#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bhi h SER 2 N 0.00 0.88 -3.01 7.83 0.87 -2.08 -3.33 113.55 114.70 1bhi h SER 2 Ca 0.00 -0.33 -0.63 0.00 -1.23 0.00 0.00 61.79 59.60 1bhi h SER 2 Cb 0.00 -0.24 -0.41 0.00 -0.44 0.00 0.00 62.40 61.31 1bhi h SER 2 CO 0.00 1.00 -0.51 -0.67 -0.53 0.00 0.00 176.83 176.13 1bhi n ASP 3 N -4.29 3.29 -0.05 6.23 2.03 -1.26 -4.91 116.55 117.59 1bhi n ASP 3 Ca 0.00 -3.24 0.01 0.00 0.52 0.00 0.00 54.79 52.09 1bhi n ASP 3 Cb 0.35 -0.79 0.32 0.00 -0.72 0.00 0.00 41.12 40.29 1bhi n ASP 3 CO 0.00 0.00 0.00 0.44 -1.92 0.00 0.00 177.20 175.72 1bhi h ASP 4 N 5.31 0.58 -5.49 1.67 3.32 -1.99 -3.48 116.42 116.34 1bhi h ASP 4 Ca 0.16 -0.06 -0.06 0.00 0.02 0.00 0.00 57.03 57.09 1bhi h ASP 4 Cb 0.75 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.15 1bhi h ASP 4 CO 0.75 0.51 -0.41 1.17 -1.72 0.00 0.00 179.24 179.54 1bhi n LYS 5 N -4.37 -1.94 -1.67 3.56 4.81 -1.26 -4.83 118.16 112.45 1bhi n LYS 5 Ca 0.03 1.79 -0.42 0.00 -0.87 0.00 0.00 58.31 58.84 1bhi n LYS 5 Cb 0.14 -5.26 -0.03 0.00 0.02 0.00 0.00 35.03 29.90 1bhi n LYS 5 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 1bhi s PRO 6 N -2.85 3.78 -0.80 1.64 0.04 -1.26 -4.90 135.00 130.66 1bhi s PRO 6 Ca 0.16 2.38 -0.23 0.00 0.04 0.00 0.00 61.00 63.35 1bhi s PRO 6 Cb -0.04 -4.23 0.06 0.00 0.04 0.00 0.00 34.50 30.33 1bhi s PRO 6 CO 0.78 -1.36 1.19 -0.06 0.04 0.00 0.00 177.00 177.58 1bhi s PHE 7 N 5.80 2.59 -0.36 0.56 0.40 -1.16 -4.98 117.98 120.82 1bhi s PHE 7 Ca 0.92 -0.58 -0.23 0.00 -0.60 0.00 0.00 56.93 56.44 1bhi s PHE 7 Cb -0.39 -4.48 0.01 0.00 0.51 0.00 0.00 43.02 38.67 1bhi s PHE 7 CO 0.39 -1.82 0.78 -0.51 0.70 0.00 0.00 175.22 174.76 1bhi s LEU 8 N 4.57 4.13 0.29 -0.37 1.43 -1.26 -2.59 118.68 124.88 1bhi s LEU 8 Ca 0.33 0.37 -0.29 0.00 -1.03 0.00 0.00 54.13 53.50 1bhi s LEU 8 Cb -0.09 -3.02 -0.10 0.00 0.03 0.00 0.00 46.19 43.01 1bhi s LEU 8 CO 0.05 -0.72 1.39 0.00 0.23 0.00 0.00 176.35 177.29 1bhi s THR 10 N -0.57 5.47 0.00 0.00 -4.23 -1.26 -4.30 115.64 110.76 1bhi s THR 10 Ca 0.54 -2.99 0.00 0.00 -1.18 0.00 0.00 61.69 58.07 1bhi s THR 10 Cb -0.41 -4.77 -0.00 0.00 1.34 0.00 0.00 72.50 68.65 1bhi s THR 10 CO 0.49 -1.42 -0.01 0.00 -0.54 0.00 0.00 174.62 173.14 1bhi s ALA 11 N 0.30 0.06 0.02 3.99 0.00 -1.26 -4.98 121.76 119.89 1bhi s ALA 11 Ca 0.37 -0.10 -0.30 0.00 0.00 0.00 0.00 51.96 51.93 1bhi s ALA 11 Cb -0.06 0.01 -0.07 0.00 0.00 0.00 0.00 23.12 23.00 1bhi s ALA 11 CO -0.04 -0.01 1.59 -1.25 0.00 0.00 0.00 175.76 176.05 1bhi s PRO 12 N -0.19 4.22 0.00 0.00 0.04 -1.26 -2.06 135.00 135.74 1bhi s PRO 12 Ca -0.02 2.20 0.00 0.00 0.04 0.00 0.00 61.00 63.22 1bhi s PRO 12 Cb -0.01 -3.69 0.00 0.00 0.04 0.00 0.00 34.50 30.84 1bhi s PRO 12 CO -0.00 -0.72 0.00 0.41 0.04 0.00 0.00 177.00 176.73 1bhi n GLY 13 N 3.94 1.14 0.08 0.56 0.00 -1.26 -4.65 105.19 104.99 1bhi n GLY 13 Ca 0.15 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.15 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 1.31 -0.45 3.88 0.00 0.00 -0.87 -4.91 105.19 104.15 1bhi n GLY 15 Ca -0.02 0.18 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 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 -6.37 1.66 0.05 1.61 -0.21 -1.26 -4.65 119.66 110.50 1bhi s GLN 16 Ca 0.27 0.10 0.06 0.00 0.02 0.00 0.00 55.36 55.81 1bhi s GLN 16 Cb -0.15 -1.92 -0.03 0.00 1.00 0.00 0.00 33.01 31.92 1bhi s GLN 16 CO 0.53 -1.80 -0.17 0.50 -2.12 0.00 0.00 175.29 172.22 1bhi s ARG 17 N -5.55 1.11 0.15 2.91 3.00 -1.26 -0.87 118.95 118.44 1bhi s ARG 17 Ca 0.63 -0.89 -0.00 0.00 -1.00 0.00 0.00 55.73 54.47 1bhi s ARG 17 Cb -0.11 -1.20 -0.04 0.00 0.00 0.00 0.00 34.95 33.60 1bhi s ARG 17 CO 0.50 0.30 0.05 -0.06 0.00 0.00 0.00 175.30 176.09 1bhi s PHE 18 N -0.90 0.97 -0.05 5.12 0.40 -1.07 -5.01 117.98 117.44 1bhi s PHE 18 Ca 0.04 -1.20 0.12 0.00 -0.60 0.00 0.00 56.93 55.29 1bhi s PHE 18 Cb -0.09 -0.54 -0.08 0.00 0.51 0.00 0.00 43.02 42.82 1bhi s PHE 18 CO 0.02 -0.46 1.25 1.79 0.70 0.00 0.00 175.22 178.51 1bhi h THR 19 N 2.80 1.10 -3.26 0.64 1.35 -1.93 -3.07 112.91 110.55 1bhi h THR 19 Ca -0.36 -2.64 -0.38 0.00 -0.55 0.00 0.00 66.41 62.48 1bhi h THR 19 Cb 1.21 2.52 -0.14 0.00 -1.73 0.00 0.00 68.15 70.00 1bhi h THR 19 CO 0.59 0.63 -0.67 0.20 -0.25 0.00 0.00 175.52 176.03 1bhi s ASN 20 N -6.42 1.92 0.46 5.36 0.01 -1.26 -4.84 114.94 110.16 1bhi s ASN 20 Ca 0.01 -1.19 0.26 0.00 -0.71 0.00 0.00 52.86 51.23 1bhi s ASN 20 Cb 0.09 -0.01 0.74 0.00 0.41 0.00 0.00 41.25 42.48 1bhi s ASN 20 CO 0.79 -0.47 1.75 -0.08 -1.51 0.00 0.00 177.10 177.57 1bhi h GLU 21 N 2.49 0.00 -0.10 -0.60 4.22 -1.94 -3.24 114.58 115.41 1bhi h GLU 21 Ca -0.38 0.00 0.02 0.00 0.08 0.00 0.00 59.36 59.08 1bhi h GLU 21 Cb 1.22 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.45 1bhi h GLU 21 CO 0.65 0.07 -0.04 0.22 -2.18 0.00 0.00 179.01 177.73 1bhi h ASP 22 N 0.00 -0.14 0.20 1.04 3.58 -1.99 0.32 116.42 119.42 1bhi h ASP 22 Ca -0.00 0.04 -0.11 0.00 0.42 0.00 0.00 57.03 57.38 1bhi h ASP 22 Cb 0.84 0.08 -0.01 0.00 1.72 0.00 0.00 39.33 41.96 1bhi h ASP 22 CO 0.01 -0.06 -0.41 0.45 -2.88 0.00 0.00 179.24 176.35 1bhi h HIS 23 N -0.03 0.33 -0.25 0.28 -0.00 -2.00 -2.56 115.15 110.93 1bhi h HIS 23 Ca 0.06 -0.09 -0.12 0.00 -0.00 0.00 0.00 60.37 60.21 1bhi h HIS 23 Cb 0.11 -0.07 -0.01 0.00 -0.00 0.00 0.00 27.41 27.44 1bhi h HIS 23 CO -0.16 0.66 -0.36 1.25 -0.00 0.00 0.00 177.93 179.31 1bhi h LEU 24 N 0.24 0.56 0.86 2.43 5.85 -1.42 -2.19 115.31 121.63 1bhi h LEU 24 Ca 0.02 -0.23 -0.04 0.00 0.84 0.00 0.00 57.88 58.47 1bhi h LEU 24 Cb 0.83 -0.16 0.01 0.00 0.37 0.00 0.00 40.66 41.71 1bhi h LEU 24 CO 0.07 0.88 -0.41 0.00 -0.34 0.00 0.00 178.44 178.63 1bhi h ALA 25 N 1.16 -1.15 -0.68 1.25 0.00 0.02 0.13 119.26 119.99 1bhi h ALA 25 Ca 0.05 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1bhi h ALA 25 Cb 0.84 0.45 -0.03 0.00 0.00 0.00 0.00 17.79 19.04 1bhi h ALA 25 CO 0.07 -1.13 0.42 -0.39 0.00 0.00 0.00 179.25 178.22 1bhi h VAL 26 N -1.19 1.18 -0.17 0.00 -1.51 -1.56 0.16 116.25 113.17 1bhi h VAL 26 Ca -0.12 -0.38 -0.02 0.00 -1.23 0.00 0.00 66.70 64.96 1bhi h VAL 26 Cb 0.89 0.21 -0.01 0.00 -2.13 0.00 0.00 31.29 30.25 1bhi h VAL 26 CO 0.19 0.19 0.04 -0.74 -1.23 0.00 0.00 177.57 176.03 1bhi h HIS 27 N 0.93 0.28 -0.29 5.19 6.17 -1.21 -2.84 115.15 123.37 1bhi h HIS 27 Ca 0.25 -0.03 -0.17 0.00 0.71 0.00 0.00 60.37 61.13 1bhi h HIS 27 Cb -0.06 -0.08 -0.00 0.00 2.52 0.00 0.00 27.41 29.78 1bhi h HIS 27 CO 0.00 0.39 -0.49 0.87 0.71 0.00 0.00 177.93 179.41 1bhi h LYS 28 N 0.08 0.79 -0.51 5.26 1.57 -0.39 -3.08 116.57 120.30 1bhi h LYS 28 Ca 0.05 -0.47 0.09 0.00 -1.87 0.00 0.00 60.65 58.45 1bhi h LYS 28 Cb 0.25 0.04 -0.07 0.00 0.08 0.00 0.00 32.23 32.53 1bhi h LYS 28 CO -0.00 1.10 0.08 1.25 -0.57 0.00 0.00 179.45 181.31 1bhi h HIS 29 N 0.62 0.11 -0.13 -1.35 2.76 -0.60 0.59 115.15 117.16 1bhi h HIS 29 Ca 0.03 0.03 -0.15 0.00 -2.20 0.00 0.00 60.37 58.08 1bhi h HIS 29 Cb 1.07 0.03 -0.01 0.00 1.55 0.00 0.00 27.41 30.05 1bhi h HIS 29 CO 0.06 -0.04 -0.55 1.57 -1.30 0.00 0.00 177.93 177.67 1bhi h LYS 30 N 0.21 0.39 0.08 5.26 2.10 -1.53 0.74 116.57 123.81 1bhi h LYS 30 Ca 0.26 -0.25 -0.00 0.00 -2.00 0.00 0.00 60.65 58.66 1bhi h LYS 30 Cb 0.36 0.03 0.00 0.00 -0.90 0.00 0.00 32.23 31.72 1bhi h LYS 30 CO -0.36 0.84 -0.04 0.45 -2.00 0.00 0.00 179.45 178.35 1bhi h HIS 31 N 0.30 -0.09 0.15 0.07 3.86 -1.24 -3.10 115.15 115.10 1bhi h HIS 31 Ca 0.00 -0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.20 1bhi h HIS 31 Cb 1.07 0.03 0.00 0.00 1.06 0.00 0.00 27.41 29.57 1bhi h HIS 31 CO 0.03 0.16 -0.07 0.93 0.86 0.00 0.00 177.93 179.84 1bhi h GLU 32 N -0.35 -0.20 -2.99 2.45 5.08 -0.92 -3.25 114.58 114.41 1bhi h GLU 32 Ca -0.01 0.01 -0.71 0.00 -1.00 0.00 0.00 59.36 57.65 1bhi h GLU 32 Cb 0.30 0.05 -0.06 0.00 0.50 0.00 0.00 28.75 29.53 1bhi h GLU 32 CO 0.02 0.16 3.00 -1.33 -1.00 0.00 0.00 179.01 179.86 1bhi n MET 33 N -5.01 3.99 0.24 2.33 2.81 0.25 -4.64 117.12 117.09 1bhi n MET 33 Ca -0.09 -2.90 0.16 0.00 -1.81 0.00 0.00 57.70 53.06 1bhi n MET 33 Cb 0.24 -2.79 0.82 0.00 -0.71 0.00 0.00 33.22 30.77 1bhi n MET 33 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1bhi h THR 34 N 3.01 0.00 0.00 2.03 1.03 -1.58 -0.95 112.91 116.45 1bhi h THR 34 Ca 0.73 -0.09 0.00 0.00 -0.01 0.00 0.00 66.41 67.03 1bhi h THR 34 Cb 0.36 0.85 0.00 0.00 -1.07 0.00 0.00 68.15 68.29 1bhi h THR 34 CO 1.65 0.00 0.00 0.00 -0.01 0.00 0.00 175.52 177.16 1bhi n LEU 35 N -2.65 0.22 -4.74 0.00 -0.00 -1.26 -4.82 117.00 103.75 1bhi n LEU 35 Ca -0.01 0.55 -0.42 0.00 -0.00 0.00 0.00 56.01 56.13 1bhi n LEU 35 Cb 0.10 -0.51 -0.00 0.00 -0.00 0.00 0.00 43.42 43.01 1bhi n LEU 35 CO 0.17 -0.30 1.03 1.17 -0.00 0.00 0.00 177.39 179.47 1bhi n LYS 36 N -1.73 2.42 -3.32 1.47 4.81 -0.36 -2.50 118.16 118.95 1bhi n LYS 36 Ca 0.04 0.85 -0.16 0.00 -0.87 0.00 0.00 58.31 58.17 1bhi n LYS 36 Cb 0.22 -2.52 0.08 0.00 0.02 0.00 0.00 35.03 32.83 1bhi n LYS 36 CO 0.00 0.00 0.00 1.19 1.17 0.00 0.00 177.40 179.76 1bhi n PHE 37 N 0.48 -2.06 -0.57 5.64 3.72 -1.26 -5.15 117.46 118.27 1bhi n PHE 37 Ca 0.03 0.86 0.00 0.00 -0.05 0.00 0.00 57.45 58.29 1bhi n PHE 37 Cb 0.37 -4.78 0.00 0.00 -0.94 0.00 0.00 39.48 34.13 1bhi n PHE 37 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12