#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 -0.58 -0.09 1.61 0.01 -1.26 -4.47 113.70 108.91 1p7a s SER 2 Ca 0.00 0.36 0.00 0.00 1.31 0.00 0.00 55.95 57.62 1p7a s SER 2 Cb 0.00 1.62 -0.06 0.00 0.21 0.00 0.00 66.02 67.79 1p7a s SER 2 CO 0.00 -0.29 -0.09 0.41 0.41 0.00 0.00 173.24 173.68 1p7a n THR 3 N 5.39 0.54 -2.78 1.44 -1.04 -1.26 -4.83 114.28 111.74 1p7a n THR 3 Ca -0.01 -0.20 -0.10 0.00 -2.04 0.00 0.00 64.05 61.70 1p7a n THR 3 Cb 0.51 -0.91 0.06 0.00 -1.82 0.00 0.00 70.33 68.17 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 -2.84 1.10 0.00 -2.82 1.74 -1.26 -4.86 116.66 107.72 1p7a n ARG 4 Ca -0.17 -2.51 0.00 0.00 -0.77 0.00 0.00 57.85 54.41 1p7a n ARG 4 Cb 0.67 -0.88 0.00 0.00 -1.02 0.00 0.00 32.46 31.23 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 -0.08 2.32 0.05 -0.13 0.00 -1.26 -2.34 105.19 103.74 1p7a n GLY 5 Ca 0.07 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1p7a n GLY 5 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1p7a n SER 6 N 4.46 0.00 -3.33 1.61 3.41 -1.26 -4.66 113.62 113.85 1p7a n SER 6 Ca 0.00 -1.05 -0.26 0.00 -0.26 0.00 0.00 58.87 57.30 1p7a n SER 6 Cb 0.00 -0.01 -0.08 0.00 -0.26 0.00 0.00 64.21 63.86 1p7a n SER 6 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1p7a n THR 7 N 0.00 -0.37 0.00 6.66 -2.24 -0.99 -3.84 114.28 113.50 1p7a n THR 7 Ca 0.00 -4.01 0.00 0.00 -2.27 0.00 0.00 64.05 57.77 1p7a n THR 7 Cb 0.51 -1.89 0.00 0.00 -2.10 0.00 0.00 70.33 66.85 1p7a n THR 7 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1p7a n GLY 8 N 1.84 0.13 3.86 3.38 0.00 -1.26 -4.35 105.19 108.79 1p7a n GLY 8 Ca 0.25 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.96 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 0.62 4.25 0.58 -0.61 1.01 -1.26 -4.94 121.20 120.85 1p7a s ILE 9 Ca 0.00 0.73 0.00 0.00 0.00 0.00 0.00 60.65 61.38 1p7a s ILE 9 Cb 0.00 -3.66 0.00 0.00 0.01 0.00 0.00 42.46 38.81 1p7a s ILE 9 CO 0.00 -0.96 0.00 0.29 0.00 0.00 0.00 174.94 174.27 1p7a n LYS 10 N -2.91 -4.36 0.30 2.79 5.02 -1.26 -4.29 118.16 113.45 1p7a n LYS 10 Ca 0.07 3.33 0.19 0.00 -2.02 0.00 0.00 58.31 59.87 1p7a n LYS 10 Cb 0.55 -4.02 0.88 0.00 -0.02 0.00 0.00 35.03 32.42 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 0.74 0.00 -3.00 1.97 0.13 -1.92 -3.33 132.00 126.58 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 0.62 0.00 -0.41 0.00 0.13 0.00 0.00 31.00 31.34 1p7a h PRO 11 CO 0.00 0.02 -0.64 -0.06 -0.23 0.00 0.00 178.00 177.09 1p7a s PHE 12 N -3.89 3.14 0.24 1.56 0.08 -1.12 -5.05 117.98 112.94 1p7a s PHE 12 Ca -0.01 -3.16 0.06 0.00 0.12 0.00 0.00 56.93 53.94 1p7a s PHE 12 Cb 0.11 -2.44 -0.03 0.00 -0.57 0.00 0.00 43.02 40.09 1p7a s PHE 12 CO 0.50 -0.61 0.27 1.14 -0.10 0.00 0.00 175.22 176.42 1p7a s GLN 13 N -1.10 3.16 -0.14 0.44 0.00 -1.25 -0.28 119.66 120.48 1p7a s GLN 13 Ca 0.25 -0.90 -0.29 0.00 -0.00 0.00 0.00 55.36 54.41 1p7a s GLN 13 Cb -0.06 -2.72 -0.02 0.00 0.00 0.00 0.00 33.01 30.22 1p7a s GLN 13 CO -0.15 0.42 1.27 0.00 0.00 0.00 0.00 175.29 176.83 1p7a n PRO 15 N 6.31 0.77 -0.05 0.00 -0.04 -1.25 0.30 135.00 141.04 1p7a n PRO 15 Ca 0.13 0.00 -0.05 0.00 -0.04 0.00 0.00 63.50 63.55 1p7a n PRO 15 Cb 0.45 -1.31 -0.09 0.00 -0.04 0.00 0.00 33.50 32.51 1p7a n PRO 15 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1p7a n ASP 16 N -0.81 2.23 -0.02 3.54 8.00 -1.26 -4.78 116.55 123.44 1p7a n ASP 16 Ca 0.12 0.00 -0.02 0.00 0.71 0.00 0.00 54.79 55.60 1p7a n ASP 16 Cb 0.05 0.83 -0.02 0.00 -0.02 0.00 0.00 41.12 41.96 1p7a n ASP 16 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1p7a n ASP 18 N -2.25 -2.00 -2.43 0.00 -0.08 0.15 0.52 116.55 110.45 1p7a n ASP 18 Ca -0.05 -0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.22 1p7a n ASP 18 Cb 0.59 -0.52 0.00 0.00 2.34 0.00 0.00 41.12 43.53 1p7a n ASP 18 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 1p7a n ARG 19 N -0.99 2.32 -3.59 -0.67 5.12 -1.23 -4.22 116.66 113.39 1p7a n ARG 19 Ca -0.00 0.00 -0.02 0.00 -1.93 0.00 0.00 57.85 55.90 1p7a n ARG 19 Cb 0.50 0.00 -0.05 0.00 -1.16 0.00 0.00 32.46 31.75 1p7a n ARG 19 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 1p7a s SER 20 N -1.00 -0.93 -0.02 0.55 1.04 -1.26 -4.00 113.70 108.08 1p7a s SER 20 Ca 0.00 1.32 0.02 0.00 0.48 0.00 0.00 55.95 57.77 1p7a s SER 20 Cb 0.00 1.90 0.00 0.00 0.10 0.00 0.00 66.02 68.03 1p7a s SER 20 CO 0.00 -0.19 -0.07 -0.36 0.98 0.00 0.00 173.24 173.60 1p7a s PHE 21 N 2.44 0.76 -0.54 5.02 0.40 0.61 -4.96 117.98 121.72 1p7a s PHE 21 Ca -0.06 -0.17 0.24 0.00 -0.60 0.00 0.00 56.93 56.34 1p7a s PHE 21 Cb -0.09 -0.55 0.54 0.00 0.51 0.00 0.00 43.02 43.43 1p7a s PHE 21 CO -0.18 -0.08 1.68 0.66 0.70 0.00 0.00 175.22 177.99 1p7a h SER 22 N 6.38 0.00 -3.32 1.36 4.64 -1.97 -2.97 113.55 117.68 1p7a h SER 22 Ca -0.33 0.00 -0.67 0.00 -0.47 0.00 0.00 61.79 60.32 1p7a h SER 22 Cb 1.17 0.00 -0.32 0.00 -0.31 0.00 0.00 62.40 62.94 1p7a h SER 22 CO 0.49 0.00 -0.86 -0.13 -0.87 0.00 0.00 176.83 175.46 1p7a s ARG 23 N -3.18 3.11 0.53 4.77 0.52 -1.26 -4.85 118.95 118.59 1p7a s ARG 23 Ca 0.08 -0.84 0.19 0.00 -0.52 0.00 0.00 55.73 54.64 1p7a s ARG 23 Cb 0.08 -2.39 1.34 0.00 0.52 0.00 0.00 34.95 34.50 1p7a s ARG 23 CO 0.64 0.15 2.12 0.66 0.02 0.00 0.00 175.30 178.89 1p7a h SER 24 N 6.82 0.00 -0.19 0.23 4.64 -1.90 -1.61 113.55 121.54 1p7a h SER 24 Ca -0.22 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.08 1p7a h SER 24 Cb 1.23 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.31 1p7a h SER 24 CO 0.50 0.00 0.06 -0.78 -0.87 0.00 0.00 176.83 175.74 1p7a h ASP 25 N 0.00 0.28 0.08 4.97 3.58 -1.98 -2.41 116.42 120.93 1p7a h ASP 25 Ca 0.05 -0.20 -0.05 0.00 0.42 0.00 0.00 57.03 57.25 1p7a h ASP 25 Cb 0.22 -0.07 -0.01 0.00 1.72 0.00 0.00 39.33 41.19 1p7a h ASP 25 CO -0.00 0.40 -0.17 0.45 -2.88 0.00 0.00 179.24 177.04 1p7a h HIS 26 N 0.14 0.20 0.53 0.28 3.86 -1.74 -1.23 115.15 117.18 1p7a h HIS 26 Ca 0.06 -0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.23 1p7a h HIS 26 Cb 0.22 -0.05 -0.02 0.00 1.06 0.00 0.00 27.41 28.62 1p7a h HIS 26 CO -0.00 0.35 -0.49 1.25 0.86 0.00 0.00 177.93 179.90 1p7a h LEU 27 N 0.18 -1.34 -1.38 2.43 5.85 -1.10 -1.57 115.31 118.38 1p7a h LEU 27 Ca 0.03 0.10 0.10 0.00 0.84 0.00 0.00 57.88 58.95 1p7a h LEU 27 Cb 0.41 0.43 -0.05 0.00 0.37 0.00 0.00 40.66 41.82 1p7a h LEU 27 CO 0.03 -0.66 0.51 0.00 -0.34 0.00 0.00 178.44 177.97 1p7a h ALA 28 N -0.97 1.80 -0.65 1.25 0.00 -1.05 0.59 119.26 120.22 1p7a h ALA 28 Ca -0.07 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1p7a h ALA 28 Cb 0.87 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 1p7a h ALA 28 CO -0.04 0.04 0.37 -0.07 0.00 0.00 0.00 179.25 179.55 1p7a h LEU 29 N 0.69 0.81 -0.42 0.00 3.38 -0.77 -0.93 115.31 118.07 1p7a h LEU 29 Ca 0.36 -0.09 -0.18 0.00 0.09 0.00 0.00 57.88 58.06 1p7a h LEU 29 Cb 0.47 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.01 1p7a h LEU 29 CO -0.13 0.66 -0.65 -0.74 0.09 0.00 0.00 178.44 177.67 1p7a h HIS 30 N 0.89 0.70 0.00 1.13 -0.00 -0.36 -3.01 115.15 114.50 1p7a h HIS 30 Ca 0.23 -0.28 0.00 0.00 -0.00 0.00 0.00 60.37 60.32 1p7a h HIS 30 Cb 0.02 -0.12 0.00 0.00 -0.00 0.00 0.00 27.41 27.32 1p7a h HIS 30 CO -0.01 1.04 0.00 0.54 -0.00 0.00 0.00 177.93 179.50 1p7a n ARG 31 N -3.91 0.57 0.26 5.26 1.74 0.11 -2.30 116.66 118.39 1p7a n ARG 31 Ca -0.04 0.03 0.12 0.00 -0.77 0.00 0.00 57.85 57.18 1p7a n ARG 31 Cb 0.67 -1.50 0.72 0.00 -1.02 0.00 0.00 32.46 31.32 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 0.00 -0.00 5.56 6.56 -1.05 1.00 116.57 128.64 1p7a h LYS 32 Ca 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 1p7a h LYS 32 Cb 0.08 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.74 1p7a h LYS 32 CO 0.00 0.11 -0.03 0.54 -2.06 0.00 0.00 179.45 178.01 1p7a n ARG 33 N -3.85 0.22 -0.21 3.15 1.74 -0.97 -3.04 116.66 113.70 1p7a n ARG 33 Ca -0.02 -0.02 0.12 0.00 -0.77 0.00 0.00 57.85 57.16 1p7a n ARG 33 Cb 0.20 -1.50 0.24 0.00 -1.02 0.00 0.00 32.46 30.39 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 -1.38 0.56 0.00 -1.55 8.25 0.34 -3.47 115.22 117.97 1p7a n HIS 34 Ca 0.10 -0.28 0.00 0.00 -0.26 0.00 0.00 57.72 57.29 1p7a n HIS 34 Cb 0.30 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.41 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 1.43 0.00 -2.83 -0.41 2.81 -1.17 -4.76 117.12 112.19 1p7a n MET 35 Ca 0.20 0.44 -0.12 0.00 -1.81 0.00 0.00 57.70 56.41 1p7a n MET 35 Cb 0.59 -0.94 0.01 0.00 -0.71 0.00 0.00 33.22 32.17 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 -1.91 1.11 0.00 4.03 4.32 -1.26 -5.17 117.00 118.11 1p7a n LEU 36 Ca 0.00 -4.12 0.00 0.00 -0.02 0.00 0.00 56.01 51.87 1p7a n LEU 36 Cb 0.00 0.52 0.00 0.00 -1.62 0.00 0.00 43.42 42.32 1p7a n LEU 36 CO 0.00 1.81 0.00 0.52 -1.22 0.00 0.00 177.39 178.50