 -1.71 0.00 0.00 55.69 52.86 2cqp s MET 971 Cb -0.04 -2.05 -0.04 0.00 2.01 0.00 0.00 34.83 34.70 2cqp s MET 971 CO 0.04 0.54 -0.06 0.14 -0.01 0.00 0.00 175.02 175.67 2cqp s VAL 972 N -0.77 0.73 0.07 -6.03 -7.23 -0.91 -0.03 120.40 106.23 2cqp s VAL 972 Ca 0.12 -1.95 0.08 0.00 -1.81 0.00 0.00 61.98 58.42 2cqp s VAL 972 Cb -0.10 -1.75 -0.03 0.00 0.56 0.00 0.00 36.38 35.06 2cqp s VAL 972 CO 0.02 -0.82 -0.23 0.00 -0.31 0.00 0.00 175.10 173.77 2cqp s ALA 973 N -3.61 1.94 -0.02 1.32 0.00 -1.26 -0.87 121.76 119.25 2cqp s ALA 973 Ca 0.14 -1.21 0.04 0.00 0.00 0.00 0.00 51.96 50.93 2cqp s ALA 973 Cb 0.05 -0.34 -0.01 0.00 0.00 0.00 0.00 23.12 22.83 2cqp s ALA 973 CO -0.03 0.43 -0.14 -0.06 0.00 0.00 0.00 175.76 175.96 2cqp s PHE 974 N -0.95 1.30 0.19 0.00 0.40 -0.32 -3.88 117.98 114.72 2cqp s PHE 974 Ca 0.09 -0.30 0.01 0.00 -0.60 0.00 0.00 56.93 56.12 2cqp s PHE 974 Cb -0.10 -0.87 0.09 0.00 0.51 0.00 0.00 43.02 42.66 2cqp s PHE 974 CO 0.03 -0.08 1.45 0.93 0.70 0.00 0.00 175.22 178.25 2cqp h GLU 975 N 6.06 0.32 -5.38 0.44 4.39 -1.88 -0.33 114.58 118.20 2cqp h GLU 975 Ca -0.34 -0.27 -0.64 0.00 0.34 0.00 0.00 59.36 58.46 2cqp h GLU 975 Cb 1.17 0.06 -0.21 0.00 -0.10 0.00 0.00 28.75 29.67 2cqp h GLU 975 CO 0.49 0.92 -0.66 -1.12 -1.16 0.00 0.00 179.01 177.47 2cqp s SER 976 N -6.95 4.84 0.09 1.42 0.01 -1.26 -4.78 113.70 107.07 2cqp s SER 976 Ca -0.05 -0.10 -0.22 0.00 1.31 0.00 0.00 55.95 56.90 2cqp s SER 976 Cb 0.11 -1.74 -0.12 0.00 0.21 0.00 0.00 66.02 64.47 2cqp s SER 976 CO 0.83 0.19 1.68 -0.09 0.41 0.00 0.00 173.24 176.25 2cqp h ARG 977 N 6.54 0.14 -0.95 12.44 2.43 -1.94 -2.06 114.38 130.98 2cqp h ARG 977 Ca -0.33 -0.02 0.07 0.00 -0.81 0.00 0.00 59.98 58.90 2cqp h ARG 977 Cb 1.19 -0.03 -0.07 0.00 -0.42 0.00 0.00 29.97 30.65 2cqp h ARG 977 CO 0.62 0.18 0.61 0.38 -1.51 0.00 0.00 179.97 180.26 2cqp h ASP 978 N 0.06 0.94 -0.44 -3.80 2.03 -1.99 -1.92 116.42 111.29 2cqp h ASP 978 Ca 0.03 0.01 -0.03 0.00 -0.73 0.00 0.00 57.03 56.32 2cqp h ASP 978 Cb 0.08 -0.19 -0.02 0.00 -0.83 0.00 0.00 39.33 38.38 2cqp h ASP 978 CO -0.01 0.59 0.17 -0.33 -1.03 0.00 0.00 179.24 178.64 2cqp h GLU 979 N 1.06 0.67 -0.15 4.15 5.08 -1.90 -0.38 114.58 123.10 2cqp h GLU 979 Ca 0.42 -0.12 0.03 0.00 -1.00 0.00 0.00 59.36 58.69 2cqp h GLU 979 Cb 0.24 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.36 2cqp h GLU 979 CO -0.17 0.62 -0.04 0.00 -1.00 0.00 0.00 179.01 178.41 2cqp h ALA 980 N 1.02 0.10 -0.48 3.43 0.00 -0.66 0.80 119.26 123.47 2cqp h ALA 980 Ca 0.15 0.06 -0.05 0.00 0.00 0.00 0.00 54.91 55.07 2cqp h ALA 980 Cb 0.20 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 2cqp h ALA 980 CO -0.01 -0.48 0.12 1.15 0.00 0.00 0.00 179.25 180.03 2cqp h THR 981 N -0.00 1.24 -0.79 0.00 2.02 -1.32 -2.19 112.91 111.85 2cqp h THR 981 Ca 0.07 -0.82 0.01 0.00 0.77 0.00 0.00 66.41 66.44 2cqp h THR 981 Cb 0.12 0.86 -0.04 0.00 -1.74 0.00 0.00 68.15 67.35 2cqp h THR 981 CO -0.16 0.29 0.53 0.00 0.37 0.00 0.00 175.52 176.55 2cqp h ALA 982 N 0.99 1.01 -0.63 6.16 0.00 -0.73 -0.20 119.26 125.85 2cqp h ALA 982 Ca 0.15 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 2cqp h ALA 982 Cb 0.32 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 2cqp h ALA 982 CO 0.00 0.42 0.22 0.00 0.00 0.00 0.00 179.25 179.89 2cqp h ALA 983 N 1.29 0.82 -0.01 0.00 0.00 -0.67 -0.74 119.26 119.95 2cqp h ALA 983 Ca 0.29 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 2cqp h ALA 983 Cb -0.12 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.42 2cqp h ALA 983 CO -0.06 0.47 -0.00 0.28 0.00 0.00 0.00 179.25 179.93 2cqp h VAL 984 N 0.89 1.25 -0.37 0.00 2.07 -0.98 0.74 116.25 119.86 2cqp h VAL 984 Ca 0.21 -0.75 0.02 0.00 0.82 0.00 0.00 66.70 67.00 2cqp h VAL 984 Cb 0.25 1.73 -0.03 0.00 -1.52 0.00 0.00 31.29 31.73 2cqp h VAL 984 CO -0.01 0.20 0.20 0.40 0.02 0.00 0.00 177.57 178.37 2cqp h ILE 985 N -0.28 1.01 -0.00 4.57 2.04 -0.98 1.93 117.51 125.79 2cqp h ILE 985 Ca 0.00 -0.14 -0.16 0.00 1.00 0.00 0.00 64.86 65.57 2cqp h ILE 985 Cb 0.32 0.57 -0.02 0.00 -0.74 0.00 0.00 36.82 36.95 2cqp h ILE 985 CO 0.00 0.07 -0.74 0.44 0.00 0.00 0.00 178.15 177.93 2cqp h ASP 986 N 0.40 0.03 -0.50 1.72 5.19 -1.12 -3.16 116.42 118.98 2cqp h ASP 986 Ca 0.15 -0.02 -0.24 0.00 -0.62 0.00 0.00 57.03 56.30 2cqp h ASP 986 Cb 0.03 -0.01 -0.14 0.00 0.18 0.00 0.00 39.33 39.39 2cqp h ASP 986 CO -0.09 0.76 0.10 0.18 -3.12 0.00 0.00 179.24 177.07 2cqp n LEU 987 N -3.67 4.76 -4.75 1.55 4.77 0.26 -4.97 117.00 114.94 2cqp n LEU 987 Ca -0.01 -3.67 -0.39 0.00 -0.03 0.00 0.00 56.01 51.91 2cqp n LEU 987 Cb 0.72 -0.68 -0.06 0.00 -2.33 0.00 0.00 43.42 41.07 2cqp n LEU 987 CO 0.44 1.16 0.27 0.21 -1.33 0.00 0.00 177.39 178.14 2cqp s ASN 988 N -2.17 6.90 -1.44 -1.43 3.84 0.65 -4.09 114.94 117.20 2cqp s ASN 988 Ca 0.48 1.08 -0.09 0.00 0.21 0.00 0.00 52.86 54.54 2cqp s ASN 988 Cb 0.42 -2.35 0.05 0.00 -0.55 0.00 0.00 41.25 38.82 2cqp s ASN 988 CO 0.03 0.07 0.92 -0.67 -2.79 0.00 0.00 177.10 174.66 2cqp n ASP 989 N 3.01 -3.77 -4.72 -4.21 2.03 -0.92 -4.94 116.55 103.02 2cqp n ASP 989 Ca -0.07 -0.76 -0.39 0.00 0.52 0.00 0.00 54.79 54.09 2cqp n ASP 989 Cb 0.51 -4.09 -0.05 0.00 -0.72 0.00 0.00 41.12 36.77 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 -6.36 4.41 -0.77 -0.67 0.52 -1.18 -4.75 118.95 110.16 2cqp s ARG 990 Ca 0.43 0.78 -0.25 0.00 -0.52 0.00 0.00 55.73 56.17 2cqp s ARG 990 Cb -0.21 -3.44 -0.04 0.00 0.52 0.00 0.00 34.95 31.78 2cqp s ARG 990 CO 0.81 0.10 1.91 -1.25 0.02 0.00 0.00 175.30 176.89 2cqp s PRO 991 N 0.72 2.59 -0.20 3.54 0.04 -1.26 -0.95 135.00 139.48 2cqp s PRO 991 Ca 0.35 0.13 -0.18 0.00 0.04 0.00 0.00 61.00 61.34 2cqp s PRO 991 Cb -0.17 -4.75 -0.03 0.00 0.04 0.00 0.00 34.50 29.58 2cqp s PRO 991 CO 0.16 -3.08 0.48 0.42 0.04 0.00 0.00 177.00 175.02 2cqp s ILE 992 N 9.63 5.14 0.00 0.56 1.01 0.26 -4.82 121.20 132.97 2cqp s ILE 992 Ca 0.69 0.87 0.00 0.00 0.00 0.00 0.00 60.65 62.21 2cqp s ILE 992 Cb -0.09 -3.80 0.00 0.00 0.01 0.00 0.00 42.46 38.57 2cqp s ILE 992 CO 0.09 0.20 0.00 0.61 0.00 0.00 0.00 174.94 175.84 2cqp n GLY 993 N 3.91 0.17 0.00 6.18 0.00 -1.26 -0.50 105.19 113.70 2cqp n GLY 993 Ca -0.06 0.71 0.00 0.00 0.00 0.00 0.00 46.02 46.67 2cqp n GLY 993 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2cqp n SER 994 N 3.28 0.29 -4.14 1.61 2.88 -1.26 -5.07 113.62 111.19 2cqp n SER 994 Ca 0.00 -0.74 -0.14 0.00 -1.33 0.00 0.00 58.87 56.67 2cqp n SER 994 Cb 0.00 0.15 -0.11 0.00 -0.75 0.00 0.00 64.21 63.50 2cqp n SER 994 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 2cqp s ARG 995 N -0.15 0.76 0.09 -1.46 0.52 0.35 -5.12 118.95 113.94 2cqp s ARG 995 Ca 0.00 -1.07 -0.19 0.00 -0.52 0.00 0.00 55.73 53.95 2cqp s ARG 995 Cb 0.00 -0.44 -0.07 0.00 0.52 0.00 0.00 34.95 34.97 2cqp s ARG 995 CO 0.00 0.06 0.59 0.15 0.02 0.00 0.00 175.30 176.12 2cqp s LYS 996 N -2.57 4.21 0.07 3.54 1.02 -1.26 0.91 119.74 125.66 2cqp s LYS 996 Ca 0.02 0.76 0.00 0.00 0.02 0.00 0.00 55.97 56.77 2cqp s LYS 996 Cb -0.04 -3.20 -0.04 0.00 -0.52 0.00 0.00 37.83 34.03 2cqp s LYS 996 CO -0.01 0.61 0.21 0.14 -0.92 0.00 0.00 175.35 175.39 2cqp s VAL 997 N -1.16 5.37 -0.13 3.17 -7.23 -0.13 -4.64 120.40 115.65 2cqp s VAL 997 Ca 0.31 -0.41 -0.00 0.00 -1.81 0.00 0.00 61.98 60.06 2cqp s VAL 997 Cb -0.19 -3.63 -0.01 0.00 0.56 0.00 0.00 36.38 33.10 2cqp s VAL 997 CO 0.20 0.13 -0.13 -0.75 -0.31 0.00 0.00 175.10 174.24 2cqp s LYS 998 N -2.55 3.39 -0.16 4.82 2.36 -0.19 -2.17 119.74 125.24 2cqp s LYS 998 Ca 0.35 -0.68 -0.03 0.00 -2.55 0.00 0.00 55.97 53.06 2cqp s LYS 998 Cb -0.13 -2.65 -0.02 0.00 -1.05 0.00 0.00 37.83 33.98 2cqp s LYS 998 CO 0.28 0.19 -0.07 -0.51 1.55 0.00 0.00 175.35 176.80 2cqp s LEU 999 N 0.41 3.04 -0.03 5.43 1.43 -1.26 -1.67 118.68 126.04 2cqp s LEU 999 Ca -0.10 -0.22 0.06 0.00 -1.03 0.00 0.00 54.13 52.84 2cqp s LEU 999 Cb -0.16 -1.73 -0.01 0.00 0.03 0.00 0.00 46.19 44.32 2cqp s LEU 999 CO 0.05 0.14 -0.21 -0.69 0.23 0.00 0.00 176.35 175.87 2cqp s VAL 1000N 0.50 1.70 0.18 -1.59 1.01 -0.85 -4.96 120.40 116.39 2cqp s VAL 1000Ca -0.05 -0.90 -0.30 0.00 0.00 0.00 0.00 61.98 60.73 2cqp s VAL 1000Cb -0.15 -1.43 -0.08 0.00 0.00 0.00 0.00 36.38 34.72 2cqp s VAL 1000CO 0.03 0.48 1.25 -0.76 0.00 0.00 0.00 175.10 176.10 2cqp s LEU 1001N -0.31 4.43 0.00 3.92 1.43 -1.26 -1.90 118.68 124.99 2cqp s LEU 1001Ca 0.03 2.28 0.00 0.00 -1.03 0.00 0.00 54.13 55.41 2cqp s LEU 1001Cb -0.10 -3.61 0.00 0.00 0.03 0.00 0.00 46.19 42.51 2cqp s LEU 1001CO 0.01 -0.45 0.00 0.61 0.23 0.00 0.00 176.35 176.75 2cqp n GLY 1002N 2.37 -3.27 3.47 -3.19 0.00 0.23 -4.91 105.19 99.88 2cqp n GLY 1002Ca 0.06 -1.09 -0.34 0.00 0.00 0.00 0.00 46.02 44.64 2cqp n GLY 1002CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2cqp s SER 1003N -1.96 4.79 0.48 1.61 0.15 -1.26 -4.99 113.70 112.52 2cqp s SER 1003Ca 0.00 -0.17 0.00 0.00 0.70 0.00 0.00 55.95 56.48 2cqp s SER 1003Cb 0.00 -1.80 0.00 0.00 -1.71 0.00 0.00 66.02 62.51 2cqp s SER 1003CO 0.00 0.12 0.00 0.61 1.20 0.00 0.00 173.24 175.17 2cqp n GLY 1004N 3.84 -0.65 3.74 9.45 0.00 -1.26 -4.83 105.19 115.48 2cqp n GLY 1004Ca -0.17 -1.12 -0.41 0.00 0.00 0.00 0.00 46.02 44.32 2cqp n GLY 1004CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2cqp s PRO 1005N 0.00 4.40 0.06 1.61 0.04 -1.26 -4.95 135.00 134.91 2cqp s PRO 1005Ca 0.00 2.05 -0.38 0.00 0.04 0.00 0.00 61.00 62.71 2cqp s PRO 1005Cb 0.00 -3.18 -0.18 0.00 0.04 0.00 0.00 34.50 31.18 2cqp s PRO 1005CO 0.00 -0.21 1.25 -1.13 0.04 0.00 0.00 177.00 176.95 2cqp n SER 1006N 2.31 1.09 -4.75 6.66 3.41 -1.26 -4.85 113.62 116.23 2cqp n SER 1006Ca 0.05 1.13 -0.41 0.00 -0.26 0.00 0.00 58.87 59.38 2cqp n SER 1006Cb 0.43 -1.10 -0.02 0.00 -0.26 0.00 0.00 64.21 63.26 2cqp n SER 1006CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2cqp s SER 1007N 0.32 6.58 0.00 4.04 0.15 -1.26 -4.95 113.70 118.58 2cqp s SER 1007Ca 0.87 2.77 0.00 0.00 0.70 0.00 0.00 55.95 60.28 2cqp s SER 1007Cb -1.06 -2.63 0.00 0.00 -1.71 0.00 0.00 66.02 60.62 2cqp s SER 1007CO 0.50 -0.74 0.11 0.61 1.20 0.00 0.00 173.24 174.92