#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bhi s SER 2 N 0.00 6.42 0.39 6.12 0.15 -1.26 -4.77 113.70 120.76 1bhi s SER 2 Ca 0.00 2.72 0.00 0.00 0.70 0.00 0.00 55.95 59.37 1bhi s SER 2 Cb 0.00 -2.65 0.00 0.00 -1.71 0.00 0.00 66.02 61.66 1bhi s SER 2 CO 0.00 -0.78 0.00 -0.67 1.20 0.00 0.00 173.24 172.99 1bhi n ASP 3 N 0.33 -6.25 -3.35 5.45 2.03 -1.26 -4.25 116.55 109.25 1bhi n ASP 3 Ca 0.02 0.87 -0.39 0.00 0.52 0.00 0.00 54.79 55.81 1bhi n ASP 3 Cb 0.42 -3.54 -0.03 0.00 -0.72 0.00 0.00 41.12 37.26 1bhi n ASP 3 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 1bhi n ASP 4 N -3.82 8.52 -4.63 1.67 2.03 -1.26 -4.93 116.55 114.14 1bhi n ASP 4 Ca -0.04 -2.66 -0.43 0.00 0.52 0.00 0.00 54.79 52.18 1bhi n ASP 4 Cb 0.50 -1.53 -0.03 0.00 -0.72 0.00 0.00 41.12 39.34 1bhi n ASP 4 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 1bhi s LYS 5 N 1.71 3.67 0.13 -0.67 2.36 -1.26 -4.93 119.74 120.75 1bhi s LYS 5 Ca 0.67 1.99 -0.31 0.00 -2.55 0.00 0.00 55.97 55.77 1bhi s LYS 5 Cb 0.18 -4.17 -0.09 0.00 -1.05 0.00 0.00 37.83 32.70 1bhi s LYS 5 CO -0.07 -1.47 1.48 -1.25 1.55 0.00 0.00 175.35 175.60 1bhi s PRO 6 N 5.14 4.27 -0.78 4.03 0.04 -1.26 -4.74 135.00 141.70 1bhi s PRO 6 Ca 0.84 2.20 -0.04 0.00 0.04 0.00 0.00 61.00 64.04 1bhi s PRO 6 Cb -0.32 -3.25 0.20 0.00 0.04 0.00 0.00 34.50 31.17 1bhi s PRO 6 CO 0.34 -0.53 0.65 -0.06 0.04 0.00 0.00 177.00 177.44 1bhi s PHE 7 N 1.29 3.69 -0.41 0.56 0.08 -0.96 -4.98 117.98 117.25 1bhi s PHE 7 Ca 0.67 -2.76 -0.26 0.00 0.12 0.00 0.00 56.93 54.71 1bhi s PHE 7 Cb -0.39 -3.32 0.02 0.00 -0.57 0.00 0.00 43.02 38.75 1bhi s PHE 7 CO 0.31 -0.82 0.92 -1.17 -0.10 0.00 0.00 175.22 174.36 1bhi s LEU 8 N -0.63 3.99 -1.03 -0.37 2.96 -1.26 -2.58 118.68 119.77 1bhi s LEU 8 Ca 0.22 0.38 -0.23 0.00 -0.22 0.00 0.00 54.13 54.28 1bhi s LEU 8 Cb -0.13 -3.23 0.01 0.00 0.50 0.00 0.00 46.19 43.34 1bhi s LEU 8 CO -0.08 -0.94 1.69 0.00 -1.32 0.00 0.00 176.35 175.69 1bhi n THR 10 N 7.24 0.63 -3.54 0.00 5.66 -1.26 -4.03 114.28 118.97 1bhi n THR 10 Ca 0.38 -0.16 -0.07 0.00 -3.05 0.00 0.00 64.05 61.16 1bhi n THR 10 Cb 0.49 -1.97 -0.02 0.00 -1.55 0.00 0.00 70.33 67.28 1bhi n THR 10 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1bhi s ALA 11 N 0.44 -1.92 -0.30 1.79 0.00 -0.98 -4.99 121.76 115.81 1bhi s ALA 11 Ca 0.68 1.23 -0.28 0.00 0.00 0.00 0.00 51.96 53.59 1bhi s ALA 11 Cb -0.50 0.21 -0.04 0.00 0.00 0.00 0.00 23.12 22.79 1bhi s ALA 11 CO 0.42 -0.66 2.10 -1.25 0.00 0.00 0.00 175.76 176.37 1bhi s PRO 12 N -2.84 3.06 0.00 0.00 0.04 -1.26 -3.29 135.00 130.70 1bhi s PRO 12 Ca 0.07 1.72 0.00 0.00 0.04 0.00 0.00 61.00 62.83 1bhi s PRO 12 Cb -0.01 -4.34 0.00 0.00 0.04 0.00 0.00 34.50 30.19 1bhi s PRO 12 CO -0.07 -2.19 0.00 0.41 0.04 0.00 0.00 177.00 175.19 1bhi n GLY 13 N 5.69 1.49 3.73 0.56 0.00 -1.26 -4.93 105.19 110.47 1bhi n GLY 13 Ca 0.28 -0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.89 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 2.32 1.02 3.81 0.00 0.00 -1.26 -2.31 105.19 108.78 1bhi n GLY 15 Ca 0.05 -0.16 -0.34 0.00 0.00 0.00 0.00 46.02 45.57 1bhi n GLY 15 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1bhi s GLN 16 N -0.02 4.31 0.08 1.61 1.11 -1.26 -4.76 119.66 120.73 1bhi s GLN 16 Ca 0.23 1.14 0.09 0.00 0.01 0.00 0.00 55.36 56.84 1bhi s GLN 16 Cb 0.33 -2.36 -0.03 0.00 -1.01 0.00 0.00 33.01 29.93 1bhi s GLN 16 CO -0.06 0.07 -0.25 0.50 0.01 0.00 0.00 175.29 175.56 1bhi s ARG 17 N -2.86 1.51 0.10 2.91 3.00 -1.26 -0.92 118.95 121.42 1bhi s ARG 17 Ca 0.58 -1.16 -0.00 0.00 -1.00 0.00 0.00 55.73 54.15 1bhi s ARG 17 Cb -0.12 -1.79 -0.04 0.00 0.00 0.00 0.00 34.95 33.01 1bhi s ARG 17 CO 0.16 0.44 -0.00 -0.06 0.00 0.00 0.00 175.30 175.84 1bhi s PHE 18 N -0.93 0.76 -0.19 5.12 0.40 -1.06 -4.96 117.98 117.13 1bhi s PHE 18 Ca 0.11 -1.10 0.16 0.00 -0.60 0.00 0.00 56.93 55.50 1bhi s PHE 18 Cb -0.10 -0.47 0.10 0.00 0.51 0.00 0.00 43.02 43.06 1bhi s PHE 18 CO 0.03 -0.38 1.47 1.79 0.70 0.00 0.00 175.22 178.83 1bhi h THR 19 N 2.98 0.77 -3.92 0.64 1.35 -1.91 -2.55 112.91 110.26 1bhi h THR 19 Ca -0.35 -2.08 -0.44 0.00 -0.55 0.00 0.00 66.41 63.00 1bhi h THR 19 Cb 1.17 2.37 -0.21 0.00 -1.73 0.00 0.00 68.15 69.75 1bhi h THR 19 CO 0.63 0.44 -0.79 0.20 -0.25 0.00 0.00 175.52 175.75 1bhi s ASN 20 N -6.43 1.83 0.42 5.36 -0.87 -1.26 -4.62 114.94 109.37 1bhi s ASN 20 Ca 0.04 -0.64 0.21 0.00 -1.57 0.00 0.00 52.86 50.90 1bhi s ASN 20 Cb 0.07 -0.06 0.93 0.00 -0.02 0.00 0.00 41.25 42.17 1bhi s ASN 20 CO 0.74 -0.06 1.86 -0.08 -2.57 0.00 0.00 177.10 176.98 1bhi h GLU 21 N 4.20 0.00 -0.74 -0.60 4.81 -1.93 -2.75 114.58 117.57 1bhi h GLU 21 Ca -0.42 0.00 0.08 0.00 -0.13 0.00 0.00 59.36 58.90 1bhi h GLU 21 Cb 1.19 0.00 -0.07 0.00 0.63 0.00 0.00 28.75 30.50 1bhi h GLU 21 CO 0.41 0.28 0.40 -0.44 -0.73 0.00 0.00 179.01 178.93 1bhi h ASP 22 N 0.00 0.56 0.16 1.04 5.19 -1.99 0.32 116.42 121.70 1bhi h ASP 22 Ca -0.00 0.05 -0.11 0.00 -0.62 0.00 0.00 57.03 56.35 1bhi h ASP 22 Cb 0.68 -0.06 -0.01 0.00 0.18 0.00 0.00 39.33 40.12 1bhi h ASP 22 CO 0.04 0.33 -0.39 0.45 -3.12 0.00 0.00 179.24 176.55 1bhi h HIS 23 N 0.69 0.36 -0.05 4.55 3.86 -1.92 -2.34 115.15 120.31 1bhi h HIS 23 Ca 0.35 -0.09 -0.10 0.00 -1.16 0.00 0.00 60.37 59.37 1bhi h HIS 23 Cb 0.32 -0.08 -0.01 0.00 1.06 0.00 0.00 27.41 28.69 1bhi h HIS 23 CO -0.08 0.66 -0.44 1.25 0.86 0.00 0.00 177.93 180.17 1bhi h LEU 24 N 0.26 0.13 0.43 2.43 5.85 -0.91 -2.13 115.31 121.36 1bhi h LEU 24 Ca 0.03 -0.06 -0.02 0.00 0.84 0.00 0.00 57.88 58.67 1bhi h LEU 24 Cb 0.80 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.80 1bhi h LEU 24 CO 0.06 0.56 -0.20 0.00 -0.34 0.00 0.00 178.44 178.52 1bhi h ALA 25 N 1.45 -0.57 -0.76 1.25 0.00 0.08 0.23 119.26 120.94 1bhi h ALA 25 Ca 0.01 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.70 1bhi h ALA 25 Cb 0.83 0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 1bhi h ALA 25 CO 0.06 -0.71 0.34 -0.39 0.00 0.00 0.00 179.25 178.55 1bhi h VAL 26 N -0.80 1.25 -0.48 0.00 -1.51 -1.53 0.72 116.25 113.89 1bhi h VAL 26 Ca -0.06 -0.73 -0.03 0.00 -1.23 0.00 0.00 66.70 64.65 1bhi h VAL 26 Cb 0.54 0.30 -0.02 0.00 -2.13 0.00 0.00 31.29 29.98 1bhi h VAL 26 CO 0.10 0.30 0.18 -0.74 -1.23 0.00 0.00 177.57 176.18 1bhi h HIS 27 N 1.09 0.75 0.22 5.19 6.17 -1.31 -2.89 115.15 124.37 1bhi h HIS 27 Ca 0.26 -0.06 -0.01 0.00 0.71 0.00 0.00 60.37 61.27 1bhi h HIS 27 Cb 0.16 -0.22 0.00 0.00 2.52 0.00 0.00 27.41 29.87 1bhi h HIS 27 CO 0.02 0.64 -0.11 0.87 0.71 0.00 0.00 177.93 180.06 1bhi h LYS 28 N 0.64 -0.29 -1.00 5.26 1.57 -0.09 -3.07 116.57 119.60 1bhi h LYS 28 Ca 0.16 0.02 0.28 0.00 -1.87 0.00 0.00 60.65 59.24 1bhi h LYS 28 Cb 0.22 0.06 -0.19 0.00 0.08 0.00 0.00 32.23 32.41 1bhi h LYS 28 CO -0.01 -0.08 0.06 1.58 -0.57 0.00 0.00 179.45 180.43 1bhi n HIS 29 N -5.15 0.67 -0.19 -1.35 -0.00 0.21 0.51 115.22 109.91 1bhi n HIS 29 Ca -0.09 1.20 -0.07 0.00 0.46 0.00 0.00 57.72 59.21 1bhi n HIS 29 Cb 0.19 -1.27 0.02 0.00 -0.12 0.00 0.00 29.99 28.81 1bhi n HIS 29 CO 0.00 0.00 0.00 -0.22 0.46 0.00 0.00 176.34 176.58 1bhi h LYS 30 N 0.00 0.78 0.00 1.57 1.63 -1.41 -1.58 116.57 117.55 1bhi h LYS 30 Ca 0.62 -0.10 -0.00 0.00 -0.85 0.00 0.00 60.65 60.32 1bhi h LYS 30 Cb 1.31 -0.15 0.00 0.00 -0.60 0.00 0.00 32.23 32.80 1bhi h LYS 30 CO -0.92 0.62 -0.00 0.45 -3.45 0.00 0.00 179.45 176.15 1bhi h HIS 31 N 0.74 -0.00 -0.16 1.91 3.86 0.08 -3.14 115.15 118.45 1bhi h HIS 31 Ca 0.19 -0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.34 1bhi h HIS 31 Cb 0.09 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.52 1bhi h HIS 31 CO -0.01 0.46 0.07 -0.85 0.86 0.00 0.00 177.93 178.46 1bhi n GLU 32 N -4.87 1.47 -1.42 2.45 0.28 0.65 -4.65 120.64 114.55 1bhi n GLU 32 Ca -0.08 -0.59 -0.39 0.00 -0.16 0.00 0.00 57.16 55.93 1bhi n GLU 32 Cb 0.24 -1.41 -0.02 0.00 1.43 0.00 0.00 31.44 31.68 1bhi n GLU 32 CO 0.00 0.00 0.00 -0.12 -0.16 0.00 0.00 177.13 176.85 1bhi n MET 33 N 0.16 3.39 0.16 3.44 1.56 -0.60 -4.64 117.12 120.58 1bhi n MET 33 Ca 0.09 -2.29 0.12 0.00 -0.27 0.00 0.00 57.70 55.34 1bhi n MET 33 Cb 0.60 -2.94 0.57 0.00 2.15 0.00 0.00 33.22 33.60 1bhi n MET 33 CO 0.00 0.00 0.00 -2.37 -0.73 0.00 0.00 175.97 172.87 1bhi n THR 34 N 4.07 0.93 -0.02 1.12 5.66 -1.26 -1.65 114.28 123.13 1bhi n THR 34 Ca 0.70 0.55 -0.10 0.00 -3.05 0.00 0.00 64.05 62.15 1bhi n THR 34 Cb 0.28 -1.53 0.05 0.00 -1.55 0.00 0.00 70.33 67.57 1bhi n THR 34 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 175.07 171.95 1bhi h LEU 35 N 0.00 0.69 0.00 1.09 -0.00 -1.98 -3.48 115.31 111.63 1bhi h LEU 35 Ca 0.00 -0.35 0.00 0.00 -0.00 0.00 0.00 57.88 57.53 1bhi h LEU 35 Cb 0.14 -0.20 0.00 0.00 -0.00 0.00 0.00 40.66 40.61 1bhi h LEU 35 CO 0.00 1.07 0.00 2.29 -0.00 0.00 0.00 178.44 181.80 1bhi n LYS 36 N -3.99 0.00 0.00 1.13 0.00 -0.66 -5.18 118.16 109.46 1bhi n LYS 36 Ca -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.28 1bhi n LYS 36 Cb 0.58 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.61 1bhi n LYS 36 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.40 179.37 1bhi n PHE 37 N 0.00 0.00 0.00 5.58 -1.74 -1.26 -4.85 117.46 115.20 1bhi n PHE 37 Ca 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.89 1bhi n PHE 37 Cb 0.00 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.00 1bhi n PHE 37 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61