#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pv0 h ARG 2 N 0.00 0.00 -3.69 2.12 2.43 -2.05 -3.42 114.38 109.77 1pv0 h ARG 2 Ca 0.00 0.00 -0.75 0.00 -0.81 0.00 0.00 59.98 58.42 1pv0 h ARG 2 Cb 0.00 0.00 -0.30 0.00 -0.42 0.00 0.00 29.97 29.25 1pv0 h ARG 2 CO 0.00 0.88 -0.09 0.15 -1.51 0.00 0.00 179.97 179.41 1pv0 s LYS 3 N -2.22 3.19 -0.13 0.20 1.02 -1.26 -5.02 119.74 115.53 1pv0 s LYS 3 Ca -0.21 -2.56 -0.14 0.00 0.02 0.00 0.00 55.97 53.08 1pv0 s LYS 3 Cb 0.00 -4.13 0.04 0.00 -0.52 0.00 0.00 37.83 33.22 1pv0 s LYS 3 CO 0.59 -1.24 0.40 -0.51 -0.92 0.00 0.00 175.35 173.66 1pv0 s LEU 4 N -0.07 0.49 0.55 3.17 1.43 -1.26 -5.10 118.68 117.89 1pv0 s LEU 4 Ca 0.18 0.72 -0.07 0.00 -1.03 0.00 0.00 54.13 53.94 1pv0 s LEU 4 Cb -0.14 1.38 -0.02 0.00 0.03 0.00 0.00 46.19 47.44 1pv0 s LEU 4 CO -0.07 -0.19 0.87 -0.94 0.23 0.00 0.00 176.35 176.26 1pv0 s SER 5 N -0.00 6.03 0.58 2.29 1.04 -1.26 -4.79 113.70 117.59 1pv0 s SER 5 Ca -0.02 0.96 0.27 0.00 0.48 0.00 0.00 55.95 57.64 1pv0 s SER 5 Cb -0.03 -2.11 1.68 0.00 0.10 0.00 0.00 66.02 65.66 1pv0 s SER 5 CO 0.01 -0.80 2.18 0.44 0.98 0.00 0.00 173.24 176.06 1pv0 h ASP 6 N -0.02 0.00 0.17 7.02 3.32 -2.02 0.92 116.42 125.81 1pv0 h ASP 6 Ca -0.46 0.00 -0.24 0.00 0.02 0.00 0.00 57.03 56.35 1pv0 h ASP 6 Cb 1.22 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.78 1pv0 h ASP 6 CO 0.61 0.00 -0.95 -0.33 -1.72 0.00 0.00 179.24 176.85 1pv0 h GLU 7 N 0.00 0.55 0.11 3.56 5.08 -1.97 0.90 114.58 122.81 1pv0 h GLU 7 Ca 0.04 -0.57 -0.27 0.00 -1.00 0.00 0.00 59.36 57.55 1pv0 h GLU 7 Cb 0.19 0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.60 1pv0 h GLU 7 CO -0.00 1.19 -1.28 -0.07 -1.00 0.00 0.00 179.01 177.85 1pv0 h LEU 8 N 0.32 0.36 -0.03 1.33 -0.00 -1.43 -2.16 115.31 113.71 1pv0 h LEU 8 Ca -0.09 -0.41 -0.16 0.00 -0.00 0.00 0.00 57.88 57.21 1pv0 h LEU 8 Cb 1.59 -0.12 0.01 0.00 -0.00 0.00 0.00 40.66 42.14 1pv0 h LEU 8 CO 0.18 1.33 -0.61 0.25 -0.00 0.00 0.00 178.44 179.58 1pv0 h LEU 9 N 0.06 0.59 -0.59 1.67 5.85 0.74 -2.89 115.31 120.73 1pv0 h LEU 9 Ca -0.14 -0.73 -0.15 0.00 0.84 0.00 0.00 57.88 57.70 1pv0 h LEU 9 Cb 1.96 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 42.80 1pv0 h LEU 9 CO 0.19 1.23 -0.58 0.40 -0.34 0.00 0.00 178.44 179.34 1pv0 h ILE 10 N -0.00 1.35 0.00 4.05 2.04 -0.94 -2.66 117.51 121.35 1pv0 h ILE 10 Ca -0.07 -1.89 -0.03 0.00 1.00 0.00 0.00 64.86 63.87 1pv0 h ILE 10 Cb 1.30 1.89 -0.00 0.00 -0.74 0.00 0.00 36.82 39.27 1pv0 h ILE 10 CO 0.12 0.57 -0.16 -0.33 0.00 0.00 0.00 178.15 178.35 1pv0 h GLU 11 N 0.29 0.00 -0.05 2.37 4.39 -1.44 0.26 114.58 120.40 1pv0 h GLU 11 Ca -0.00 0.00 -0.17 0.00 0.34 0.00 0.00 59.36 59.53 1pv0 h GLU 11 Cb 1.10 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.76 1pv0 h GLU 11 CO 0.10 0.16 -0.64 0.66 -1.16 0.00 0.00 179.01 178.13 1pv0 h SER 12 N 0.00 0.66 -0.49 1.42 4.64 -1.27 0.46 113.55 118.97 1pv0 h SER 12 Ca -0.00 -0.70 -0.10 0.00 -0.47 0.00 0.00 61.79 60.52 1pv0 h SER 12 Cb 0.31 -0.20 -0.02 0.00 -0.31 0.00 0.00 62.40 62.18 1pv0 h SER 12 CO 0.02 1.26 -0.07 0.22 -0.87 0.00 0.00 176.83 177.39 1pv0 h TYR 13 N 0.11 1.04 -0.08 4.77 3.20 -1.10 0.55 116.97 125.46 1pv0 h TYR 13 Ca -0.06 -0.19 -0.06 0.00 3.14 0.00 0.00 58.73 61.55 1pv0 h TYR 13 Cb 1.31 -0.27 0.00 0.00 1.54 0.00 0.00 36.73 39.31 1pv0 h TYR 13 CO 0.12 0.97 -0.20 0.74 -1.64 0.00 0.00 178.16 178.15 1pv0 h PHE 14 N 0.86 0.35 -0.37 -3.82 -1.00 -0.50 -1.45 116.94 111.00 1pv0 h PHE 14 Ca 0.14 -0.13 -0.03 0.00 2.81 0.00 0.00 57.97 60.76 1pv0 h PHE 14 Cb 0.60 -0.06 -0.02 0.00 3.61 0.00 0.00 35.95 40.08 1pv0 h PHE 14 CO 0.04 0.81 0.11 0.87 -1.61 0.00 0.00 178.31 178.53 1pv0 h LYS 15 N -0.21 0.57 -0.66 1.51 1.79 0.02 -2.39 116.57 117.20 1pv0 h LYS 15 Ca -0.00 -0.13 -0.04 0.00 -2.18 0.00 0.00 60.65 58.30 1pv0 h LYS 15 Cb 0.80 -0.08 -0.03 0.00 -1.58 0.00 0.00 32.23 31.34 1pv0 h LYS 15 CO 0.04 0.59 0.24 0.00 -1.08 0.00 0.00 179.45 179.25 1pv0 h ALA 16 N 0.95 1.18 -0.15 3.86 0.00 0.05 -1.08 119.26 124.07 1pv0 h ALA 16 Ca 0.12 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.77 1pv0 h ALA 16 Cb 0.26 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1pv0 h ALA 16 CO -0.00 0.59 -0.23 1.79 0.00 0.00 0.00 179.25 181.39 1pv0 h THR 17 N 0.96 1.23 -0.01 0.00 1.35 -1.07 0.60 112.91 115.98 1pv0 h THR 17 Ca 0.22 -1.08 -0.09 0.00 -0.55 0.00 0.00 66.41 64.90 1pv0 h THR 17 Cb 0.22 1.37 0.01 0.00 -1.73 0.00 0.00 68.15 68.02 1pv0 h THR 17 CO -0.02 0.33 -0.36 -0.33 -0.25 0.00 0.00 175.52 174.89 1pv0 h GLU 18 N 0.25 0.27 0.00 4.72 5.08 -0.90 -3.28 114.58 120.71 1pv0 h GLU 18 Ca 0.04 -0.27 0.00 0.00 -1.00 0.00 0.00 59.36 58.13 1pv0 h GLU 18 Cb 0.55 0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.87 1pv0 h GLU 18 CO 0.04 0.97 -0.15 0.00 -1.00 0.00 0.00 179.01 178.87 1pv0 n MET 19 N -4.41 0.24 -2.76 2.33 0.00 -0.46 -4.93 117.12 107.12 1pv0 n MET 19 Ca -0.10 0.16 -0.06 0.00 0.00 0.00 0.00 57.70 57.70 1pv0 n MET 19 Cb 0.55 -1.74 0.02 0.00 0.00 0.00 0.00 33.22 32.05 1pv0 n MET 19 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 175.97 176.06 1pv0 n ASN 20 N -2.13 -3.15 -4.53 3.17 3.02 0.18 -5.01 115.26 106.81 1pv0 n ASN 20 Ca 0.05 -0.14 -0.32 0.00 -0.03 0.00 0.00 54.58 54.14 1pv0 n ASN 20 Cb 0.42 -1.73 0.14 0.00 -0.61 0.00 0.00 39.78 37.99 1pv0 n ASN 20 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 1pv0 n LEU 21 N -1.68 1.45 -4.50 3.41 0.00 0.61 -4.81 117.00 111.48 1pv0 n LEU 21 Ca -0.00 0.40 -0.55 0.00 0.00 0.00 0.00 56.01 55.86 1pv0 n LEU 21 Cb 0.52 -1.33 -0.06 0.00 0.00 0.00 0.00 43.42 42.55 1pv0 n LEU 21 CO 0.17 -2.94 0.52 -3.20 0.00 0.00 0.00 177.39 171.94 1pv0 n ASN 22 N -2.44 0.14 0.09 1.96 5.15 -1.26 -4.67 115.26 114.23 1pv0 n ASN 22 Ca 0.09 1.15 0.19 0.00 -0.60 0.00 0.00 54.58 55.41 1pv0 n ASN 22 Cb 0.53 -1.00 0.75 0.00 -0.53 0.00 0.00 39.78 39.53 1pv0 n ASN 22 CO 0.00 0.00 0.00 -0.09 1.40 0.00 0.00 177.26 178.57 1pv0 h ARG 23 N 2.85 0.00 -0.32 1.20 9.65 -1.99 0.17 114.38 125.95 1pv0 h ARG 23 Ca -0.45 0.00 -0.13 0.00 -1.10 0.00 0.00 59.98 58.30 1pv0 h ARG 23 Cb 1.41 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.98 1pv0 h ARG 23 CO 0.66 0.00 -0.33 0.22 2.80 0.00 0.00 179.97 183.32 1pv0 h ASP 24 N 0.00 0.72 -0.05 -3.80 1.82 -1.98 0.11 116.42 113.25 1pv0 h ASP 24 Ca 0.18 -0.30 -0.21 0.00 -0.39 0.00 0.00 57.03 56.31 1pv0 h ASP 24 Cb 0.89 -0.20 0.01 0.00 0.68 0.00 0.00 39.33 40.71 1pv0 h ASP 24 CO -0.00 0.99 -0.80 0.15 -1.61 0.00 0.00 179.24 177.97 1pv0 h PHE 25 N 0.59 0.90 -0.62 0.28 3.57 -1.33 0.11 116.94 120.44 1pv0 h PHE 25 Ca 0.06 -0.46 -0.02 0.00 3.53 0.00 0.00 57.97 61.09 1pv0 h PHE 25 Cb 0.84 -0.12 -0.03 0.00 2.79 0.00 0.00 35.95 39.44 1pv0 h PHE 25 CO 0.04 1.28 0.31 0.82 -2.23 0.00 0.00 178.31 178.53 1pv0 h ILE 26 N 0.27 1.21 -0.05 1.41 2.04 -1.23 0.25 117.51 121.40 1pv0 h ILE 26 Ca -0.09 -0.58 -0.17 0.00 1.00 0.00 0.00 64.86 65.02 1pv0 h ILE 26 Cb 1.46 0.45 -0.01 0.00 -0.74 0.00 0.00 36.82 37.99 1pv0 h ILE 26 CO 0.16 0.24 -0.71 -0.08 0.00 0.00 0.00 178.15 177.76 1pv0 h GLU 27 N 0.85 0.28 -0.15 2.37 4.81 -0.78 -1.19 114.58 120.76 1pv0 h GLU 27 Ca 0.21 -0.23 -0.02 0.00 -0.13 0.00 0.00 59.36 59.20 1pv0 h GLU 27 Cb 0.10 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.52 1pv0 h GLU 27 CO -0.03 0.88 0.02 1.25 -0.73 0.00 0.00 179.01 180.40 1pv0 h LEU 28 N 0.19 0.25 -1.04 1.64 6.46 -0.27 0.85 115.31 123.38 1pv0 h LEU 28 Ca -0.02 -0.28 -0.10 0.00 -0.12 0.00 0.00 57.88 57.37 1pv0 h LEU 28 Cb 1.27 -0.07 -0.01 0.00 -0.73 0.00 0.00 40.66 41.12 1pv0 h LEU 28 CO 0.11 0.46 -0.36 0.40 -0.62 0.00 0.00 178.44 178.43 1pv0 h ILE 29 N 0.02 1.29 0.00 4.05 2.04 -0.52 -2.13 117.51 122.26 1pv0 h ILE 29 Ca 0.04 -1.39 -0.20 0.00 1.00 0.00 0.00 64.86 64.31 1pv0 h ILE 29 Cb 0.32 1.61 -0.01 0.00 -0.74 0.00 0.00 36.82 38.01 1pv0 h ILE 29 CO 0.00 0.41 -0.88 -0.08 0.00 0.00 0.00 178.15 177.61 1pv0 h GLU 30 N 0.18 0.23 0.00 2.37 4.81 -0.95 -2.03 114.58 119.20 1pv0 h GLU 30 Ca 0.02 -0.25 -0.08 0.00 -0.13 0.00 0.00 59.36 58.92 1pv0 h GLU 30 Cb 0.73 0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.18 1pv0 h GLU 30 CO 0.06 0.98 -0.37 -0.91 -0.73 0.00 0.00 179.01 178.03 1pv0 h ASN 31 N 0.13 0.00 0.07 1.04 2.35 0.11 0.41 115.58 119.69 1pv0 h ASN 31 Ca -0.05 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 55.60 1pv0 h ASN 31 Cb 1.51 0.00 0.01 0.00 0.05 0.00 0.00 38.32 39.89 1pv0 h ASN 31 CO 0.14 0.37 -0.47 -0.08 -1.65 0.00 0.00 177.43 175.74 1pv0 h GLU 32 N 0.00 0.15 -0.15 0.81 4.57 -1.34 -2.06 114.58 116.57 1pv0 h GLU 32 Ca -0.00 -0.26 -0.04 0.00 -1.18 0.00 0.00 59.36 57.87 1pv0 h GLU 32 Cb 0.70 0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 29.37 1pv0 h GLU 32 CO 0.05 1.12 -0.09 0.82 -1.18 0.00 0.00 179.01 179.73 1pv0 h ILE 33 N -0.68 1.16 -0.06 2.32 2.04 -1.28 0.50 117.51 121.50 1pv0 h ILE 33 Ca -0.09 -0.68 -0.04 0.00 1.00 0.00 0.00 64.86 65.05 1pv0 h ILE 33 Cb 1.34 1.15 0.00 0.00 -0.74 0.00 0.00 36.82 38.57 1pv0 h ILE 33 CO 0.07 0.21 -0.13 0.11 0.00 0.00 0.00 178.15 178.41 1pv0 h LYS 34 N 0.22 0.20 0.00 2.37 1.57 -0.24 0.13 116.57 120.83 1pv0 h LYS 34 Ca 0.05 -0.13 -0.04 0.00 -1.87 0.00 0.00 60.65 58.66 1pv0 h LYS 34 Cb 0.31 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.63 1pv0 h LYS 34 CO 0.02 0.72 -0.19 -0.09 -0.57 0.00 0.00 179.45 179.34 1pv0 h ARG 35 N -0.29 0.00 -0.06 3.15 2.43 -1.05 -2.61 114.38 115.95 1pv0 h ARG 35 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1pv0 h ARG 35 Cb 0.72 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.27 1pv0 h ARG 35 CO 0.03 0.19 0.00 0.54 -1.51 0.00 0.00 179.97 179.22 1pv0 n ARG 36 N -3.36 1.23 -2.96 0.20 1.74 0.17 -4.88 116.66 108.80 1pv0 n ARG 36 Ca 0.00 -0.36 -0.21 0.00 -0.77 0.00 0.00 57.85 56.52 1pv0 n ARG 36 Cb 0.40 -1.27 0.03 0.00 -1.02 0.00 0.00 32.46 30.60 1pv0 n ARG 36 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1pv0 n SER 37 N -0.38 -5.86 -0.45 0.55 2.88 -0.98 -4.89 113.62 104.49 1pv0 n SER 37 Ca 0.12 -0.27 0.07 0.00 -1.33 0.00 0.00 58.87 57.47 1pv0 n SER 37 Cb 0.14 -4.68 0.15 0.00 -0.75 0.00 0.00 64.21 59.06 1pv0 n SER 37 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 1pv0 n LEU 38 N -3.78 2.22 0.00 2.46 7.94 0.45 -4.75 117.00 121.54 1pv0 n LEU 38 Ca -0.11 -3.20 0.06 0.00 -1.11 0.00 0.00 56.01 51.65 1pv0 n LEU 38 Cb 0.61 -0.41 0.29 0.00 0.53 0.00 0.00 43.42 44.44 1pv0 n LEU 38 CO 0.44 0.96 0.70 0.61 -1.11 0.00 0.00 177.39 179.00 1pv0 n GLY 39 N -1.03 -0.93 0.08 -3.96 0.00 -1.13 -2.07 105.19 96.15 1pv0 n GLY 39 Ca 0.15 -0.05 -0.06 0.00 0.00 0.00 0.00 46.02 46.07 1pv0 n GLY 39 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 173.32 174.44 1pv0 h HIS 40 N 0.00 0.00 -0.22 1.61 2.07 -1.91 -3.24 115.15 113.46 1pv0 h HIS 40 Ca 0.00 0.00 -0.05 0.00 -2.85 0.00 0.00 60.37 57.47 1pv0 h HIS 40 Cb 0.22 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.18 1pv0 h HIS 40 CO 0.00 0.92 -0.10 0.97 -3.07 0.00 0.00 177.93 176.64 1pv0 h ILE 41 N 0.00 1.19 -4.08 6.12 6.09 -1.80 -3.44 117.51 121.60 1pv0 h ILE 41 Ca -0.05 -0.84 -0.48 0.00 -1.37 0.00 0.00 64.86 62.12 1pv0 h ILE 41 Cb 1.74 1.14 0.01 0.00 0.47 0.00 0.00 36.82 40.19 1pv0 h ILE 41 CO 0.11 0.27 0.32 0.27 -3.07 0.00 0.00 178.15 176.05 1pv0 s ILE 42 N -4.77 4.58 -1.22 2.19 -4.36 -1.22 -4.93 121.20 111.46 1pv0 s ILE 42 Ca -0.06 1.10 -0.12 0.00 -0.26 0.00 0.00 60.65 61.31 1pv0 s ILE 42 Cb 0.15 -3.72 -0.06 0.00 1.25 0.00 0.00 42.46 40.08 1pv0 s ILE 42 CO 0.75 -0.64 2.36 -0.24 0.24 0.00 0.00 174.94 177.41 1pv0 n SER 43 N -1.48 5.38 -4.31 4.36 2.88 -1.26 -4.85 113.62 114.34 1pv0 n SER 43 Ca 0.06 -2.58 -0.27 0.00 -1.33 0.00 0.00 58.87 54.75 1pv0 n SER 43 Cb 0.54 -1.36 -0.13 0.00 -0.75 0.00 0.00 64.21 62.50 1pv0 n SER 43 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 1pv0 s VAL 44 N 3.30 1.90 -0.73 2.46 1.01 -1.26 -5.09 120.40 121.98 1pv0 s VAL 44 Ca 0.54 -1.47 -0.07 0.00 0.00 0.00 0.00 61.98 60.97 1pv0 s VAL 44 Cb 0.14 -1.68 0.19 0.00 0.00 0.00 0.00 36.38 35.03 1pv0 s VAL 44 CO -0.03 0.12 0.60 -0.94 0.00 0.00 0.00 175.10 174.86 1pv0 s SER 45 N -1.62 5.91 0.00 3.32 1.04 -1.26 -4.93 113.70 116.16 1pv0 s SER 45 Ca 0.09 -2.87 0.00 0.00 0.48 0.00 0.00 55.95 53.65 1pv0 s SER 45 Cb -0.10 -2.00 0.00 0.00 0.10 0.00 0.00 66.02 64.02 1pv0 s SER 45 CO 0.04 -0.43 0.03 -1.54 0.98 0.00 0.00 173.24 172.31