#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 -0.08 -0.68 0.03 2.47 -2.07 -3.45 114.38 110.61 1pv0 h ARG 2 Ca 0.00 0.01 0.16 0.00 -1.26 0.00 0.00 59.98 58.89 1pv0 h ARG 2 Cb 0.00 0.02 -0.21 0.00 -1.65 0.00 0.00 29.97 28.13 1pv0 h ARG 2 CO 0.00 0.28 -0.08 0.21 0.56 0.00 0.00 179.97 180.95 1pv0 s LYS 3 N -4.67 0.39 0.05 0.04 2.47 -1.26 -5.17 119.74 111.59 1pv0 s LYS 3 Ca -0.15 0.68 0.03 0.00 -1.56 0.00 0.00 55.97 54.97 1pv0 s LYS 3 Cb 0.02 0.38 -0.03 0.00 -1.46 0.00 0.00 37.83 36.75 1pv0 s LYS 3 CO 0.64 -0.42 -0.09 -0.51 0.16 0.00 0.00 175.35 175.13 1pv0 s LEU 4 N 2.91 2.26 0.73 5.43 1.43 -1.26 -5.14 118.68 125.03 1pv0 s LEU 4 Ca 0.10 -0.57 -0.15 0.00 -1.03 0.00 0.00 54.13 52.48 1pv0 s LEU 4 Cb -0.13 -0.24 0.04 0.00 0.03 0.00 0.00 46.19 45.89 1pv0 s LEU 4 CO -0.16 -0.18 1.24 -0.44 0.23 0.00 0.00 176.35 177.05 1pv0 s SER 5 N -1.62 4.09 0.51 2.29 0.01 -1.26 -4.63 113.70 113.10 1pv0 s SER 5 Ca -0.08 2.47 0.15 0.00 1.31 0.00 0.00 55.95 59.80 1pv0 s SER 5 Cb -0.10 -2.60 1.22 0.00 0.21 0.00 0.00 66.02 64.75 1pv0 s SER 5 CO 0.01 -2.34 2.13 0.44 0.41 0.00 0.00 173.24 173.89 1pv0 h ASP 6 N -0.21 0.03 -0.53 2.44 3.32 -2.01 0.85 116.42 120.31 1pv0 h ASP 6 Ca -0.48 -0.00 -0.07 0.00 0.02 0.00 0.00 57.03 56.49 1pv0 h ASP 6 Cb 1.31 -0.01 -0.02 0.00 0.22 0.00 0.00 39.33 40.84 1pv0 h ASP 6 CO 0.50 0.04 0.04 -0.33 -1.72 0.00 0.00 179.24 177.77 1pv0 h GLU 7 N 0.04 0.90 0.19 3.56 5.08 -1.98 0.49 114.58 122.87 1pv0 h GLU 7 Ca 0.01 -0.27 -0.31 0.00 -1.00 0.00 0.00 59.36 57.79 1pv0 h GLU 7 Cb 0.02 -0.09 0.02 0.00 0.50 0.00 0.00 28.75 29.20 1pv0 h GLU 7 CO -0.00 0.90 -1.39 -0.07 -1.00 0.00 0.00 179.01 177.45 1pv0 h LEU 8 N 0.78 0.63 -0.43 1.33 4.07 -1.60 -0.65 115.31 119.44 1pv0 h LEU 8 Ca 0.15 -0.69 -0.03 0.00 0.08 0.00 0.00 57.88 57.40 1pv0 h LEU 8 Cb 0.47 -0.21 -0.02 0.00 1.08 0.00 0.00 40.66 41.98 1pv0 h LEU 8 CO 0.02 1.54 0.16 0.25 -1.08 0.00 0.00 178.44 179.34 1pv0 h LEU 9 N 0.11 0.61 -0.49 1.67 5.85 0.77 -0.71 115.31 123.11 1pv0 h LEU 9 Ca -0.20 -0.18 -0.17 0.00 0.84 0.00 0.00 57.88 58.17 1pv0 h LEU 9 Cb 2.08 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 42.94 1pv0 h LEU 9 CO 0.24 0.62 -0.65 0.40 -0.34 0.00 0.00 178.44 178.71 1pv0 h ILE 10 N 0.56 1.36 0.00 4.05 2.04 -0.09 -2.63 117.51 122.80 1pv0 h ILE 10 Ca 0.14 -2.01 -0.01 0.00 1.00 0.00 0.00 64.86 63.99 1pv0 h ILE 10 Cb 0.21 1.99 -0.00 0.00 -0.74 0.00 0.00 36.82 38.28 1pv0 h ILE 10 CO -0.01 0.61 -0.06 -0.33 0.00 0.00 0.00 178.15 178.36 1pv0 h GLU 11 N 0.30 0.00 -0.05 2.37 3.07 -0.70 0.29 114.58 119.85 1pv0 h GLU 11 Ca -0.01 0.00 -0.06 0.00 -0.50 0.00 0.00 59.36 58.78 1pv0 h GLU 11 Cb 1.20 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.11 1pv0 h GLU 11 CO 0.11 0.06 -0.22 0.77 -1.40 0.00 0.00 179.01 178.33 1pv0 h SER 12 N 0.00 0.28 -0.70 1.42 0.02 -0.79 0.48 113.55 114.26 1pv0 h SER 12 Ca -0.00 -0.65 -0.04 0.00 -0.84 0.00 0.00 61.79 60.26 1pv0 h SER 12 Cb 0.11 -0.08 -0.03 0.00 0.14 0.00 0.00 62.40 62.54 1pv0 h SER 12 CO 0.01 0.88 0.30 0.22 -1.14 0.00 0.00 176.83 177.10 1pv0 h TYR 13 N -0.30 1.08 -0.09 3.45 3.20 -1.10 0.73 116.97 123.94 1pv0 h TYR 13 Ca -0.01 -0.07 -0.08 0.00 3.14 0.00 0.00 58.73 61.71 1pv0 h TYR 13 Cb 0.87 -0.33 0.00 0.00 1.54 0.00 0.00 36.73 38.82 1pv0 h TYR 13 CO 0.14 0.81 -0.26 0.74 -1.64 0.00 0.00 178.16 177.95 1pv0 h PHE 14 N 1.04 0.42 -0.54 -3.82 -1.00 -0.44 -1.53 116.94 111.07 1pv0 h PHE 14 Ca 0.24 -0.17 -0.05 0.00 2.81 0.00 0.00 57.97 60.80 1pv0 h PHE 14 Cb 0.19 -0.07 -0.02 0.00 3.61 0.00 0.00 35.95 39.65 1pv0 h PHE 14 CO 0.02 0.87 0.13 0.87 -1.61 0.00 0.00 178.31 178.59 1pv0 h LYS 15 N -0.15 0.87 -0.53 1.51 1.79 0.20 -2.45 116.57 117.80 1pv0 h LYS 15 Ca -0.01 -0.21 -0.09 0.00 -2.18 0.00 0.00 60.65 58.17 1pv0 h LYS 15 Cb 0.88 -0.11 -0.02 0.00 -1.58 0.00 0.00 32.23 31.39 1pv0 h LYS 15 CO 0.05 0.82 -0.01 0.00 -1.08 0.00 0.00 179.45 179.23 1pv0 h ALA 16 N 1.01 0.98 -0.18 3.86 0.00 0.44 -1.48 119.26 123.89 1pv0 h ALA 16 Ca 0.17 -0.29 -0.06 0.00 0.00 0.00 0.00 54.91 54.73 1pv0 h ALA 16 Cb 0.34 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1pv0 h ALA 16 CO 0.00 0.62 -0.15 1.79 0.00 0.00 0.00 179.25 181.51 1pv0 h THR 17 N 0.84 1.20 -0.01 0.00 1.35 -1.09 0.56 112.91 115.77 1pv0 h THR 17 Ca 0.16 -0.90 -0.05 0.00 -0.55 0.00 0.00 66.41 65.06 1pv0 h THR 17 Cb 0.51 1.23 0.00 0.00 -1.73 0.00 0.00 68.15 68.17 1pv0 h THR 17 CO 0.03 0.28 -0.19 -0.33 -0.25 0.00 0.00 175.52 175.06 1pv0 h GLU 18 N 0.28 0.14 0.00 4.72 5.08 -1.06 -3.29 114.58 120.45 1pv0 h GLU 18 Ca 0.05 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 1pv0 h GLU 18 Cb 0.44 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.72 1pv0 h GLU 18 CO 0.03 0.86 -0.03 0.00 -1.00 0.00 0.00 179.01 178.87 1pv0 n MET 19 N -4.56 0.24 -2.62 2.33 0.00 -0.59 -4.93 117.12 106.99 1pv0 n MET 19 Ca -0.09 0.19 -0.05 0.00 0.00 0.00 0.00 57.70 57.75 1pv0 n MET 19 Cb 0.46 -1.78 0.01 0.00 0.00 0.00 0.00 33.22 31.92 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 -2.20 -2.80 -4.52 3.17 5.03 0.17 -5.01 115.26 109.11 1pv0 n ASN 20 Ca 0.06 -0.10 -0.33 0.00 0.87 0.00 0.00 54.58 55.08 1pv0 n ASN 20 Cb 0.42 -1.47 0.13 0.00 -1.02 0.00 0.00 39.78 37.84 1pv0 n ASN 20 CO 0.00 0.00 0.00 -0.11 -1.83 0.00 0.00 177.26 175.32 1pv0 n LEU 21 N -1.33 1.34 -4.49 3.41 0.00 0.49 -4.81 117.00 111.61 1pv0 n LEU 21 Ca -0.01 0.41 -0.54 0.00 0.00 0.00 0.00 56.01 55.88 1pv0 n LEU 21 Cb 0.52 -1.31 -0.06 0.00 0.00 0.00 0.00 43.42 42.57 1pv0 n LEU 21 CO 0.13 -2.98 0.44 -3.20 0.00 0.00 0.00 177.39 171.78 1pv0 n ASN 22 N -2.16 -0.07 -0.05 1.96 2.85 -1.26 -4.67 115.26 111.87 1pv0 n ASN 22 Ca 0.09 1.15 0.18 0.00 -0.11 0.00 0.00 54.58 55.89 1pv0 n ASN 22 Cb 0.52 -0.99 0.63 0.00 1.24 0.00 0.00 39.78 41.18 1pv0 n ASN 22 CO 0.00 0.00 0.00 -0.09 -2.11 0.00 0.00 177.26 175.06 1pv0 h ARG 23 N 2.55 0.13 -0.20 1.20 9.65 -1.99 0.21 114.38 125.93 1pv0 h ARG 23 Ca -0.43 -0.01 -0.09 0.00 -1.10 0.00 0.00 59.98 58.35 1pv0 h ARG 23 Cb 1.41 -0.03 -0.01 0.00 -1.39 0.00 0.00 29.97 29.95 1pv0 h ARG 23 CO 0.64 0.09 -0.27 -0.44 2.80 0.00 0.00 179.97 182.79 1pv0 h ASP 24 N 0.14 0.37 0.00 -3.80 3.32 -1.98 0.19 116.42 114.66 1pv0 h ASP 24 Ca 0.28 -0.12 -0.17 0.00 0.02 0.00 0.00 57.03 57.04 1pv0 h ASP 24 Cb 0.93 -0.10 0.01 0.00 0.22 0.00 0.00 39.33 40.39 1pv0 h ASP 24 CO -0.04 0.64 -0.67 0.15 -1.72 0.00 0.00 179.24 177.60 1pv0 h PHE 25 N 0.33 0.67 -0.47 4.55 3.57 -1.32 0.96 116.94 125.22 1pv0 h PHE 25 Ca 0.05 -0.37 -0.00 0.00 3.53 0.00 0.00 57.97 61.18 1pv0 h PHE 25 Cb 0.65 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 39.29 1pv0 h PHE 25 CO 0.02 1.19 0.28 0.82 -2.23 0.00 0.00 178.31 178.38 1pv0 h ILE 26 N -0.04 1.15 -0.07 1.41 2.04 -1.15 0.30 117.51 121.15 1pv0 h ILE 26 Ca -0.08 -0.36 -0.15 0.00 1.00 0.00 0.00 64.86 65.26 1pv0 h ILE 26 Cb 1.38 0.54 -0.01 0.00 -0.74 0.00 0.00 36.82 37.98 1pv0 h ILE 26 CO 0.13 0.16 -0.62 -0.08 0.00 0.00 0.00 178.15 177.74 1pv0 h GLU 27 N 0.63 0.25 -0.13 2.37 4.57 -0.67 -0.96 114.58 120.64 1pv0 h GLU 27 Ca 0.17 -0.18 -0.02 0.00 -1.18 0.00 0.00 59.36 58.15 1pv0 h GLU 27 Cb 0.01 0.03 -0.00 0.00 -0.16 0.00 0.00 28.75 28.62 1pv0 h GLU 27 CO -0.03 0.79 -0.00 1.25 -1.18 0.00 0.00 179.01 179.84 1pv0 h LEU 28 N 0.19 0.24 -1.07 1.64 6.46 -0.26 0.82 115.31 123.33 1pv0 h LEU 28 Ca -0.01 -0.32 -0.09 0.00 -0.12 0.00 0.00 57.88 57.34 1pv0 h LEU 28 Cb 1.13 -0.06 -0.01 0.00 -0.73 0.00 0.00 40.66 40.99 1pv0 h LEU 28 CO 0.10 0.50 -0.34 0.40 -0.62 0.00 0.00 178.44 178.47 1pv0 h ILE 29 N -0.03 1.28 0.01 4.05 2.04 -0.40 -2.17 117.51 122.29 1pv0 h ILE 29 Ca 0.04 -1.33 -0.21 0.00 1.00 0.00 0.00 64.86 64.36 1pv0 h ILE 29 Cb 0.38 1.57 -0.01 0.00 -0.74 0.00 0.00 36.82 38.02 1pv0 h ILE 29 CO 0.01 0.40 -0.92 -0.08 0.00 0.00 0.00 178.15 177.56 1pv0 h GLU 30 N 0.20 0.25 0.00 2.37 4.81 -0.95 -2.28 114.58 118.97 1pv0 h GLU 30 Ca 0.02 -0.28 -0.08 0.00 -0.13 0.00 0.00 59.36 58.90 1pv0 h GLU 30 Cb 0.70 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 30.15 1pv0 h GLU 30 CO 0.05 1.01 -0.37 -0.91 -0.73 0.00 0.00 179.01 178.06 1pv0 h ASN 31 N 0.13 0.00 0.13 1.04 2.35 0.10 0.30 115.58 119.64 1pv0 h ASN 31 Ca -0.06 0.00 -0.18 0.00 -0.55 0.00 0.00 56.30 55.51 1pv0 h ASN 31 Cb 1.56 0.00 0.02 0.00 0.05 0.00 0.00 38.32 39.95 1pv0 h ASN 31 CO 0.15 0.37 -0.82 -0.08 -1.65 0.00 0.00 177.43 175.39 1pv0 h GLU 32 N 0.00 0.28 -0.14 0.81 4.57 -1.37 -2.28 114.58 116.45 1pv0 h GLU 32 Ca -0.00 -0.47 -0.06 0.00 -1.18 0.00 0.00 59.36 57.64 1pv0 h GLU 32 Cb 0.68 0.18 -0.01 0.00 -0.16 0.00 0.00 28.75 29.43 1pv0 h GLU 32 CO 0.05 1.23 -0.18 0.82 -1.18 0.00 0.00 179.01 179.74 1pv0 h ILE 33 N -0.41 1.20 -0.11 2.32 2.04 -1.30 0.34 117.51 121.59 1pv0 h ILE 33 Ca -0.15 -0.92 -0.07 0.00 1.00 0.00 0.00 64.86 64.72 1pv0 h ILE 33 Cb 1.62 1.30 0.00 0.00 -0.74 0.00 0.00 36.82 39.00 1pv0 h ILE 33 CO 0.13 0.28 -0.20 0.11 0.00 0.00 0.00 178.15 178.47 1pv0 h LYS 34 N 0.21 0.34 0.00 2.37 1.57 -0.45 0.98 116.57 121.58 1pv0 h LYS 34 Ca 0.04 -0.21 -0.04 0.00 -1.87 0.00 0.00 60.65 58.56 1pv0 h LYS 34 Cb 0.45 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.78 1pv0 h LYS 34 CO 0.03 0.80 -0.21 0.00 -0.57 0.00 0.00 179.45 179.50 1pv0 h ARG 35 N -0.09 0.00 -0.08 3.15 3.08 -1.13 -2.62 114.38 116.69 1pv0 h ARG 35 Ca 0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.06 1pv0 h ARG 35 Cb 0.79 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.84 1pv0 h ARG 35 CO 0.05 0.21 0.00 0.54 -1.07 0.00 0.00 179.97 179.69 1pv0 n ARG 36 N -3.40 1.28 -2.92 0.04 1.74 0.12 -4.88 116.66 108.63 1pv0 n ARG 36 Ca -0.00 -0.42 -0.22 0.00 -0.77 0.00 0.00 57.85 56.44 1pv0 n ARG 36 Cb 0.41 -1.25 0.03 0.00 -1.02 0.00 0.00 32.46 30.63 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 -0.29 -6.01 -0.57 0.55 2.88 -0.99 -4.88 113.62 104.31 1pv0 n SER 37 Ca 0.11 -0.25 0.06 0.00 -1.33 0.00 0.00 58.87 57.47 1pv0 n SER 37 Cb 0.14 -4.85 0.16 0.00 -0.75 0.00 0.00 64.21 58.92 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 -3.80 2.32 0.00 2.46 7.94 0.33 -4.75 117.00 121.49 1pv0 n LEU 38 Ca -0.13 -3.38 0.08 0.00 -1.11 0.00 0.00 56.01 51.47 1pv0 n LEU 38 Cb 0.63 -0.43 0.38 0.00 0.53 0.00 0.00 43.42 44.53 1pv0 n LEU 38 CO 0.44 1.09 0.74 0.61 -1.11 0.00 0.00 177.39 179.16 1pv0 n GLY 39 N -0.97 -0.93 0.08 -3.96 0.00 -1.15 -2.29 105.19 95.96 1pv0 n GLY 39 Ca 0.16 -0.07 -0.10 0.00 0.00 0.00 0.00 46.02 46.01 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 0.12 -0.33 1.61 2.07 -1.91 -3.26 115.15 113.45 1pv0 h HIS 40 Ca 0.00 -0.09 -0.01 0.00 -2.85 0.00 0.00 60.37 57.42 1pv0 h HIS 40 Cb 0.21 -0.00 -0.02 0.00 2.57 0.00 0.00 27.41 30.17 1pv0 h HIS 40 CO 0.00 1.09 0.16 0.97 -3.07 0.00 0.00 177.93 177.09 1pv0 h ILE 41 N 0.02 1.12 -4.02 6.12 6.09 -1.84 -3.43 117.51 121.57 1pv0 h ILE 41 Ca -0.13 -0.32 -0.48 0.00 -1.37 0.00 0.00 64.86 62.56 1pv0 h ILE 41 Cb 1.89 0.69 0.02 0.00 0.47 0.00 0.00 36.82 39.88 1pv0 h ILE 41 CO 0.13 0.13 0.28 0.27 -3.07 0.00 0.00 178.15 175.89 1pv0 s ILE 42 N -5.30 4.65 -1.36 2.19 -4.36 -1.23 -4.94 121.20 110.85 1pv0 s ILE 42 Ca -0.08 0.95 -0.11 0.00 -0.26 0.00 0.00 60.65 61.15 1pv0 s ILE 42 Cb 0.17 -3.74 -0.06 0.00 1.25 0.00 0.00 42.46 40.08 1pv0 s ILE 42 CO 0.73 -0.68 2.51 -0.24 0.24 0.00 0.00 174.94 177.50 1pv0 n SER 43 N -1.62 6.20 -4.35 4.36 2.88 -1.26 -4.86 113.62 114.97 1pv0 n SER 43 Ca 0.05 -2.60 -0.26 0.00 -1.33 0.00 0.00 58.87 54.74 1pv0 n SER 43 Cb 0.54 -1.45 -0.12 0.00 -0.75 0.00 0.00 64.21 62.43 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 2.95 1.99 -0.59 2.46 1.01 -1.26 -5.10 120.40 121.86 1pv0 s VAL 44 Ca 0.57 -1.74 0.01 0.00 0.00 0.00 0.00 61.98 60.82 1pv0 s VAL 44 Cb 0.15 -1.82 0.15 0.00 0.00 0.00 0.00 36.38 34.86 1pv0 s VAL 44 CO -0.04 -0.06 0.37 -0.94 0.00 0.00 0.00 175.10 174.42 1pv0 s SER 45 N -2.18 4.80 0.00 3.32 1.04 -1.26 -4.91 113.70 114.50 1pv0 s SER 45 Ca 0.12 -3.00 0.14 0.00 0.48 0.00 0.00 55.95 53.69 1pv0 s SER 45 Cb -0.09 -1.75 0.82 0.00 0.10 0.00 0.00 66.02 65.10 1pv0 s SER 45 CO 0.06 -0.29 1.24 -0.24 0.98 0.00 0.00 173.24 174.99