#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 -5.08 116.66 113.58 1vgh n ARG 2 Ca 0.00 0.00 -0.39 0.00 -1.93 0.00 0.00 57.85 55.53 1vgh n ARG 2 Cb 0.00 -0.14 0.02 0.00 -1.16 0.00 0.00 32.46 31.18 1vgh n ARG 2 CO 0.00 0.00 0.00 1.14 -1.93 0.00 0.00 177.63 176.84 1vgh s GLN 3 N -1.60 3.60 -0.53 5.56 -2.07 -1.26 -4.92 119.66 118.43 1vgh s GLN 3 Ca 0.00 2.29 -0.28 0.00 -1.82 0.00 0.00 55.36 55.55 1vgh s GLN 3 Cb 0.00 -2.55 0.00 0.00 -1.09 0.00 0.00 33.01 29.37 1vgh s GLN 3 CO 0.00 -0.84 1.56 -2.00 -1.32 0.00 0.00 175.29 172.69 1vgh s GLU 4 N -2.55 3.18 -0.42 9.60 2.12 -1.26 -4.95 118.70 124.42 1vgh s GLU 4 Ca 0.63 0.64 0.03 0.00 0.36 0.00 0.00 54.97 56.63 1vgh s GLU 4 Cb -0.41 -4.19 0.12 0.00 0.26 0.00 0.00 34.13 29.91 1vgh s GLU 4 CO 0.51 -2.08 0.16 -0.80 -0.54 0.00 0.00 175.26 172.52 1vgh s ASN 5 N 5.39 4.41 0.53 -1.70 0.01 -1.26 -4.99 114.94 117.33 1vgh s ASN 5 Ca 0.59 -2.53 0.26 0.00 -0.71 0.00 0.00 52.86 50.47 1vgh s ASN 5 Cb -0.13 -1.52 1.42 0.00 0.41 0.00 0.00 41.25 41.43 1vgh s ASN 5 CO 0.25 -0.31 1.77 -0.65 -1.51 0.00 0.00 177.10 176.66 1vgh h PRO 6 N 7.09 0.00 -6.52 -0.60 0.11 -1.92 -3.42 132.00 126.74 1vgh h PRO 6 Ca -0.06 0.00 -0.63 0.00 0.11 0.00 0.00 66.00 65.42 1vgh h PRO 6 Cb 0.96 0.00 -0.23 0.00 0.11 0.00 0.00 31.00 31.84 1vgh h PRO 6 CO 0.58 0.00 -0.85 0.00 -0.21 0.00 0.00 178.00 177.52 1vgh s GLY 8 N -1.83 1.59 0.27 0.00 0.00 -1.26 -5.03 107.32 101.05 1vgh s GLY 8 Ca 0.10 -0.56 -0.29 0.00 0.00 0.00 0.00 44.72 43.97 1vgh s GLY 8 CO 0.04 -0.30 1.05 -1.05 0.00 0.00 0.00 173.10 172.85 1vgh n PRO 9 N -2.57 1.33 0.00 2.90 -0.02 -1.26 -4.98 135.00 130.40 1vgh n PRO 9 Ca 0.04 0.47 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 1vgh n PRO 9 Cb 0.57 -1.87 0.00 0.00 -0.02 0.00 0.00 33.50 32.18 1vgh n PRO 9 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1vgh s SER 11 N -1.80 4.94 0.00 0.00 0.01 -1.26 -5.08 113.70 110.51 1vgh s SER 11 Ca 0.00 0.06 0.00 0.00 1.31 0.00 0.00 55.95 57.32 1vgh s SER 11 Cb 0.00 -0.78 0.00 0.00 0.21 0.00 0.00 66.02 65.45 1vgh s SER 11 CO 0.00 -1.43 0.43 -1.84 0.41 0.00 0.00 173.24 170.81 1vgh n GLU 12 N -2.62 0.00 0.00 12.44 -0.00 -1.26 -4.99 120.64 124.21 1vgh n GLU 12 Ca 0.09 0.22 0.00 0.00 -0.00 0.00 0.00 57.16 57.47 1vgh n GLU 12 Cb 0.60 -1.02 0.00 0.00 -0.00 0.00 0.00 31.44 31.02 1vgh n GLU 12 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.13 175.00 1vgh n ARG 13 N -1.16 0.00 0.18 3.44 0.63 -1.26 -4.94 116.66 113.55 1vgh n ARG 13 Ca 0.00 0.00 0.11 0.00 -0.92 0.00 0.00 57.85 57.04 1vgh n ARG 13 Cb 0.00 0.00 0.65 0.00 0.45 0.00 0.00 32.46 33.56 1vgh n ARG 13 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1vgh h ARG 14 N 0.00 0.00 -4.19 -0.14 3.08 -2.03 -3.11 114.38 108.00 1vgh h ARG 14 Ca 0.00 -0.00 -0.62 0.00 0.07 0.00 0.00 59.98 59.43 1vgh h ARG 14 Cb 0.00 -0.00 0.03 0.00 0.08 0.00 0.00 29.97 30.08 1vgh h ARG 14 CO 0.00 0.00 2.53 1.63 -1.07 0.00 0.00 179.97 183.06 1vgh n LYS 15 N -4.49 1.88 0.24 0.04 5.02 -1.26 -4.65 118.16 114.93 1vgh n LYS 15 Ca 0.01 -1.91 0.14 0.00 -2.02 0.00 0.00 58.31 54.52 1vgh n LYS 15 Cb 0.24 -2.90 0.34 0.00 -0.02 0.00 0.00 35.03 32.69 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 7.25 0.00 -0.25 2.13 3.86 -1.88 -3.37 115.15 122.89 1vgh h HIS 16 Ca 0.47 0.00 -0.22 0.00 -1.16 0.00 0.00 60.37 59.46 1vgh h HIS 16 Cb 0.57 0.00 -0.08 0.00 1.06 0.00 0.00 27.41 28.96 1vgh h HIS 16 CO 1.41 0.00 -0.09 1.28 0.86 0.00 0.00 177.93 181.40 1vgh n LEU 17 N -3.08 5.61 -4.02 2.43 4.77 -1.26 -4.78 117.00 116.67 1vgh n LEU 17 Ca 0.03 -3.20 -0.14 0.00 -0.03 0.00 0.00 56.01 52.68 1vgh n LEU 17 Cb 0.45 -1.29 -0.12 0.00 -2.33 0.00 0.00 43.42 40.13 1vgh n LEU 17 CO 0.32 1.52 -0.40 -0.36 -1.33 0.00 0.00 177.39 177.14 1vgh s PHE 18 N 0.02 0.56 0.13 -1.77 0.40 -1.26 -3.63 117.98 112.44 1vgh s PHE 18 Ca 0.48 -0.35 0.08 0.00 -0.60 0.00 0.00 56.93 56.53 1vgh s PHE 18 Cb 0.26 -0.35 -0.04 0.00 0.51 0.00 0.00 43.02 43.40 1vgh s PHE 18 CO -0.04 -0.06 -0.17 0.14 0.70 0.00 0.00 175.22 175.78 1vgh s VAL 19 N -0.94 1.62 -0.00 -0.44 -7.23 0.03 -4.90 120.40 108.54 1vgh s VAL 19 Ca -0.06 -1.75 -0.00 0.00 -1.81 0.00 0.00 61.98 58.36 1vgh s VAL 19 Cb -0.07 -1.65 0.00 0.00 0.56 0.00 0.00 36.38 35.21 1vgh s VAL 19 CO 0.00 -0.29 0.01 -1.58 -0.31 0.00 0.00 175.10 172.93 1vgh s GLN 20 N -2.52 0.02 -0.25 4.82 0.74 -1.26 -1.71 119.66 119.50 1vgh s GLN 20 Ca 0.11 -0.01 -0.27 0.00 0.05 0.00 0.00 55.36 55.23 1vgh s GLN 20 Cb -0.07 0.01 0.01 0.00 1.10 0.00 0.00 33.01 34.06 1vgh s GLN 20 CO 0.05 -0.00 0.97 0.34 -0.55 0.00 0.00 175.29 176.10 1vgh s ASP 21 N -0.05 6.98 0.54 6.67 -1.08 -0.59 -4.95 116.67 124.19 1vgh s ASP 21 Ca -0.01 1.21 0.32 0.00 -0.52 0.00 0.00 52.55 53.56 1vgh s ASP 21 Cb -0.00 -2.50 1.24 0.00 -1.46 0.00 0.00 42.92 40.19 1vgh s ASP 21 CO -0.00 -0.65 1.94 1.55 0.52 0.00 0.00 175.17 178.53 1vgh h PRO 22 N 7.63 0.00 0.00 4.34 0.13 -1.97 -0.74 132.00 141.39 1vgh h PRO 22 Ca -0.21 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.72 1vgh h PRO 22 Cb 1.07 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.17 1vgh h PRO 22 CO 0.95 0.00 -1.26 1.04 -0.23 0.00 0.00 178.00 178.51 1vgh n GLN 23 N -3.09 0.54 0.00 0.86 6.02 -1.26 -3.40 117.38 117.05 1vgh n GLN 23 Ca 0.01 0.52 0.11 0.00 -0.01 0.00 0.00 57.00 57.63 1vgh n GLN 23 Cb 0.33 -1.70 -0.03 0.00 1.02 0.00 0.00 30.24 29.86 1vgh n GLN 23 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1vgh n THR 24 N -4.45 0.00 -1.28 5.09 -2.24 -1.24 -4.78 114.28 105.38 1vgh n THR 24 Ca -0.29 -0.13 -0.10 0.00 -2.27 0.00 0.00 64.05 61.26 1vgh n THR 24 Cb 0.62 1.07 -0.04 0.00 -2.10 0.00 0.00 70.33 69.88 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 -2.68 4.23 -0.18 0.00 1.02 -1.25 -4.79 119.74 116.10 1vgh s LYS 26 Ca 0.00 1.92 -0.09 0.00 0.02 0.00 0.00 55.97 57.82 1vgh s LYS 26 Cb 0.00 -3.78 -0.05 0.00 -0.52 0.00 0.00 37.83 33.48 1vgh s LYS 26 CO 0.00 -0.71 0.14 0.00 -0.92 0.00 0.00 175.35 173.86 1vgh s SER 28 N -0.03 0.03 0.10 0.00 0.01 -0.69 -5.04 113.70 108.08 1vgh s SER 28 Ca 0.10 -0.09 -0.26 0.00 1.31 0.00 0.00 55.95 57.01 1vgh s SER 28 Cb -0.11 0.10 -0.07 0.00 0.21 0.00 0.00 66.02 66.15 1vgh s SER 28 CO -0.00 -0.12 0.80 0.00 0.41 0.00 0.00 173.24 174.33 1vgh h LYS 30 N 5.12 0.26 -6.41 0.00 3.64 -1.91 -3.38 116.57 113.88 1vgh h LYS 30 Ca -0.45 -0.05 -0.55 0.00 -1.27 0.00 0.00 60.65 58.32 1vgh h LYS 30 Cb 1.21 -0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 32.93 1vgh h LYS 30 CO 0.69 0.37 1.12 1.21 -2.27 0.00 0.00 179.45 180.57 1vgh s ASN 31 N -5.61 6.12 0.37 4.20 2.47 -1.26 -4.99 114.94 116.24 1vgh s ASN 31 Ca -0.14 0.58 0.07 0.00 0.42 0.00 0.00 52.86 53.80 1vgh s ASN 31 Cb 0.07 -2.54 -0.00 0.00 -1.45 0.00 0.00 41.25 37.33 1vgh s ASN 31 CO 0.71 -1.65 0.51 0.42 -3.72 0.00 0.00 177.10 173.36 1vgh s THR 32 N 6.12 3.64 0.34 -5.21 -4.23 -1.26 -4.91 115.64 110.13 1vgh s THR 32 Ca 0.59 -0.99 0.06 0.00 -1.18 0.00 0.00 61.69 60.17 1vgh s THR 32 Cb -0.13 -3.24 0.14 0.00 1.34 0.00 0.00 72.50 70.60 1vgh s THR 32 CO 0.28 -0.09 1.85 -0.78 -0.54 0.00 0.00 174.62 175.34 1vgh h ASP 33 N 0.78 0.39 -0.75 3.99 3.58 -1.95 -1.17 116.42 121.29 1vgh h ASP 33 Ca -0.43 -0.09 -0.02 0.00 0.42 0.00 0.00 57.03 56.91 1vgh h ASP 33 Cb 1.27 -0.10 -0.04 0.00 1.72 0.00 0.00 39.33 42.18 1vgh h ASP 33 CO 0.50 0.54 0.39 0.77 -2.88 0.00 0.00 179.24 178.56 1vgh h SER 34 N 0.39 0.96 0.18 2.28 4.64 -1.95 0.96 113.55 121.01 1vgh h SER 34 Ca 0.08 -0.11 0.01 0.00 -0.47 0.00 0.00 61.79 61.30 1vgh h SER 34 Cb 0.42 -0.24 -0.03 0.00 -0.31 0.00 0.00 62.40 62.24 1vgh h SER 34 CO 0.02 0.79 -0.28 -0.09 -0.87 0.00 0.00 176.83 176.41 1vgh h ARG 35 N 1.05 -0.52 -0.90 4.77 1.12 -1.72 -2.50 114.38 115.68 1vgh h ARG 35 Ca 0.26 0.04 0.01 0.00 -1.11 0.00 0.00 59.98 59.17 1vgh h ARG 35 Cb 0.07 0.12 -0.04 0.00 -0.01 0.00 0.00 29.97 30.10 1vgh h ARG 35 CO -0.04 -0.34 0.59 0.00 -3.11 0.00 0.00 179.97 177.06 1vgh h LYS 37 N 1.22 0.00 -0.09 0.00 3.64 -0.27 0.21 116.57 121.28 1vgh h LYS 37 Ca 0.33 0.00 0.03 0.00 -1.27 0.00 0.00 60.65 59.74 1vgh h LYS 37 Cb -0.13 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 31.69 1vgh h LYS 37 CO -0.07 0.07 0.07 0.00 -2.27 0.00 0.00 179.45 177.25 1vgh h ALA 38 N 1.93 2.04 -0.66 5.00 0.00 -0.98 -0.29 119.26 126.31 1vgh h ALA 38 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1vgh h ALA 38 Cb 0.21 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1vgh h ALA 38 CO 0.01 -0.12 0.00 0.54 0.00 0.00 0.00 179.25 179.68 1vgh n ARG 39 N -4.43 2.67 -3.70 0.00 3.00 -0.11 -4.96 116.66 109.13 1vgh n ARG 39 Ca -0.01 -2.58 -0.24 0.00 -0.01 0.00 0.00 57.85 55.02 1vgh n ARG 39 Cb 0.18 -1.56 0.05 0.00 0.00 0.00 0.00 32.46 31.13 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 1.63 -5.89 -4.60 5.56 1.13 -0.12 -5.03 117.38 110.06 1vgh n GLN 40 Ca 0.24 0.69 -0.27 0.00 -1.94 0.00 0.00 57.00 55.71 1vgh n GLN 40 Cb 0.62 -5.50 -0.10 0.00 0.11 0.00 0.00 30.24 25.36 1vgh n GLN 40 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1vgh s LEU 41 N -6.90 2.65 0.04 1.08 1.43 -0.23 -4.63 118.68 112.12 1vgh s LEU 41 Ca 0.29 -1.41 0.06 0.00 -1.03 0.00 0.00 54.13 52.03 1vgh s LEU 41 Cb -0.14 -0.75 -0.02 0.00 0.03 0.00 0.00 46.19 45.31 1vgh s LEU 41 CO 0.79 -0.54 -0.16 -1.61 0.23 0.00 0.00 176.35 175.06 1vgh s GLU 42 N -3.77 1.07 0.16 1.70 0.41 -0.31 -2.13 118.70 115.83 1vgh s GLU 42 Ca 0.32 -0.83 -0.30 0.00 -0.41 0.00 0.00 54.97 53.75 1vgh s GLU 42 Cb 0.09 -1.12 -0.07 0.00 -1.78 0.00 0.00 34.13 31.25 1vgh s GLU 42 CO 0.16 0.28 0.96 -1.17 -0.49 0.00 0.00 175.26 175.00 1vgh s LEU 43 N -1.18 4.55 -0.45 1.80 2.96 -1.26 -0.88 118.68 124.21 1vgh s LEU 43 Ca 0.03 1.86 -0.22 0.00 -0.22 0.00 0.00 54.13 55.58 1vgh s LEU 43 Cb -0.08 -3.60 0.03 0.00 0.50 0.00 0.00 46.19 43.04 1vgh s LEU 43 CO 0.02 -0.00 0.74 0.21 -1.32 0.00 0.00 176.35 175.99 1vgh s ASN 44 N -0.38 6.38 0.43 3.68 2.47 -0.32 -4.94 114.94 122.26 1vgh s ASN 44 Ca 0.45 -0.19 0.21 0.00 0.42 0.00 0.00 52.86 53.75 1vgh s ASN 44 Cb -0.25 -2.37 1.17 0.00 -1.45 0.00 0.00 41.25 38.36 1vgh s ASN 44 CO 0.31 -0.88 1.81 -0.08 -3.72 0.00 0.00 177.10 174.54 1vgh h GLU 45 N 8.95 0.32 0.01 0.43 4.81 -1.96 0.20 114.58 127.35 1vgh h GLU 45 Ca -0.25 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 58.96 1vgh h GLU 45 Cb 1.09 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.40 1vgh h GLU 45 CO 0.94 0.21 -0.00 0.00 -0.73 0.00 0.00 179.01 179.43 1vgh h ARG 46 N 0.33 -0.01 0.00 1.92 2.47 -1.97 -3.35 114.38 113.77 1vgh h ARG 46 Ca 0.53 0.00 -0.09 0.00 -1.26 0.00 0.00 59.98 59.17 1vgh h ARG 46 Cb 1.47 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.78 1vgh h ARG 46 CO -0.20 0.80 -1.13 1.79 0.56 0.00 0.00 179.97 181.79 1vgh h THR 47 N -0.95 0.29 -5.90 2.04 1.35 -1.98 -3.48 112.91 104.28 1vgh h THR 47 Ca -0.00 -1.55 -0.37 0.00 -0.55 0.00 0.00 66.41 63.95 1vgh h THR 47 Cb 0.82 1.83 0.11 0.00 -1.73 0.00 0.00 68.15 69.18 1vgh h THR 47 CO 0.00 0.16 -0.86 0.00 -0.25 0.00 0.00 175.52 174.58 1vgh s ARG 49 N -5.48 1.89 -0.01 0.00 1.81 -1.25 -4.79 118.95 111.12 1vgh s ARG 49 Ca 0.24 -1.31 -0.20 0.00 -1.72 0.00 0.00 55.73 52.74 1vgh s ARG 49 Cb -0.06 -2.08 -0.05 0.00 -0.45 0.00 0.00 34.95 32.31 1vgh s ARG 49 CO 0.80 0.43 0.57 0.00 -0.68 0.00 0.00 175.30 176.42 1vgh s ASP 51 N -0.19 0.17 0.20 0.00 1.01 -0.06 -4.93 116.67 112.87 1vgh s ASP 51 Ca 0.30 -1.36 -0.33 0.00 0.71 0.00 0.00 52.55 51.87 1vgh s ASP 51 Cb -0.18 0.37 -0.14 0.00 1.01 0.00 0.00 42.92 43.99 1vgh s ASP 51 CO 0.16 -0.83 1.48 2.29 0.21 0.00 0.00 175.17 178.48 1vgh n LYS 52 N -0.25 2.06 -0.15 8.23 2.85 -1.26 -1.16 118.16 128.47 1vgh n LYS 52 Ca 0.01 0.74 -0.03 0.00 -1.05 0.00 0.00 58.31 57.97 1vgh n LYS 52 Cb 0.66 -2.44 0.04 0.00 -0.65 0.00 0.00 35.03 32.63 1vgh n LYS 52 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 177.40 176.00 1vgh h PRO 53 N 4.96 0.03 0.00 -1.58 0.11 -1.90 -3.44 132.00 130.19 1vgh h PRO 53 Ca -0.45 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1vgh h PRO 53 Cb 1.27 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1vgh h PRO 53 CO 0.81 0.02 0.00 2.89 -0.21 0.00 0.00 178.00 181.51 1vgh n ARG 54 N -5.31 0.00 0.00 1.05 -4.01 -1.26 -4.99 116.66 102.13 1vgh n ARG 54 Ca 0.04 0.00 0.00 0.00 -1.04 0.00 0.00 57.85 56.85 1vgh n ARG 54 Cb 0.26 0.00 0.00 0.00 -3.04 0.00 0.00 32.46 29.68 1vgh n ARG 54 CO 0.00 0.00 0.00 0.54 -3.04 0.00 0.00 177.63 175.13