#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 -3.62 1.61 7.64 -1.26 -4.66 113.62 112.17 2cqp n SER 912 Ca 0.00 -1.19 -0.48 0.00 1.01 0.00 0.00 58.87 58.21 2cqp n SER 912 Cb 0.00 -1.51 -0.07 0.00 -1.01 0.00 0.00 64.21 61.62 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 -2.38 0.14 -4.93 6.43 2.88 -1.26 -4.91 113.62 109.59 2cqp n SER 913 Ca 0.02 0.93 -0.26 0.00 -1.33 0.00 0.00 58.87 58.23 2cqp n SER 913 Cb 0.48 -0.73 0.05 0.00 -0.75 0.00 0.00 64.21 63.26 2cqp n SER 913 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2cqp s GLY 914 N 0.36 1.67 -0.06 0.46 0.00 -1.26 -5.06 107.32 103.42 2cqp s GLY 914 Ca 0.74 -0.86 -0.21 0.00 0.00 0.00 0.00 44.72 44.38 2cqp s GLY 914 CO 0.48 -0.52 0.62 -0.45 0.00 0.00 0.00 173.10 173.23 2cqp s SER 915 N -4.43 6.91 0.33 1.64 0.15 -1.26 -5.04 113.70 112.00 2cqp s SER 915 Ca 0.57 1.09 -0.18 0.00 0.70 0.00 0.00 55.95 58.13 2cqp s SER 915 Cb -0.11 -2.37 0.04 0.00 -1.71 0.00 0.00 66.02 61.87 2cqp s SER 915 CO 0.44 -0.03 0.75 -0.94 1.20 0.00 0.00 173.24 174.66 2cqp s SER 916 N 0.51 -0.12 -0.27 5.45 1.04 -1.26 -5.15 113.70 113.90 2cqp s SER 916 Ca 0.33 -0.88 -0.00 0.00 0.48 0.00 0.00 55.95 55.87 2cqp s SER 916 Cb -0.17 0.79 0.14 0.00 0.10 0.00 0.00 66.02 66.88 2cqp s SER 916 CO 0.16 -1.51 0.37 -0.83 0.98 0.00 0.00 173.24 172.41 2cqp s GLY 917 N -3.00 -0.42 -1.26 7.32 0.00 -1.26 -5.07 107.32 103.63 2cqp s GLY 917 Ca 0.13 0.40 -0.16 0.00 0.00 0.00 0.00 44.72 45.09 2cqp s GLY 917 CO 0.09 2.80 1.60 0.00 0.00 0.00 0.00 173.10 177.60 2cqp n ALA 918 N 5.35 3.72 -3.28 3.20 0.00 -1.26 -4.95 120.51 123.30 2cqp n ALA 918 Ca -0.02 -4.04 -0.31 0.00 0.00 0.00 0.00 53.44 49.07 2cqp n ALA 918 Cb 0.49 -3.35 -0.17 0.00 0.00 0.00 0.00 19.45 16.43 2cqp n ALA 918 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2cqp s SER 919 N 3.55 2.98 -0.55 0.00 0.01 -1.26 -4.69 113.70 113.73 2cqp s SER 919 Ca 0.49 -0.54 -0.03 0.00 1.31 0.00 0.00 55.95 57.18 2cqp s SER 919 Cb 0.01 -1.36 0.00 0.00 0.21 0.00 0.00 66.02 64.88 2cqp s SER 919 CO 0.04 0.14 0.48 -0.24 0.41 0.00 0.00 173.24 174.07 2cqp n SER 920 N 3.59 -3.37 -3.57 2.44 2.88 -1.26 -5.04 113.62 109.29 2cqp n SER 920 Ca -0.19 -0.24 0.00 0.00 -1.33 0.00 0.00 58.87 57.11 2cqp n SER 920 Cb 0.53 -2.41 0.00 0.00 -0.75 0.00 0.00 64.21 61.57 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 -1.12 -1.49 3.60 0.46 0.00 -1.26 -5.04 105.19 100.35 2cqp n GLY 921 Ca -0.03 -1.23 -0.33 0.00 0.00 0.00 0.00 46.02 44.43 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 0.00 2.64 1.24 1.61 1.02 -1.26 -5.13 119.74 119.86 2cqp s LYS 922 Ca 0.00 -0.65 -0.20 0.00 0.02 0.00 0.00 55.97 55.14 2cqp s LYS 922 Cb 0.00 -2.55 0.30 0.00 -0.52 0.00 0.00 37.83 35.06 2cqp s LYS 922 CO 0.00 0.63 1.11 -1.25 -0.92 0.00 0.00 175.35 174.92 2cqp s PRO 923 N -1.21 -1.50 0.00 -1.68 0.04 -1.26 -5.03 135.00 124.36 2cqp s PRO 923 Ca 0.16 -0.16 0.00 0.00 0.04 0.00 0.00 61.00 61.03 2cqp s PRO 923 Cb -0.11 -1.57 0.00 0.00 0.04 0.00 0.00 34.50 32.86 2cqp s PRO 923 CO 0.05 -3.88 0.00 0.41 0.04 0.00 0.00 177.00 173.63 2cqp n GLY 924 N -0.93 3.08 3.65 0.56 0.00 -1.26 -5.11 105.19 105.19 2cqp n GLY 924 Ca 0.15 -1.92 -0.29 0.00 0.00 0.00 0.00 46.02 43.95 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 -2.28 -0.03 -0.27 1.61 0.04 -1.26 -5.00 135.00 127.80 2cqp s PRO 925 Ca 0.00 0.37 -0.18 0.00 0.04 0.00 0.00 61.00 61.23 2cqp s PRO 925 Cb 0.00 -1.70 -0.03 0.00 0.04 0.00 0.00 34.50 32.82 2cqp s PRO 925 CO 0.00 -3.01 0.50 0.99 0.04 0.00 0.00 177.00 175.52 2cqp s THR 926 N -2.97 5.08 -0.23 1.26 2.01 -0.69 -4.86 115.64 115.24 2cqp s THR 926 Ca 0.67 0.81 -0.12 0.00 0.31 0.00 0.00 61.69 63.36 2cqp s THR 926 Cb -0.17 -3.82 -0.05 0.00 0.01 0.00 0.00 72.50 68.47 2cqp s THR 926 CO 0.57 0.07 0.25 -0.63 -0.69 0.00 0.00 174.62 174.20 2cqp s ILE 927 N 2.29 5.30 -0.03 1.82 -1.09 -1.26 -0.12 121.20 128.10 2cqp s ILE 927 Ca 0.20 0.38 -0.01 0.00 -2.23 0.00 0.00 60.65 58.99 2cqp s ILE 927 Cb -0.16 -3.59 -0.04 0.00 -1.58 0.00 0.00 42.46 37.10 2cqp s ILE 927 CO 0.09 0.31 0.06 -0.63 -1.23 0.00 0.00 174.94 173.54 2cqp s ILE 928 N 1.15 4.63 -0.14 2.92 1.01 0.30 0.19 121.20 131.27 2cqp s ILE 928 Ca 0.12 -0.33 -0.01 0.00 0.00 0.00 0.00 60.65 60.42 2cqp s ILE 928 Cb -0.14 -3.06 -0.02 0.00 0.01 0.00 0.00 42.46 39.25 2cqp s ILE 928 CO 0.06 0.44 -0.09 -0.75 0.00 0.00 0.00 174.94 174.60 2cqp s LYS 929 N -1.44 3.46 -0.13 2.79 2.20 -0.53 -1.69 119.74 124.40 2cqp s LYS 929 Ca 0.19 -0.61 -0.01 0.00 -0.36 0.00 0.00 55.97 55.18 2cqp s LYS 929 Cb -0.12 -2.74 -0.02 0.00 -1.51 0.00 0.00 37.83 33.44 2cqp s LYS 929 CO 0.10 0.25 -0.09 0.08 -0.36 0.00 0.00 175.35 175.33 2cqp s VAL 930 N 0.28 3.40 0.21 4.02 1.01 0.12 -1.28 120.40 128.16 2cqp s VAL 930 Ca -0.07 -0.54 0.01 0.00 0.00 0.00 0.00 61.98 61.38 2cqp s VAL 930 Cb -0.15 -2.44 -0.05 0.00 0.00 0.00 0.00 36.38 33.74 2cqp s VAL 930 CO 0.04 0.52 0.06 -1.58 0.00 0.00 0.00 175.10 174.14 2cqp s GLN 931 N 0.20 1.22 -0.74 2.72 2.00 -0.44 -2.02 119.66 122.60 2cqp s GLN 931 Ca -0.06 -1.62 -0.01 0.00 -2.00 0.00 0.00 55.36 51.67 2cqp s GLN 931 Cb -0.15 -0.16 -0.02 0.00 0.80 0.00 0.00 33.01 33.48 2cqp s GLN 931 CO 0.04 -0.23 0.63 -1.71 -0.50 0.00 0.00 175.29 173.52 2cqp n ASN 932 N -0.32 -3.13 -4.18 6.67 4.05 -1.21 -0.60 115.26 116.54 2cqp n ASN 932 Ca -0.03 -0.42 -0.31 0.00 0.45 0.00 0.00 54.58 54.27 2cqp n ASN 932 Cb 0.65 -3.51 -0.17 0.00 1.23 0.00 0.00 39.78 37.98 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 -4.52 2.84 0.69 1.20 -1.94 -0.93 -3.85 119.30 112.80 2cqp s MET 933 Ca 0.11 -0.80 -0.14 0.00 -1.71 0.00 0.00 55.69 53.15 2cqp s MET 933 Cb -0.01 -2.19 0.02 0.00 2.01 0.00 0.00 34.83 34.65 2cqp s MET 933 CO 0.47 0.12 1.11 -1.25 -0.01 0.00 0.00 175.02 175.46 2cqp s PRO 934 N 0.49 2.63 0.44 2.03 0.04 -1.26 -3.79 135.00 135.59 2cqp s PRO 934 Ca -0.16 1.33 0.17 0.00 0.04 0.00 0.00 61.00 62.38 2cqp s PRO 934 Cb -0.17 -1.93 1.11 0.00 0.04 0.00 0.00 34.50 33.55 2cqp s PRO 934 CO 0.06 -1.38 1.93 0.74 0.04 0.00 0.00 177.00 178.39 2cqp h PHE 935 N -0.32 0.40 -0.83 0.56 0.04 -1.97 -0.07 116.94 114.75 2cqp h PHE 935 Ca -0.46 0.01 0.17 0.00 2.80 0.00 0.00 57.97 60.50 2cqp h PHE 935 Cb 1.24 -0.13 -0.06 0.00 2.20 0.00 0.00 35.95 39.21 2cqp h PHE 935 CO 0.55 0.15 0.55 1.79 -0.60 0.00 0.00 178.31 180.76 2cqp h THR 936 N 0.35 0.74 -1.88 -1.55 1.35 -2.00 -3.43 112.91 106.49 2cqp h THR 936 Ca 0.35 -0.15 -0.65 0.00 -0.55 0.00 0.00 66.41 65.42 2cqp h THR 936 Cb 0.89 0.28 0.09 0.00 -1.73 0.00 0.00 68.15 67.69 2cqp h THR 936 CO -0.10 0.08 0.05 0.52 -0.25 0.00 0.00 175.52 175.82 2cqp n VAL 937 N -4.49 1.44 -4.24 6.82 0.31 -0.04 -4.98 118.33 113.15 2cqp n VAL 937 Ca 0.17 -0.36 -0.16 0.00 -0.01 0.00 0.00 64.34 63.97 2cqp n VAL 937 Cb 0.61 -0.68 -0.09 0.00 -0.91 0.00 0.00 33.84 32.77 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 -0.39 1.06 0.20 4.52 0.01 -1.26 -5.03 113.70 112.80 2cqp s SER 938 Ca 0.67 -1.60 -0.10 0.00 1.31 0.00 0.00 55.95 56.23 2cqp s SER 938 Cb -0.84 0.50 0.14 0.00 0.21 0.00 0.00 66.02 66.03 2cqp s SER 938 CO 0.56 -0.99 1.81 0.40 0.41 0.00 0.00 173.24 175.43 2cqp h ILE 939 N 2.32 1.23 -0.34 1.44 2.04 -1.98 0.30 117.51 122.51 2cqp h ILE 939 Ca -0.29 -0.59 -0.02 0.00 1.00 0.00 0.00 64.86 64.96 2cqp h ILE 939 Cb 1.24 0.27 -0.01 0.00 -0.74 0.00 0.00 36.82 37.58 2cqp h ILE 939 CO 0.43 0.26 0.14 -0.78 0.00 0.00 0.00 178.15 178.19 2cqp h ASP 940 N 1.02 0.46 -0.46 1.72 1.82 -1.99 0.89 116.42 119.90 2cqp h ASP 940 Ca 0.26 -0.16 -0.09 0.00 -0.39 0.00 0.00 57.03 56.64 2cqp h ASP 940 Cb 0.06 -0.12 -0.02 0.00 0.68 0.00 0.00 39.33 39.93 2cqp h ASP 940 CO -0.04 0.50 -0.04 -0.33 -1.61 0.00 0.00 179.24 177.72 2cqp h GLU 941 N 0.40 0.89 -0.04 0.28 4.39 -1.91 -1.80 114.58 116.79 2cqp h GLU 941 Ca 0.11 -0.28 -0.01 0.00 0.34 0.00 0.00 59.36 59.52 2cqp h GLU 941 Cb 0.18 -0.08 -0.00 0.00 -0.10 0.00 0.00 28.75 28.75 2cqp h GLU 941 CO -0.01 0.92 -0.02 0.82 -1.16 0.00 0.00 179.01 179.56 2cqp h ILE 942 N 0.82 1.32 -0.85 3.13 2.04 -0.73 -0.39 117.51 122.85 2cqp h ILE 942 Ca 0.15 -1.00 0.04 0.00 1.00 0.00 0.00 64.86 65.04 2cqp h ILE 942 Cb 0.55 1.91 -0.05 0.00 -0.74 0.00 0.00 36.82 38.48 2cqp h ILE 942 CO 0.03 0.27 0.54 -0.07 0.00 0.00 0.00 178.15 178.93 2cqp h LEU 943 N -0.30 0.89 -0.79 1.44 3.38 -0.78 -1.46 115.31 117.70 2cqp h LEU 943 Ca 0.01 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.85 2cqp h LEU 943 Cb 0.45 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 2cqp h LEU 943 CO 0.01 0.60 -0.59 -0.78 0.09 0.00 0.00 178.44 177.77 2cqp h ASP 944 N 1.04 0.07 -0.61 -0.43 3.58 -1.30 -3.08 116.42 115.70 2cqp h ASP 944 Ca 0.35 -0.04 -0.07 0.00 0.42 0.00 0.00 57.03 57.68 2cqp h ASP 944 Cb 0.05 -0.02 -0.03 0.00 1.72 0.00 0.00 39.33 41.06 2cqp h ASP 944 CO -0.13 0.64 0.10 0.15 -2.88 0.00 0.00 179.24 177.12 2cqp h PHE 945 N 0.05 1.09 -0.25 0.28 3.04 -0.05 -2.00 116.94 119.10 2cqp h PHE 945 Ca -0.01 -0.14 0.00 0.00 3.98 0.00 0.00 57.97 61.80 2cqp h PHE 945 Cb 1.05 -0.30 0.00 0.00 2.56 0.00 0.00 35.95 39.26 2cqp h PHE 945 CO 0.01 0.92 0.00 1.19 -2.02 0.00 0.00 178.31 178.41 2cqp n PHE 946 N -4.22 0.49 -1.42 0.41 3.72 -0.79 -4.95 117.46 110.69 2cqp n PHE 946 Ca 0.04 -0.21 -0.39 0.00 -0.05 0.00 0.00 57.45 56.84 2cqp n PHE 946 Cb 0.28 -0.08 0.02 0.00 -0.94 0.00 0.00 39.48 38.77 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 0.27 -1.04 0.00 1.38 9.36 -0.76 -2.29 117.16 124.08 2cqp n TYR 947 Ca 0.09 0.49 0.00 0.00 3.32 0.00 0.00 57.90 61.80 2cqp n TYR 947 Cb 0.34 -1.91 0.00 0.00 -0.63 0.00 0.00 39.34 37.14 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 1.92 2.55 3.77 2.98 0.00 -1.26 -5.00 105.19 110.15 2cqp n GLY 948 Ca 0.11 -0.60 -0.38 0.00 0.00 0.00 0.00 46.02 45.15 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 -0.38 3.63 -1.09 1.61 2.02 -0.97 -4.99 117.35 117.19 2cqp s TYR 949 Ca 0.00 0.98 -0.23 0.00 -0.37 0.00 0.00 57.07 57.45 2cqp s TYR 949 Cb 0.00 -2.45 -0.04 0.00 -0.40 0.00 0.00 41.96 39.07 2cqp s TYR 949 CO 0.00 0.39 1.86 -0.65 -1.57 0.00 0.00 175.55 175.59 2cqp s GLN 950 N -0.21 2.82 -0.08 -0.62 -1.52 -1.26 -4.94 119.66 113.85 2cqp s GLN 950 Ca 0.25 -0.97 -0.30 0.00 -1.95 0.00 0.00 55.36 52.40 2cqp s GLN 950 Cb -0.16 -5.23 -0.03 0.00 -0.22 0.00 0.00 33.01 27.37 2cqp s GLN 950 CO 0.13 -3.38 1.25 0.08 -0.25 0.00 0.00 175.29 173.12 2cqp s VAL 951 N 9.21 4.19 0.09 1.09 1.01 -1.26 -4.79 120.40 129.93 2cqp s VAL 951 Ca 0.65 1.50 -0.36 0.00 0.00 0.00 0.00 61.98 63.76 2cqp s VAL 951 Cb -0.02 -3.96 -0.16 0.00 0.00 0.00 0.00 36.38 32.23 2cqp s VAL 951 CO 0.05 -0.04 1.40 -0.38 0.00 0.00 0.00 175.10 176.13 2cqp n ILE 952 N 4.86 0.01 -2.23 2.22 5.41 -1.19 -4.89 119.36 123.56 2cqp n ILE 952 Ca 0.12 -0.00 -0.41 0.00 1.00 0.00 0.00 62.75 63.46 2cqp n ILE 952 Cb 0.45 -0.96 -0.03 0.00 -0.71 0.00 0.00 39.64 38.40 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 0.67 4.39 0.00 0.38 0.04 -1.26 -2.76 135.00 136.46 2cqp s PRO 953 Ca 0.84 2.04 0.00 0.00 0.04 0.00 0.00 61.00 63.92 2cqp s PRO 953 Cb -0.91 -3.20 0.00 0.00 0.04 0.00 0.00 34.50 30.43 2cqp s PRO 953 CO 0.46 -0.25 0.00 0.41 0.04 0.00 0.00 177.00 177.65 2cqp n GLY 954 N 2.43 0.72 0.08 0.56 0.00 -1.26 -4.93 105.19 102.78 2cqp n GLY 954 Ca 0.06 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.98 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 0.00 0.00 1.61 4.64 -1.87 -3.45 113.55 114.48 2cqp h SER 955 Ca 0.00 -0.29 -0.35 0.00 -0.47 0.00 0.00 61.79 60.68 2cqp h SER 955 Cb 0.00 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.01 2cqp h SER 955 CO 0.00 0.98 1.51 0.52 -0.87 0.00 0.00 176.83 178.97 2cqp n VAL 956 N -4.58 0.00 -4.38 0.95 0.31 -1.24 -4.58 118.33 104.81 2cqp n VAL 956 Ca -0.14 -0.18 -0.34 0.00 -0.01 0.00 0.00 64.34 63.67 2cqp n VAL 956 Cb 0.38 -0.22 -0.14 0.00 -0.91 0.00 0.00 33.84 32.95 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 0.79 4.40 -0.22 0.00 1.43 -1.26 -0.29 118.68 123.53 2cqp s LEU 958 Ca -0.03 0.70 -0.16 0.00 -1.03 0.00 0.00 54.13 53.61 2cqp s LEU 958 Cb -0.15 -2.37 -0.04 0.00 0.03 0.00 0.00 46.19 43.67 2cqp s LEU 958 CO 0.01 0.31 0.40 -0.75 0.23 0.00 0.00 176.35 176.55 2cqp s LYS 959 N -0.76 4.14 0.49 1.70 2.36 -0.86 -5.00 119.74 121.81 2cqp s LYS 959 Ca 0.19 0.18 0.06 0.00 -2.55 0.00 0.00 55.97 53.85 2cqp s LYS 959 Cb -0.14 -3.57 0.00 0.00 -1.05 0.00 0.00 37.83 33.07 2cqp s LYS 959 CO 0.08 -0.10 0.30 0.71 1.55 0.00 0.00 175.35 177.89 2cqp s TYR 960 N 1.52 2.06 0.46 4.03 2.02 -1.26 -2.29 117.35 123.89 2cqp s TYR 960 Ca 0.18 -0.74 0.06 0.00 -0.37 0.00 0.00 57.07 56.20 2cqp s TYR 960 Cb -0.15 -1.93 0.06 0.00 -0.40 0.00 0.00 41.96 39.54 2cqp s TYR 960 CO 0.08 -0.18 0.49 0.27 -1.57 0.00 0.00 175.55 174.65 2cqp n ASN 961 N -1.54 2.07 0.29 2.29 6.94 -0.96 -4.87 115.26 119.48 2cqp n ASN 961 Ca -0.03 -2.39 0.18 0.00 -0.02 0.00 0.00 54.58 52.32 2cqp n ASN 961 Cb 0.64 -0.19 0.96 0.00 -2.36 0.00 0.00 39.78 38.83 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 0.00 0.08 -3.83 4.11 -2.02 -0.85 114.58 112.07 2cqp h GLU 962 Ca -0.25 0.00 -0.33 0.00 0.07 0.00 0.00 59.36 58.84 2cqp h GLU 962 Cb 1.02 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.24 2cqp h GLU 962 CO 0.38 0.00 -1.87 1.63 0.07 0.00 0.00 179.01 179.22 2cqp n LYS 963 N -2.79 0.71 0.00 1.06 4.01 -1.26 -5.00 118.16 114.89 2cqp n LYS 963 Ca -0.02 0.28 0.00 0.00 -0.51 0.00 0.00 58.31 58.06 2cqp n LYS 963 Cb 0.13 -1.75 0.00 0.00 -0.51 0.00 0.00 35.03 32.90 2cqp n LYS 963 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2cqp n GLY 964 N 1.81 1.86 3.77 0.72 0.00 -0.33 -5.11 105.19 107.92 2cqp n GLY 964 Ca -0.25 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.44 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 2.66 0.27 1.61 -1.94 -1.26 -4.57 119.30 116.07 2cqp s MET 965 Ca 0.00 1.38 -0.29 0.00 -1.71 0.00 0.00 55.69 55.07 2cqp s MET 965 Cb 0.00 -1.93 -0.09 0.00 2.01 0.00 0.00 34.83 34.81 2cqp s MET 965 CO 0.00 -1.36 1.26 -1.25 -0.01 0.00 0.00 175.02 173.66 2cqp s PRO 966 N -4.20 4.43 0.00 2.03 0.04 -1.26 -2.26 135.00 133.78 2cqp s PRO 966 Ca 0.67 2.05 0.24 0.00 0.04 0.00 0.00 61.00 64.00 2cqp s PRO 966 Cb -0.21 -3.15 0.20 0.00 0.04 0.00 0.00 34.50 31.39 2cqp s PRO 966 CO 0.44 -0.12 1.25 0.25 0.04 0.00 0.00 177.00 178.86 2cqp n THR 967 N 1.63 0.03 -1.90 1.26 -2.24 -0.97 -4.90 114.28 107.19 2cqp n THR 967 Ca 0.02 -0.51 0.00 0.00 -2.27 0.00 0.00 64.05 61.29 2cqp n THR 967 Cb 0.43 1.46 0.00 0.00 -2.10 0.00 0.00 70.33 70.12 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 1.33 0.58 3.18 3.38 0.00 -1.25 -4.81 105.19 107.60 2cqp n GLY 968 Ca 0.14 -0.78 -0.21 0.00 0.00 0.00 0.00 46.02 45.17 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 -3.87 0.99 -0.12 1.61 2.02 -1.26 -2.19 118.70 115.88 2cqp s GLU 969 Ca 0.00 -0.86 -0.14 0.00 0.02 0.00 0.00 54.97 53.99 2cqp s GLU 969 Cb 0.00 -1.04 0.04 0.00 0.10 0.00 0.00 34.13 33.23 2cqp s GLU 969 CO 0.00 0.25 0.39 0.00 0.02 0.00 0.00 175.26 175.92 2cqp s ALA 970 N -0.96 -0.96 0.02 5.21 0.00 -0.85 -2.04 121.76 122.18 2cqp s ALA 970 Ca 0.02 0.96 0.08 0.00 0.00 0.00 0.00 51.96 53.03 2cqp s ALA 970 Cb -0.09 -0.49 -0.02 0.00 0.00 0.00 0.00 23.12 22.52 2cqp s ALA 970 CO 0.02 -0.21 -0.25 -1.64 0.00 0.00 0.00 175.76 173.68 2cqp s MET 971 N -0.13 1.82 0.17 0.00 -1.94 0.61 0.14 119.30 119.97 2cqp s MET 971 Ca -0.03 -1.01 0.00 0.00 -1.71 0.00 0.00 55.69 52.94 2cqp s MET 971 Cb -0.03 -1.90 -0.04 0.00 2.01 0.00 0.00 34.83 34.86 2cqp s MET 971 CO 0.02 0.50 0.05 0.14 -0.01 0.00 0.00 175.02 175.72 2cqp s VAL 972 N -0.72 0.35 0.08 -6.03 -7.23 -0.68 -0.59 120.40 105.58 2cqp s VAL 972 Ca 0.10 -1.96 0.06 0.00 -1.81 0.00 0.00 61.98 58.37 2cqp s VAL 972 Cb -0.10 -2.20 -0.03 0.00 0.56 0.00 0.00 36.38 34.61 2cqp s VAL 972 CO 0.01 -0.35 -0.16 0.00 -0.31 0.00 0.00 175.10 174.29 2cqp s ALA 973 N -3.89 1.30 0.14 1.32 0.00 -1.26 -0.54 121.76 118.84 2cqp s ALA 973 Ca 0.28 -1.05 0.06 0.00 0.00 0.00 0.00 51.96 51.24 2cqp s ALA 973 Cb 0.07 -0.13 -0.04 0.00 0.00 0.00 0.00 23.12 23.02 2cqp s ALA 973 CO 0.05 0.20 -0.13 -0.06 0.00 0.00 0.00 175.76 175.83 2cqp s PHE 974 N -1.27 1.38 -0.05 0.00 0.40 0.82 -3.16 117.98 116.10 2cqp s PHE 974 Ca -0.00 -0.63 -0.18 0.00 -0.60 0.00 0.00 56.93 55.52 2cqp s PHE 974 Cb -0.10 -0.70 -0.31 0.00 0.51 0.00 0.00 43.02 42.42 2cqp s PHE 974 CO 0.03 0.15 0.79 0.93 0.70 0.00 0.00 175.22 177.82 2cqp h GLU 975 N 3.14 0.34 -6.38 0.44 3.07 -1.87 -1.83 114.58 111.49 2cqp h GLU 975 Ca -0.38 -0.59 -0.69 0.00 -0.50 0.00 0.00 59.36 57.20 2cqp h GLU 975 Cb 1.20 0.22 -0.27 0.00 -0.84 0.00 0.00 28.75 29.05 2cqp h GLU 975 CO 0.57 1.28 -0.84 -1.12 -1.40 0.00 0.00 179.01 177.50 2cqp s SER 976 N -7.15 3.48 0.32 1.42 0.01 -1.26 -4.70 113.70 105.82 2cqp s SER 976 Ca -0.15 -0.36 0.01 0.00 1.31 0.00 0.00 55.95 56.76 2cqp s SER 976 Cb 0.03 -0.65 0.54 0.00 0.21 0.00 0.00 66.02 66.16 2cqp s SER 976 CO 0.84 0.32 1.95 0.03 0.41 0.00 0.00 173.24 176.78 2cqp h ARG 977 N 5.54 0.85 -0.70 12.44 3.08 -1.97 -2.28 114.38 131.35 2cqp h ARG 977 Ca -0.42 -0.09 0.04 0.00 0.07 0.00 0.00 59.98 59.58 2cqp h ARG 977 Cb 1.14 -0.17 -0.05 0.00 0.08 0.00 0.00 29.97 30.98 2cqp h ARG 977 CO 0.49 0.63 0.42 0.22 -1.07 0.00 0.00 179.97 180.66 2cqp h ASP 978 N 0.85 0.68 -0.27 7.04 3.58 -1.99 0.14 116.42 126.45 2cqp h ASP 978 Ca 0.22 0.01 -0.06 0.00 0.42 0.00 0.00 57.03 57.62 2cqp h ASP 978 Cb 0.03 -0.13 -0.01 0.00 1.72 0.00 0.00 39.33 40.94 2cqp h ASP 978 CO -0.03 0.46 -0.05 -0.33 -2.88 0.00 0.00 179.24 176.41 2cqp h GLU 979 N 0.81 0.51 -0.12 0.28 3.07 -1.87 -0.85 114.58 116.42 2cqp h GLU 979 Ca 0.29 -0.19 -0.00 0.00 -0.50 0.00 0.00 59.36 58.96 2cqp h GLU 979 Cb 0.07 -0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 27.94 2cqp h GLU 979 CO -0.13 0.71 0.07 0.00 -1.40 0.00 0.00 179.01 178.26 2cqp h ALA 980 N 0.79 0.15 -0.52 3.43 0.00 -1.04 -0.48 119.26 121.58 2cqp h ALA 980 Ca 0.07 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 2cqp h ALA 980 Cb 0.51 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 2cqp h ALA 980 CO 0.02 -0.32 0.25 1.15 0.00 0.00 0.00 179.25 180.36 2cqp h THR 981 N 0.10 1.20 -0.31 0.00 2.02 -0.73 -1.55 112.91 113.64 2cqp h THR 981 Ca 0.04 -0.55 -0.00 0.00 0.77 0.00 0.00 66.41 66.67 2cqp h THR 981 Cb 0.07 0.61 -0.01 0.00 -1.74 0.00 0.00 68.15 67.07 2cqp h THR 981 CO -0.01 0.22 0.18 0.00 0.37 0.00 0.00 175.52 176.28 2cqp h ALA 982 N 1.09 0.39 -0.88 6.16 0.00 -1.00 -0.79 119.26 124.23 2cqp h ALA 982 Ca 0.18 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 2cqp h ALA 982 Cb 0.12 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 2cqp h ALA 982 CO -0.02 -0.11 0.55 0.00 0.00 0.00 0.00 179.25 179.67 2cqp h ALA 983 N 1.07 1.12 0.02 0.00 0.00 -0.91 0.11 119.26 120.66 2cqp h ALA 983 Ca 0.11 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 2cqp h ALA 983 Cb 0.02 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.45 2cqp h ALA 983 CO -0.02 0.56 -0.01 0.28 0.00 0.00 0.00 179.25 180.06 2cqp h VAL 984 N 1.21 1.16 -0.43 0.00 2.07 -0.97 0.67 116.25 119.96 2cqp h VAL 984 Ca 0.32 -0.55 -0.01 0.00 0.82 0.00 0.00 66.70 67.27 2cqp h VAL 984 Cb -0.08 1.54 -0.02 0.00 -1.52 0.00 0.00 31.29 31.21 2cqp h VAL 984 CO -0.06 0.14 0.21 0.40 0.02 0.00 0.00 177.57 178.28 2cqp h ILE 985 N -0.26 1.18 0.00 4.57 2.04 -0.96 1.71 117.51 125.78 2cqp h ILE 985 Ca -0.00 -0.49 -0.04 0.00 1.00 0.00 0.00 64.86 65.33 2cqp h ILE 985 Cb 0.25 0.71 -0.01 0.00 -0.74 0.00 0.00 36.82 37.03 2cqp h ILE 985 CO 0.00 0.19 -0.17 0.44 0.00 0.00 0.00 178.15 178.62 2cqp h ASP 986 N 0.56 0.00 -0.01 1.72 5.19 -0.76 -3.15 116.42 119.97 2cqp h ASP 986 Ca 0.15 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.56 2cqp h ASP 986 Cb 0.11 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 39.62 2cqp h ASP 986 CO -0.02 0.17 -0.45 0.18 -3.12 0.00 0.00 179.24 176.00 2cqp n LEU 987 N -3.23 2.71 -4.71 1.55 4.77 0.23 -5.00 117.00 113.33 2cqp n LEU 987 Ca 0.01 -3.84 -0.39 0.00 -0.03 0.00 0.00 56.01 51.77 2cqp n LEU 987 Cb 0.48 -0.52 -0.06 0.00 -2.33 0.00 0.00 43.42 40.99 2cqp n LEU 987 CO 0.33 1.35 0.27 0.21 -1.33 0.00 0.00 177.39 178.22 2cqp s ASN 988 N -3.20 6.76 -1.20 -1.43 3.84 0.58 -4.07 114.94 116.22 2cqp s ASN 988 Ca 0.38 0.91 -0.06 0.00 0.21 0.00 0.00 52.86 54.30 2cqp s ASN 988 Cb 0.36 -2.33 0.01 0.00 -0.55 0.00 0.00 41.25 38.74 2cqp s ASN 988 CO -0.06 -0.09 1.03 0.47 -2.79 0.00 0.00 177.10 175.67 2cqp n ASP 989 N 3.99 -4.80 -4.73 -4.21 8.00 -0.83 -4.97 116.55 109.00 2cqp n ASP 989 Ca -0.04 -0.52 -0.40 0.00 0.71 0.00 0.00 54.79 54.54 2cqp n ASP 989 Cb 0.51 -4.68 -0.05 0.00 -0.02 0.00 0.00 41.12 36.89 2cqp n ASP 989 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2cqp s ARG 990 N -5.91 4.45 -1.13 -1.24 1.81 -1.20 -4.71 118.95 111.02 2cqp s ARG 990 Ca 0.37 0.96 -0.23 0.00 -1.72 0.00 0.00 55.73 55.11 2cqp s ARG 990 Cb -0.16 -3.42 -0.08 0.00 -0.45 0.00 0.00 34.95 30.84 2cqp s ARG 990 CO 0.67 0.14 1.94 -1.25 -0.68 0.00 0.00 175.30 176.11 2cqp s PRO 991 N 0.50 2.50 -0.08 3.54 0.04 -1.26 -1.12 135.00 139.12 2cqp s PRO 991 Ca 0.38 -1.01 -0.28 0.00 0.04 0.00 0.00 61.00 60.13 2cqp s PRO 991 Cb -0.19 -5.21 -0.02 0.00 0.04 0.00 0.00 34.50 29.12 2cqp s PRO 991 CO 0.20 -3.88 0.94 0.42 0.04 0.00 0.00 177.00 174.72 2cqp s ILE 992 N 10.88 4.85 0.00 0.56 1.01 0.23 -4.72 121.20 134.00 2cqp s ILE 992 Ca 0.69 1.93 0.00 0.00 0.00 0.00 0.00 60.65 63.27 2cqp s ILE 992 Cb -0.02 -4.26 0.00 0.00 0.01 0.00 0.00 42.46 38.19 2cqp s ILE 992 CO 0.11 0.08 0.00 0.61 0.00 0.00 0.00 174.94 175.73 2cqp n GLY 993 N 3.09 0.25 0.00 6.18 0.00 -1.26 -0.72 105.19 112.73 2cqp n GLY 993 Ca 0.06 0.68 0.00 0.00 0.00 0.00 0.00 46.02 46.76 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 4.34 0.32 -4.27 1.61 2.88 -1.26 -5.08 113.62 112.15 2cqp n SER 994 Ca 0.00 -0.91 -0.15 0.00 -1.33 0.00 0.00 58.87 56.49 2cqp n SER 994 Cb 0.00 0.04 -0.10 0.00 -0.75 0.00 0.00 64.21 63.40 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 -0.04 1.16 0.03 -1.46 0.52 0.10 -5.12 118.95 114.14 2cqp s ARG 995 Ca 0.00 -1.55 -0.15 0.00 -0.52 0.00 0.00 55.73 53.51 2cqp s ARG 995 Cb 0.00 -0.48 -0.06 0.00 0.52 0.00 0.00 34.95 34.93 2cqp s ARG 995 CO 0.00 -0.06 0.44 0.15 0.02 0.00 0.00 175.30 175.85 2cqp s LYS 996 N -3.85 3.95 0.09 3.54 1.02 -1.26 0.73 119.74 123.96 2cqp s LYS 996 Ca 0.23 0.44 0.02 0.00 0.02 0.00 0.00 55.97 56.68 2cqp s LYS 996 Cb 0.05 -3.17 -0.04 0.00 -0.52 0.00 0.00 37.83 34.15 2cqp s LYS 996 CO 0.04 0.65 0.16 0.14 -0.92 0.00 0.00 175.35 175.43 2cqp s VAL 997 N -1.15 4.97 -0.13 3.17 -7.23 -0.28 -4.61 120.40 115.15 2cqp s VAL 997 Ca 0.27 -0.63 0.01 0.00 -1.81 0.00 0.00 61.98 59.81 2cqp s VAL 997 Cb -0.17 -3.44 -0.01 0.00 0.56 0.00 0.00 36.38 33.32 2cqp s VAL 997 CO 0.15 0.08 -0.17 -0.75 -0.31 0.00 0.00 175.10 174.11 2cqp s LYS 998 N -2.61 3.23 -0.14 4.82 2.47 0.23 -1.95 119.74 125.79 2cqp s LYS 998 Ca 0.32 -0.76 -0.02 0.00 -1.56 0.00 0.00 55.97 53.95 2cqp s LYS 998 Cb -0.12 -2.54 -0.02 0.00 -1.46 0.00 0.00 37.83 33.68 2cqp s LYS 998 CO 0.25 0.13 -0.08 -0.51 0.16 0.00 0.00 175.35 175.30 2cqp s LEU 999 N 0.53 3.03 0.02 5.43 1.43 -1.26 -1.32 118.68 126.54 2cqp s LEU 999 Ca -0.11 -0.19 0.07 0.00 -1.03 0.00 0.00 54.13 52.87 2cqp s LEU 999 Cb -0.16 -1.71 -0.02 0.00 0.03 0.00 0.00 46.19 44.33 2cqp s LEU 999 CO 0.04 0.19 -0.20 -0.69 0.23 0.00 0.00 176.35 175.92 2cqp s VAL 1000N 0.22 1.62 0.08 -1.59 1.01 -0.40 -4.96 120.40 116.38 2cqp s VAL 1000Ca -0.05 -1.06 -0.27 0.00 0.00 0.00 0.00 61.98 60.60 2cqp s VAL 1000Cb -0.14 -1.38 -0.06 0.00 0.00 0.00 0.00 36.38 34.80 2cqp s VAL 1000CO 0.04 0.29 0.86 -0.76 0.00 0.00 0.00 175.10 175.53 2cqp s LEU 1001N -0.90 4.48 0.00 3.92 1.43 -1.26 -1.46 118.68 124.89 2cqp s LEU 1001Ca 0.07 1.63 0.00 0.00 -1.03 0.00 0.00 54.13 54.80 2cqp s LEU 1001Cb -0.08 -3.41 0.00 0.00 0.03 0.00 0.00 46.19 42.73 2cqp s LEU 1001CO 0.01 -0.02 0.00 0.61 0.23 0.00 0.00 176.35 177.18 2cqp n GLY 1002N 2.29 -3.06 3.01 -3.19 0.00 0.13 -4.90 105.19 99.46 2cqp n GLY 1002Ca -0.00 -0.41 -0.18 0.00 0.00 0.00 0.00 46.02 45.42 2cqp n GLY 1002CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2cqp n SER 1003N 0.00 -2.90 -1.72 1.61 2.88 -1.26 -4.71 113.62 107.52 2cqp n SER 1003Ca 0.00 -0.33 -0.01 0.00 -1.33 0.00 0.00 58.87 57.20 2cqp n SER 1003Cb 0.00 -0.74 0.00 0.00 -0.75 0.00 0.00 64.21 62.72 2cqp n SER 1003CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2cqp n GLY 1004N 2.50 -0.79 3.76 0.46 0.00 -1.26 -4.79 105.19 105.07 2cqp n GLY 1004Ca 0.05 0.11 -0.31 0.00 0.00 0.00 0.00 46.02 45.87 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 -1.27 2.05 0.45 1.61 0.04 -1.26 -5.06 135.00 131.57 2cqp s PRO 1005Ca 0.04 1.09 -0.04 0.00 0.04 0.00 0.00 61.00 62.13 2cqp s PRO 1005Cb -0.01 -1.88 0.10 0.00 0.04 0.00 0.00 34.50 32.75 2cqp s PRO 1005CO 0.12 -1.77 0.62 -1.13 0.04 0.00 0.00 177.00 174.89 2cqp n SER 1006N -3.60 0.42 -3.38 6.66 3.41 -1.26 -5.07 113.62 110.80 2cqp n SER 1006Ca 0.09 -1.45 -0.20 0.00 -0.26 0.00 0.00 58.87 57.04 2cqp n SER 1006Cb 0.53 -0.44 -0.08 0.00 -0.26 0.00 0.00 64.21 63.96 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 -3.39 1.85 0.00 4.04 0.15 -1.26 -4.93 113.70 110.16 2cqp s SER 1007Ca 0.38 -1.77 0.00 0.00 0.70 0.00 0.00 55.95 55.26 2cqp s SER 1007Cb -0.02 0.57 0.00 0.00 -1.71 0.00 0.00 66.02 64.86 2cqp s SER 1007CO 0.26 -1.07 0.00 0.61 1.20 0.00 0.00 173.24 174.24