#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bhi n SER 2 N 0.00 0.00 -4.64 7.83 3.41 -1.26 -5.15 113.62 113.80 1bhi n SER 2 Ca 0.00 0.00 -0.37 0.00 -0.26 0.00 0.00 58.87 58.24 1bhi n SER 2 Cb 0.00 0.00 0.07 0.00 -0.26 0.00 0.00 64.21 64.02 1bhi n SER 2 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1bhi n ASP 3 N 0.00 0.99 -0.17 4.04 9.92 -1.26 -4.91 116.55 125.16 1bhi n ASP 3 Ca 0.00 0.76 -0.06 0.00 -0.53 0.00 0.00 54.79 54.96 1bhi n ASP 3 Cb 0.00 -1.44 0.11 0.00 -0.64 0.00 0.00 41.12 39.15 1bhi n ASP 3 CO 0.00 0.00 0.00 -0.78 0.13 0.00 0.00 177.20 176.55 1bhi h ASP 4 N 0.21 0.90 -2.96 -2.24 3.58 -2.05 -3.34 116.42 110.53 1bhi h ASP 4 Ca -0.49 -0.22 -0.61 0.00 0.42 0.00 0.00 57.03 56.14 1bhi h ASP 4 Cb 1.35 -0.24 -0.40 0.00 1.72 0.00 0.00 39.33 41.76 1bhi h ASP 4 CO 0.50 0.93 -0.74 -0.54 -2.88 0.00 0.00 179.24 176.51 1bhi s LYS 5 N -5.09 1.70 1.23 0.28 1.02 -1.26 -5.12 119.74 112.49 1bhi s LYS 5 Ca -0.11 -2.65 -0.18 0.00 0.02 0.00 0.00 55.97 53.05 1bhi s LYS 5 Cb 0.15 -2.53 0.29 0.00 -0.52 0.00 0.00 37.83 35.22 1bhi s LYS 5 CO 0.83 -1.29 1.05 -1.25 -0.92 0.00 0.00 175.35 173.77 1bhi s PRO 6 N -0.57 -1.42 -0.91 -1.68 0.05 -1.26 -4.93 135.00 124.28 1bhi s PRO 6 Ca 0.26 0.16 -0.19 0.00 0.05 0.00 0.00 61.00 61.28 1bhi s PRO 6 Cb -0.06 -1.55 0.12 0.00 0.05 0.00 0.00 34.50 33.06 1bhi s PRO 6 CO -0.14 -3.89 1.13 -0.06 0.05 0.00 0.00 177.00 174.09 1bhi s PHE 7 N -2.75 3.05 -0.31 0.56 0.40 -0.88 -4.97 117.98 113.08 1bhi s PHE 7 Ca 0.69 -1.29 -0.12 0.00 -0.60 0.00 0.00 56.93 55.61 1bhi s PHE 7 Cb -0.14 -4.30 -0.03 0.00 0.51 0.00 0.00 43.02 39.06 1bhi s PHE 7 CO 0.58 -1.52 0.23 -1.17 0.70 0.00 0.00 175.22 174.03 1bhi s LEU 8 N 2.92 4.24 -0.99 -0.37 0.20 -1.26 -1.10 118.68 122.31 1bhi s LEU 8 Ca 0.32 -0.17 -0.23 0.00 0.69 0.00 0.00 54.13 54.74 1bhi s LEU 8 Cb -0.06 -2.15 -0.01 0.00 -0.43 0.00 0.00 46.19 43.54 1bhi s LEU 8 CO -0.08 -0.14 1.75 0.00 -0.29 0.00 0.00 176.35 177.58 1bhi s THR 10 N 7.92 2.19 0.10 0.00 -1.32 -1.26 -4.01 115.64 119.26 1bhi s THR 10 Ca 0.60 0.14 -0.26 0.00 -1.21 0.00 0.00 61.69 60.96 1bhi s THR 10 Cb -0.03 -3.09 0.08 0.00 -1.51 0.00 0.00 72.50 67.95 1bhi s THR 10 CO -0.03 0.01 0.86 0.00 -2.21 0.00 0.00 174.62 173.25 1bhi s ALA 11 N 1.14 -1.68 0.00 11.08 0.00 -0.92 -4.99 121.76 126.39 1bhi s ALA 11 Ca 0.73 0.52 -0.05 0.00 0.00 0.00 0.00 51.96 53.16 1bhi s ALA 11 Cb -0.48 0.60 -0.03 0.00 0.00 0.00 0.00 23.12 23.21 1bhi s ALA 11 CO 0.32 -0.85 0.74 -1.00 0.00 0.00 0.00 175.76 174.97 1bhi h PRO 12 N 2.00 -0.18 -0.93 0.00 0.13 -2.05 -3.32 132.00 127.65 1bhi h PRO 12 Ca -0.24 0.01 -0.32 0.00 -0.87 0.00 0.00 66.00 64.58 1bhi h PRO 12 Cb 1.25 0.04 -0.19 0.00 0.13 0.00 0.00 31.00 32.23 1bhi h PRO 12 CO 0.29 -0.12 0.40 0.41 -0.23 0.00 0.00 178.00 178.76 1bhi n GLY 13 N -0.09 3.67 3.60 1.56 0.00 -1.26 -4.88 105.19 107.79 1bhi n GLY 13 Ca -0.02 -0.82 -0.14 0.00 0.00 0.00 0.00 46.02 45.03 1bhi n GLY 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bhi n GLY 15 N 2.20 1.38 3.78 0.00 0.00 -1.26 -2.16 105.19 109.14 1bhi n GLY 15 Ca -0.15 -0.43 -0.37 0.00 0.00 0.00 0.00 46.02 45.08 1bhi n GLY 15 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1bhi s GLN 16 N -0.65 4.44 0.09 1.61 0.74 -1.26 -4.76 119.66 119.87 1bhi s GLN 16 Ca 0.24 1.40 0.09 0.00 0.05 0.00 0.00 55.36 57.14 1bhi s GLN 16 Cb 0.41 -2.71 -0.03 0.00 1.10 0.00 0.00 33.01 31.78 1bhi s GLN 16 CO -0.06 0.13 -0.24 0.50 -0.55 0.00 0.00 175.29 175.08 1bhi s ARG 17 N -2.22 1.40 0.10 1.67 3.00 -1.26 -0.64 118.95 121.00 1bhi s ARG 17 Ca 0.53 -1.17 -0.00 0.00 -1.00 0.00 0.00 55.73 54.08 1bhi s ARG 17 Cb -0.20 -1.70 -0.04 0.00 0.00 0.00 0.00 34.95 33.01 1bhi s ARG 17 CO 0.25 0.41 -0.01 -0.06 0.00 0.00 0.00 175.30 175.90 1bhi s PHE 18 N -0.99 0.77 -2.38 5.12 0.40 -0.26 -4.99 117.98 115.65 1bhi s PHE 18 Ca 0.10 -1.09 0.23 0.00 -0.60 0.00 0.00 56.93 55.57 1bhi s PHE 18 Cb -0.10 -0.48 0.77 0.00 0.51 0.00 0.00 43.02 43.72 1bhi s PHE 18 CO 0.04 -0.36 1.57 2.41 0.70 0.00 0.00 175.22 179.58 1bhi n THR 19 N -0.02 0.18 -3.89 0.64 -1.04 -1.26 -2.08 114.28 106.81 1bhi n THR 19 Ca -0.10 -0.37 -0.10 0.00 -2.04 0.00 0.00 64.05 61.44 1bhi n THR 19 Cb 0.62 0.50 -0.10 0.00 -1.82 0.00 0.00 70.33 69.54 1bhi n THR 19 CO 0.00 0.00 0.00 0.20 -0.64 0.00 0.00 175.07 174.63 1bhi s ASN 20 N -1.68 0.09 0.32 8.00 -0.87 -1.26 -4.91 114.94 114.63 1bhi s ASN 20 Ca 0.34 -0.35 0.16 0.00 -1.57 0.00 0.00 52.86 51.44 1bhi s ASN 20 Cb 0.19 0.21 0.43 0.00 -0.02 0.00 0.00 41.25 42.06 1bhi s ASN 20 CO 0.29 -0.43 1.62 1.05 -2.57 0.00 0.00 177.10 177.05 1bhi h GLU 21 N 4.00 0.00 -0.28 -0.60 -0.00 -1.96 -3.09 114.58 112.66 1bhi h GLU 21 Ca -0.32 0.00 0.02 0.00 -0.00 0.00 0.00 59.36 59.07 1bhi h GLU 21 Cb 1.19 0.00 -0.02 0.00 -0.00 0.00 0.00 28.75 29.92 1bhi h GLU 21 CO 0.45 0.49 0.13 0.22 -0.00 0.00 0.00 179.01 180.29 1bhi h ASP 22 N 0.00 0.18 0.05 3.06 3.58 -1.99 0.23 116.42 121.52 1bhi h ASP 22 Ca -0.00 0.02 -0.08 0.00 0.42 0.00 0.00 57.03 57.39 1bhi h ASP 22 Cb 1.10 -0.01 -0.01 0.00 1.72 0.00 0.00 39.33 42.13 1bhi h ASP 22 CO 0.06 0.14 -0.22 0.45 -2.88 0.00 0.00 179.24 176.79 1bhi h HIS 23 N 0.27 0.34 -0.20 0.28 3.86 -1.98 -2.00 115.15 115.72 1bhi h HIS 23 Ca 0.12 -0.06 -0.12 0.00 -1.16 0.00 0.00 60.37 59.15 1bhi h HIS 23 Cb 0.05 -0.09 -0.01 0.00 1.06 0.00 0.00 27.41 28.42 1bhi h HIS 23 CO -0.11 0.52 -0.39 1.25 0.86 0.00 0.00 177.93 180.07 1bhi h LEU 24 N 0.29 0.46 0.68 2.43 5.85 -1.26 -2.20 115.31 121.57 1bhi h LEU 24 Ca 0.05 -0.20 -0.03 0.00 0.84 0.00 0.00 57.88 58.54 1bhi h LEU 24 Cb 0.56 -0.13 0.01 0.00 0.37 0.00 0.00 40.66 41.47 1bhi h LEU 24 CO 0.04 0.81 -0.33 0.00 -0.34 0.00 0.00 178.44 178.62 1bhi h ALA 25 N 1.21 -0.92 -0.87 1.25 0.00 0.16 0.19 119.26 120.29 1bhi h ALA 25 Ca 0.04 -0.22 0.01 0.00 0.00 0.00 0.00 54.91 54.73 1bhi h ALA 25 Cb 0.85 0.35 -0.04 0.00 0.00 0.00 0.00 17.79 18.95 1bhi h ALA 25 CO 0.07 -0.94 0.57 -0.39 0.00 0.00 0.00 179.25 178.56 1bhi h VAL 26 N -1.06 1.23 -0.46 0.00 -1.51 -1.52 0.18 116.25 113.11 1bhi h VAL 26 Ca -0.09 -0.44 -0.03 0.00 -1.23 0.00 0.00 66.70 64.91 1bhi h VAL 26 Cb 0.73 -0.05 -0.02 0.00 -2.13 0.00 0.00 31.29 29.82 1bhi h VAL 26 CO 0.15 0.23 0.18 -0.74 -1.23 0.00 0.00 177.57 176.16 1bhi h HIS 27 N 1.19 0.71 -0.56 5.19 6.17 -1.30 -0.94 115.15 125.60 1bhi h HIS 27 Ca 0.32 -0.06 -0.09 0.00 0.71 0.00 0.00 60.37 61.25 1bhi h HIS 27 Cb -0.12 -0.21 -0.02 0.00 2.52 0.00 0.00 27.41 29.58 1bhi h HIS 27 CO 0.00 0.61 -0.01 -0.22 0.71 0.00 0.00 177.93 179.02 1bhi h LYS 28 N 0.60 0.98 -0.74 5.26 1.63 0.10 -2.49 116.57 121.91 1bhi h LYS 28 Ca 0.15 -0.30 -0.01 0.00 -0.85 0.00 0.00 60.65 59.64 1bhi h LYS 28 Cb 0.21 -0.09 -0.04 0.00 -0.60 0.00 0.00 32.23 31.71 1bhi h LYS 28 CO -0.01 0.97 0.43 1.25 -3.45 0.00 0.00 179.45 178.64 1bhi h HIS 29 N 0.90 0.99 -0.41 1.91 2.76 -0.30 -0.49 115.15 120.50 1bhi h HIS 29 Ca 0.16 -0.01 -0.03 0.00 -2.20 0.00 0.00 60.37 58.29 1bhi h HIS 29 Cb 0.54 -0.32 -0.02 0.00 1.55 0.00 0.00 27.41 29.16 1bhi h HIS 29 CO 0.03 0.67 0.12 -0.22 -1.30 0.00 0.00 177.93 177.23 1bhi h LYS 30 N 1.03 0.60 0.53 5.26 1.63 -0.74 -0.92 116.57 123.96 1bhi h LYS 30 Ca 0.27 -0.09 -0.03 0.00 -0.85 0.00 0.00 60.65 59.95 1bhi h LYS 30 Cb -0.01 -0.10 0.01 0.00 -0.60 0.00 0.00 32.23 31.52 1bhi h LYS 30 CO -0.05 0.53 -0.25 0.45 -3.45 0.00 0.00 179.45 176.68 1bhi h HIS 31 N 0.59 -0.66 -0.43 1.91 3.86 -0.95 -3.21 115.15 116.27 1bhi h HIS 31 Ca 0.14 -0.02 -0.34 0.00 -1.16 0.00 0.00 60.37 59.00 1bhi h HIS 31 Cb 0.19 0.22 -0.11 0.00 1.06 0.00 0.00 27.41 28.77 1bhi h HIS 31 CO 0.01 -0.39 0.12 0.39 0.86 0.00 0.00 177.93 178.92 1bhi n GLU 32 N -5.25 2.27 0.07 2.45 4.71 -0.31 -4.44 120.64 120.15 1bhi n GLU 32 Ca -0.09 -1.61 -0.07 0.00 -0.01 0.00 0.00 57.16 55.38 1bhi n GLU 32 Cb 0.29 -2.10 0.08 0.00 -1.01 0.00 0.00 31.44 28.70 1bhi n GLU 32 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1bhi h MET 33 N 3.11 0.28 0.00 3.49 -0.00 -1.17 -3.46 114.93 117.18 1bhi h MET 33 Ca 0.30 -0.21 0.00 0.00 -0.00 0.00 0.00 59.70 59.79 1bhi h MET 33 Cb 1.15 0.04 0.00 0.00 -0.00 0.00 0.00 31.60 32.79 1bhi h MET 33 CO 0.56 0.84 0.00 2.41 -0.00 0.00 0.00 176.91 180.72 1bhi n THR 34 N -3.84 0.00 -0.19 -0.10 -1.04 -1.26 -2.85 114.28 105.00 1bhi n THR 34 Ca -0.03 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.98 1bhi n THR 34 Cb 0.66 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.17 1bhi n THR 34 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 1bhi n LEU 35 N 0.00 0.00 -4.13 -4.42 0.00 -1.26 -5.01 117.00 102.18 1bhi n LEU 35 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 56.01 55.63 1bhi n LEU 35 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 43.42 43.38 1bhi n LEU 35 CO 0.00 0.00 1.99 1.17 0.00 0.00 0.00 177.39 180.55 1bhi n LYS 36 N 0.00 2.09 0.04 1.96 3.00 -1.13 -4.72 118.16 119.40 1bhi n LYS 36 Ca 0.00 -2.45 -0.12 0.00 -0.00 0.00 0.00 58.31 55.74 1bhi n LYS 36 Cb 0.00 -3.35 -0.07 0.00 0.00 0.00 0.00 35.03 31.61 1bhi n LYS 36 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.40 177.75 1bhi h PHE 37 N 8.09 0.01 -0.00 5.64 3.57 -1.95 -3.46 116.94 128.84 1bhi h PHE 37 Ca 0.39 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.89 1bhi h PHE 37 Cb 0.79 -0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.53 1bhi h PHE 37 CO 1.30 0.01 0.00 0.41 -2.23 0.00 0.00 178.31 177.81