#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 0.32 0.38 0.00 0.00 -0.88 -4.87 116.66 111.61 1vgh n ARG 2 Ca 0.00 -0.70 -0.18 0.00 -0.00 0.00 0.00 57.85 56.97 1vgh n ARG 2 Cb 0.00 0.84 -0.09 0.00 -0.00 0.00 0.00 32.46 33.21 1vgh n ARG 2 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.63 178.00 1vgh h GLN 3 N 0.00 -0.89 -3.23 2.89 5.75 -1.69 -3.30 115.11 114.64 1vgh h GLN 3 Ca -0.10 0.06 -0.68 0.00 -0.15 0.00 0.00 58.65 57.78 1vgh h GLN 3 Cb 0.37 0.20 0.01 0.00 1.07 0.00 0.00 27.48 29.14 1vgh h GLN 3 CO 0.13 -0.59 3.68 -0.85 -2.65 0.00 0.00 178.83 178.55 1vgh n GLU 4 N -5.48 3.52 -3.72 1.69 0.28 -1.26 -4.80 120.64 110.87 1vgh n GLU 4 Ca -0.14 -2.31 -0.11 0.00 -0.16 0.00 0.00 57.16 54.44 1vgh n GLU 4 Cb 0.38 -2.91 -0.11 0.00 1.43 0.00 0.00 31.44 30.22 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 2.39 -0.43 -0.63 -1.84 2.47 -1.24 -5.11 114.94 110.55 1vgh s ASN 5 Ca 0.64 0.78 -0.27 0.00 0.42 0.00 0.00 52.86 54.44 1vgh s ASN 5 Cb 0.17 0.70 -0.01 0.00 -1.45 0.00 0.00 41.25 40.66 1vgh s ASN 5 CO -0.07 -0.17 1.73 -2.16 -3.72 0.00 0.00 177.10 172.71 1vgh s PRO 6 N 1.04 2.78 0.23 0.43 0.04 -1.26 -4.91 135.00 133.35 1vgh s PRO 6 Ca -0.07 0.46 -0.30 0.00 0.04 0.00 0.00 61.00 61.13 1vgh s PRO 6 Cb -0.07 -4.33 -0.09 0.00 0.04 0.00 0.00 34.50 30.04 1vgh s PRO 6 CO -0.08 -2.56 1.34 0.00 0.04 0.00 0.00 177.00 175.74 1vgh n GLY 8 N 2.16 0.93 3.82 0.00 0.00 -1.26 -5.10 105.19 105.73 1vgh n GLY 8 Ca 0.06 -2.03 -0.32 0.00 0.00 0.00 0.00 46.02 43.72 1vgh n GLY 8 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1vgh s PRO 9 N -3.81 3.42 0.00 1.61 0.04 -1.26 -5.01 135.00 130.00 1vgh s PRO 9 Ca 0.36 1.10 -0.25 0.00 0.04 0.00 0.00 61.00 62.26 1vgh s PRO 9 Cb -0.02 -2.05 -0.16 0.00 0.04 0.00 0.00 34.50 32.30 1vgh s PRO 9 CO 0.24 -0.72 1.21 0.00 0.04 0.00 0.00 177.00 177.77 1vgh n SER 11 N -5.12 0.00 0.47 0.00 2.88 -1.26 -5.01 113.62 105.58 1vgh n SER 11 Ca -0.09 0.00 -0.19 0.00 -1.33 0.00 0.00 58.87 57.25 1vgh n SER 11 Cb 0.26 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.63 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 -1.16 0.00 -1.46 4.39 -2.00 -3.47 114.58 110.89 1vgh h GLU 12 Ca 0.00 0.08 0.00 0.00 0.34 0.00 0.00 59.36 59.78 1vgh h GLU 12 Cb 0.00 0.26 0.00 0.00 -0.10 0.00 0.00 28.75 28.91 1vgh h GLU 12 CO 0.00 -0.77 0.00 -2.13 -1.16 0.00 0.00 179.01 174.95 1vgh n ARG 13 N -5.59 0.00 -1.90 2.33 0.63 -1.26 -4.81 116.66 106.06 1vgh n ARG 13 Ca -0.15 0.00 -0.41 0.00 -0.92 0.00 0.00 57.85 56.36 1vgh n ARG 13 Cb 0.48 0.00 -0.00 0.00 0.45 0.00 0.00 32.46 33.38 1vgh n ARG 13 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 1vgh n ARG 14 N -3.34 3.47 0.40 -0.14 5.12 -1.26 -4.76 116.66 116.16 1vgh n ARG 14 Ca 0.00 -2.96 -0.16 0.00 -1.93 0.00 0.00 57.85 52.80 1vgh n ARG 14 Cb 0.00 -3.00 -0.07 0.00 -1.16 0.00 0.00 32.46 28.22 1vgh n ARG 14 CO 0.00 0.00 0.00 1.57 -1.93 0.00 0.00 177.63 177.27 1vgh h LYS 15 N 5.57 -0.98 0.00 5.56 5.09 -1.94 -3.46 116.57 126.40 1vgh h LYS 15 Ca 0.58 0.07 0.00 0.00 0.09 0.00 0.00 60.65 61.38 1vgh h LYS 15 Cb 0.54 0.22 0.00 0.00 0.10 0.00 0.00 32.23 33.09 1vgh h LYS 15 CO 1.73 -0.65 0.00 0.72 -2.09 0.00 0.00 179.45 179.16 1vgh n HIS 16 N -4.90 0.00 -0.86 0.07 8.25 -1.26 -4.53 115.22 111.99 1vgh n HIS 16 Ca -0.13 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.22 1vgh n HIS 16 Cb 0.40 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.49 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 0.00 5.92 -4.00 2.41 4.77 -1.26 -4.82 117.00 120.01 1vgh n LEU 17 Ca 0.00 -3.09 -0.08 0.00 -0.03 0.00 0.00 56.01 52.81 1vgh n LEU 17 Cb 0.00 -1.16 -0.10 0.00 -2.33 0.00 0.00 43.42 39.83 1vgh n LEU 17 CO 0.00 1.29 -0.31 -0.36 -1.33 0.00 0.00 177.39 176.68 1vgh s PHE 18 N -0.79 0.34 0.02 -1.77 0.40 -1.26 -1.45 117.98 113.47 1vgh s PHE 18 Ca 0.29 -0.74 0.07 0.00 -0.60 0.00 0.00 56.93 55.95 1vgh s PHE 18 Cb 0.19 -0.25 -0.03 0.00 0.51 0.00 0.00 43.02 43.44 1vgh s PHE 18 CO -0.03 -0.33 -0.18 0.14 0.70 0.00 0.00 175.22 175.52 1vgh s VAL 19 N -2.86 2.77 0.02 -0.44 -7.23 -0.16 -4.74 120.40 107.76 1vgh s VAL 19 Ca -0.03 -1.09 0.07 0.00 -1.81 0.00 0.00 61.98 59.11 1vgh s VAL 19 Cb 0.00 -2.13 -0.02 0.00 0.56 0.00 0.00 36.38 34.79 1vgh s VAL 19 CO -0.06 0.41 -0.19 -1.58 -0.31 0.00 0.00 175.10 173.36 1vgh s GLN 20 N -1.23 1.40 -0.35 4.82 0.74 -1.26 -1.83 119.66 121.95 1vgh s GLN 20 Ca 0.14 -0.83 -0.11 0.00 0.05 0.00 0.00 55.36 54.60 1vgh s GLN 20 Cb -0.10 -1.45 0.01 0.00 1.10 0.00 0.00 33.01 32.57 1vgh s GLN 20 CO 0.04 0.38 0.21 0.34 -0.55 0.00 0.00 175.29 175.70 1vgh s ASP 21 N -0.92 5.77 0.07 6.67 2.15 -0.44 -4.97 116.67 125.00 1vgh s ASP 21 Ca 0.07 -0.74 0.17 0.00 0.43 0.00 0.00 52.55 52.47 1vgh s ASP 21 Cb -0.08 -2.05 0.72 0.00 -0.30 0.00 0.00 42.92 41.20 1vgh s ASP 21 CO 0.01 -0.31 1.53 -0.81 -0.17 0.00 0.00 175.17 175.42 1vgh n PRO 22 N 5.03 0.05 0.05 4.34 -0.04 -1.26 -0.23 135.00 142.93 1vgh n PRO 22 Ca -0.12 0.29 0.12 0.00 -0.04 0.00 0.00 63.50 63.74 1vgh n PRO 22 Cb 0.48 -1.59 0.16 0.00 -0.04 0.00 0.00 33.50 32.51 1vgh n PRO 22 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1vgh n GLN 23 N -1.69 0.25 0.00 0.54 1.13 -1.26 -4.35 117.38 111.99 1vgh n GLN 23 Ca 0.03 0.06 0.00 0.00 -1.94 0.00 0.00 57.00 55.15 1vgh n GLN 23 Cb 0.19 -1.64 0.00 0.00 0.11 0.00 0.00 30.24 28.90 1vgh n GLN 23 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 1vgh n THR 24 N -1.99 0.00 -0.98 5.09 -2.24 -1.16 -2.01 114.28 110.99 1vgh n THR 24 Ca 0.03 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.81 1vgh n THR 24 Cb 0.42 0.05 0.00 0.00 -2.10 0.00 0.00 70.33 68.70 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 -0.45 3.74 0.20 0.00 1.02 -1.24 -4.65 119.74 118.36 1vgh s LYS 26 Ca 0.00 0.55 0.03 0.00 0.02 0.00 0.00 55.97 56.57 1vgh s LYS 26 Cb 0.00 -2.29 -0.05 0.00 -0.52 0.00 0.00 37.83 34.97 1vgh s LYS 26 CO 0.00 -0.19 -0.00 0.00 -0.92 0.00 0.00 175.35 174.24 1vgh s SER 28 N -3.24 0.33 0.32 0.00 0.15 -0.76 -5.02 113.70 105.47 1vgh s SER 28 Ca 0.26 -0.68 -0.27 0.00 0.70 0.00 0.00 55.95 55.96 1vgh s SER 28 Cb 0.06 0.14 -0.09 0.00 -1.71 0.00 0.00 66.02 64.42 1vgh s SER 28 CO 0.07 -0.42 1.07 0.00 1.20 0.00 0.00 173.24 175.16 1vgh h LYS 30 N 3.34 0.17 -6.58 0.00 3.11 -1.54 -3.40 116.57 111.67 1vgh h LYS 30 Ca -0.47 -0.04 -0.56 0.00 -2.81 0.00 0.00 60.65 56.77 1vgh h LYS 30 Cb 1.21 -0.02 -0.06 0.00 -1.00 0.00 0.00 32.23 32.36 1vgh h LYS 30 CO 0.65 0.31 1.00 1.21 -2.81 0.00 0.00 179.45 179.81 1vgh s ASN 31 N -5.54 6.51 0.26 4.20 2.47 -1.26 -5.02 114.94 116.56 1vgh s ASN 31 Ca -0.14 0.73 0.05 0.00 0.42 0.00 0.00 52.86 53.92 1vgh s ASN 31 Cb 0.06 -2.54 -0.03 0.00 -1.45 0.00 0.00 41.25 37.29 1vgh s ASN 31 CO 0.69 -1.31 0.38 0.42 -3.72 0.00 0.00 177.10 173.56 1vgh s THR 32 N 4.88 5.04 0.42 -5.21 -4.23 -1.26 -4.91 115.64 110.37 1vgh s THR 32 Ca 0.55 -0.98 0.23 0.00 -1.18 0.00 0.00 61.69 60.30 1vgh s THR 32 Cb -0.11 -3.78 0.25 0.00 1.34 0.00 0.00 72.50 70.20 1vgh s THR 32 CO 0.31 -0.30 2.03 -0.78 -0.54 0.00 0.00 174.62 175.34 1vgh h ASP 33 N 1.11 0.00 -0.28 3.99 3.58 -1.96 -2.50 116.42 120.35 1vgh h ASP 33 Ca -0.51 0.00 0.01 0.00 0.42 0.00 0.00 57.03 56.95 1vgh h ASP 33 Cb 1.23 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 42.27 1vgh h ASP 33 CO 0.59 0.15 0.16 -1.28 -2.88 0.00 0.00 179.24 175.99 1vgh h SER 34 N 0.00 0.26 -0.13 2.28 0.87 -1.96 0.59 113.55 115.46 1vgh h SER 34 Ca -0.00 0.00 0.01 0.00 -1.23 0.00 0.00 61.79 60.58 1vgh h SER 34 Cb 0.35 -0.05 -0.01 0.00 -0.44 0.00 0.00 62.40 62.25 1vgh h SER 34 CO 0.02 0.19 0.04 0.03 -0.53 0.00 0.00 176.83 176.58 1vgh h ARG 35 N 0.33 0.10 -0.44 2.24 3.08 -1.86 -1.03 114.38 116.80 1vgh h ARG 35 Ca 0.11 -0.01 0.05 0.00 0.07 0.00 0.00 59.98 60.21 1vgh h ARG 35 Cb 0.00 -0.02 -0.05 0.00 0.08 0.00 0.00 29.97 29.99 1vgh h ARG 35 CO -0.06 0.06 0.17 0.00 -1.07 0.00 0.00 179.97 179.08 1vgh h LYS 37 N 0.36 1.09 0.00 0.00 1.57 -0.64 0.22 116.57 119.16 1vgh h LYS 37 Ca 0.20 -0.13 -0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1vgh h LYS 37 Cb 0.18 -0.21 -0.00 0.00 0.08 0.00 0.00 32.23 32.28 1vgh h LYS 37 CO -0.19 0.81 -0.02 0.00 -0.57 0.00 0.00 179.45 179.48 1vgh h ALA 38 N 1.22 1.50 -0.52 3.86 0.00 -0.69 -0.91 119.26 123.72 1vgh h ALA 38 Ca 0.27 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1vgh h ALA 38 Cb 0.04 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1vgh h ALA 38 CO -0.04 0.02 0.00 0.54 0.00 0.00 0.00 179.25 179.77 1vgh n ARG 39 N -3.83 2.55 -3.38 0.00 1.74 -0.29 -4.97 116.66 108.49 1vgh n ARG 39 Ca -0.03 -2.37 -0.16 0.00 -0.77 0.00 0.00 57.85 54.51 1vgh n ARG 39 Cb 0.10 -1.53 0.09 0.00 -1.02 0.00 0.00 32.46 30.10 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 1.50 -6.39 -4.25 5.56 3.00 -0.33 -5.03 117.38 111.44 1vgh n GLN 40 Ca 0.21 0.82 -0.17 0.00 -0.01 0.00 0.00 57.00 57.85 1vgh n GLN 40 Cb 0.60 -5.73 -0.08 0.00 0.00 0.00 0.00 30.24 25.02 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 -6.20 1.56 0.13 1.08 1.43 0.60 -4.41 118.68 112.86 1vgh s LEU 41 Ca 0.01 -1.65 0.06 0.00 -1.03 0.00 0.00 54.13 51.52 1vgh s LEU 41 Cb -0.01 0.55 -0.04 0.00 0.03 0.00 0.00 46.19 46.73 1vgh s LEU 41 CO 0.70 -1.02 -0.14 -1.61 0.23 0.00 0.00 176.35 174.52 1vgh s GLU 42 N -3.62 1.04 0.13 1.70 0.41 -0.43 -2.74 118.70 115.20 1vgh s GLU 42 Ca 0.40 -1.26 -0.27 0.00 -0.41 0.00 0.00 54.97 53.43 1vgh s GLU 42 Cb 0.03 -0.91 -0.07 0.00 -1.78 0.00 0.00 34.13 31.40 1vgh s GLU 42 CO 0.23 0.17 0.83 -1.17 -0.49 0.00 0.00 175.26 174.84 1vgh s LEU 43 N -2.51 4.55 -0.42 1.80 2.96 -1.26 -0.59 118.68 123.20 1vgh s LEU 43 Ca 0.10 1.67 -0.22 0.00 -0.22 0.00 0.00 54.13 55.45 1vgh s LEU 43 Cb -0.05 -3.38 0.02 0.00 0.50 0.00 0.00 46.19 43.28 1vgh s LEU 43 CO 0.03 0.10 0.72 0.21 -1.32 0.00 0.00 176.35 176.09 1vgh s ASN 44 N -0.63 6.41 0.60 3.68 3.84 -0.32 -4.89 114.94 123.62 1vgh s ASN 44 Ca 0.39 -0.08 0.30 0.00 0.21 0.00 0.00 52.86 53.68 1vgh s ASN 44 Cb -0.23 -2.36 1.72 0.00 -0.55 0.00 0.00 41.25 39.83 1vgh s ASN 44 CO 0.27 -0.81 2.13 -0.33 -2.79 0.00 0.00 177.10 175.57 1vgh h GLU 45 N 8.81 0.00 0.04 0.43 5.08 -1.96 0.12 114.58 127.09 1vgh h GLU 45 Ca -0.25 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.11 1vgh h GLU 45 Cb 1.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.34 1vgh h GLU 45 CO 0.92 0.00 -0.02 0.00 -1.00 0.00 0.00 179.01 178.91 1vgh h ARG 46 N 0.00 -0.05 0.00 2.33 2.47 -1.96 -3.38 114.38 113.79 1vgh h ARG 46 Ca 0.07 0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 58.77 1vgh h ARG 46 Cb 0.40 0.01 -0.00 0.00 -1.65 0.00 0.00 29.97 28.72 1vgh h ARG 46 CO -0.00 0.16 -1.38 -2.37 0.56 0.00 0.00 179.97 176.95 1vgh n THR 47 N -4.78 0.46 -3.31 2.04 5.66 -1.21 -5.00 114.28 108.14 1vgh n THR 47 Ca -0.03 -0.55 -0.16 0.00 -3.05 0.00 0.00 64.05 60.27 1vgh n THR 47 Cb 0.11 -0.25 0.07 0.00 -1.55 0.00 0.00 70.33 68.71 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 -4.68 1.41 -0.27 0.00 1.81 -1.25 -4.69 118.95 111.29 1vgh s ARG 49 Ca 0.34 -1.39 -0.21 0.00 -1.72 0.00 0.00 55.73 52.74 1vgh s ARG 49 Cb -0.05 -1.83 -0.01 0.00 -0.45 0.00 0.00 34.95 32.61 1vgh s ARG 49 CO 0.74 0.42 0.67 0.00 -0.68 0.00 0.00 175.30 176.45 1vgh n ASP 51 N 5.83 2.48 -4.44 0.00 5.75 0.24 -4.91 116.55 121.50 1vgh n ASP 51 Ca 0.01 -2.53 -0.40 0.00 -0.01 0.00 0.00 54.79 51.86 1vgh n ASP 51 Cb 0.49 0.01 0.02 0.00 -1.03 0.00 0.00 41.12 40.61 1vgh n ASP 51 CO 0.00 0.00 0.00 2.29 -0.11 0.00 0.00 177.20 179.38 1vgh n LYS 52 N -1.44 0.51 -2.06 0.11 2.85 -1.26 -1.31 118.16 115.55 1vgh n LYS 52 Ca -0.04 0.19 -0.40 0.00 -1.05 0.00 0.00 58.31 57.02 1vgh n LYS 52 Cb 0.50 -1.56 -0.03 0.00 -0.65 0.00 0.00 35.03 33.29 1vgh n LYS 52 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 177.40 176.10 1vgh s PRO 53 N -1.76 2.86 0.00 -1.58 0.04 -1.26 -3.56 135.00 129.73 1vgh s PRO 53 Ca 0.65 0.81 0.00 0.00 0.04 0.00 0.00 61.00 62.50 1vgh s PRO 53 Cb -0.52 -4.32 0.00 0.00 0.04 0.00 0.00 34.50 29.70 1vgh s PRO 53 CO 0.57 -2.45 0.23 0.54 0.04 0.00 0.00 177.00 175.93 1vgh n ARG 54 N 8.94 0.00 0.00 4.56 1.74 -1.26 -4.93 116.66 125.71 1vgh n ARG 54 Ca 0.21 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.29 1vgh n ARG 54 Cb 0.51 -0.71 0.00 0.00 -1.02 0.00 0.00 32.46 31.24 1vgh n ARG 54 CO 0.00 0.00 0.00 2.89 -1.52 0.00 0.00 177.63 179.00