#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p7a s SER 2 N 0.00 6.39 1.17 1.61 0.01 -1.26 -3.02 113.70 118.60 1p7a s SER 2 Ca 0.00 -0.18 0.00 0.00 1.31 0.00 0.00 55.95 57.08 1p7a s SER 2 Cb 0.00 -2.45 0.00 0.00 0.21 0.00 0.00 66.02 63.78 1p7a s SER 2 CO 0.00 -1.21 0.00 0.41 0.41 0.00 0.00 173.24 172.85 1p7a n THR 3 N 6.31 0.00 -2.09 1.44 -1.04 0.68 -4.92 114.28 114.66 1p7a n THR 3 Ca 0.04 0.00 -0.03 0.00 -2.04 0.00 0.00 64.05 62.01 1p7a n THR 3 Cb 0.48 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.99 1p7a n THR 3 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1p7a n ARG 4 N 14.00 -1.02 0.00 -2.82 1.74 -1.26 -4.62 116.66 122.68 1p7a n ARG 4 Ca 0.00 1.20 0.00 0.00 -0.77 0.00 0.00 57.85 58.28 1p7a n ARG 4 Cb 0.00 -3.33 0.00 0.00 -1.02 0.00 0.00 32.46 28.11 1p7a n ARG 4 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1p7a n GLY 5 N -0.46 1.18 3.83 -0.13 0.00 -1.26 -4.98 105.19 103.37 1p7a n GLY 5 Ca 0.05 -0.74 -0.36 0.00 0.00 0.00 0.00 46.02 44.97 1p7a n GLY 5 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1p7a s SER 6 N -4.00 6.94 -0.82 1.61 0.01 -1.26 -5.01 113.70 111.17 1p7a s SER 6 Ca 0.00 1.22 -0.22 0.00 1.31 0.00 0.00 55.95 58.25 1p7a s SER 6 Cb 0.00 -2.34 0.08 0.00 0.21 0.00 0.00 66.02 63.96 1p7a s SER 6 CO 0.00 0.11 1.16 0.42 0.41 0.00 0.00 173.24 175.34 1p7a s THR 7 N -1.43 4.24 0.00 1.44 -4.23 -1.26 -4.21 115.64 110.20 1p7a s THR 7 Ca 0.38 -0.64 0.00 0.00 -1.18 0.00 0.00 61.69 60.25 1p7a s THR 7 Cb -0.16 -4.83 0.00 0.00 1.34 0.00 0.00 72.50 68.85 1p7a s THR 7 CO 0.20 -1.64 0.00 0.61 -0.54 0.00 0.00 174.62 173.25 1p7a n GLY 8 N 5.70 -0.25 3.78 3.99 0.00 -1.26 -5.06 105.19 112.10 1p7a n GLY 8 Ca 0.12 -0.26 -0.31 0.00 0.00 0.00 0.00 46.02 45.58 1p7a n GLY 8 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1p7a s ILE 9 N -1.72 3.42 0.42 -0.61 1.01 -1.25 -4.83 121.20 117.64 1p7a s ILE 9 Ca 0.00 0.46 0.00 0.00 0.00 0.00 0.00 60.65 61.11 1p7a s ILE 9 Cb 0.00 -3.08 0.00 0.00 0.01 0.00 0.00 42.46 39.39 1p7a s ILE 9 CO 0.00 -0.60 0.00 0.29 0.00 0.00 0.00 174.94 174.63 1p7a n LYS 10 N -3.43 -2.97 0.32 2.79 5.02 -1.26 -4.21 118.16 114.42 1p7a n LYS 10 Ca 0.08 2.30 0.20 0.00 -2.02 0.00 0.00 58.31 58.87 1p7a n LYS 10 Cb 0.54 -2.85 1.08 0.00 -0.02 0.00 0.00 35.03 33.78 1p7a n LYS 10 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 1p7a h PRO 11 N 0.20 0.00 -3.19 1.97 0.13 -1.88 -3.34 132.00 125.88 1p7a h PRO 11 Ca 0.00 0.00 -0.62 0.00 -0.87 0.00 0.00 66.00 64.51 1p7a h PRO 11 Cb 0.64 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.37 1p7a h PRO 11 CO 0.00 0.00 -0.71 -0.06 -0.23 0.00 0.00 178.00 177.00 1p7a s PHE 12 N -4.25 2.31 0.14 1.56 0.08 -0.60 -5.04 117.98 112.18 1p7a s PHE 12 Ca -0.05 -2.57 0.02 0.00 0.12 0.00 0.00 56.93 54.46 1p7a s PHE 12 Cb 0.13 -2.13 -0.04 0.00 -0.57 0.00 0.00 43.02 40.41 1p7a s PHE 12 CO 0.42 -0.79 0.26 1.14 -0.10 0.00 0.00 175.22 176.15 1p7a s GLN 13 N 0.32 3.38 0.15 0.44 0.00 -1.26 -0.14 119.66 122.55 1p7a s GLN 13 Ca 0.17 -0.61 -0.31 0.00 -0.00 0.00 0.00 55.36 54.61 1p7a s GLN 13 Cb -0.24 -2.94 -0.08 0.00 0.00 0.00 0.00 33.01 29.75 1p7a s GLN 13 CO -0.02 0.53 1.32 0.00 0.00 0.00 0.00 175.29 177.12 1p7a n PRO 15 N 3.27 0.33 -0.04 0.00 -0.04 -1.26 -0.57 135.00 136.69 1p7a n PRO 15 Ca 0.08 0.05 -0.05 0.00 -0.04 0.00 0.00 63.50 63.54 1p7a n PRO 15 Cb 0.43 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.33 1p7a n PRO 15 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1p7a n ASP 16 N -1.31 3.09 -0.07 3.54 2.03 -1.26 -4.78 116.55 117.80 1p7a n ASP 16 Ca 0.12 -0.02 -0.08 0.00 0.52 0.00 0.00 54.79 55.33 1p7a n ASP 16 Cb 0.21 0.42 -0.10 0.00 -0.72 0.00 0.00 41.12 40.94 1p7a n ASP 16 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1p7a n ASP 18 N -2.60 -2.19 -3.16 0.00 2.03 0.27 -4.61 116.55 106.28 1p7a n ASP 18 Ca -0.23 -0.03 0.00 0.00 0.52 0.00 0.00 54.79 55.05 1p7a n ASP 18 Cb 0.90 -0.71 0.00 0.00 -0.72 0.00 0.00 41.12 40.59 1p7a n ASP 18 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1p7a n ARG 19 N -0.74 1.23 -3.66 -0.67 1.74 -1.25 -0.23 116.66 113.07 1p7a n ARG 19 Ca -0.00 0.00 -0.10 0.00 -0.77 0.00 0.00 57.85 56.98 1p7a n ARG 19 Cb 0.50 0.00 -0.11 0.00 -1.02 0.00 0.00 32.46 31.84 1p7a n ARG 19 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1p7a s SER 20 N -1.16 -0.11 0.00 0.55 1.04 -1.17 -3.77 113.70 109.08 1p7a s SER 20 Ca 0.00 0.88 0.03 0.00 0.48 0.00 0.00 55.95 57.33 1p7a s SER 20 Cb 0.00 1.14 -0.01 0.00 0.10 0.00 0.00 66.02 67.25 1p7a s SER 20 CO 0.00 -0.23 -0.08 -0.36 0.98 0.00 0.00 173.24 173.55 1p7a s PHE 21 N 2.49 0.73 -0.28 5.02 0.40 0.80 -4.58 117.98 122.57 1p7a s PHE 21 Ca -0.01 -0.20 0.21 0.00 -0.60 0.00 0.00 56.93 56.33 1p7a s PHE 21 Cb -0.12 -0.46 0.09 0.00 0.51 0.00 0.00 43.02 43.04 1p7a s PHE 21 CO -0.12 -0.02 1.23 0.66 0.70 0.00 0.00 175.22 177.68 1p7a h SER 22 N 5.68 0.00 -3.83 1.36 4.64 -1.94 -1.59 113.55 117.87 1p7a h SER 22 Ca -0.31 0.00 -0.68 0.00 -0.47 0.00 0.00 61.79 60.33 1p7a h SER 22 Cb 1.19 0.00 -0.28 0.00 -0.31 0.00 0.00 62.40 62.99 1p7a h SER 22 CO 0.48 0.11 -0.83 -0.13 -0.87 0.00 0.00 176.83 175.60 1p7a s ARG 23 N -3.23 2.76 0.46 4.77 0.52 -1.26 -4.76 118.95 118.22 1p7a s ARG 23 Ca 0.02 -0.80 0.19 0.00 -0.52 0.00 0.00 55.73 54.62 1p7a s ARG 23 Cb 0.08 -2.34 1.12 0.00 0.52 0.00 0.00 34.95 34.33 1p7a s ARG 23 CO 0.75 0.40 1.99 0.66 0.02 0.00 0.00 175.30 179.11 1p7a h SER 24 N 6.06 0.00 -0.63 0.23 4.64 -1.92 -0.93 113.55 121.01 1p7a h SER 24 Ca -0.34 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.96 1p7a h SER 24 Cb 1.18 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.24 1p7a h SER 24 CO 0.50 0.20 0.29 -0.78 -0.87 0.00 0.00 176.83 176.17 1p7a h ASP 25 N 0.00 0.83 0.00 4.97 3.58 -1.99 0.03 116.42 123.83 1p7a h ASP 25 Ca -0.00 -0.14 -0.13 0.00 0.42 0.00 0.00 57.03 57.18 1p7a h ASP 25 Cb 0.40 -0.21 -0.01 0.00 1.72 0.00 0.00 39.33 41.23 1p7a h ASP 25 CO 0.03 0.73 -0.40 0.45 -2.88 0.00 0.00 179.24 177.17 1p7a h HIS 26 N 0.86 0.60 0.50 0.28 3.86 -1.65 -1.20 115.15 118.39 1p7a h HIS 26 Ca 0.21 -0.17 -0.01 0.00 -1.16 0.00 0.00 60.37 59.24 1p7a h HIS 26 Cb 0.13 -0.13 -0.02 0.00 1.06 0.00 0.00 27.41 28.45 1p7a h HIS 26 CO 0.00 0.83 -0.46 1.25 0.86 0.00 0.00 177.93 180.42 1p7a h LEU 27 N 0.42 -1.23 -1.37 2.43 5.85 -0.68 -2.23 115.31 118.49 1p7a h LEU 27 Ca 0.04 0.10 0.11 0.00 0.84 0.00 0.00 57.88 58.97 1p7a h LEU 27 Cb 0.88 0.40 -0.06 0.00 0.37 0.00 0.00 40.66 42.26 1p7a h LEU 27 CO 0.07 -0.63 0.52 0.00 -0.34 0.00 0.00 178.44 178.07 1p7a h ALA 28 N -0.71 1.82 -0.81 1.25 0.00 -0.81 0.19 119.26 120.18 1p7a h ALA 28 Ca -0.06 -0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.88 1p7a h ALA 28 Cb 0.82 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 18.42 1p7a h ALA 28 CO -0.04 -0.00 0.52 -0.07 0.00 0.00 0.00 179.25 179.65 1p7a h LEU 29 N 0.67 0.86 -0.26 0.00 3.38 -0.76 -1.36 115.31 117.85 1p7a h LEU 29 Ca 0.38 -0.00 -0.21 0.00 0.09 0.00 0.00 57.88 58.13 1p7a h LEU 29 Cb 0.54 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.10 1p7a h LEU 29 CO -0.15 0.59 -0.86 -0.74 0.09 0.00 0.00 178.44 177.37 1p7a h HIS 30 N 1.01 0.59 0.00 1.13 -0.00 -0.60 -3.24 115.15 114.04 1p7a h HIS 30 Ca 0.32 -0.30 0.00 0.00 -0.00 0.00 0.00 60.37 60.39 1p7a h HIS 30 Cb 0.01 -0.08 0.00 0.00 -0.00 0.00 0.00 27.41 27.34 1p7a h HIS 30 CO -0.03 1.10 0.00 0.54 -0.00 0.00 0.00 177.93 179.54 1p7a n ARG 31 N -3.78 0.92 -0.31 5.26 1.74 0.51 -3.65 116.66 117.36 1p7a n ARG 31 Ca -0.06 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.02 1p7a n ARG 31 Cb 0.79 -1.34 0.13 0.00 -1.02 0.00 0.00 32.46 31.02 1p7a n ARG 31 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 1p7a h LYS 32 N 0.00 0.96 0.00 5.56 6.56 -1.31 0.23 116.57 128.57 1p7a h LYS 32 Ca 0.00 -0.06 0.00 0.00 -1.06 0.00 0.00 60.65 59.53 1p7a h LYS 32 Cb 0.00 -0.22 0.00 0.00 -0.57 0.00 0.00 32.23 31.44 1p7a h LYS 32 CO 0.00 0.64 0.00 0.54 -2.06 0.00 0.00 179.45 178.57 1p7a n ARG 33 N -4.60 0.20 0.00 3.15 1.74 -1.24 -1.72 116.66 114.18 1p7a n ARG 33 Ca 0.12 0.37 0.13 0.00 -0.77 0.00 0.00 57.85 57.70 1p7a n ARG 33 Cb 0.15 -1.84 0.46 0.00 -1.02 0.00 0.00 32.46 30.21 1p7a n ARG 33 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1p7a n HIS 34 N -2.21 0.00 1.18 -1.55 8.25 0.05 -2.83 115.22 118.11 1p7a n HIS 34 Ca 0.03 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.62 1p7a n HIS 34 Cb 0.27 -0.38 0.30 0.00 1.12 0.00 0.00 29.99 31.29 1p7a n HIS 34 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 1p7a n MET 35 N -1.48 2.03 -3.20 -0.41 2.81 -0.70 -4.40 117.12 111.77 1p7a n MET 35 Ca 0.07 -1.51 -0.36 0.00 -1.81 0.00 0.00 57.70 54.09 1p7a n MET 35 Cb 0.34 -1.47 -0.03 0.00 -0.71 0.00 0.00 33.22 31.35 1p7a n MET 35 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 1p7a n LEU 36 N 0.82 5.25 0.00 4.03 4.77 -1.13 -5.13 117.00 125.61 1p7a n LEU 36 Ca 0.17 -5.31 0.12 0.00 -0.03 0.00 0.00 56.01 50.95 1p7a n LEU 36 Cb 0.48 -1.01 0.70 0.00 -2.33 0.00 0.00 43.42 41.26 1p7a n LEU 36 CO 0.16 1.85 0.88 1.33 -1.33 0.00 0.00 177.39 180.27