#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 0.42 -0.16 1.61 1.04 -1.26 -3.78 113.70 111.57 1p7a s SER 2 Ca 0.00 -0.22 0.19 0.00 0.48 0.00 0.00 55.95 56.40 1p7a s SER 2 Cb 0.00 1.08 -0.27 0.00 0.10 0.00 0.00 66.02 66.93 1p7a s SER 2 CO 0.00 -0.34 0.17 0.35 0.98 0.00 0.00 173.24 174.40 1p7a n THR 3 N 5.35 1.11 -2.76 2.02 -2.24 -1.26 -4.59 114.28 111.91 1p7a n THR 3 Ca -0.01 -0.78 -0.10 0.00 -2.27 0.00 0.00 64.05 60.89 1p7a n THR 3 Cb 0.49 -0.38 0.04 0.00 -2.10 0.00 0.00 70.33 68.39 1p7a n THR 3 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1p7a n ARG 4 N -2.66 1.11 -1.93 -0.78 5.12 -1.26 -4.91 116.66 111.36 1p7a n ARG 4 Ca -0.27 -2.94 -0.11 0.00 -1.93 0.00 0.00 57.85 52.60 1p7a n ARG 4 Cb 1.04 -1.09 -0.02 0.00 -1.16 0.00 0.00 32.46 31.23 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 -0.08 0.32 2.59 -0.13 0.00 -1.26 -1.93 105.19 104.71 1p7a n GLY 5 Ca 0.09 -0.46 -0.04 0.00 0.00 0.00 0.00 46.02 45.62 1p7a n GLY 5 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1p7a n SER 6 N 0.02 -4.90 -3.30 1.61 7.64 -1.26 -4.89 113.62 108.53 1p7a n SER 6 Ca -0.12 0.10 -0.25 0.00 1.01 0.00 0.00 58.87 59.60 1p7a n SER 6 Cb 0.52 -2.74 -0.08 0.00 -1.01 0.00 0.00 64.21 60.90 1p7a n SER 6 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1p7a n THR 7 N -2.41 -0.41 0.00 0.44 -2.24 -0.81 -3.76 114.28 105.09 1p7a n THR 7 Ca -0.04 -4.02 0.00 0.00 -2.27 0.00 0.00 64.05 57.72 1p7a n THR 7 Cb 0.37 -1.90 0.00 0.00 -2.10 0.00 0.00 70.33 66.70 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 1.77 0.37 3.87 3.38 0.00 -1.26 -4.78 105.19 108.54 1p7a n GLY 8 Ca 0.24 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.95 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 0.59 4.55 0.60 -0.61 1.01 -1.26 -4.93 121.20 121.14 1p7a s ILE 9 Ca 0.00 0.83 0.00 0.00 0.00 0.00 0.00 60.65 61.48 1p7a s ILE 9 Cb 0.00 -3.80 0.00 0.00 0.01 0.00 0.00 42.46 38.67 1p7a s ILE 9 CO 0.00 -1.08 0.00 0.29 0.00 0.00 0.00 174.94 174.15 1p7a n LYS 10 N -2.80 -4.43 0.30 2.79 5.02 -1.26 -4.30 118.16 113.48 1p7a n LYS 10 Ca 0.06 3.39 0.19 0.00 -2.02 0.00 0.00 58.31 59.94 1p7a n LYS 10 Cb 0.54 -4.11 0.92 0.00 -0.02 0.00 0.00 35.03 32.35 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 0.63 0.00 -2.87 1.97 0.13 -1.90 -3.35 132.00 126.61 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 0.71 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.44 1p7a h PRO 11 CO 0.00 0.01 -0.74 -0.06 -0.23 0.00 0.00 178.00 176.99 1p7a s PHE 12 N -3.93 2.36 0.27 1.56 0.08 -1.13 -5.05 117.98 112.15 1p7a s PHE 12 Ca -0.02 -2.76 0.08 0.00 0.12 0.00 0.00 56.93 54.36 1p7a s PHE 12 Cb 0.11 -1.96 -0.04 0.00 -0.57 0.00 0.00 43.02 40.57 1p7a s PHE 12 CO 0.49 -0.71 0.14 1.14 -0.10 0.00 0.00 175.22 176.18 1p7a s GLN 13 N -0.40 2.65 -0.06 0.44 0.00 -1.26 -0.46 119.66 120.57 1p7a s GLN 13 Ca 0.24 -1.25 -0.30 0.00 -0.00 0.00 0.00 55.36 54.06 1p7a s GLN 13 Cb -0.10 -2.39 -0.04 0.00 0.00 0.00 0.00 33.01 30.49 1p7a s GLN 13 CO -0.11 0.33 1.32 0.00 0.00 0.00 0.00 175.29 176.82 1p7a n PRO 15 N 5.71 0.88 -0.07 0.00 -0.04 -1.25 0.22 135.00 140.45 1p7a n PRO 15 Ca 0.13 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.47 1p7a n PRO 15 Cb 0.45 -1.33 -0.06 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 -0.83 2.41 -0.09 3.54 9.92 -1.26 -4.76 116.55 125.46 1p7a n ASP 16 Ca 0.14 -0.01 -0.10 0.00 -0.53 0.00 0.00 54.79 54.29 1p7a n ASP 16 Cb 0.06 -0.28 -0.14 0.00 -0.64 0.00 0.00 41.12 40.13 1p7a n ASP 16 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1p7a n ASP 18 N -2.78 -2.13 -1.37 0.00 -0.08 0.13 -4.13 116.55 106.20 1p7a n ASP 18 Ca -0.32 -0.08 0.00 0.00 -1.51 0.00 0.00 54.79 52.88 1p7a n ASP 18 Cb 1.06 -1.05 0.00 0.00 2.34 0.00 0.00 41.12 43.46 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 -1.45 3.44 -3.53 -0.67 1.74 -1.24 -4.83 116.66 110.12 1p7a n ARG 19 Ca -0.03 0.00 -0.01 0.00 -0.77 0.00 0.00 57.85 57.04 1p7a n ARG 19 Cb 0.52 0.00 -0.05 0.00 -1.02 0.00 0.00 32.46 31.91 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 -1.00 -0.72 -0.01 0.55 1.04 -1.26 -4.18 113.70 108.12 1p7a s SER 20 Ca 0.00 1.04 0.02 0.00 0.48 0.00 0.00 55.95 57.49 1p7a s SER 20 Cb 0.00 1.68 -0.00 0.00 0.10 0.00 0.00 66.02 67.79 1p7a s SER 20 CO 0.00 -0.15 -0.08 -0.36 0.98 0.00 0.00 173.24 173.63 1p7a s PHE 21 N 2.22 0.76 0.02 5.02 0.40 0.39 -4.95 117.98 121.85 1p7a s PHE 21 Ca -0.05 -0.16 0.20 0.00 -0.60 0.00 0.00 56.93 56.31 1p7a s PHE 21 Cb -0.07 -0.53 0.55 0.00 0.51 0.00 0.00 43.02 43.49 1p7a s PHE 21 CO -0.17 -0.05 1.67 0.77 0.70 0.00 0.00 175.22 178.13 1p7a h SER 22 N 6.17 0.00 -3.70 1.36 0.02 -1.97 -2.99 113.55 112.44 1p7a h SER 22 Ca -0.32 0.00 -0.68 0.00 -0.84 0.00 0.00 61.79 59.96 1p7a h SER 22 Cb 1.18 0.00 -0.23 0.00 0.14 0.00 0.00 62.40 63.49 1p7a h SER 22 CO 0.49 0.34 -0.74 -0.13 -1.14 0.00 0.00 176.83 175.65 1p7a s ARG 23 N -3.39 2.89 0.48 3.45 0.52 -1.26 -4.78 118.95 116.86 1p7a s ARG 23 Ca 0.02 -0.65 0.22 0.00 -0.52 0.00 0.00 55.73 54.80 1p7a s ARG 23 Cb 0.09 -2.54 1.22 0.00 0.52 0.00 0.00 34.95 34.25 1p7a s ARG 23 CO 0.69 0.49 2.01 0.66 0.02 0.00 0.00 175.30 179.17 1p7a h SER 24 N 5.80 0.00 -0.63 0.23 4.64 -1.89 -0.83 113.55 120.87 1p7a h SER 24 Ca -0.40 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 60.84 1p7a h SER 24 Cb 1.18 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.24 1p7a h SER 24 CO 0.53 0.17 0.08 -0.78 -0.87 0.00 0.00 176.83 175.97 1p7a h ASP 25 N 0.00 1.02 -0.11 4.97 3.58 -1.98 -1.76 116.42 122.15 1p7a h ASP 25 Ca -0.00 -0.27 -0.09 0.00 0.42 0.00 0.00 57.03 57.08 1p7a h ASP 25 Cb 0.39 -0.27 -0.01 0.00 1.72 0.00 0.00 39.33 41.16 1p7a h ASP 25 CO 0.02 1.03 -0.23 0.45 -2.88 0.00 0.00 179.24 177.64 1p7a h HIS 26 N 0.96 0.60 0.32 0.28 3.86 -1.60 -1.58 115.15 118.00 1p7a h HIS 26 Ca 0.19 -0.12 -0.01 0.00 -1.16 0.00 0.00 60.37 59.27 1p7a h HIS 26 Cb 0.46 -0.15 -0.01 0.00 1.06 0.00 0.00 27.41 28.77 1p7a h HIS 26 CO 0.03 0.72 -0.33 1.25 0.86 0.00 0.00 177.93 180.47 1p7a h LEU 27 N 0.47 -0.90 -1.31 2.43 5.85 -0.87 -2.23 115.31 118.75 1p7a h LEU 27 Ca 0.07 0.07 0.10 0.00 0.84 0.00 0.00 57.88 58.97 1p7a h LEU 27 Cb 0.65 0.30 -0.06 0.00 0.37 0.00 0.00 40.66 41.92 1p7a h LEU 27 CO 0.05 -0.43 0.54 0.00 -0.34 0.00 0.00 178.44 178.25 1p7a h ALA 28 N -1.20 1.74 -0.40 1.25 0.00 -1.20 0.67 119.26 120.12 1p7a h ALA 28 Ca -0.04 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.89 1p7a h ALA 28 Cb 0.56 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 1p7a h ALA 28 CO -0.04 0.08 0.22 -0.07 0.00 0.00 0.00 179.25 179.44 1p7a h LEU 29 N 0.76 0.34 -0.52 0.00 3.38 -1.02 -1.50 115.31 116.76 1p7a h LEU 29 Ca 0.38 0.01 -0.16 0.00 0.09 0.00 0.00 57.88 58.20 1p7a h LEU 29 Cb 0.46 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 1p7a h LEU 29 CO -0.15 0.25 -0.57 -0.74 0.09 0.00 0.00 178.44 177.32 1p7a h HIS 30 N 0.45 0.66 0.00 1.13 -0.00 -0.75 -2.97 115.15 113.66 1p7a h HIS 30 Ca 0.17 -0.24 0.00 0.00 -0.00 0.00 0.00 60.37 60.30 1p7a h HIS 30 Cb 0.04 -0.12 0.00 0.00 -0.00 0.00 0.00 27.41 27.33 1p7a h HIS 30 CO -0.08 0.97 0.00 0.54 -0.00 0.00 0.00 177.93 179.35 1p7a n ARG 31 N -3.95 0.71 0.09 5.26 1.74 0.16 -3.04 116.66 117.63 1p7a n ARG 31 Ca -0.03 0.00 0.04 0.00 -0.77 0.00 0.00 57.85 57.09 1p7a n ARG 31 Cb 0.61 -1.33 0.46 0.00 -1.02 0.00 0.00 32.46 31.18 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 0.34 0.00 5.56 6.56 -1.13 0.10 116.57 128.00 1p7a h LYS 32 Ca 0.00 -0.03 0.00 0.00 -1.06 0.00 0.00 60.65 59.56 1p7a h LYS 32 Cb 0.00 -0.07 0.00 0.00 -0.57 0.00 0.00 32.23 31.59 1p7a h LYS 32 CO 0.00 0.28 0.00 2.89 -2.06 0.00 0.00 179.45 180.56 1p7a n ARG 33 N -4.44 0.45 -0.15 3.15 1.85 -1.17 -2.48 116.66 113.88 1p7a n ARG 33 Ca 0.01 0.02 0.11 0.00 -1.00 0.00 0.00 57.85 56.99 1p7a n ARG 33 Cb 0.12 -1.50 0.18 0.00 -1.05 0.00 0.00 32.46 30.21 1p7a n ARG 33 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 1p7a n HIS 34 N -1.25 0.38 -0.85 2.89 8.25 0.35 -4.16 115.22 120.82 1p7a n HIS 34 Ca 0.14 -0.21 -0.07 0.00 -0.26 0.00 0.00 57.72 57.32 1p7a n HIS 34 Cb 0.21 -0.00 0.27 0.00 1.12 0.00 0.00 29.99 31.59 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 1.37 3.38 -3.23 -0.41 2.81 -1.03 -4.49 117.12 115.51 1p7a n MET 35 Ca 0.17 -2.78 -0.24 0.00 -1.81 0.00 0.00 57.70 53.04 1p7a n MET 35 Cb 0.58 -2.13 -0.07 0.00 -0.71 0.00 0.00 33.22 30.88 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 -0.18 -0.12 -0.34 4.03 4.77 -1.26 -5.13 117.00 118.77 1p7a n LEU 36 Ca 0.39 -4.55 0.15 0.00 -0.03 0.00 0.00 56.01 51.96 1p7a n LEU 36 Cb 1.33 0.62 0.65 0.00 -2.33 0.00 0.00 43.42 43.69 1p7a n LEU 36 CO 0.42 2.01 0.94 0.52 -1.33 0.00 0.00 177.39 179.95