#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vgh n ARG 2 N 0.00 2.94 -1.07 0.00 1.74 -1.26 -4.81 116.66 114.20 1vgh n ARG 2 Ca 0.00 -2.75 -0.14 0.00 -0.77 0.00 0.00 57.85 54.19 1vgh n ARG 2 Cb 0.00 -3.29 -0.14 0.00 -1.02 0.00 0.00 32.46 28.00 1vgh n ARG 2 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1vgh n GLN 3 N 6.27 2.04 -1.45 5.56 10.64 -1.26 -4.74 117.38 134.43 1vgh n GLN 3 Ca 0.51 -1.22 -0.30 0.00 -1.83 0.00 0.00 57.00 54.16 1vgh n GLN 3 Cb 0.40 -1.99 -0.06 0.00 -0.86 0.00 0.00 30.24 27.72 1vgh n GLN 3 CO 0.00 0.00 0.00 -0.85 -1.83 0.00 0.00 177.06 174.38 1vgh n GLU 4 N 2.15 3.25 -3.43 2.61 0.28 -1.26 -4.89 120.64 119.35 1vgh n GLU 4 Ca 0.43 -2.27 -0.42 0.00 -0.16 0.00 0.00 57.16 54.73 1vgh n GLU 4 Cb 0.84 -2.42 -0.10 0.00 1.43 0.00 0.00 31.44 31.19 1vgh n GLU 4 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 177.13 178.18 1vgh s ASN 5 N 1.26 6.13 0.81 -1.84 2.47 -1.26 -5.08 114.94 117.43 1vgh s ASN 5 Ca 0.63 -0.73 -0.12 0.00 0.42 0.00 0.00 52.86 53.06 1vgh s ASN 5 Cb 0.26 -2.18 0.08 0.00 -1.45 0.00 0.00 41.25 37.96 1vgh s ASN 5 CO -0.09 -0.45 1.11 -2.16 -3.72 0.00 0.00 177.10 171.80 1vgh s PRO 6 N 1.83 1.95 0.43 0.43 0.04 -1.26 -5.00 135.00 133.41 1vgh s PRO 6 Ca 0.07 0.48 -0.25 0.00 0.04 0.00 0.00 61.00 61.34 1vgh s PRO 6 Cb -0.18 -1.92 -0.08 0.00 0.04 0.00 0.00 34.50 32.36 1vgh s PRO 6 CO 0.11 -1.68 1.32 0.00 0.04 0.00 0.00 177.00 176.80 1vgh s GLY 8 N -0.74 1.79 0.18 0.00 0.00 -1.26 -5.04 107.32 102.24 1vgh s GLY 8 Ca 0.59 -1.34 -0.32 0.00 0.00 0.00 0.00 44.72 43.65 1vgh s GLY 8 CO 0.49 -0.98 1.74 -4.14 0.00 0.00 0.00 173.10 170.21 1vgh s PRO 9 N -4.91 4.14 -0.06 2.90 0.02 -1.26 -4.89 135.00 130.94 1vgh s PRO 9 Ca 0.59 2.58 -0.20 0.00 0.02 0.00 0.00 61.00 64.00 1vgh s PRO 9 Cb -0.09 -3.25 -0.30 0.00 0.02 0.00 0.00 34.50 30.88 1vgh s PRO 9 CO 0.40 -0.77 0.80 0.00 -0.33 0.00 0.00 177.00 177.10 1vgh n SER 11 N -4.04 0.00 0.03 0.00 2.88 -1.26 -4.99 113.62 106.24 1vgh n SER 11 Ca -0.18 0.07 0.00 0.00 -1.33 0.00 0.00 58.87 57.44 1vgh n SER 11 Cb 0.86 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.32 1vgh n SER 11 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1vgh n GLU 12 N -0.41 0.00 -0.10 -1.46 -0.58 -1.26 -5.01 120.64 111.81 1vgh n GLU 12 Ca 0.00 0.00 -0.16 0.00 -0.42 0.00 0.00 57.16 56.58 1vgh n GLU 12 Cb 0.00 0.00 -0.09 0.00 -0.57 0.00 0.00 31.44 30.78 1vgh n GLU 12 CO 0.00 0.00 0.00 2.89 -0.48 0.00 0.00 177.13 179.54 1vgh n ARG 13 N -2.66 0.50 -3.38 3.49 1.85 -1.26 -4.86 116.66 110.35 1vgh n ARG 13 Ca 0.00 0.14 0.02 0.00 -1.00 0.00 0.00 57.85 57.01 1vgh n ARG 13 Cb 0.00 -1.38 -0.04 0.00 -1.05 0.00 0.00 32.46 29.99 1vgh n ARG 13 CO 0.00 0.00 0.00 0.50 -0.01 0.00 0.00 177.63 178.12 1vgh s ARG 14 N -2.41 0.26 0.20 2.89 6.06 -1.26 -4.70 118.95 119.99 1vgh s ARG 14 Ca -0.28 0.64 -0.32 0.00 -2.50 0.00 0.00 55.73 53.27 1vgh s ARG 14 Cb 0.08 0.38 -0.15 0.00 0.06 0.00 0.00 34.95 35.33 1vgh s ARG 14 CO 0.46 -0.09 1.25 0.36 -2.50 0.00 0.00 175.30 174.78 1vgh n LYS 15 N 4.90 1.48 0.04 5.12 -0.00 -1.26 -4.88 118.16 123.55 1vgh n LYS 15 Ca -0.09 0.53 0.00 0.00 -0.00 0.00 0.00 58.31 58.75 1vgh n LYS 15 Cb 0.53 -2.08 0.00 0.00 -0.00 0.00 0.00 35.03 33.48 1vgh n LYS 15 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.40 178.12 1vgh n HIS 16 N 1.65 -0.51 -0.35 5.58 8.25 -1.26 -4.83 115.22 123.75 1vgh n HIS 16 Ca 0.14 0.09 -0.02 0.00 -0.26 0.00 0.00 57.72 57.66 1vgh n HIS 16 Cb 0.27 0.25 0.01 0.00 1.12 0.00 0.00 29.99 31.64 1vgh n HIS 16 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1vgh n LEU 17 N -3.07 5.19 -3.75 2.41 4.77 -1.26 -4.79 117.00 116.50 1vgh n LEU 17 Ca 0.00 -2.41 -0.13 0.00 -0.03 0.00 0.00 56.01 53.43 1vgh n LEU 17 Cb 0.16 -1.03 -0.09 0.00 -2.33 0.00 0.00 43.42 40.13 1vgh n LEU 17 CO 0.00 0.97 0.04 -0.36 -1.33 0.00 0.00 177.39 176.71 1vgh s PHE 18 N -0.26 -0.25 -0.11 -1.77 0.40 -1.26 -1.54 117.98 113.18 1vgh s PHE 18 Ca 0.05 0.47 -0.03 0.00 -0.60 0.00 0.00 56.93 56.81 1vgh s PHE 18 Cb 0.04 0.12 -0.03 0.00 0.51 0.00 0.00 43.02 43.65 1vgh s PHE 18 CO 0.00 -0.35 0.02 0.14 0.70 0.00 0.00 175.22 175.73 1vgh s VAL 19 N -0.97 4.50 -0.05 -0.44 -7.23 -0.06 -4.75 120.40 111.39 1vgh s VAL 19 Ca -0.10 -0.17 0.04 0.00 -1.81 0.00 0.00 61.98 59.94 1vgh s VAL 19 Cb -0.04 -2.93 -0.00 0.00 0.56 0.00 0.00 36.38 33.97 1vgh s VAL 19 CO 0.04 0.58 -0.17 -1.58 -0.31 0.00 0.00 175.10 173.65 1vgh s GLN 20 N -0.62 1.91 -0.01 4.82 0.74 -1.26 -1.47 119.66 123.77 1vgh s GLN 20 Ca 0.11 -0.61 -0.30 0.00 0.05 0.00 0.00 55.36 54.60 1vgh s GLN 20 Cb -0.12 -1.61 -0.05 0.00 1.10 0.00 0.00 33.01 32.32 1vgh s GLN 20 CO 0.02 0.21 1.41 0.34 -0.55 0.00 0.00 175.29 176.71 1vgh s ASP 21 N 0.16 6.85 0.49 6.67 2.15 -0.56 -4.93 116.67 127.50 1vgh s ASP 21 Ca -0.07 2.10 0.27 0.00 0.43 0.00 0.00 52.55 55.28 1vgh s ASP 21 Cb -0.13 -2.56 1.21 0.00 -0.30 0.00 0.00 42.92 41.14 1vgh s ASP 21 CO 0.03 -0.73 1.95 1.55 -0.17 0.00 0.00 175.17 177.80 1vgh h PRO 22 N 7.90 0.00 0.04 4.34 0.13 -1.97 0.31 132.00 142.76 1vgh h PRO 22 Ca -0.38 0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 64.50 1vgh h PRO 22 Cb 1.18 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.28 1vgh h PRO 22 CO 0.91 0.16 -1.39 1.96 -0.23 0.00 0.00 178.00 179.41 1vgh h GLN 23 N 0.00 0.08 0.00 0.86 4.20 -1.99 -3.40 115.11 114.86 1vgh h GLN 23 Ca -0.00 -0.14 0.00 0.00 0.06 0.00 0.00 58.65 58.57 1vgh h GLN 23 Cb 0.55 0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.38 1vgh h GLN 23 CO 0.02 1.07 -1.43 0.25 -0.67 0.00 0.00 178.83 178.06 1vgh n THR 24 N -4.19 0.02 -1.44 -0.54 -2.24 -1.23 -4.98 114.28 99.67 1vgh n THR 24 Ca -0.31 -0.24 -0.15 0.00 -2.27 0.00 0.00 64.05 61.08 1vgh n THR 24 Cb 0.77 0.48 -0.06 0.00 -2.10 0.00 0.00 70.33 69.42 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 -3.29 4.31 0.05 0.00 1.02 -1.25 -4.76 119.74 115.82 1vgh s LYS 26 Ca 0.00 1.60 -0.01 0.00 0.02 0.00 0.00 55.97 57.58 1vgh s LYS 26 Cb 0.00 -3.64 -0.04 0.00 -0.52 0.00 0.00 37.83 33.63 1vgh s LYS 26 CO 0.00 -0.54 0.21 0.00 -0.92 0.00 0.00 175.35 174.10 1vgh s SER 28 N -2.43 0.16 0.24 0.00 1.04 -0.54 -5.01 113.70 107.16 1vgh s SER 28 Ca 0.34 -0.33 -0.30 0.00 0.48 0.00 0.00 55.95 56.14 1vgh s SER 28 Cb -0.13 0.07 -0.09 0.00 0.10 0.00 0.00 66.02 65.97 1vgh s SER 28 CO 0.27 -0.21 1.25 0.00 0.98 0.00 0.00 173.24 175.53 1vgh h LYS 30 N 4.56 0.36 -6.35 0.00 3.64 -1.58 -3.43 116.57 113.77 1vgh h LYS 30 Ca -0.46 -0.26 -0.55 0.00 -1.27 0.00 0.00 60.65 58.12 1vgh h LYS 30 Cb 1.22 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 33.06 1vgh h LYS 30 CO 0.72 0.87 0.63 1.21 -2.27 0.00 0.00 179.45 180.61 1vgh s ASN 31 N -6.33 7.10 0.31 4.20 2.47 -1.26 -5.02 114.94 116.41 1vgh s ASN 31 Ca -0.14 1.82 0.07 0.00 0.42 0.00 0.00 52.86 55.03 1vgh s ASN 31 Cb 0.04 -2.56 -0.03 0.00 -1.45 0.00 0.00 41.25 37.25 1vgh s ASN 31 CO 0.77 -0.52 0.26 0.42 -3.72 0.00 0.00 177.10 174.31 1vgh s THR 32 N 1.83 3.80 0.37 -5.21 -4.23 -1.26 -4.96 115.64 105.97 1vgh s THR 32 Ca 0.55 -1.39 0.10 0.00 -1.18 0.00 0.00 61.69 59.77 1vgh s THR 32 Cb -0.25 -3.24 0.12 0.00 1.34 0.00 0.00 72.50 70.47 1vgh s THR 32 CO 0.24 -0.23 1.85 -0.78 -0.54 0.00 0.00 174.62 175.16 1vgh h ASP 33 N 1.34 0.17 -0.17 3.99 3.58 -1.96 -2.39 116.42 120.98 1vgh h ASP 33 Ca -0.46 -0.05 -0.00 0.00 0.42 0.00 0.00 57.03 56.94 1vgh h ASP 33 Cb 1.25 -0.04 -0.01 0.00 1.72 0.00 0.00 39.33 42.25 1vgh h ASP 33 CO 0.59 0.43 0.09 -1.28 -2.88 0.00 0.00 179.24 176.19 1vgh h SER 34 N 0.16 0.21 -0.64 2.28 0.87 -1.95 0.13 113.55 114.61 1vgh h SER 34 Ca 0.03 -0.09 0.12 0.00 -1.23 0.00 0.00 61.79 60.61 1vgh h SER 34 Cb 0.53 -0.05 -0.09 0.00 -0.44 0.00 0.00 62.40 62.35 1vgh h SER 34 CO 0.04 0.25 0.15 -0.09 -0.53 0.00 0.00 176.83 176.65 1vgh h ARG 35 N 0.16 0.27 -0.35 2.24 9.65 -1.89 -1.71 114.38 122.75 1vgh h ARG 35 Ca 0.06 -0.02 -0.16 0.00 -1.10 0.00 0.00 59.98 58.76 1vgh h ARG 35 Cb 0.08 -0.06 -0.00 0.00 -1.39 0.00 0.00 29.97 28.60 1vgh h ARG 35 CO -0.01 0.18 -0.41 0.00 2.80 0.00 0.00 179.97 182.54 1vgh h LYS 37 N 0.71 0.00 -0.94 0.00 1.63 -0.08 -0.79 116.57 117.10 1vgh h LYS 37 Ca 0.05 0.00 0.18 0.00 -0.85 0.00 0.00 60.65 60.03 1vgh h LYS 37 Cb 1.00 0.00 -0.08 0.00 -0.60 0.00 0.00 32.23 32.55 1vgh h LYS 37 CO 0.10 0.10 0.60 0.00 -3.45 0.00 0.00 179.45 176.80 1vgh h ALA 38 N 1.90 1.91 -0.43 5.00 0.00 -1.32 -0.51 119.26 125.81 1vgh h ALA 38 Ca -0.00 0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.83 1vgh h ALA 38 Cb 0.22 -0.08 -0.07 0.00 0.00 0.00 0.00 17.79 17.86 1vgh h ALA 38 CO 0.01 -0.21 0.07 2.89 0.00 0.00 0.00 179.25 182.01 1vgh n ARG 39 N -4.60 2.88 -3.55 0.00 0.00 -0.82 -4.97 116.66 105.60 1vgh n ARG 39 Ca 0.20 -3.01 -0.19 0.00 -0.00 0.00 0.00 57.85 54.85 1vgh n ARG 39 Cb 0.58 -1.95 0.07 0.00 -0.00 0.00 0.00 32.46 31.15 1vgh n ARG 39 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.63 178.67 1vgh n GLN 40 N -0.57 -6.11 -4.55 2.89 3.00 -0.20 -5.03 117.38 106.81 1vgh n GLN 40 Ca 0.30 0.76 -0.27 0.00 -0.01 0.00 0.00 57.00 57.79 1vgh n GLN 40 Cb 1.08 -5.62 -0.08 0.00 0.00 0.00 0.00 30.24 25.62 1vgh n GLN 40 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 1vgh s LEU 41 N -6.57 2.07 0.12 1.08 1.43 -0.36 -4.94 118.68 111.50 1vgh s LEU 41 Ca 0.07 -1.65 0.03 0.00 -1.03 0.00 0.00 54.13 51.55 1vgh s LEU 41 Cb -0.03 -0.24 -0.04 0.00 0.03 0.00 0.00 46.19 45.90 1vgh s LEU 41 CO 0.76 -0.89 -0.08 -1.61 0.23 0.00 0.00 176.35 174.76 1vgh s GLU 42 N -3.75 0.94 0.34 1.70 2.02 -0.45 -2.10 118.70 117.40 1vgh s GLU 42 Ca 0.22 -1.39 -0.27 0.00 0.02 0.00 0.00 54.97 53.55 1vgh s GLU 42 Cb 0.03 -0.42 -0.09 0.00 0.10 0.00 0.00 34.13 33.75 1vgh s GLU 42 CO 0.13 0.03 1.14 -1.17 0.02 0.00 0.00 175.26 175.41 1vgh s LEU 43 N -3.09 4.37 -0.40 1.80 2.96 -1.26 -0.89 118.68 122.18 1vgh s LEU 43 Ca 0.14 2.33 -0.22 0.00 -0.22 0.00 0.00 54.13 56.15 1vgh s LEU 43 Cb 0.04 -3.82 0.01 0.00 0.50 0.00 0.00 46.19 42.92 1vgh s LEU 43 CO -0.02 -0.41 0.74 0.21 -1.32 0.00 0.00 176.35 175.55 1vgh s ASN 44 N -0.99 6.46 0.57 3.68 3.84 0.29 -4.77 114.94 124.02 1vgh s ASN 44 Ca 0.51 0.09 0.27 0.00 0.21 0.00 0.00 52.86 53.93 1vgh s ASN 44 Cb -0.31 -2.37 1.54 0.00 -0.55 0.00 0.00 41.25 39.56 1vgh s ASN 44 CO 0.40 -0.77 2.07 -0.08 -2.79 0.00 0.00 177.10 175.92 1vgh h GLU 45 N 8.69 0.00 0.02 0.43 4.81 -1.45 0.13 114.58 127.21 1vgh h GLU 45 Ca -0.25 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 58.98 1vgh h GLU 45 Cb 1.09 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.47 1vgh h GLU 45 CO 0.91 0.00 -0.01 0.00 -0.73 0.00 0.00 179.01 179.18 1vgh h ARG 46 N 0.00 -0.02 0.00 1.92 3.08 -1.92 -3.41 114.38 114.03 1vgh h ARG 46 Ca 0.13 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.13 1vgh h ARG 46 Cb 0.61 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.65 1vgh h ARG 46 CO -0.00 -0.02 -1.83 -2.37 -1.07 0.00 0.00 179.97 174.68 1vgh n THR 47 N -3.83 0.34 -2.72 2.04 5.66 -1.21 -5.02 114.28 109.53 1vgh n THR 47 Ca -0.00 -0.56 -0.10 0.00 -3.05 0.00 0.00 64.05 60.34 1vgh n THR 47 Cb 0.01 -0.16 0.05 0.00 -1.55 0.00 0.00 70.33 68.68 1vgh n THR 47 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1vgh s ARG 49 N -4.23 1.52 0.01 0.00 1.81 -1.26 -4.68 118.95 112.13 1vgh s ARG 49 Ca 0.19 -1.68 -0.20 0.00 -1.72 0.00 0.00 55.73 52.33 1vgh s ARG 49 Cb -0.03 -1.50 -0.06 0.00 -0.45 0.00 0.00 34.95 32.92 1vgh s ARG 49 CO 0.47 0.27 0.58 0.00 -0.68 0.00 0.00 175.30 175.95 1vgh s ASP 51 N -0.43 0.30 -0.09 0.00 1.47 -0.06 -4.94 116.67 112.92 1vgh s ASP 51 Ca 0.30 -1.18 -0.29 0.00 1.18 0.00 0.00 52.55 52.55 1vgh s ASP 51 Cb -0.18 0.30 -0.04 0.00 -0.34 0.00 0.00 42.92 42.65 1vgh s ASP 51 CO 0.17 -0.73 1.57 -0.75 0.68 0.00 0.00 175.17 176.12 1vgh s LYS 52 N -4.04 4.15 -0.45 2.11 2.20 -1.26 -1.34 119.74 121.11 1vgh s LYS 52 Ca 0.23 2.03 -0.40 0.00 -0.36 0.00 0.00 55.97 57.47 1vgh s LYS 52 Cb 0.07 -3.95 -0.17 0.00 -1.51 0.00 0.00 37.83 32.27 1vgh s LYS 52 CO 0.01 -0.87 1.78 -2.30 -0.36 0.00 0.00 175.35 173.61 1vgh n PRO 53 N 7.08 0.00 0.00 4.03 -0.02 -1.26 -4.71 135.00 140.12 1vgh n PRO 53 Ca 0.17 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.65 1vgh n PRO 53 Cb 0.43 -1.34 0.00 0.00 -0.02 0.00 0.00 33.50 32.58 1vgh n PRO 53 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 1vgh n ARG 54 N 5.85 0.00 0.00 -0.52 0.00 -1.26 -5.10 116.66 115.63 1vgh n ARG 54 Ca 0.43 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 58.28 1vgh n ARG 54 Cb -0.04 -0.06 0.00 0.00 -0.00 0.00 0.00 32.46 32.36 1vgh n ARG 54 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17