#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ab3 s VAL 2 N 0.00 4.30 0.09 2.03 1.01 -1.26 -1.14 120.40 125.42 2ab3 s VAL 2 Ca 0.00 1.77 0.02 0.00 0.00 0.00 0.00 61.98 63.77 2ab3 s VAL 2 Cb 0.00 -4.14 -0.04 0.00 0.00 0.00 0.00 36.38 32.20 2ab3 s VAL 2 CO 0.00 0.44 -0.07 -0.31 0.00 0.00 0.00 175.10 175.16 2ab3 s TYR 3 N -1.25 0.86 -0.26 5.22 1.51 -0.52 -4.93 117.35 117.98 2ab3 s TYR 3 Ca 0.39 -0.82 0.03 0.00 -1.01 0.00 0.00 57.07 55.67 2ab3 s TYR 3 Cb -0.23 -0.50 0.06 0.00 -0.11 0.00 0.00 41.96 41.19 2ab3 s TYR 3 CO 0.27 -0.12 -0.10 0.54 -1.11 0.00 0.00 175.55 175.02 2ab3 s VAL 4 N -3.11 2.12 -1.17 0.71 0.11 -1.26 -0.84 120.40 116.96 2ab3 s VAL 4 Ca 0.07 -1.63 -0.08 0.00 -2.93 0.00 0.00 61.98 57.41 2ab3 s VAL 4 Cb 0.02 -2.26 -0.10 0.00 -1.53 0.00 0.00 36.38 32.51 2ab3 s VAL 4 CO -0.03 -0.06 2.76 0.00 -3.33 0.00 0.00 175.10 174.44 2ab3 n HIS 6 N 3.59 0.00 -1.52 0.00 -0.00 -1.24 -2.13 115.22 113.93 2ab3 n HIS 6 Ca 0.63 0.00 -0.33 0.00 0.46 0.00 0.00 57.72 58.48 2ab3 n HIS 6 Cb 0.29 -0.02 0.08 0.00 -0.12 0.00 0.00 29.99 30.21 2ab3 n HIS 6 CO 0.00 0.00 0.00 0.12 0.46 0.00 0.00 176.34 176.92 2ab3 s PHE 7 N -1.50 2.37 0.00 1.57 5.36 -1.26 -4.57 117.98 119.95 2ab3 s PHE 7 Ca 0.00 1.59 0.00 0.00 -0.96 0.00 0.00 56.93 57.56 2ab3 s PHE 7 Cb 0.00 -3.26 0.00 0.00 -0.34 0.00 0.00 43.02 39.42 2ab3 s PHE 7 CO 0.00 -2.06 0.57 0.39 -1.46 0.00 0.00 175.22 172.67 2ab3 n GLU 8 N -2.78 0.45 -0.06 10.12 -0.58 -1.26 -1.46 120.64 125.06 2ab3 n GLU 8 Ca 0.11 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.85 2ab3 n GLU 8 Cb 0.52 -1.28 0.00 0.00 -0.57 0.00 0.00 31.44 30.11 2ab3 n GLU 8 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 2ab3 n ASN 9 N 1.06 0.00 0.14 1.62 5.15 -1.26 -5.04 115.26 116.92 2ab3 n ASN 9 Ca 0.00 -1.01 0.00 0.00 -0.60 0.00 0.00 54.58 52.97 2ab3 n ASN 9 Cb 0.22 -0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.47 2ab3 n ASN 9 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2ab3 n GLY 11 N 0.27 -0.31 3.97 0.00 0.00 -1.04 -4.98 105.19 103.10 2ab3 n GLY 11 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 2ab3 n GLY 11 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ab3 s ARG 12 N -4.95 2.95 0.01 1.61 1.81 -0.90 -4.85 118.95 114.62 2ab3 s ARG 12 Ca 0.00 -1.15 0.03 0.00 -1.72 0.00 0.00 55.73 52.90 2ab3 s ARG 12 Cb 0.00 -2.73 -0.01 0.00 -0.45 0.00 0.00 34.95 31.76 2ab3 s ARG 12 CO 0.00 -0.04 -0.11 -1.54 -0.68 0.00 0.00 175.30 172.93 2ab3 s SER 13 N -4.20 1.27 -0.10 0.23 1.04 -1.26 -0.58 113.70 110.10 2ab3 s SER 13 Ca 0.47 -0.27 -0.02 0.00 0.48 0.00 0.00 55.95 56.61 2ab3 s SER 13 Cb -0.09 -0.11 0.04 0.00 0.10 0.00 0.00 66.02 65.96 2ab3 s SER 13 CO 0.31 0.08 0.04 -0.36 0.98 0.00 0.00 173.24 174.29 2ab3 s PHE 14 N -0.45 0.45 -0.45 5.02 0.08 -0.02 -4.95 117.98 117.66 2ab3 s PHE 14 Ca 0.02 -0.17 0.00 0.00 0.12 0.00 0.00 56.93 56.90 2ab3 s PHE 14 Cb -0.05 -0.72 0.00 0.00 -0.57 0.00 0.00 43.02 41.68 2ab3 s PHE 14 CO 0.00 -0.37 0.49 0.09 -0.10 0.00 0.00 175.22 175.33 2ab3 n ASN 15 N 5.20 1.33 -3.65 1.36 3.02 -1.26 -1.44 115.26 119.83 2ab3 n ASN 15 Ca -0.06 -1.26 -0.14 0.00 -0.03 0.00 0.00 54.58 53.09 2ab3 n ASN 15 Cb 0.49 -0.31 -0.08 0.00 -0.61 0.00 0.00 39.78 39.27 2ab3 n ASN 15 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2ab3 s ASP 16 N 0.39 -0.63 0.21 6.41 2.15 -1.24 -4.54 116.67 119.41 2ab3 s ASP 16 Ca 0.00 1.10 -0.10 0.00 0.43 0.00 0.00 52.55 53.98 2ab3 s ASP 16 Cb 0.00 1.10 0.15 0.00 -0.30 0.00 0.00 42.92 43.87 2ab3 s ASP 16 CO 0.00 -0.29 1.88 -0.09 -0.17 0.00 0.00 175.17 176.50 2ab3 h ARG 17 N 4.74 0.98 -0.79 4.34 2.43 -1.40 -2.11 114.38 122.57 2ab3 h ARG 17 Ca -0.28 -0.06 -0.02 0.00 -0.81 0.00 0.00 59.98 58.81 2ab3 h ARG 17 Cb 1.16 -0.22 -0.04 0.00 -0.42 0.00 0.00 29.97 30.45 2ab3 h ARG 17 CO 0.17 0.65 0.42 -0.09 -1.51 0.00 0.00 179.97 179.61 2ab3 h ARG 18 N 1.01 1.10 -0.04 0.20 1.12 -1.97 0.24 114.38 116.04 2ab3 h ARG 18 Ca 0.27 -0.13 -0.13 0.00 -1.11 0.00 0.00 59.98 58.88 2ab3 h ARG 18 Cb -0.12 -0.22 -0.01 0.00 -0.01 0.00 0.00 29.97 29.61 2ab3 h ARG 18 CO -0.06 0.81 -0.58 0.87 -3.11 0.00 0.00 179.97 177.91 2ab3 h LYS 19 N 1.11 0.14 0.04 0.20 1.57 -1.88 -1.14 116.57 116.60 2ab3 h LYS 19 Ca 0.28 -0.09 -0.14 0.00 -1.87 0.00 0.00 60.65 58.82 2ab3 h LYS 19 Cb 0.04 0.01 0.01 0.00 0.08 0.00 0.00 32.23 32.37 2ab3 h LYS 19 CO -0.04 0.68 -0.58 1.25 -0.57 0.00 0.00 179.45 180.19 2ab3 h LEU 20 N 0.11 0.43 -0.55 2.94 5.85 -0.92 -3.02 115.31 120.15 2ab3 h LEU 20 Ca -0.00 -0.83 0.02 0.00 0.84 0.00 0.00 57.88 57.91 2ab3 h LEU 20 Cb 1.05 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 41.91 2ab3 h LEU 20 CO 0.08 1.22 0.33 -1.13 -0.34 0.00 0.00 178.44 178.60 2ab3 h ASN 21 N -0.30 0.54 0.51 1.25 -1.24 -0.50 0.37 115.58 116.21 2ab3 h ASN 21 Ca -0.08 0.00 -0.07 0.00 0.71 0.00 0.00 56.30 56.86 2ab3 h ASN 21 Cb 1.35 -0.11 -0.01 0.00 0.73 0.00 0.00 38.32 40.28 2ab3 h ASN 21 CO 0.11 0.38 -0.32 0.08 -1.29 0.00 0.00 177.43 176.39 2ab3 h ARG 22 N 0.65 0.00 0.17 6.67 -0.00 -1.35 -3.18 114.38 117.34 2ab3 h ARG 22 Ca 0.22 0.00 -0.34 0.00 -0.00 0.00 0.00 59.98 59.86 2ab3 h ARG 22 Cb 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 29.99 2ab3 h ARG 22 CO -0.10 0.32 -1.72 1.25 -0.00 0.00 0.00 179.97 179.73 2ab3 h HIS 23 N 0.00 0.64 -0.53 4.08 2.76 -1.14 -3.35 115.15 117.61 2ab3 h HIS 23 Ca -0.00 -0.47 0.15 0.00 -2.20 0.00 0.00 60.37 57.85 2ab3 h HIS 23 Cb 0.66 -0.03 -0.02 0.00 1.55 0.00 0.00 27.41 29.58 2ab3 h HIS 23 CO 0.00 1.61 0.39 0.87 -1.30 0.00 0.00 177.93 179.50 2ab3 h LYS 24 N 0.10 0.00 -0.84 5.26 1.79 -0.28 0.10 116.57 122.69 2ab3 h LYS 24 Ca -0.33 0.00 0.16 0.00 -2.18 0.00 0.00 60.65 58.30 2ab3 h LYS 24 Cb 2.08 0.00 -0.10 0.00 -1.58 0.00 0.00 32.23 32.63 2ab3 h LYS 24 CO 0.17 0.00 0.41 -0.22 -1.08 0.00 0.00 179.45 178.73 2ab3 h LYS 25 N 0.00 0.54 0.00 3.15 3.64 -1.70 -1.12 116.57 121.08 2ab3 h LYS 25 Ca 0.25 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.60 2ab3 h LYS 25 Cb 1.04 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.73 2ab3 h LYS 25 CO -0.00 0.36 0.00 -0.89 -2.27 0.00 0.00 179.45 176.64 2ab3 n ILE 26 N -4.92 0.13 -0.00 2.00 5.41 0.02 -0.41 119.36 121.59 2ab3 n ILE 26 Ca 0.17 0.03 0.00 0.00 1.00 0.00 0.00 62.75 63.96 2ab3 n ILE 26 Cb 0.47 -0.81 0.00 0.00 -0.71 0.00 0.00 39.64 38.59 2ab3 n ILE 26 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 176.55 177.96 2ab3 n HIS 27 N -1.06 0.00 -0.01 1.39 8.25 -0.45 -4.63 115.22 118.72 2ab3 n HIS 27 Ca 0.10 -0.48 -0.01 0.00 -0.26 0.00 0.00 57.72 57.07 2ab3 n HIS 27 Cb 0.06 -0.05 -0.01 0.00 1.12 0.00 0.00 29.99 31.11 2ab3 n HIS 27 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 2ab3 n THR 28 N -0.48 0.12 -1.62 1.59 -1.04 0.27 -5.09 114.28 108.02 2ab3 n THR 28 Ca 0.00 -0.08 0.00 0.00 -2.04 0.00 0.00 64.05 61.93 2ab3 n THR 28 Cb 0.24 -0.87 0.00 0.00 -1.82 0.00 0.00 70.33 67.88 2ab3 n THR 28 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04