#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cqp h SER 912 N 0.00 -0.01 -3.89 1.61 0.87 -2.08 -3.45 113.55 106.60 2cqp h SER 912 Ca 0.00 -0.84 -0.49 0.00 -1.23 0.00 0.00 61.79 59.23 2cqp h SER 912 Cb 0.00 0.00 0.02 0.00 -0.44 0.00 0.00 62.40 61.98 2cqp h SER 912 CO 0.00 0.86 0.43 -0.55 -0.53 0.00 0.00 176.83 177.05 2cqp s SER 913 N -6.07 6.99 0.00 6.23 0.15 -1.26 -4.82 113.70 114.93 2cqp s SER 913 Ca -0.17 2.13 0.00 0.00 0.70 0.00 0.00 55.95 58.61 2cqp s SER 913 Cb -0.02 -2.60 0.00 0.00 -1.71 0.00 0.00 66.02 61.69 2cqp s SER 913 CO 0.65 -0.33 0.00 0.61 1.20 0.00 0.00 173.24 175.37 2cqp n GLY 914 N 0.74 -0.02 3.60 9.45 0.00 -1.26 -5.08 105.19 112.61 2cqp n GLY 914 Ca 0.02 -0.31 -0.57 0.00 0.00 0.00 0.00 46.02 45.17 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 2.08 -4.64 1.61 7.64 -1.26 -4.89 113.62 114.16 2cqp n SER 915 Ca 0.00 0.89 -0.30 0.00 1.01 0.00 0.00 58.87 60.46 2cqp n SER 915 Cb 0.00 -1.13 0.18 0.00 -1.01 0.00 0.00 64.21 62.26 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 4.68 2.57 0.00 6.43 0.01 -1.26 -4.78 113.70 121.35 2cqp s SER 916 Ca 1.04 2.01 0.00 0.00 1.31 0.00 0.00 55.95 60.30 2cqp s SER 916 Cb -1.10 -2.50 0.00 0.00 0.21 0.00 0.00 66.02 62.63 2cqp s SER 916 CO 0.63 -3.29 0.00 0.61 0.41 0.00 0.00 173.24 171.60 2cqp n GLY 917 N 0.23 0.75 3.41 3.44 0.00 -1.26 -5.02 105.19 106.74 2cqp n GLY 917 Ca 0.10 -0.67 -0.44 0.00 0.00 0.00 0.00 46.02 45.00 2cqp n GLY 917 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cqp n ALA 918 N 0.00 4.03 -2.49 4.61 0.00 -1.26 -5.01 120.51 120.39 2cqp n ALA 918 Ca 0.00 -4.39 -0.38 0.00 0.00 0.00 0.00 53.44 48.67 2cqp n ALA 918 Cb 0.00 -2.86 -0.06 0.00 0.00 0.00 0.00 19.45 16.53 2cqp n ALA 918 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2cqp s SER 919 N 2.27 6.82 -0.03 0.00 0.15 -1.26 -4.82 113.70 116.83 2cqp s SER 919 Ca 0.39 0.98 -0.05 0.00 0.70 0.00 0.00 55.95 57.97 2cqp s SER 919 Cb -0.05 -2.26 -0.02 0.00 -1.71 0.00 0.00 66.02 61.99 2cqp s SER 919 CO -0.02 0.31 -0.10 -0.24 1.20 0.00 0.00 173.24 174.38 2cqp n SER 920 N 1.72 0.82 0.00 5.45 2.88 -1.26 -5.06 113.62 118.17 2cqp n SER 920 Ca -0.13 0.13 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2cqp n SER 920 Cb 0.52 -0.43 0.00 0.00 -0.75 0.00 0.00 64.21 63.56 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 2.38 3.23 3.77 0.46 0.00 -1.26 -5.07 105.19 108.70 2cqp n GLY 921 Ca -0.04 -0.92 -0.39 0.00 0.00 0.00 0.00 46.02 44.67 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 3.80 0.28 1.61 1.02 -1.26 -5.02 119.74 120.17 2cqp s LYS 922 Ca 0.00 2.12 -0.05 0.00 0.02 0.00 0.00 55.97 58.06 2cqp s LYS 922 Cb 0.00 -2.62 0.07 0.00 -0.52 0.00 0.00 37.83 34.76 2cqp s LYS 922 CO 0.00 -0.62 0.25 -0.35 -0.92 0.00 0.00 175.35 173.71 2cqp n PRO 923 N -0.16 -1.51 0.00 -1.68 -0.04 -1.26 -4.98 135.00 125.38 2cqp n PRO 923 Ca 0.05 -0.40 0.00 0.00 -0.04 0.00 0.00 63.50 63.12 2cqp n PRO 923 Cb 0.44 -0.37 0.00 0.00 -0.04 0.00 0.00 33.50 33.53 2cqp n PRO 923 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2cqp n GLY 924 N 0.81 0.09 3.66 0.55 0.00 -1.26 -5.06 105.19 103.98 2cqp n GLY 924 Ca 0.03 -2.16 -0.29 0.00 0.00 0.00 0.00 46.02 43.61 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 0.14 -0.28 1.61 0.04 -1.26 -5.00 135.00 130.25 2cqp s PRO 925 Ca 0.00 0.42 -0.18 0.00 0.04 0.00 0.00 61.00 61.28 2cqp s PRO 925 Cb 0.00 -1.71 -0.02 0.00 0.04 0.00 0.00 34.50 32.81 2cqp s PRO 925 CO 0.00 -2.90 0.53 0.99 0.04 0.00 0.00 177.00 175.65 2cqp s THR 926 N -2.97 5.05 -0.11 1.26 2.01 -0.67 -4.86 115.64 115.35 2cqp s THR 926 Ca 0.66 0.79 -0.19 0.00 0.31 0.00 0.00 61.69 63.26 2cqp s THR 926 Cb -0.18 -3.87 -0.04 0.00 0.01 0.00 0.00 72.50 68.43 2cqp s THR 926 CO 0.57 0.01 0.51 -0.63 -0.69 0.00 0.00 174.62 174.40 2cqp s ILE 927 N 2.36 5.17 0.05 1.82 -1.09 -1.26 -1.12 121.20 127.12 2cqp s ILE 927 Ca 0.21 1.03 0.02 0.00 -2.23 0.00 0.00 60.65 59.68 2cqp s ILE 927 Cb -0.15 -3.85 -0.04 0.00 -1.58 0.00 0.00 42.46 36.83 2cqp s ILE 927 CO 0.10 0.31 0.08 -0.63 -1.23 0.00 0.00 174.94 173.58 2cqp s ILE 928 N 0.65 4.62 -0.15 2.92 1.01 0.73 -0.26 121.20 130.71 2cqp s ILE 928 Ca 0.28 -0.63 -0.02 0.00 0.00 0.00 0.00 60.65 60.28 2cqp s ILE 928 Cb -0.16 -3.18 -0.02 0.00 0.01 0.00 0.00 42.46 39.12 2cqp s ILE 928 CO 0.12 0.21 -0.10 -0.75 0.00 0.00 0.00 174.94 174.42 2cqp s LYS 929 N -2.15 3.45 -0.19 2.79 2.20 -0.46 -2.12 119.74 123.26 2cqp s LYS 929 Ca 0.27 -0.64 -0.04 0.00 -0.36 0.00 0.00 55.97 55.21 2cqp s LYS 929 Cb -0.12 -2.76 -0.02 0.00 -1.51 0.00 0.00 37.83 33.42 2cqp s LYS 929 CO 0.19 0.15 -0.04 0.08 -0.36 0.00 0.00 175.35 175.37 2cqp s VAL 930 N 0.55 3.58 0.28 4.02 1.01 0.49 -1.54 120.40 128.79 2cqp s VAL 930 Ca -0.06 -0.44 0.05 0.00 0.00 0.00 0.00 61.98 61.52 2cqp s VAL 930 Cb -0.15 -2.60 -0.06 0.00 0.00 0.00 0.00 36.38 33.57 2cqp s VAL 930 CO 0.03 0.45 -0.01 -1.58 0.00 0.00 0.00 175.10 174.00 2cqp s GLN 931 N 0.96 1.52 -0.75 2.72 -0.44 -0.30 -2.06 119.66 121.30 2cqp s GLN 931 Ca 0.00 -1.79 -0.01 0.00 -2.50 0.00 0.00 55.36 51.06 2cqp s GLN 931 Cb -0.15 -0.90 -0.01 0.00 -1.64 0.00 0.00 33.01 30.31 2cqp s GLN 931 CO 0.01 -0.07 0.63 -1.71 0.50 0.00 0.00 175.29 174.65 2cqp n ASN 932 N -0.56 -2.71 -4.27 6.67 4.05 -1.22 -0.17 115.26 117.05 2cqp n ASN 932 Ca -0.04 -0.41 -0.33 0.00 0.45 0.00 0.00 54.58 54.24 2cqp n ASN 932 Cb 0.64 -3.49 -0.15 0.00 1.23 0.00 0.00 39.78 38.02 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 -4.65 3.24 0.98 1.20 -1.94 -0.78 -3.83 119.30 113.51 2cqp s MET 933 Ca 0.07 -0.73 -0.12 0.00 -1.71 0.00 0.00 55.69 53.19 2cqp s MET 933 Cb -0.01 -2.66 0.18 0.00 2.01 0.00 0.00 34.83 34.35 2cqp s MET 933 CO 0.47 0.01 1.09 -1.25 -0.01 0.00 0.00 175.02 175.33 2cqp s PRO 934 N 0.84 0.60 0.24 2.03 0.04 -1.26 -3.84 135.00 133.66 2cqp s PRO 934 Ca -0.04 0.58 -0.06 0.00 0.04 0.00 0.00 61.00 61.52 2cqp s PRO 934 Cb -0.15 -1.75 0.23 0.00 0.04 0.00 0.00 34.50 32.87 2cqp s PRO 934 CO -0.00 -2.63 1.85 0.74 0.04 0.00 0.00 177.00 177.00 2cqp h PHE 935 N -1.82 1.20 -1.09 0.56 0.04 -1.98 -2.20 116.94 111.64 2cqp h PHE 935 Ca -0.53 -0.04 0.31 0.00 2.80 0.00 0.00 57.97 60.51 2cqp h PHE 935 Cb 1.32 -0.38 -0.05 0.00 2.20 0.00 0.00 35.95 39.04 2cqp h PHE 935 CO 0.32 0.85 0.78 1.79 -0.60 0.00 0.00 178.31 181.45 2cqp h THR 936 N 1.21 0.46 -3.04 -1.55 1.35 -2.00 -3.42 112.91 105.91 2cqp h THR 936 Ca 0.30 -0.01 -0.58 0.00 -0.55 0.00 0.00 66.41 65.57 2cqp h THR 936 Cb 0.07 0.44 0.14 0.00 -1.73 0.00 0.00 68.15 67.07 2cqp h THR 936 CO -0.04 0.00 0.07 0.52 -0.25 0.00 0.00 175.52 175.82 2cqp n VAL 937 N -4.23 2.53 -4.00 6.82 0.31 -0.83 -5.00 118.33 113.93 2cqp n VAL 937 Ca 0.23 -0.50 -0.13 0.00 -0.01 0.00 0.00 64.34 63.93 2cqp n VAL 937 Cb 1.14 -1.07 -0.02 0.00 -0.91 0.00 0.00 33.84 32.99 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 -0.85 0.71 0.16 4.52 0.01 -1.26 -5.03 113.70 111.95 2cqp s SER 938 Ca 0.65 -1.42 -0.12 0.00 1.31 0.00 0.00 55.95 56.37 2cqp s SER 938 Cb -0.54 0.73 0.04 0.00 0.21 0.00 0.00 66.02 66.47 2cqp s SER 938 CO 0.55 -1.44 1.64 0.40 0.41 0.00 0.00 173.24 174.81 2cqp h ILE 939 N 2.06 1.26 -0.33 1.44 2.04 -1.99 -0.94 117.51 121.05 2cqp h ILE 939 Ca -0.30 -0.98 -0.02 0.00 1.00 0.00 0.00 64.86 64.57 2cqp h ILE 939 Cb 1.24 0.84 -0.01 0.00 -0.74 0.00 0.00 36.82 38.15 2cqp h ILE 939 CO 0.39 0.35 0.14 -0.78 0.00 0.00 0.00 178.15 178.25 2cqp h ASP 940 N 0.79 0.45 -0.59 1.72 3.58 -1.99 -1.22 116.42 119.15 2cqp h ASP 940 Ca 0.16 -0.16 -0.05 0.00 0.42 0.00 0.00 57.03 57.41 2cqp h ASP 940 Cb 0.43 -0.12 -0.02 0.00 1.72 0.00 0.00 39.33 41.33 2cqp h ASP 940 CO 0.01 0.48 0.18 -0.33 -2.88 0.00 0.00 179.24 176.71 2cqp h GLU 941 N 0.39 0.92 -0.22 0.28 4.39 -1.93 -2.08 114.58 116.32 2cqp h GLU 941 Ca 0.11 -0.20 -0.00 0.00 0.34 0.00 0.00 59.36 59.61 2cqp h GLU 941 Cb 0.17 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.68 2cqp h GLU 941 CO -0.01 0.82 0.13 0.82 -1.16 0.00 0.00 179.01 179.61 2cqp h ILE 942 N 0.84 1.10 -0.84 3.13 2.04 -1.00 0.16 117.51 122.93 2cqp h ILE 942 Ca 0.19 -0.26 0.03 0.00 1.00 0.00 0.00 64.86 65.82 2cqp h ILE 942 Cb 0.29 0.87 -0.05 0.00 -0.74 0.00 0.00 36.82 37.19 2cqp h ILE 942 CO -0.01 0.10 0.54 -0.07 0.00 0.00 0.00 178.15 178.71 2cqp h LEU 943 N 0.26 0.91 -0.78 1.44 3.38 -1.10 -1.69 115.31 117.73 2cqp h LEU 943 Ca 0.08 -0.01 -0.13 0.00 0.09 0.00 0.00 57.88 57.91 2cqp h LEU 943 Cb 0.04 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 2cqp h LEU 943 CO -0.01 0.64 -0.59 -0.78 0.09 0.00 0.00 178.44 177.79 2cqp h ASP 944 N 1.07 0.09 -0.62 -0.43 3.58 -1.09 -2.98 116.42 116.04 2cqp h ASP 944 Ca 0.33 -0.05 -0.07 0.00 0.42 0.00 0.00 57.03 57.65 2cqp h ASP 944 Cb -0.03 -0.03 -0.03 0.00 1.72 0.00 0.00 39.33 40.97 2cqp h ASP 944 CO -0.10 0.65 0.11 0.15 -2.88 0.00 0.00 179.24 177.17 2cqp h PHE 945 N 0.06 1.10 -0.31 0.28 3.04 0.18 -2.06 116.94 119.22 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 -0.31 0.00 0.00 2.56 0.00 0.00 35.95 39.26 2cqp h PHE 945 CO 0.01 0.93 0.00 1.19 -2.02 0.00 0.00 178.31 178.41 2cqp n PHE 946 N -4.22 0.59 -1.49 0.41 3.72 -0.80 -4.96 117.46 110.72 2cqp n PHE 946 Ca 0.04 -0.25 -0.40 0.00 -0.05 0.00 0.00 57.45 56.79 2cqp n PHE 946 Cb 0.28 -0.08 0.02 0.00 -0.94 0.00 0.00 39.48 38.76 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 0.42 -0.33 0.00 1.38 9.36 -0.78 -2.18 117.16 125.03 2cqp n TYR 947 Ca 0.12 0.51 0.00 0.00 3.32 0.00 0.00 57.90 61.85 2cqp n TYR 947 Cb 0.40 -2.01 0.00 0.00 -0.63 0.00 0.00 39.34 37.10 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 1.69 2.80 3.82 2.98 0.00 -1.26 -5.01 105.19 110.20 2cqp n GLY 948 Ca 0.11 -0.22 -0.34 0.00 0.00 0.00 0.00 46.02 45.57 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 -1.79 3.41 -0.85 1.61 2.02 -0.93 -5.03 117.35 115.80 2cqp s TYR 949 Ca 0.00 0.33 -0.25 0.00 -0.37 0.00 0.00 57.07 56.78 2cqp s TYR 949 Cb 0.00 -1.82 0.00 0.00 -0.40 0.00 0.00 41.96 39.74 2cqp s TYR 949 CO 0.00 0.61 1.64 -0.65 -1.57 0.00 0.00 175.55 175.58 2cqp s GLN 950 N -1.47 3.01 -0.20 -0.62 -1.52 -1.26 -4.96 119.66 112.63 2cqp s GLN 950 Ca 0.20 -0.35 -0.24 0.00 -1.95 0.00 0.00 55.36 53.02 2cqp s GLN 950 Cb -0.12 -4.84 -0.01 0.00 -0.22 0.00 0.00 33.01 27.82 2cqp s GLN 950 CO 0.11 -2.64 0.79 0.08 -0.25 0.00 0.00 175.29 173.37 2cqp s VAL 951 N 7.45 4.89 0.12 1.09 1.01 -1.26 -4.59 120.40 129.11 2cqp s VAL 951 Ca 0.55 1.51 -0.35 0.00 0.00 0.00 0.00 61.98 63.69 2cqp s VAL 951 Cb -0.06 -4.09 -0.15 0.00 0.00 0.00 0.00 36.38 32.08 2cqp s VAL 951 CO 0.04 0.01 1.44 -0.38 0.00 0.00 0.00 175.10 176.21 2cqp n ILE 952 N 4.93 0.04 -2.18 2.22 5.41 -1.20 -4.89 119.36 123.68 2cqp n ILE 952 Ca 0.04 -0.01 -0.42 0.00 1.00 0.00 0.00 62.75 63.35 2cqp n ILE 952 Cb 0.48 -1.15 -0.03 0.00 -0.71 0.00 0.00 39.64 38.24 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 0.63 4.29 0.00 0.38 0.04 -1.26 -2.50 135.00 136.58 2cqp s PRO 953 Ca 0.81 2.03 0.00 0.00 0.04 0.00 0.00 61.00 63.88 2cqp s PRO 953 Cb -0.83 -3.47 0.00 0.00 0.04 0.00 0.00 34.50 30.24 2cqp s PRO 953 CO 0.43 -0.54 0.00 0.41 0.04 0.00 0.00 177.00 177.34 2cqp n GLY 954 N 3.62 1.10 0.09 0.56 0.00 -1.26 -4.93 105.19 104.36 2cqp n GLY 954 Ca 0.13 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.07 -0.06 1.61 4.64 -1.86 -3.44 113.55 114.37 2cqp h SER 955 Ca 0.00 -0.54 -0.71 0.00 -0.47 0.00 0.00 61.79 60.07 2cqp h SER 955 Cb 0.00 0.02 -0.03 0.00 -0.31 0.00 0.00 62.40 62.07 2cqp h SER 955 CO 0.00 0.54 1.18 0.52 -0.87 0.00 0.00 176.83 178.20 2cqp n VAL 956 N -4.83 0.00 -4.48 0.95 0.31 -1.25 -4.62 118.33 104.40 2cqp n VAL 956 Ca -0.08 0.00 -0.28 0.00 -0.01 0.00 0.00 64.34 63.96 2cqp n VAL 956 Cb 0.30 -0.46 -0.17 0.00 -0.91 0.00 0.00 33.84 32.60 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 0.96 4.43 -0.19 0.00 1.43 -1.26 -0.08 118.68 123.96 2cqp s LEU 958 Ca -0.07 0.68 -0.10 0.00 -1.03 0.00 0.00 54.13 53.61 2cqp s LEU 958 Cb -0.15 -2.30 -0.05 0.00 0.03 0.00 0.00 46.19 43.72 2cqp s LEU 958 CO -0.01 0.37 0.14 -0.54 0.23 0.00 0.00 176.35 176.54 2cqp s LYS 959 N -1.06 4.12 0.40 1.70 3.01 -0.90 -5.00 119.74 122.00 2cqp s LYS 959 Ca 0.19 -0.19 0.07 0.00 -1.01 0.00 0.00 55.97 55.03 2cqp s LYS 959 Cb -0.14 -3.40 -0.08 0.00 -1.01 0.00 0.00 37.83 33.21 2cqp s LYS 959 CO 0.08 0.34 -0.01 0.71 0.51 0.00 0.00 175.35 176.99 2cqp s TYR 960 N 0.23 2.50 0.50 3.18 2.02 -1.26 -0.79 117.35 123.72 2cqp s TYR 960 Ca 0.09 -0.64 0.04 0.00 -0.37 0.00 0.00 57.07 56.19 2cqp s TYR 960 Cb -0.11 -1.71 0.09 0.00 -0.40 0.00 0.00 41.96 39.83 2cqp s TYR 960 CO -0.01 0.47 0.68 0.27 -1.57 0.00 0.00 175.55 175.39 2cqp n ASN 961 N -0.94 1.33 -0.08 2.29 6.94 -0.04 -4.80 115.26 119.96 2cqp n ASN 961 Ca -0.05 -2.03 -0.06 0.00 -0.02 0.00 0.00 54.58 52.42 2cqp n ASN 961 Cb 0.66 -0.41 -0.00 0.00 -2.36 0.00 0.00 39.78 37.67 2cqp n ASN 961 CO 0.00 0.00 0.00 -0.08 -1.03 0.00 0.00 177.26 176.15 2cqp h GLU 962 N 0.00 0.01 -0.64 -3.83 4.81 -2.02 -1.98 114.58 110.93 2cqp h GLU 962 Ca -0.23 -0.00 0.03 0.00 -0.13 0.00 0.00 59.36 59.03 2cqp h GLU 962 Cb 0.94 -0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.28 2cqp h GLU 962 CO 0.28 0.00 0.39 0.87 -0.73 0.00 0.00 179.01 179.83 2cqp h LYS 963 N 0.01 0.74 0.00 1.92 1.57 -2.04 -3.46 116.57 115.30 2cqp h LYS 963 Ca 0.15 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 2cqp h LYS 963 Cb 0.22 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.37 2cqp h LYS 963 CO -0.31 0.49 0.00 0.41 -0.57 0.00 0.00 179.45 179.47 2cqp n GLY 964 N -1.28 1.30 3.68 3.86 0.00 -0.75 -5.13 105.19 106.87 2cqp n GLY 964 Ca 0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.26 1.61 2.81 -1.26 -4.42 117.12 113.45 2cqp n MET 965 Ca 0.00 0.03 -0.37 0.00 -1.81 0.00 0.00 57.70 55.55 2cqp n MET 965 Cb 0.00 -2.41 -0.01 0.00 -0.71 0.00 0.00 33.22 30.09 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 -4.37 3.85 -0.48 0.03 0.04 -1.26 -0.86 135.00 131.95 2cqp s PRO 966 Ca 0.70 1.81 0.03 0.00 0.04 0.00 0.00 61.00 63.58 2cqp s PRO 966 Cb -0.26 -2.50 0.53 0.00 0.04 0.00 0.00 34.50 32.31 2cqp s PRO 966 CO 0.54 -0.49 1.78 0.25 0.04 0.00 0.00 177.00 179.13 2cqp n THR 967 N -0.30 3.15 -4.42 1.26 -2.24 0.03 -4.77 114.28 106.98 2cqp n THR 967 Ca 0.06 -2.77 -0.37 0.00 -2.27 0.00 0.00 64.05 58.70 2cqp n THR 967 Cb 0.47 -0.78 -0.08 0.00 -2.10 0.00 0.00 70.33 67.84 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 -1.00 -0.28 3.18 3.38 0.00 -1.25 -4.88 105.19 104.34 2cqp n GLY 968 Ca 0.54 0.12 -0.13 0.00 0.00 0.00 0.00 46.02 46.55 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 -7.27 0.51 0.02 1.61 2.02 -1.26 -1.87 118.70 112.46 2cqp s GLU 969 Ca 0.47 -0.05 -0.15 0.00 0.02 0.00 0.00 54.97 55.26 2cqp s GLU 969 Cb -0.27 0.23 0.02 0.00 0.10 0.00 0.00 34.13 34.21 2cqp s GLU 969 CO 1.01 -0.12 0.32 0.00 0.02 0.00 0.00 175.26 176.49 2cqp s ALA 970 N -0.86 -0.77 0.01 5.21 0.00 -0.87 -2.13 121.76 122.36 2cqp s ALA 970 Ca -0.09 0.18 0.06 0.00 0.00 0.00 0.00 51.96 52.11 2cqp s ALA 970 Cb -0.05 0.22 -0.02 0.00 0.00 0.00 0.00 23.12 23.27 2cqp s ALA 970 CO 0.02 -0.35 -0.18 -1.64 0.00 0.00 0.00 175.76 173.61 2cqp s MET 971 N -2.03 1.35 0.16 0.00 -1.94 0.88 -0.38 119.30 117.35 2cqp s MET 971 Ca -0.09 -0.75 0.02 0.00 -1.71 0.00 0.00 55.69 53.16 2cqp s MET 971 Cb -0.03 -1.37 -0.04 0.00 2.01 0.00 0.00 34.83 35.40 2cqp s MET 971 CO 0.00 0.36 -0.00 0.14 -0.01 0.00 0.00 175.02 175.51 2cqp s VAL 972 N -0.60 0.63 0.08 -6.03 -7.23 -0.90 -0.26 120.40 106.09 2cqp s VAL 972 Ca 0.06 -1.97 0.08 0.00 -1.81 0.00 0.00 61.98 58.35 2cqp s VAL 972 Cb -0.08 -2.06 -0.03 0.00 0.56 0.00 0.00 36.38 34.78 2cqp s VAL 972 CO 0.00 -0.53 -0.22 0.00 -0.31 0.00 0.00 175.10 174.05 2cqp s ALA 973 N -3.69 1.86 -0.03 1.32 0.00 -1.26 -0.20 121.76 119.76 2cqp s ALA 973 Ca 0.22 -1.21 0.04 0.00 0.00 0.00 0.00 51.96 51.02 2cqp s ALA 973 Cb 0.06 -0.30 -0.01 0.00 0.00 0.00 0.00 23.12 22.88 2cqp s ALA 973 CO 0.03 0.39 -0.15 -0.06 0.00 0.00 0.00 175.76 175.97 2cqp s PHE 974 N -1.03 1.46 0.15 0.00 0.40 -0.28 -3.27 117.98 115.41 2cqp s PHE 974 Ca 0.08 -0.35 -0.08 0.00 -0.60 0.00 0.00 56.93 55.97 2cqp s PHE 974 Cb -0.10 -0.97 -0.02 0.00 0.51 0.00 0.00 43.02 42.45 2cqp s PHE 974 CO 0.04 -0.09 1.44 0.93 0.70 0.00 0.00 175.22 178.23 2cqp h GLU 975 N 6.04 0.75 -5.24 0.44 5.08 -1.88 -1.78 114.58 118.00 2cqp h GLU 975 Ca -0.34 -0.49 -0.64 0.00 -1.00 0.00 0.00 59.36 56.89 2cqp h GLU 975 Cb 1.16 0.06 -0.22 0.00 0.50 0.00 0.00 28.75 30.26 2cqp h GLU 975 CO 0.48 1.11 -0.66 -1.12 -1.00 0.00 0.00 179.01 177.82 2cqp s SER 976 N -6.95 4.83 0.22 1.42 0.01 -1.26 -4.77 113.70 107.20 2cqp s SER 976 Ca -0.09 -0.15 -0.08 0.00 1.31 0.00 0.00 55.95 56.94 2cqp s SER 976 Cb 0.10 -1.80 0.19 0.00 0.21 0.00 0.00 66.02 64.72 2cqp s SER 976 CO 0.87 0.13 1.87 -0.09 0.41 0.00 0.00 173.24 176.43 2cqp h ARG 977 N 6.98 1.16 -0.70 12.44 2.43 -1.96 -2.12 114.38 132.61 2cqp h ARG 977 Ca -0.33 -0.11 0.00 0.00 -0.81 0.00 0.00 59.98 58.73 2cqp h ARG 977 Cb 1.19 -0.24 -0.03 0.00 -0.42 0.00 0.00 29.97 30.46 2cqp h ARG 977 CO 0.63 0.82 0.44 -0.44 -1.51 0.00 0.00 179.97 179.91 2cqp h ASP 978 N 1.18 0.81 -0.29 -3.80 3.32 -1.99 -2.26 116.42 113.40 2cqp h ASP 978 Ca 0.31 -0.03 -0.06 0.00 0.02 0.00 0.00 57.03 57.26 2cqp h ASP 978 Cb -0.04 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.30 2cqp h ASP 978 CO -0.06 0.61 -0.07 -0.33 -1.72 0.00 0.00 179.24 177.67 2cqp h GLU 979 N 0.95 0.56 -0.17 3.56 5.08 -1.82 -0.99 114.58 121.74 2cqp h GLU 979 Ca 0.25 -0.22 0.03 0.00 -1.00 0.00 0.00 59.36 58.43 2cqp h GLU 979 Cb -0.07 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.11 2cqp h GLU 979 CO -0.05 0.76 -0.04 0.00 -1.00 0.00 0.00 179.01 178.68 2cqp h ALA 980 N 0.78 0.12 -0.41 3.43 0.00 -1.00 0.27 119.26 122.45 2cqp h ALA 980 Ca 0.07 0.07 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 2cqp h ALA 980 Cb 0.55 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 2cqp h ALA 980 CO 0.03 -0.48 0.07 1.15 0.00 0.00 0.00 179.25 180.03 2cqp h THR 981 N 0.01 1.24 -0.59 0.00 2.02 -1.41 -0.16 112.91 114.01 2cqp h THR 981 Ca 0.08 -0.86 -0.01 0.00 0.77 0.00 0.00 66.41 66.39 2cqp h THR 981 Cb 0.12 1.00 -0.03 0.00 -1.74 0.00 0.00 68.15 67.51 2cqp h THR 981 CO -0.17 0.30 0.33 0.00 0.37 0.00 0.00 175.52 176.34 2cqp h ALA 982 N 0.93 0.76 -0.43 6.16 0.00 -0.85 -0.50 119.26 125.33 2cqp h ALA 982 Ca 0.13 -0.10 -0.11 0.00 0.00 0.00 0.00 54.91 54.83 2cqp h ALA 982 Cb 0.36 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2cqp h ALA 982 CO 0.01 0.27 -0.18 0.00 0.00 0.00 0.00 179.25 179.35 2cqp h ALA 983 N 1.15 0.60 -0.09 0.00 0.00 -0.35 -1.68 119.26 118.90 2cqp h ALA 983 Ca 0.21 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 2cqp h ALA 983 Cb 0.03 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 2cqp h ALA 983 CO -0.03 0.55 0.04 0.28 0.00 0.00 0.00 179.25 180.09 2cqp h VAL 984 N 0.71 1.11 -0.32 0.00 2.07 -0.78 0.72 116.25 119.77 2cqp h VAL 984 Ca 0.10 -0.33 -0.01 0.00 0.82 0.00 0.00 66.70 67.28 2cqp h VAL 984 Cb 0.73 1.18 -0.02 0.00 -1.52 0.00 0.00 31.29 31.67 2cqp h VAL 984 CO 0.06 0.10 0.18 0.40 0.02 0.00 0.00 177.57 178.32 2cqp h ILE 985 N 0.02 1.13 0.00 4.57 2.04 -1.09 1.90 117.51 126.08 2cqp h ILE 985 Ca 0.03 -0.35 -0.02 0.00 1.00 0.00 0.00 64.86 65.52 2cqp h ILE 985 Cb 0.12 0.78 -0.00 0.00 -0.74 0.00 0.00 36.82 36.98 2cqp h ILE 985 CO -0.00 0.14 -0.08 0.44 0.00 0.00 0.00 178.15 178.64 2cqp h ASP 986 N 0.40 0.00 -0.12 1.72 5.19 -1.21 -3.03 116.42 119.36 2cqp h ASP 986 Ca 0.11 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.51 2cqp h ASP 986 Cb 0.06 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.56 2cqp h ASP 986 CO -0.02 0.08 -0.04 0.18 -3.12 0.00 0.00 179.24 176.32 2cqp n LEU 987 N -3.17 3.08 -4.75 1.55 4.77 0.25 -4.99 117.00 113.74 2cqp n LEU 987 Ca 0.02 -3.18 -0.40 0.00 -0.03 0.00 0.00 56.01 52.42 2cqp n LEU 987 Cb 0.42 -0.50 -0.05 0.00 -2.33 0.00 0.00 43.42 40.97 2cqp n LEU 987 CO 0.31 0.79 0.53 0.21 -1.33 0.00 0.00 177.39 177.90 2cqp s ASN 988 N -2.54 7.33 -1.42 -1.43 3.84 0.64 -3.86 114.94 117.51 2cqp s ASN 988 Ca 0.37 1.59 -0.08 0.00 0.21 0.00 0.00 52.86 54.95 2cqp s ASN 988 Cb 0.32 -2.51 0.04 0.00 -0.55 0.00 0.00 41.25 38.55 2cqp s ASN 988 CO 0.04 0.03 0.93 0.47 -2.79 0.00 0.00 177.10 175.78 2cqp n ASP 989 N 2.54 -3.73 -4.72 -4.21 8.00 -0.91 -4.94 116.55 108.59 2cqp n ASP 989 Ca -0.02 -0.75 -0.40 0.00 0.71 0.00 0.00 54.79 54.34 2cqp n ASP 989 Cb 0.50 -4.19 -0.05 0.00 -0.02 0.00 0.00 41.12 37.36 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 -6.30 4.44 -1.15 -1.24 1.81 -1.19 -4.73 118.95 110.59 2cqp s ARG 990 Ca 0.40 0.87 -0.23 0.00 -1.72 0.00 0.00 55.73 55.06 2cqp s ARG 990 Cb -0.20 -3.44 -0.08 0.00 -0.45 0.00 0.00 34.95 30.78 2cqp s ARG 990 CO 0.80 0.08 1.94 -1.25 -0.68 0.00 0.00 175.30 176.19 2cqp s PRO 991 N 0.75 2.50 0.03 3.54 0.04 -1.26 -0.80 135.00 139.80 2cqp s PRO 991 Ca 0.37 -1.06 -0.30 0.00 0.04 0.00 0.00 61.00 60.05 2cqp s PRO 991 Cb -0.18 -5.22 -0.04 0.00 0.04 0.00 0.00 34.50 29.10 2cqp s PRO 991 CO 0.18 -3.91 0.98 0.42 0.04 0.00 0.00 177.00 174.71 2cqp s ILE 992 N 10.91 4.77 0.00 0.56 1.01 0.16 -4.72 121.20 133.89 2cqp s ILE 992 Ca 0.69 2.06 0.00 0.00 0.00 0.00 0.00 60.65 63.39 2cqp s ILE 992 Cb -0.01 -4.32 0.00 0.00 0.01 0.00 0.00 42.46 38.14 2cqp s ILE 992 CO 0.12 0.20 0.00 0.61 0.00 0.00 0.00 174.94 175.86 2cqp n GLY 993 N 2.75 0.25 0.00 6.18 0.00 -1.26 -0.29 105.19 112.82 2cqp n GLY 993 Ca 0.05 0.62 0.00 0.00 0.00 0.00 0.00 46.02 46.69 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 3.82 0.28 -4.16 1.61 2.88 -1.26 -5.08 113.62 111.71 2cqp n SER 994 Ca 0.00 -0.71 -0.13 0.00 -1.33 0.00 0.00 58.87 56.69 2cqp n SER 994 Cb 0.00 0.16 -0.11 0.00 -0.75 0.00 0.00 64.21 63.52 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 -0.16 0.82 0.22 -1.46 0.52 0.61 -5.11 118.95 114.38 2cqp s ARG 995 Ca 0.00 -1.17 -0.21 0.00 -0.52 0.00 0.00 55.73 53.83 2cqp s ARG 995 Cb 0.00 -0.42 -0.08 0.00 0.52 0.00 0.00 34.95 34.97 2cqp s ARG 995 CO 0.00 0.05 0.75 0.15 0.02 0.00 0.00 175.30 176.27 2cqp s LYS 996 N -2.98 4.32 0.10 3.54 1.02 -1.26 0.37 119.74 124.85 2cqp s LYS 996 Ca 0.06 0.95 0.03 0.00 0.02 0.00 0.00 55.97 57.03 2cqp s LYS 996 Cb -0.01 -2.92 -0.04 0.00 -0.52 0.00 0.00 37.83 34.34 2cqp s LYS 996 CO -0.01 0.41 0.10 0.14 -0.92 0.00 0.00 175.35 175.06 2cqp s VAL 997 N -1.48 4.55 -0.15 3.17 -7.23 0.02 -4.60 120.40 114.68 2cqp s VAL 997 Ca 0.43 -0.82 -0.01 0.00 -1.81 0.00 0.00 61.98 59.77 2cqp s VAL 997 Cb -0.18 -3.22 -0.02 0.00 0.56 0.00 0.00 36.38 33.53 2cqp s VAL 997 CO 0.22 0.08 -0.11 -0.75 -0.31 0.00 0.00 175.10 174.23 2cqp s LYS 998 N -2.55 3.42 -0.14 4.82 2.47 0.76 -2.14 119.74 126.38 2cqp s LYS 998 Ca 0.30 -0.65 -0.02 0.00 -1.56 0.00 0.00 55.97 54.03 2cqp s LYS 998 Cb -0.12 -2.72 -0.02 0.00 -1.46 0.00 0.00 37.83 33.51 2cqp s LYS 998 CO 0.22 0.16 -0.07 -0.51 0.16 0.00 0.00 175.35 175.31 2cqp s LEU 999 N 0.50 3.06 -0.00 5.43 1.43 -1.26 -1.15 118.68 126.69 2cqp s LEU 999 Ca -0.08 -0.19 0.05 0.00 -1.03 0.00 0.00 54.13 52.88 2cqp s LEU 999 Cb -0.15 -1.72 -0.01 0.00 0.03 0.00 0.00 46.19 44.34 2cqp s LEU 999 CO 0.04 0.18 -0.15 -0.69 0.23 0.00 0.00 176.35 175.96 2cqp s VAL 1000N 0.29 1.19 -0.21 -1.59 1.01 -0.59 -4.96 120.40 115.53 2cqp s VAL 1000Ca -0.06 -0.71 -0.27 0.00 0.00 0.00 0.00 61.98 60.94 2cqp s VAL 1000Cb -0.15 -1.00 -0.00 0.00 0.00 0.00 0.00 36.38 35.23 2cqp s VAL 1000CO 0.04 0.28 0.95 -0.76 0.00 0.00 0.00 175.10 175.61 2cqp s LEU 1001N -0.49 4.13 0.25 3.92 1.43 -1.26 -1.35 118.68 125.31 2cqp s LEU 1001Ca 0.05 1.28 -0.07 0.00 -1.03 0.00 0.00 54.13 54.36 2cqp s LEU 1001Cb -0.06 -3.41 0.45 0.00 0.03 0.00 0.00 46.19 43.20 2cqp s LEU 1001CO -0.00 -0.56 1.62 1.23 0.23 0.00 0.00 176.35 178.87 2cqp h GLY 1002N 9.02 0.83 -7.13 -3.19 0.00 -0.95 -3.37 103.07 98.27 2cqp h GLY 1002Ca -0.23 0.15 -0.48 0.00 0.00 0.00 0.00 47.33 46.77 2cqp h GLY 1002CO 0.91 -0.32 -0.77 -0.45 0.00 0.00 0.00 176.54 175.92 2cqp s SER 1003N -5.18 2.27 0.00 0.19 0.15 -1.26 -4.68 113.70 105.19 2cqp s SER 1003Ca -0.14 -0.46 0.00 0.00 0.70 0.00 0.00 55.95 56.05 2cqp s SER 1003Cb 0.23 -0.53 0.00 0.00 -1.71 0.00 0.00 66.02 64.01 2cqp s SER 1003CO 0.76 -0.25 0.00 0.61 1.20 0.00 0.00 173.24 175.56 2cqp n GLY 1004N 5.09 0.66 0.23 9.45 0.00 -1.26 -4.92 105.19 114.44 2cqp n GLY 1004Ca -0.08 -2.14 -0.13 0.00 0.00 0.00 0.00 46.02 43.67 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 2.40 0.77 -1.77 1.61 0.13 -1.99 -3.46 132.00 129.69 2cqp h PRO 1005Ca 0.00 -0.40 -0.36 0.00 -0.87 0.00 0.00 66.00 64.36 2cqp h PRO 1005Cb 0.00 0.01 -0.08 0.00 0.13 0.00 0.00 31.00 31.07 2cqp h PRO 1005CO 0.00 1.03 -0.40 0.43 -0.23 0.00 0.00 178.00 178.83 2cqp n SER 1006N -4.21 -5.21 -3.80 1.44 7.64 -1.26 -4.81 113.62 103.42 2cqp n SER 1006Ca -0.03 0.20 -0.54 0.00 1.01 0.00 0.00 58.87 59.50 2cqp n SER 1006Cb 0.49 -4.28 -0.10 0.00 -1.01 0.00 0.00 64.21 59.31 2cqp n SER 1006CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2cqp n SER 1007N -1.19 0.80 0.00 6.43 3.41 -1.26 -5.31 113.62 116.49 2cqp n SER 1007Ca -0.20 0.75 0.00 0.00 -0.26 0.00 0.00 58.87 59.17 2cqp n SER 1007Cb 0.63 -0.76 0.01 0.00 -0.26 0.00 0.00 64.21 63.83 2cqp n SER 1007CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49