#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p7a n SER 2 N 0.00 -4.61 -0.19 1.61 7.64 -0.99 -4.66 113.62 112.42 1p7a n SER 2 Ca 0.00 -0.75 0.15 0.00 1.01 0.00 0.00 58.87 59.28 1p7a n SER 2 Cb 0.00 -4.75 0.73 0.00 -1.01 0.00 0.00 64.21 59.17 1p7a n SER 2 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1p7a n THR 3 N -3.73 0.00 -2.92 0.44 -1.04 -1.14 -4.95 114.28 100.95 1p7a n THR 3 Ca -0.16 -0.10 -0.01 0.00 -2.04 0.00 0.00 64.05 61.74 1p7a n THR 3 Cb 0.64 -0.07 0.00 0.00 -1.82 0.00 0.00 70.33 69.08 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 -0.59 -2.21 0.00 -2.82 5.12 -0.47 -4.81 116.66 110.88 1p7a n ARG 4 Ca 0.20 1.98 0.00 0.00 -1.93 0.00 0.00 57.85 58.10 1p7a n ARG 4 Cb 0.23 -3.64 0.00 0.00 -1.16 0.00 0.00 32.46 27.89 1p7a n ARG 4 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1p7a n GLY 5 N 0.89 -0.42 0.19 -0.13 0.00 -1.06 -4.86 105.19 99.80 1p7a n GLY 5 Ca 0.00 -0.10 -0.19 0.00 0.00 0.00 0.00 46.02 45.73 1p7a n GLY 5 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1p7a h SER 6 N 0.00 0.84 -3.02 1.61 0.02 -2.01 -3.27 113.55 107.72 1p7a h SER 6 Ca 0.00 -0.69 -0.72 0.00 -0.84 0.00 0.00 61.79 59.54 1p7a h SER 6 Cb 0.00 -0.26 -0.21 0.00 0.14 0.00 0.00 62.40 62.07 1p7a h SER 6 CO 0.00 1.49 0.21 0.42 -1.14 0.00 0.00 176.83 177.81 1p7a s THR 7 N -3.27 4.99 0.00 -2.27 -4.23 -1.26 -4.16 115.64 105.44 1p7a s THR 7 Ca -0.09 -1.43 0.00 0.00 -1.18 0.00 0.00 61.69 58.99 1p7a s THR 7 Cb 0.07 -4.52 0.00 0.00 1.34 0.00 0.00 72.50 69.39 1p7a s THR 7 CO 0.91 -1.15 0.00 0.61 -0.54 0.00 0.00 174.62 174.45 1p7a n GLY 8 N 5.05 0.56 3.85 3.99 0.00 -1.25 -1.37 105.19 116.02 1p7a n GLY 8 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.33 3.75 0.47 -0.61 1.01 -1.23 -2.56 121.20 121.70 1p7a s ILE 9 Ca 0.00 0.57 0.00 0.00 0.00 0.00 0.00 60.65 61.22 1p7a s ILE 9 Cb 0.00 -3.46 0.00 0.00 0.01 0.00 0.00 42.46 39.01 1p7a s ILE 9 CO 0.00 -0.74 0.00 0.29 0.00 0.00 0.00 174.94 174.49 1p7a n LYS 10 N -3.08 -3.50 0.18 2.79 5.02 -1.26 -4.50 118.16 113.81 1p7a n LYS 10 Ca 0.07 2.68 0.14 0.00 -2.02 0.00 0.00 58.31 59.18 1p7a n LYS 10 Cb 0.56 -3.25 0.61 0.00 -0.02 0.00 0.00 35.03 32.92 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 0.50 0.00 -3.31 1.97 0.13 -1.90 -3.37 132.00 126.02 1p7a h PRO 11 Ca 0.00 0.00 -0.61 0.00 -0.87 0.00 0.00 66.00 64.52 1p7a h PRO 11 Cb 0.56 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.29 1p7a h PRO 11 CO 0.00 0.00 -0.73 -0.06 -0.23 0.00 0.00 178.00 176.98 1p7a s PHE 12 N -3.50 2.18 0.26 1.56 0.08 -1.09 -5.07 117.98 112.41 1p7a s PHE 12 Ca 0.01 -2.38 0.07 0.00 0.12 0.00 0.00 56.93 54.75 1p7a s PHE 12 Cb 0.09 -2.02 -0.03 0.00 -0.57 0.00 0.00 43.02 40.48 1p7a s PHE 12 CO 0.38 -0.82 0.21 -0.65 -0.10 0.00 0.00 175.22 174.25 1p7a s GLN 13 N 0.65 2.91 -0.07 0.44 -0.21 -1.26 0.15 119.66 122.28 1p7a s GLN 13 Ca 0.15 -1.08 -0.30 0.00 0.02 0.00 0.00 55.36 54.15 1p7a s GLN 13 Cb -0.22 -2.56 -0.04 0.00 1.00 0.00 0.00 33.01 31.19 1p7a s GLN 13 CO -0.06 0.36 1.37 0.00 -2.12 0.00 0.00 175.29 174.83 1p7a n PRO 15 N 5.98 0.60 -0.03 0.00 -0.04 -1.26 -1.80 135.00 138.45 1p7a n PRO 15 Ca 0.14 0.01 -0.04 0.00 -0.04 0.00 0.00 63.50 63.57 1p7a n PRO 15 Cb 0.44 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.38 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 -1.04 3.23 -0.06 3.54 2.03 -1.26 -3.67 116.55 119.32 1p7a n ASP 16 Ca 0.15 -0.02 -0.13 0.00 0.52 0.00 0.00 54.79 55.31 1p7a n ASP 16 Cb 0.08 -0.10 -0.14 0.00 -0.72 0.00 0.00 41.12 40.24 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 -3.06 -2.79 -4.78 0.00 5.68 -0.75 -4.72 116.55 106.14 1p7a n ASP 18 Ca -0.29 0.05 -0.32 0.00 -0.50 0.00 0.00 54.79 53.74 1p7a n ASP 18 Cb 1.08 -1.25 0.05 0.00 -1.14 0.00 0.00 41.12 39.86 1p7a n ASP 18 CO 0.00 0.00 0.00 -0.13 -1.33 0.00 0.00 177.20 175.74 1p7a s ARG 19 N -3.06 2.75 0.02 0.11 0.52 -1.26 -4.60 118.95 113.42 1p7a s ARG 19 Ca 0.00 1.23 0.05 0.00 -0.52 0.00 0.00 55.73 56.48 1p7a s ARG 19 Cb 0.00 -1.95 -0.02 0.00 0.52 0.00 0.00 34.95 33.50 1p7a s ARG 19 CO 0.00 -1.27 -0.14 -1.12 0.02 0.00 0.00 175.30 172.79 1p7a s SER 20 N -3.04 1.65 -0.01 0.23 0.01 -1.26 0.46 113.70 111.74 1p7a s SER 20 Ca 0.63 -0.36 -0.02 0.00 1.31 0.00 0.00 55.95 57.52 1p7a s SER 20 Cb -0.18 -0.14 -0.00 0.00 0.21 0.00 0.00 66.02 65.91 1p7a s SER 20 CO 0.47 0.10 0.03 -0.36 0.41 0.00 0.00 173.24 173.89 1p7a s PHE 21 N -0.59 0.04 -0.32 2.43 0.40 0.12 -4.96 117.98 115.10 1p7a s PHE 21 Ca 0.03 -0.06 0.22 0.00 -0.60 0.00 0.00 56.93 56.52 1p7a s PHE 21 Cb -0.07 -0.04 0.15 0.00 0.51 0.00 0.00 43.02 43.58 1p7a s PHE 21 CO 0.00 -0.08 1.31 0.77 0.70 0.00 0.00 175.22 177.92 1p7a h SER 22 N 5.60 0.00 -3.53 1.36 0.02 -1.96 -2.88 113.55 112.15 1p7a h SER 22 Ca -0.27 0.00 -0.59 0.00 -0.84 0.00 0.00 61.79 60.09 1p7a h SER 22 Cb 1.21 0.00 -0.33 0.00 0.14 0.00 0.00 62.40 63.42 1p7a h SER 22 CO 0.46 0.03 -0.85 -0.13 -1.14 0.00 0.00 176.83 175.21 1p7a s ARG 23 N -3.27 2.25 0.60 3.45 0.52 -1.26 -4.81 118.95 116.44 1p7a s ARG 23 Ca 0.03 -0.65 0.36 0.00 -0.52 0.00 0.00 55.73 54.94 1p7a s ARG 23 Cb 0.07 -1.80 1.95 0.00 0.52 0.00 0.00 34.95 35.69 1p7a s ARG 23 CO 0.74 0.15 2.24 1.03 0.02 0.00 0.00 175.30 179.48 1p7a h SER 24 N 6.66 0.00 -0.30 0.23 0.87 -1.91 -0.96 113.55 118.14 1p7a h SER 24 Ca -0.27 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.27 1p7a h SER 24 Cb 1.20 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.15 1p7a h SER 24 CO 0.47 0.03 0.13 -2.24 -0.53 0.00 0.00 176.83 174.69 1p7a h ASP 25 N 0.00 0.41 -0.27 6.23 2.03 -1.99 0.14 116.42 122.97 1p7a h ASP 25 Ca -0.00 -0.15 -0.07 0.00 -0.73 0.00 0.00 57.03 56.08 1p7a h ASP 25 Cb 0.12 -0.10 -0.02 0.00 -0.83 0.00 0.00 39.33 38.50 1p7a h ASP 25 CO 0.00 0.44 -0.06 0.45 -1.03 0.00 0.00 179.24 179.05 1p7a h HIS 26 N 0.34 0.69 0.53 4.15 3.86 -1.63 -1.30 115.15 121.79 1p7a h HIS 26 Ca 0.10 -0.10 -0.02 0.00 -1.16 0.00 0.00 60.37 59.19 1p7a h HIS 26 Cb 0.16 -0.19 -0.02 0.00 1.06 0.00 0.00 27.41 28.42 1p7a h HIS 26 CO -0.01 0.69 -0.48 1.25 0.86 0.00 0.00 177.93 180.24 1p7a h LEU 27 N 0.60 -1.30 -1.19 2.43 5.85 -0.84 -2.40 115.31 118.46 1p7a h LEU 27 Ca 0.11 0.10 0.09 0.00 0.84 0.00 0.00 57.88 59.03 1p7a h LEU 27 Cb 0.47 0.42 -0.06 0.00 0.37 0.00 0.00 40.66 41.86 1p7a h LEU 27 CO 0.02 -0.65 0.58 0.00 -0.34 0.00 0.00 178.44 178.05 1p7a h ALA 28 N -1.00 1.62 -0.87 1.25 0.00 -0.75 0.23 119.26 119.74 1p7a h ALA 28 Ca -0.07 -0.01 0.09 0.00 0.00 0.00 0.00 54.91 54.93 1p7a h ALA 28 Cb 0.85 -0.21 -0.07 0.00 0.00 0.00 0.00 17.79 18.36 1p7a h ALA 28 CO -0.03 0.20 0.52 -0.07 0.00 0.00 0.00 179.25 179.87 1p7a h LEU 29 N 0.90 0.78 -0.04 0.00 3.38 -0.95 0.16 115.31 119.55 1p7a h LEU 29 Ca 0.41 0.04 -0.22 0.00 0.09 0.00 0.00 57.88 58.20 1p7a h LEU 29 Cb 0.39 -0.12 0.02 0.00 0.09 0.00 0.00 40.66 41.04 1p7a h LEU 29 CO -0.18 0.46 -0.84 -0.74 0.09 0.00 0.00 178.44 177.23 1p7a h HIS 30 N 0.90 0.93 0.00 1.13 2.76 -0.67 -3.27 115.15 116.93 1p7a h HIS 30 Ca 0.41 -0.48 0.00 0.00 -2.20 0.00 0.00 60.37 58.10 1p7a h HIS 30 Cb 0.32 -0.12 0.00 0.00 1.55 0.00 0.00 27.41 29.16 1p7a h HIS 30 CO -0.04 1.30 0.00 0.54 -1.30 0.00 0.00 177.93 178.43 1p7a n ARG 31 N -3.99 0.08 0.19 5.26 1.74 0.66 -2.43 116.66 118.18 1p7a n ARG 31 Ca -0.10 0.12 0.06 0.00 -0.77 0.00 0.00 57.85 57.16 1p7a n ARG 31 Cb 0.78 -1.50 0.53 0.00 -1.02 0.00 0.00 32.46 31.25 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 0.10 0.00 5.56 6.56 -0.77 0.16 116.57 128.19 1p7a h LYS 32 Ca 0.00 -0.01 0.00 0.00 -1.06 0.00 0.00 60.65 59.58 1p7a h LYS 32 Cb 0.32 -0.02 0.00 0.00 -0.57 0.00 0.00 32.23 31.96 1p7a h LYS 32 CO 0.00 0.16 0.00 0.00 -2.06 0.00 0.00 179.45 177.55 1p7a h ARG 33 N 0.10 0.00 -0.00 3.15 3.08 -1.69 -2.19 114.38 116.83 1p7a h ARG 33 Ca 0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.08 1p7a h ARG 33 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.20 1p7a h ARG 33 CO 0.01 0.00 -0.13 0.72 -1.07 0.00 0.00 179.97 179.50 1p7a n HIS 34 N -2.64 0.00 1.01 3.04 8.25 0.55 -2.60 115.22 122.82 1p7a n HIS 34 Ca 0.02 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.59 1p7a n HIS 34 Cb 0.31 -0.38 -0.03 0.00 1.12 0.00 0.00 29.99 31.01 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 -1.41 0.20 -3.18 -0.41 2.81 -0.83 -4.46 117.12 109.84 1p7a n MET 35 Ca 0.08 -0.16 -0.20 0.00 -1.81 0.00 0.00 57.70 55.62 1p7a n MET 35 Cb 0.32 -1.50 -0.04 0.00 -0.71 0.00 0.00 33.22 31.29 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 -1.27 0.81 -0.23 4.03 4.77 -1.07 -5.14 117.00 118.91 1p7a n LEU 36 Ca 0.05 -4.95 0.15 0.00 -0.03 0.00 0.00 56.01 51.23 1p7a n LEU 36 Cb 0.35 0.64 0.75 0.00 -2.33 0.00 0.00 43.42 42.83 1p7a n LEU 36 CO 0.39 2.23 1.00 1.33 -1.33 0.00 0.00 177.39 181.01