#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vgh h ARG 2 N 0.00 0.00 0.00 0.00 3.08 -2.05 -3.40 114.38 112.01 1vgh h ARG 2 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1vgh h ARG 2 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 1vgh h ARG 2 CO 0.00 0.99 0.00 0.94 -1.07 0.00 0.00 179.97 180.83 1vgh n GLN 3 N -4.47 0.00 -2.64 0.04 7.27 -1.26 -4.70 117.38 111.62 1vgh n GLN 3 Ca -0.28 0.47 -0.43 0.00 0.07 0.00 0.00 57.00 56.84 1vgh n GLN 3 Cb 0.64 -1.14 -0.02 0.00 2.41 0.00 0.00 30.24 32.12 1vgh n GLN 3 CO 0.00 0.00 0.00 -2.00 0.07 0.00 0.00 177.06 175.13 1vgh s GLU 4 N -1.61 4.38 -0.51 3.69 -6.30 -1.26 -5.01 118.70 112.07 1vgh s GLU 4 Ca 0.00 1.44 0.00 0.00 -2.50 0.00 0.00 54.97 53.91 1vgh s GLU 4 Cb 0.00 -3.56 0.13 0.00 0.00 0.00 0.00 34.13 30.70 1vgh s GLU 4 CO 0.00 -0.39 0.29 -0.80 0.02 0.00 0.00 175.26 174.38 1vgh s ASN 5 N 1.19 4.90 -0.41 -1.70 0.02 -1.26 -4.61 114.94 113.07 1vgh s ASN 5 Ca 0.49 -2.66 -0.29 0.00 -1.02 0.00 0.00 52.86 49.39 1vgh s ASN 5 Cb -0.19 -1.76 0.01 0.00 0.02 0.00 0.00 41.25 39.34 1vgh s ASN 5 CO 0.17 -0.36 1.34 -2.16 0.02 0.00 0.00 177.10 176.11 1vgh s PRO 6 N 0.22 3.65 0.55 -0.60 0.04 -1.26 -4.99 135.00 132.62 1vgh s PRO 6 Ca 0.15 0.90 -0.21 0.00 0.04 0.00 0.00 61.00 61.87 1vgh s PRO 6 Cb -0.22 -3.98 -0.05 0.00 0.04 0.00 0.00 34.50 30.29 1vgh s PRO 6 CO -0.03 -1.47 1.34 0.00 0.04 0.00 0.00 177.00 176.88 1vgh s GLY 8 N -1.03 1.61 0.07 0.00 0.00 -1.26 -5.00 107.32 101.71 1vgh s GLY 8 Ca 0.72 -0.71 -0.30 0.00 0.00 0.00 0.00 44.72 44.43 1vgh s GLY 8 CO 0.46 -0.06 1.12 2.56 0.00 0.00 0.00 173.10 177.18 1vgh s PRO 9 N -5.41 4.50 0.11 2.90 0.04 -1.26 -4.94 135.00 130.95 1vgh s PRO 9 Ca 0.67 1.67 -0.14 0.00 0.04 0.00 0.00 61.00 63.23 1vgh s PRO 9 Cb -0.12 -3.36 -0.05 0.00 0.04 0.00 0.00 34.50 31.01 1vgh s PRO 9 CO 0.54 -0.14 1.49 0.00 0.04 0.00 0.00 177.00 178.93 1vgh n SER 11 N -4.33 -0.89 0.24 0.00 2.88 -1.26 -5.00 113.62 105.25 1vgh n SER 11 Ca -0.02 -0.62 -0.14 0.00 -1.33 0.00 0.00 58.87 56.75 1vgh n SER 11 Cb 0.39 -0.06 -0.08 0.00 -0.75 0.00 0.00 64.21 63.71 1vgh n SER 11 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 1vgh h GLU 12 N 0.00 -0.59 0.00 -1.46 5.08 -1.93 -3.46 114.58 112.22 1vgh h GLU 12 Ca -0.03 0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1vgh h GLU 12 Cb 0.08 0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.46 1vgh h GLU 12 CO 0.02 -0.29 0.00 0.54 -1.00 0.00 0.00 179.01 178.27 1vgh n ARG 13 N -5.26 0.00 -2.25 2.33 3.00 -1.26 -4.82 116.66 108.40 1vgh n ARG 13 Ca -0.11 0.00 -0.33 0.00 -0.01 0.00 0.00 57.85 57.41 1vgh n ARG 13 Cb 0.30 -0.04 -0.04 0.00 0.00 0.00 0.00 32.46 32.68 1vgh n ARG 13 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.63 178.13 1vgh s ARG 14 N -1.94 2.99 -0.37 5.56 3.52 -1.26 -4.81 118.95 122.64 1vgh s ARG 14 Ca 0.00 -0.93 -0.01 0.00 -0.13 0.00 0.00 55.73 54.66 1vgh s ARG 14 Cb 0.00 -5.24 0.24 0.00 -1.56 0.00 0.00 34.95 28.38 1vgh s ARG 14 CO 0.00 -3.08 2.05 0.36 -0.81 0.00 0.00 175.30 173.82 1vgh n LYS 15 N 8.67 1.94 0.11 5.12 2.85 -1.26 -4.57 118.16 131.02 1vgh n LYS 15 Ca 0.41 -1.81 -0.18 0.00 -1.05 0.00 0.00 58.31 55.68 1vgh n LYS 15 Cb 0.48 -1.72 -0.14 0.00 -0.65 0.00 0.00 35.03 33.00 1vgh n LYS 15 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 1vgh h HIS 16 N 1.60 0.62 -0.24 5.58 3.86 -1.96 -3.30 115.15 121.30 1vgh h HIS 16 Ca 0.33 -0.44 -0.16 0.00 -1.16 0.00 0.00 60.37 58.94 1vgh h HIS 16 Cb 0.89 -0.03 -0.07 0.00 1.06 0.00 0.00 27.41 29.26 1vgh h HIS 16 CO 0.91 1.33 0.21 1.28 0.86 0.00 0.00 177.93 182.52 1vgh n LEU 17 N -3.59 5.84 -3.91 2.43 4.32 -1.26 -4.84 117.00 115.99 1vgh n LEU 17 Ca -0.10 -2.83 -0.09 0.00 -0.02 0.00 0.00 56.01 52.97 1vgh n LEU 17 Cb 1.02 -1.07 -0.07 0.00 -1.62 0.00 0.00 43.42 41.68 1vgh n LEU 17 CO 0.55 1.10 -0.05 -0.36 -1.22 0.00 0.00 177.39 177.41 1vgh s PHE 18 N -0.92 0.28 -0.08 -1.77 0.40 -1.25 -1.53 117.98 113.11 1vgh s PHE 18 Ca 0.16 -0.67 0.03 0.00 -0.60 0.00 0.00 56.93 55.84 1vgh s PHE 18 Cb 0.12 -0.05 0.01 0.00 0.51 0.00 0.00 43.02 43.61 1vgh s PHE 18 CO -0.00 -0.64 -0.17 0.14 0.70 0.00 0.00 175.22 175.25 1vgh s VAL 19 N -3.92 1.53 -0.16 -0.44 -7.23 -0.18 -4.68 120.40 105.32 1vgh s VAL 19 Ca 0.12 -0.71 -0.04 0.00 -1.81 0.00 0.00 61.98 59.54 1vgh s VAL 19 Cb 0.04 -1.36 -0.03 0.00 0.56 0.00 0.00 36.38 35.59 1vgh s VAL 19 CO -0.05 0.44 -0.03 -1.58 -0.31 0.00 0.00 175.10 173.57 1vgh s GLN 20 N 0.56 3.68 0.15 4.82 0.74 -1.26 -1.51 119.66 126.84 1vgh s GLN 20 Ca -0.16 -0.51 -0.31 0.00 0.05 0.00 0.00 55.36 54.43 1vgh s GLN 20 Cb -0.17 -2.92 -0.09 0.00 1.10 0.00 0.00 33.01 30.93 1vgh s GLN 20 CO 0.05 0.25 1.45 0.34 -0.55 0.00 0.00 175.29 176.83 1vgh s ASP 21 N 0.35 6.73 0.14 6.67 -1.08 -0.46 -4.95 116.67 124.08 1vgh s ASP 21 Ca -0.04 2.46 -0.13 0.00 -0.52 0.00 0.00 52.55 54.32 1vgh s ASP 21 Cb -0.14 -2.59 0.01 0.00 -1.46 0.00 0.00 42.92 38.73 1vgh s ASP 21 CO 0.03 -0.71 1.58 1.55 0.52 0.00 0.00 175.17 178.15 1vgh h PRO 22 N 6.58 0.84 0.01 4.34 0.13 -1.98 -0.78 132.00 141.14 1vgh h PRO 22 Ca -0.43 -0.28 -0.29 0.00 -0.87 0.00 0.00 66.00 64.14 1vgh h PRO 22 Cb 1.21 -0.07 -0.05 0.00 0.13 0.00 0.00 31.00 32.22 1vgh h PRO 22 CO 0.87 0.90 -1.65 -0.56 -0.23 0.00 0.00 178.00 177.33 1vgh h GLN 23 N 0.69 0.02 0.00 0.86 3.07 -1.98 -3.37 115.11 114.39 1vgh h GLN 23 Ca 0.13 -0.03 -0.11 0.00 0.09 0.00 0.00 58.65 58.73 1vgh h GLN 23 Cb 0.53 0.01 -0.02 0.00 0.08 0.00 0.00 27.48 28.08 1vgh h GLN 23 CO 0.03 0.59 -2.07 0.25 0.09 0.00 0.00 178.83 177.72 1vgh n THR 24 N -3.10 0.44 -2.11 1.86 -2.24 -1.25 -5.00 114.28 102.88 1vgh n THR 24 Ca -0.16 -0.61 -0.19 0.00 -2.27 0.00 0.00 64.05 60.82 1vgh n THR 24 Cb 1.04 -0.16 -0.03 0.00 -2.10 0.00 0.00 70.33 69.08 1vgh n THR 24 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1vgh s LYS 26 N -4.54 4.27 0.16 0.00 1.02 -1.26 -4.83 119.74 114.56 1vgh s LYS 26 Ca 0.00 0.62 0.03 0.00 0.02 0.00 0.00 55.97 56.65 1vgh s LYS 26 Cb 0.00 -3.35 -0.04 0.00 -0.52 0.00 0.00 37.83 33.93 1vgh s LYS 26 CO 0.00 0.36 0.25 0.00 -0.92 0.00 0.00 175.35 175.04 1vgh s SER 28 N -3.29 1.50 0.25 0.00 0.01 -0.57 -5.00 113.70 106.61 1vgh s SER 28 Ca 0.34 -0.30 -0.30 0.00 1.31 0.00 0.00 55.95 56.99 1vgh s SER 28 Cb -0.11 -0.14 -0.09 0.00 0.21 0.00 0.00 66.02 65.89 1vgh s SER 28 CO 0.27 0.11 1.23 0.00 0.41 0.00 0.00 173.24 175.26 1vgh h LYS 30 N 4.49 0.53 -6.96 0.00 3.64 -1.55 -3.44 116.57 113.27 1vgh h LYS 30 Ca -0.46 -0.33 -0.46 0.00 -1.27 0.00 0.00 60.65 58.13 1vgh h LYS 30 Cb 1.22 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 33.05 1vgh h LYS 30 CO 0.71 0.94 0.34 1.21 -2.27 0.00 0.00 179.45 180.38 1vgh s ASN 31 N -6.47 7.15 0.07 4.20 2.47 -1.26 -5.02 114.94 116.09 1vgh s ASN 31 Ca -0.13 1.76 -0.00 0.00 0.42 0.00 0.00 52.86 54.91 1vgh s ASN 31 Cb 0.06 -2.56 -0.04 0.00 -1.45 0.00 0.00 41.25 37.27 1vgh s ASN 31 CO 0.80 -0.20 -0.03 0.42 -3.72 0.00 0.00 177.10 174.37 1vgh s THR 32 N -1.87 0.36 0.61 -5.21 -4.23 -1.26 -5.01 115.64 99.02 1vgh s THR 32 Ca 0.55 -1.86 0.32 0.00 -1.18 0.00 0.00 61.69 59.52 1vgh s THR 32 Cb -0.14 -1.63 0.37 0.00 1.34 0.00 0.00 72.50 72.44 1vgh s THR 32 CO 0.19 -0.90 2.18 0.44 -0.54 0.00 0.00 174.62 175.98 1vgh h ASP 33 N 3.06 0.00 0.11 3.99 3.32 -1.95 -2.40 116.42 122.55 1vgh h ASP 33 Ca -0.35 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.70 1vgh h ASP 33 Cb 1.15 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.70 1vgh h ASP 33 CO 0.65 0.00 -0.05 0.28 -1.72 0.00 0.00 179.24 178.39 1vgh h SER 34 N 0.00 -0.13 -0.27 6.45 0.02 -1.96 0.94 113.55 118.59 1vgh h SER 34 Ca 0.04 -0.12 -0.00 0.00 -0.84 0.00 0.00 61.79 60.86 1vgh h SER 34 Cb 0.28 0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.84 1vgh h SER 34 CO -0.00 0.04 0.16 0.03 -1.14 0.00 0.00 176.83 175.92 1vgh h ARG 35 N -0.30 0.38 -0.37 3.45 3.08 -1.86 -1.82 114.38 116.93 1vgh h ARG 35 Ca -0.02 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.00 1vgh h ARG 35 Cb 0.25 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.20 1vgh h ARG 35 CO 0.03 0.31 0.24 0.00 -1.07 0.00 0.00 179.97 179.47 1vgh h LYS 37 N 0.50 1.13 -0.06 0.00 3.64 -0.41 0.20 116.57 121.56 1vgh h LYS 37 Ca 0.13 -0.09 0.02 0.00 -1.27 0.00 0.00 60.65 59.45 1vgh h LYS 37 Cb -0.04 -0.24 -0.00 0.00 -0.41 0.00 0.00 32.23 31.54 1vgh h LYS 37 CO -0.03 0.77 0.05 0.00 -2.27 0.00 0.00 179.45 177.97 1vgh h ALA 38 N 1.29 1.85 -0.64 5.00 0.00 -0.99 -1.00 119.26 124.77 1vgh h ALA 38 Ca 0.30 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.21 1vgh h ALA 38 Cb -0.09 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1vgh h ALA 38 CO -0.06 -0.08 0.00 0.54 0.00 0.00 0.00 179.25 179.65 1vgh n ARG 39 N -4.22 2.57 -3.39 0.00 1.74 -0.13 -4.96 116.66 108.27 1vgh n ARG 39 Ca -0.02 -2.43 -0.19 0.00 -0.77 0.00 0.00 57.85 54.45 1vgh n ARG 39 Cb 0.15 -1.53 0.08 0.00 -1.02 0.00 0.00 32.46 30.13 1vgh n ARG 39 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1vgh n GLN 40 N 1.49 -6.61 -3.61 5.56 1.13 -0.35 -5.02 117.38 109.96 1vgh n GLN 40 Ca 0.22 0.76 -0.14 0.00 -1.94 0.00 0.00 57.00 55.90 1vgh n GLN 40 Cb 0.58 -5.55 -0.06 0.00 0.11 0.00 0.00 30.24 25.32 1vgh n GLN 40 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 1vgh n LEU 41 N -4.21 0.00 -4.11 1.08 4.77 0.51 -4.93 117.00 110.11 1vgh n LEU 41 Ca -0.13 -2.29 -0.08 0.00 -0.03 0.00 0.00 56.01 53.48 1vgh n LEU 41 Cb 0.60 1.24 -0.10 0.00 -2.33 0.00 0.00 43.42 42.83 1vgh n LEU 41 CO 0.57 -0.38 -0.37 -1.61 -1.33 0.00 0.00 177.39 174.26 1vgh s GLU 42 N -2.97 0.67 0.07 3.23 0.41 -0.24 -2.34 118.70 117.53 1vgh s GLU 42 Ca 0.29 -1.22 -0.30 0.00 -0.41 0.00 0.00 54.97 53.32 1vgh s GLU 42 Cb 0.01 0.05 -0.06 0.00 -1.78 0.00 0.00 34.13 32.36 1vgh s GLU 42 CO 0.20 -0.07 1.15 -1.17 -0.49 0.00 0.00 175.26 174.88 1vgh s LEU 43 N -2.87 4.39 -0.64 1.80 2.96 -1.26 -1.03 118.68 122.02 1vgh s LEU 43 Ca 0.07 1.97 -0.22 0.00 -0.22 0.00 0.00 54.13 55.74 1vgh s LEU 43 Cb 0.06 -3.58 0.07 0.00 0.50 0.00 0.00 46.19 43.24 1vgh s LEU 43 CO -0.08 -0.39 0.92 0.21 -1.32 0.00 0.00 176.35 175.69 1vgh s ASN 44 N 0.84 6.18 0.21 3.68 2.47 -0.15 -4.91 114.94 123.25 1vgh s ASN 44 Ca 0.56 -1.04 0.15 0.00 0.42 0.00 0.00 52.86 52.95 1vgh s ASN 44 Cb -0.28 -2.40 0.78 0.00 -1.45 0.00 0.00 41.25 37.90 1vgh s ASN 44 CO 0.30 -1.38 1.45 -0.62 -3.72 0.00 0.00 177.10 173.13 1vgh n GLU 45 N 7.47 0.09 -0.04 0.43 1.02 -1.26 0.04 120.64 128.40 1vgh n GLU 45 Ca -0.05 0.57 -0.05 0.00 -0.02 0.00 0.00 57.16 57.62 1vgh n GLU 45 Cb 0.45 -1.80 -0.04 0.00 -0.02 0.00 0.00 31.44 30.03 1vgh n GLU 45 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1vgh h ARG 46 N 0.00 -0.04 0.00 3.49 3.08 -1.96 -3.38 114.38 115.57 1vgh h ARG 46 Ca 0.00 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 1vgh h ARG 46 Cb 0.03 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.08 1vgh h ARG 46 CO 0.00 0.26 -1.15 0.25 -1.07 0.00 0.00 179.97 178.25 1vgh n THR 47 N -4.76 0.54 -3.57 2.04 -2.24 -1.10 -4.96 114.28 100.22 1vgh n THR 47 Ca -0.03 -0.54 -0.20 0.00 -2.27 0.00 0.00 64.05 61.01 1vgh n THR 47 Cb 0.15 -0.30 0.06 0.00 -2.10 0.00 0.00 70.33 68.15 1vgh n THR 47 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1vgh s ARG 49 N -5.65 2.46 -0.14 0.00 0.52 -1.24 -4.61 118.95 110.30 1vgh s ARG 49 Ca 0.04 -1.39 -0.21 0.00 -0.52 0.00 0.00 55.73 53.65 1vgh s ARG 49 Cb -0.01 -2.26 -0.03 0.00 0.52 0.00 0.00 34.95 33.17 1vgh s ARG 49 CO 0.78 0.27 0.60 0.00 0.02 0.00 0.00 175.30 176.97 1vgh s ASP 51 N 0.92 0.47 0.11 0.00 1.01 -0.20 -4.92 116.67 114.06 1vgh s ASP 51 Ca 0.30 -0.88 -0.31 0.00 0.71 0.00 0.00 52.55 52.37 1vgh s ASP 51 Cb -0.16 0.17 -0.08 0.00 1.01 0.00 0.00 42.92 43.86 1vgh s ASP 51 CO 0.12 -0.52 1.39 -0.75 0.21 0.00 0.00 175.17 175.62 1vgh s LYS 52 N -3.34 4.32 0.01 8.23 2.20 -1.26 -1.08 119.74 128.82 1vgh s LYS 52 Ca 0.02 2.07 -0.25 0.00 -0.36 0.00 0.00 55.97 57.45 1vgh s LYS 52 Cb 0.04 -3.27 -0.18 0.00 -1.51 0.00 0.00 37.83 32.90 1vgh s LYS 52 CO -0.08 -0.45 1.37 -1.00 -0.36 0.00 0.00 175.35 174.84 1vgh h PRO 53 N 6.88 -0.13 -4.45 4.03 0.13 -1.92 -3.38 132.00 133.16 1vgh h PRO 53 Ca -0.42 0.01 -0.74 0.00 -0.87 0.00 0.00 66.00 63.98 1vgh h PRO 53 Cb 1.21 0.03 -0.22 0.00 0.13 0.00 0.00 31.00 32.15 1vgh h PRO 53 CO 0.87 0.19 0.40 1.03 -0.23 0.00 0.00 178.00 180.26 1vgh s ARG 54 N -4.85 3.51 0.00 0.86 1.81 -1.26 -5.12 118.95 113.91 1vgh s ARG 54 Ca -0.15 -2.00 0.18 0.00 -1.72 0.00 0.00 55.73 52.04 1vgh s ARG 54 Cb 0.03 -4.60 0.14 0.00 -0.45 0.00 0.00 34.95 30.06 1vgh s ARG 54 CO 0.63 -1.53 1.06 0.54 -0.68 0.00 0.00 175.30 175.33