#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 0.00 -1.87 0.00 5.12 -1.26 -4.01 116.66 114.65 1vgh n ARG 2 Ca 0.00 0.00 -0.42 0.00 -1.93 0.00 0.00 57.85 55.50 1vgh n ARG 2 Cb 0.00 0.00 -0.01 0.00 -1.16 0.00 0.00 32.46 31.29 1vgh n ARG 2 CO 0.00 0.00 0.00 0.94 -1.93 0.00 0.00 177.63 176.64 1vgh n GLN 3 N 0.00 2.77 0.00 5.56 7.27 -1.26 -4.84 117.38 126.88 1vgh n GLN 3 Ca 0.00 -2.67 0.00 0.00 0.07 0.00 0.00 57.00 54.40 1vgh n GLN 3 Cb 0.00 -3.31 0.00 0.00 2.41 0.00 0.00 30.24 29.34 1vgh n GLN 3 CO 0.00 0.00 0.00 -1.91 0.07 0.00 0.00 177.06 175.22 1vgh n GLU 4 N 6.72 0.00 -3.46 3.69 2.13 -1.26 -4.04 120.64 124.42 1vgh n GLU 4 Ca 0.51 0.00 -0.12 0.00 0.66 0.00 0.00 57.16 58.21 1vgh n GLU 4 Cb 0.41 0.00 -0.10 0.00 0.27 0.00 0.00 31.44 32.02 1vgh n GLU 4 CO 0.00 0.00 0.00 1.21 -0.41 0.00 0.00 177.13 177.93 1vgh s ASN 5 N -4.00 0.46 -0.18 4.31 2.47 -1.26 -1.45 114.94 115.29 1vgh s ASN 5 Ca 0.00 0.27 -0.35 0.00 0.42 0.00 0.00 52.86 53.20 1vgh s ASN 5 Cb 0.00 0.92 -0.12 0.00 -1.45 0.00 0.00 41.25 40.60 1vgh s ASN 5 CO 0.00 -0.29 1.93 -2.65 -3.72 0.00 0.00 177.10 172.37 1vgh n PRO 6 N 5.36 1.80 -4.34 0.43 -0.02 -1.26 -4.73 135.00 132.24 1vgh n PRO 6 Ca -0.05 0.63 -0.20 0.00 -2.02 0.00 0.00 63.50 61.86 1vgh n PRO 6 Cb 0.50 -2.55 -0.09 0.00 -0.02 0.00 0.00 33.50 31.34 1vgh n PRO 6 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1vgh s GLY 8 N -3.41 0.13 0.07 0.00 0.00 -1.26 -5.13 107.32 97.72 1vgh s GLY 8 Ca 0.35 -0.51 -0.34 0.00 0.00 0.00 0.00 44.72 44.23 1vgh s GLY 8 CO 0.21 -0.29 1.66 -1.05 0.00 0.00 0.00 173.10 173.63 1vgh n PRO 9 N -0.43 2.08 -0.02 2.90 -0.02 -1.26 -4.92 135.00 133.33 1vgh n PRO 9 Ca -0.03 0.76 -0.13 0.00 -2.02 0.00 0.00 63.50 62.07 1vgh n PRO 9 Cb 0.60 -2.54 -0.09 0.00 -0.02 0.00 0.00 33.50 31.45 1vgh n PRO 9 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1vgh n SER 11 N -4.81 3.39 0.00 0.00 3.41 -1.26 -5.01 113.62 109.35 1vgh n SER 11 Ca -0.08 -2.54 0.00 0.00 -0.26 0.00 0.00 58.87 55.99 1vgh n SER 11 Cb 0.27 -0.61 0.00 0.00 -0.26 0.00 0.00 64.21 63.61 1vgh n SER 11 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1vgh n GLU 12 N 0.17 0.00 -3.16 4.33 4.07 -1.17 -2.60 120.64 122.28 1vgh n GLU 12 Ca 0.18 0.00 -0.22 0.00 -0.06 0.00 0.00 57.16 57.06 1vgh n GLU 12 Cb 0.81 0.00 -0.04 0.00 -0.06 0.00 0.00 31.44 32.14 1vgh n GLU 12 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 1vgh n ARG 13 N 3.53 1.42 0.03 5.31 5.12 -1.26 -4.80 116.66 126.01 1vgh n ARG 13 Ca 0.00 -3.70 0.00 0.00 -1.93 0.00 0.00 57.85 52.22 1vgh n ARG 13 Cb 0.00 -1.73 0.00 0.00 -1.16 0.00 0.00 32.46 29.57 1vgh n ARG 13 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 1vgh n ARG 14 N 0.49 0.00 -2.38 5.56 1.74 -1.07 -4.95 116.66 116.05 1vgh n ARG 14 Ca 0.25 0.00 -0.43 0.00 -0.77 0.00 0.00 57.85 56.91 1vgh n ARG 14 Cb 0.56 -0.01 0.00 0.00 -1.02 0.00 0.00 32.46 31.99 1vgh n ARG 14 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1vgh n LYS 15 N -2.69 3.68 0.16 5.56 5.02 -1.24 -4.74 118.16 123.92 1vgh n LYS 15 Ca 0.00 -3.60 0.12 0.00 -2.02 0.00 0.00 58.31 52.82 1vgh n LYS 15 Cb 0.00 -2.90 0.58 0.00 -0.02 0.00 0.00 35.03 32.70 1vgh n LYS 15 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1vgh h HIS 16 N 5.74 0.00 0.00 2.13 3.86 -1.91 -2.02 115.15 122.94 1vgh h HIS 16 Ca 0.38 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.59 1vgh h HIS 16 Cb 0.63 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.10 1vgh h HIS 16 CO 1.23 0.00 0.00 1.28 0.86 0.00 0.00 177.93 181.30 1vgh n LEU 17 N -2.33 0.10 -4.85 2.43 4.77 -1.26 -4.68 117.00 111.19 1vgh n LEU 17 Ca 0.00 0.54 -0.34 0.00 -0.03 0.00 0.00 56.01 56.17 1vgh n LEU 17 Cb 0.13 -0.54 -0.06 0.00 -2.33 0.00 0.00 43.42 40.62 1vgh n LEU 17 CO 0.15 -0.46 0.28 -0.36 -1.33 0.00 0.00 177.39 175.67 1vgh s PHE 18 N -3.08 3.56 0.06 -1.77 0.40 -0.76 -1.43 117.98 114.95 1vgh s PHE 18 Ca 0.03 1.09 0.09 0.00 -0.60 0.00 0.00 56.93 57.54 1vgh s PHE 18 Cb 0.05 -2.40 -0.03 0.00 0.51 0.00 0.00 43.02 41.14 1vgh s PHE 18 CO 0.14 0.35 -0.23 0.14 0.70 0.00 0.00 175.22 176.32 1vgh s VAL 19 N -1.59 2.40 0.10 -0.44 -7.23 -0.29 -4.88 120.40 108.47 1vgh s VAL 19 Ca 0.42 -1.37 0.03 0.00 -1.81 0.00 0.00 61.98 59.25 1vgh s VAL 19 Cb -0.14 -1.98 -0.04 0.00 0.56 0.00 0.00 36.38 34.78 1vgh s VAL 19 CO 0.20 0.31 0.10 -1.58 -0.31 0.00 0.00 175.10 173.82 1vgh s GLN 20 N -1.44 2.93 -0.34 4.82 0.74 -1.26 -1.22 119.66 123.89 1vgh s GLN 20 Ca 0.13 -0.72 -0.07 0.00 0.05 0.00 0.00 55.36 54.76 1vgh s GLN 20 Cb -0.10 -2.73 0.04 0.00 1.10 0.00 0.00 33.01 31.31 1vgh s GLN 20 CO 0.04 0.55 0.11 0.34 -0.55 0.00 0.00 175.29 175.78 1vgh s ASP 21 N -2.59 5.33 0.00 6.67 2.15 0.11 -4.99 116.67 123.36 1vgh s ASP 21 Ca 0.30 -1.09 0.22 0.00 0.43 0.00 0.00 52.55 52.40 1vgh s ASP 21 Cb -0.12 -1.88 1.29 0.00 -0.30 0.00 0.00 42.92 41.91 1vgh s ASP 21 CO 0.23 -0.32 1.75 -0.81 -0.17 0.00 0.00 175.17 175.84 1vgh n PRO 22 N 4.83 0.86 -0.04 4.34 -0.04 -1.26 -0.87 135.00 142.81 1vgh n PRO 22 Ca -0.13 0.00 -0.22 0.00 -0.04 0.00 0.00 63.50 63.12 1vgh n PRO 22 Cb 0.45 -1.39 -0.13 0.00 -0.04 0.00 0.00 33.50 32.39 1vgh n PRO 22 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 1vgh h GLN 23 N 0.00 0.15 0.00 0.54 4.20 -1.95 -3.36 115.11 114.69 1vgh h GLN 23 Ca 0.00 -0.25 -0.18 0.00 0.06 0.00 0.00 58.65 58.28 1vgh h GLN 23 Cb 0.00 0.09 -0.03 0.00 0.30 0.00 0.00 27.48 27.84 1vgh h GLN 23 CO 0.00 1.12 -1.94 0.25 -0.67 0.00 0.00 178.83 177.59 1vgh n THR 24 N -3.97 0.68 -0.77 -0.54 -2.24 -1.23 -4.67 114.28 101.55 1vgh n THR 24 Ca -0.31 -0.55 0.00 0.00 -2.27 0.00 0.00 64.05 60.92 1vgh n THR 24 Cb 0.87 -0.35 0.00 0.00 -2.10 0.00 0.00 70.33 68.74 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 -0.23 2.62 0.14 0.00 2.20 -1.23 -4.80 119.74 118.44 1vgh s LYS 26 Ca 0.00 1.40 0.07 0.00 -0.36 0.00 0.00 55.97 57.08 1vgh s LYS 26 Cb 0.00 -1.93 -0.04 0.00 -1.51 0.00 0.00 37.83 34.35 1vgh s LYS 26 CO 0.00 -1.39 -0.16 0.00 -0.36 0.00 0.00 175.35 173.45 1vgh s SER 28 N -2.60 0.20 0.02 0.00 0.01 -0.35 -4.99 113.70 106.00 1vgh s SER 28 Ca 0.12 -0.17 -0.30 0.00 1.31 0.00 0.00 55.95 56.91 1vgh s SER 28 Cb -0.05 0.02 -0.05 0.00 0.21 0.00 0.00 66.02 66.15 1vgh s SER 28 CO 0.04 -0.07 1.25 0.00 0.41 0.00 0.00 173.24 174.87 1vgh h LYS 30 N 7.18 0.72 -6.58 0.00 3.64 -1.58 -3.39 116.57 116.55 1vgh h LYS 30 Ca -0.39 -0.12 -0.57 0.00 -1.27 0.00 0.00 60.65 58.31 1vgh h LYS 30 Cb 1.19 -0.12 -0.07 0.00 -0.41 0.00 0.00 32.23 32.82 1vgh h LYS 30 CO 0.85 0.62 0.88 1.21 -2.27 0.00 0.00 179.45 180.75 1vgh s ASN 31 N -5.92 6.70 0.43 4.20 2.47 -1.26 -4.99 114.94 116.57 1vgh s ASN 31 Ca -0.13 0.58 0.08 0.00 0.42 0.00 0.00 52.86 53.81 1vgh s ASN 31 Cb 0.11 -2.54 0.00 0.00 -1.45 0.00 0.00 41.25 37.37 1vgh s ASN 31 CO 0.77 -1.15 0.49 0.42 -3.72 0.00 0.00 177.10 173.91 1vgh s THR 32 N 4.22 2.75 0.27 -5.21 -4.23 -1.26 -4.89 115.64 107.29 1vgh s THR 32 Ca 0.47 -1.17 -0.03 0.00 -1.18 0.00 0.00 61.69 59.77 1vgh s THR 32 Cb -0.08 -2.92 0.27 0.00 1.34 0.00 0.00 72.50 71.11 1vgh s THR 32 CO 0.27 0.00 1.92 -2.24 -0.54 0.00 0.00 174.62 174.04 1vgh h ASP 33 N 0.79 1.05 -0.53 3.99 2.03 -1.95 -1.30 116.42 120.50 1vgh h ASP 33 Ca -0.40 -0.01 -0.02 0.00 -0.73 0.00 0.00 57.03 55.86 1vgh h ASP 33 Cb 1.28 -0.24 -0.02 0.00 -0.83 0.00 0.00 39.33 39.51 1vgh h ASP 33 CO 0.51 0.73 0.24 0.28 -1.03 0.00 0.00 179.24 179.96 1vgh h SER 34 N 1.22 0.71 0.02 4.15 0.02 -1.96 0.15 113.55 117.85 1vgh h SER 34 Ca 0.38 -0.15 0.00 0.00 -0.84 0.00 0.00 61.79 61.18 1vgh h SER 34 Cb -0.02 -0.18 -0.00 0.00 0.14 0.00 0.00 62.40 62.34 1vgh h SER 34 CO -0.11 0.66 -0.03 -0.09 -1.14 0.00 0.00 176.83 176.12 1vgh h ARG 35 N 0.71 -0.05 -0.38 3.45 9.65 -1.84 0.01 114.38 125.92 1vgh h ARG 35 Ca 0.18 0.00 -0.02 0.00 -1.10 0.00 0.00 59.98 59.04 1vgh h ARG 35 Cb 0.15 0.01 -0.02 0.00 -1.39 0.00 0.00 29.97 28.73 1vgh h ARG 35 CO -0.02 -0.04 0.16 0.00 2.80 0.00 0.00 179.97 182.87 1vgh h LYS 37 N 0.47 1.19 -0.07 0.00 3.64 -0.51 0.10 116.57 121.40 1vgh h LYS 37 Ca 0.13 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 1vgh h LYS 37 Cb 0.18 -0.27 -0.00 0.00 -0.41 0.00 0.00 32.23 31.73 1vgh h LYS 37 CO -0.01 0.79 0.05 0.00 -2.27 0.00 0.00 179.45 178.00 1vgh h ALA 38 N 1.35 1.97 -0.57 5.00 0.00 -0.84 -0.77 119.26 125.40 1vgh h ALA 38 Ca 0.34 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.25 1vgh h ALA 38 Cb -0.11 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1vgh h ALA 38 CO -0.09 0.03 0.00 0.54 0.00 0.00 0.00 179.25 179.73 1vgh n ARG 39 N -4.53 4.53 -3.58 0.00 1.74 -0.17 -4.96 116.66 109.70 1vgh n ARG 39 Ca -0.02 -2.97 -0.22 0.00 -0.77 0.00 0.00 57.85 53.86 1vgh n ARG 39 Cb 0.09 -2.17 0.08 0.00 -1.02 0.00 0.00 32.46 29.44 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 0.70 -7.25 -3.74 5.56 1.13 -0.30 -5.00 117.38 108.48 1vgh n GLN 40 Ca 0.26 0.81 -0.15 0.00 -1.94 0.00 0.00 57.00 55.98 1vgh n GLN 40 Cb 1.10 -5.82 -0.06 0.00 0.11 0.00 0.00 30.24 25.58 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 -4.69 0.00 -4.18 1.08 4.77 0.18 -4.97 117.00 109.20 1vgh n LEU 41 Ca -0.09 -2.48 -0.19 0.00 -0.03 0.00 0.00 56.01 53.22 1vgh n LEU 41 Cb 0.60 1.33 -0.12 0.00 -2.33 0.00 0.00 43.42 42.89 1vgh n LEU 41 CO 0.65 -0.41 -0.46 -1.61 -1.33 0.00 0.00 177.39 174.22 1vgh s GLU 42 N -3.05 0.83 0.15 3.23 2.02 -0.45 -2.26 118.70 119.17 1vgh s GLU 42 Ca 0.31 -0.96 -0.29 0.00 0.02 0.00 0.00 54.97 54.05 1vgh s GLU 42 Cb 0.01 -0.85 -0.07 0.00 0.10 0.00 0.00 34.13 33.32 1vgh s GLU 42 CO 0.22 0.19 0.90 -1.17 0.02 0.00 0.00 175.26 175.42 1vgh s LEU 43 N -1.75 4.55 -0.42 1.80 2.96 -1.26 -0.93 118.68 123.62 1vgh s LEU 43 Ca -0.02 1.77 -0.22 0.00 -0.22 0.00 0.00 54.13 55.44 1vgh s LEU 43 Cb -0.10 -3.50 0.02 0.00 0.50 0.00 0.00 46.19 43.11 1vgh s LEU 43 CO 0.02 0.05 0.72 0.21 -1.32 0.00 0.00 176.35 176.03 1vgh s ASN 44 N -0.51 6.40 0.40 3.68 2.47 -0.29 -4.94 114.94 122.16 1vgh s ASN 44 Ca 0.42 -0.10 0.28 0.00 0.42 0.00 0.00 52.86 53.89 1vgh s ASN 44 Cb -0.24 -2.36 1.44 0.00 -1.45 0.00 0.00 41.25 38.65 1vgh s ASN 44 CO 0.29 -0.80 1.85 -0.33 -3.72 0.00 0.00 177.10 174.39 1vgh h GLU 45 N 8.82 0.00 0.01 0.43 3.07 -1.96 0.19 114.58 125.13 1vgh h GLU 45 Ca -0.25 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.61 1vgh h GLU 45 Cb 1.09 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.00 1vgh h GLU 45 CO 0.91 0.00 -0.01 0.00 -1.40 0.00 0.00 179.01 178.52 1vgh h ARG 46 N 0.00 -0.01 0.00 2.33 2.47 -1.96 -3.38 114.38 113.82 1vgh h ARG 46 Ca 0.00 0.00 -0.08 0.00 -1.26 0.00 0.00 59.98 58.64 1vgh h ARG 46 Cb 0.09 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.40 1vgh h ARG 46 CO 0.00 0.29 -1.15 1.79 0.56 0.00 0.00 179.97 181.45 1vgh h THR 47 N -1.00 0.26 -5.68 2.04 1.35 -1.98 -3.49 112.91 104.42 1vgh h THR 47 Ca -0.00 -1.51 -0.33 0.00 -0.55 0.00 0.00 66.41 64.02 1vgh h THR 47 Cb 0.31 1.80 0.16 0.00 -1.73 0.00 0.00 68.15 68.68 1vgh h THR 47 CO 0.00 0.15 -0.80 0.00 -0.25 0.00 0.00 175.52 174.62 1vgh s ARG 49 N -5.25 1.41 0.04 0.00 0.52 -1.24 -4.75 118.95 109.69 1vgh s ARG 49 Ca 0.12 -1.46 -0.20 0.00 -0.52 0.00 0.00 55.73 53.67 1vgh s ARG 49 Cb -0.02 -1.65 -0.06 0.00 0.52 0.00 0.00 34.95 33.74 1vgh s ARG 49 CO 0.75 0.35 0.58 0.00 0.02 0.00 0.00 175.30 177.00 1vgh s ASP 51 N -0.74 0.44 0.10 0.00 -4.77 -0.11 -4.95 116.67 106.64 1vgh s ASP 51 Ca 0.30 -0.91 -0.30 0.00 -3.30 0.00 0.00 52.55 48.33 1vgh s ASP 51 Cb -0.19 0.19 -0.06 0.00 -1.09 0.00 0.00 42.92 41.77 1vgh s ASP 51 CO 0.18 -0.56 1.21 -0.54 0.70 0.00 0.00 175.17 176.16 1vgh s LYS 52 N -3.55 4.44 -1.32 2.11 1.02 -1.26 -1.33 119.74 119.84 1vgh s LYS 52 Ca 0.04 1.82 -0.17 0.00 0.02 0.00 0.00 55.97 57.68 1vgh s LYS 52 Cb 0.05 -3.31 0.02 0.00 -0.52 0.00 0.00 37.83 34.08 1vgh s LYS 52 CO -0.09 -0.22 2.00 -0.35 -0.92 0.00 0.00 175.35 175.77 1vgh n PRO 53 N 3.54 2.77 -2.27 -1.68 -0.04 -1.26 -4.21 135.00 131.85 1vgh n PRO 53 Ca 0.08 -2.77 -0.03 0.00 -0.04 0.00 0.00 63.50 60.74 1vgh n PRO 53 Cb 0.46 -3.36 0.07 0.00 -0.04 0.00 0.00 33.50 30.63 1vgh n PRO 53 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 1vgh n ARG 54 N 7.17 1.05 0.00 0.54 -4.01 -1.26 -5.13 116.66 115.03 1vgh n ARG 54 Ca 0.50 -1.42 0.00 0.00 -1.04 0.00 0.00 57.85 55.89 1vgh n ARG 54 Cb 0.42 0.23 0.00 0.00 -3.04 0.00 0.00 32.46 30.07 1vgh n ARG 54 CO 0.00 0.00 0.00 -2.13 -3.04 0.00 0.00 177.63 172.46