#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 -3.78 -4.67 1.61 7.64 -1.26 -4.92 113.62 108.23 1p7a n SER 2 Ca 0.00 -0.64 -0.42 0.00 1.01 0.00 0.00 58.87 58.82 1p7a n SER 2 Cb 0.00 -4.81 -0.03 0.00 -1.01 0.00 0.00 64.21 58.36 1p7a n SER 2 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1p7a s THR 3 N -3.38 3.87 -1.24 0.44 2.01 -1.26 -3.13 115.64 112.95 1p7a s THR 3 Ca 0.28 1.12 -0.05 0.00 0.31 0.00 0.00 61.69 63.35 1p7a s THR 3 Cb -0.13 -3.72 -0.01 0.00 0.01 0.00 0.00 72.50 68.65 1p7a s THR 3 CO 0.75 -0.07 0.76 0.54 -0.69 0.00 0.00 174.62 175.91 1p7a n ARG 4 N 6.42 -3.94 0.00 4.92 5.12 -1.26 -1.80 116.66 126.12 1p7a n ARG 4 Ca 0.15 0.63 0.00 0.00 -1.93 0.00 0.00 57.85 56.70 1p7a n ARG 4 Cb 0.44 -5.10 0.00 0.00 -1.16 0.00 0.00 32.46 26.64 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 -1.53 1.54 0.32 -0.13 0.00 -1.18 -1.65 105.19 102.56 1p7a n GLY 5 Ca -0.23 0.13 0.02 0.00 0.00 0.00 0.00 46.02 45.94 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 7.30 0.62 -3.32 1.61 7.64 -1.25 -4.38 113.62 121.83 1p7a n SER 6 Ca 0.00 -2.12 -0.26 0.00 1.01 0.00 0.00 58.87 57.51 1p7a n SER 6 Cb 0.00 -0.22 -0.08 0.00 -1.01 0.00 0.00 64.21 62.90 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 -0.35 -0.52 0.00 0.44 -2.24 -0.66 -4.49 114.28 106.46 1p7a n THR 7 Ca 0.04 -3.94 0.00 0.00 -2.27 0.00 0.00 64.05 57.88 1p7a n THR 7 Cb 0.64 -1.87 0.00 0.00 -2.10 0.00 0.00 70.33 67.00 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 1.92 0.64 3.85 3.38 0.00 -0.74 -4.65 105.19 109.59 1p7a n GLY 8 Ca 0.25 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 0.00 4.52 0.51 -0.61 1.01 -1.26 -4.89 121.20 120.47 1p7a s ILE 9 Ca 0.00 0.96 0.00 0.00 0.00 0.00 0.00 60.65 61.61 1p7a s ILE 9 Cb 0.00 -3.74 0.00 0.00 0.01 0.00 0.00 42.46 38.73 1p7a s ILE 9 CO 0.00 -0.93 0.00 0.29 0.00 0.00 0.00 174.94 174.30 1p7a n LYS 10 N -2.37 -3.69 0.31 2.79 5.02 -1.26 -4.13 118.16 114.82 1p7a n LYS 10 Ca 0.07 2.85 0.17 0.00 -2.02 0.00 0.00 58.31 59.37 1p7a n LYS 10 Cb 0.54 -3.58 0.99 0.00 -0.02 0.00 0.00 35.03 32.96 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 0.38 0.00 -3.18 1.97 0.13 -1.88 -3.35 132.00 126.07 1p7a h PRO 11 Ca 0.00 0.00 -0.60 0.00 -0.87 0.00 0.00 66.00 64.53 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 -0.75 -0.06 -0.23 0.00 0.00 178.00 176.97 1p7a s PHE 12 N -4.44 1.82 0.29 1.56 0.08 -0.99 -5.00 117.98 111.30 1p7a s PHE 12 Ca -0.05 -2.14 0.06 0.00 0.12 0.00 0.00 56.93 54.92 1p7a s PHE 12 Cb 0.14 -1.77 -0.02 0.00 -0.57 0.00 0.00 43.02 40.80 1p7a s PHE 12 CO 0.51 -0.82 0.42 1.14 -0.10 0.00 0.00 175.22 176.36 1p7a s GLN 13 N 0.85 3.28 0.01 0.44 -2.07 -1.26 0.19 119.66 121.10 1p7a s GLN 13 Ca 0.15 -0.89 -0.30 0.00 -1.82 0.00 0.00 55.36 52.50 1p7a s GLN 13 Cb -0.22 -2.86 -0.04 0.00 -1.09 0.00 0.00 33.01 28.80 1p7a s GLN 13 CO -0.08 0.24 1.14 0.00 -1.32 0.00 0.00 175.29 175.27 1p7a n PRO 15 N 4.28 0.60 -0.07 0.00 -0.04 -1.26 -0.98 135.00 137.53 1p7a n PRO 15 Ca 0.09 0.01 -0.09 0.00 -0.04 0.00 0.00 63.50 63.46 1p7a n PRO 15 Cb 0.47 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.37 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 -1.18 2.94 -0.05 3.54 8.00 -1.26 -4.71 116.55 123.83 1p7a n ASP 16 Ca 0.17 -0.07 -0.12 0.00 0.71 0.00 0.00 54.79 55.47 1p7a n ASP 16 Cb 0.18 -0.21 -0.14 0.00 -0.02 0.00 0.00 41.12 40.92 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 -3.06 -2.39 -3.02 0.00 -0.08 -0.15 -4.76 116.55 103.09 1p7a n ASP 18 Ca -0.28 -0.05 0.00 0.00 -1.51 0.00 0.00 54.79 52.95 1p7a n ASP 18 Cb 1.08 -0.98 0.00 0.00 2.34 0.00 0.00 41.12 43.56 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 -1.00 0.93 -3.55 -0.67 1.74 -1.21 -4.78 116.66 108.13 1p7a n ARG 19 Ca -0.00 0.00 -0.01 0.00 -0.77 0.00 0.00 57.85 57.07 1p7a n ARG 19 Cb 0.51 0.00 -0.05 0.00 -1.02 0.00 0.00 32.46 31.90 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 -1.08 -0.81 -0.00 0.55 1.04 -1.26 -3.37 113.70 108.78 1p7a s SER 20 Ca 0.00 1.15 0.02 0.00 0.48 0.00 0.00 55.95 57.60 1p7a s SER 20 Cb 0.00 1.80 -0.01 0.00 0.10 0.00 0.00 66.02 67.91 1p7a s SER 20 CO 0.00 -0.17 -0.07 -0.36 0.98 0.00 0.00 173.24 173.62 1p7a s PHE 21 N 2.38 0.66 -0.09 5.02 0.40 0.13 -4.96 117.98 121.52 1p7a s PHE 21 Ca -0.05 -0.14 0.16 0.00 -0.60 0.00 0.00 56.93 56.29 1p7a s PHE 21 Cb -0.08 -0.42 0.20 0.00 0.51 0.00 0.00 43.02 43.23 1p7a s PHE 21 CO -0.18 -0.01 1.51 0.66 0.70 0.00 0.00 175.22 177.89 1p7a h SER 22 N 5.88 0.00 -3.57 1.36 4.64 -1.96 -2.63 113.55 117.27 1p7a h SER 22 Ca -0.30 0.00 -0.67 0.00 -0.47 0.00 0.00 61.79 60.35 1p7a h SER 22 Cb 1.19 0.00 -0.27 0.00 -0.31 0.00 0.00 62.40 63.00 1p7a h SER 22 CO 0.49 0.48 -0.80 -0.13 -0.87 0.00 0.00 176.83 176.01 1p7a s ARG 23 N -3.09 3.04 0.49 4.77 0.52 -1.26 -4.76 118.95 118.66 1p7a s ARG 23 Ca 0.03 -0.74 0.22 0.00 -0.52 0.00 0.00 55.73 54.72 1p7a s ARG 23 Cb 0.08 -2.47 1.26 0.00 0.52 0.00 0.00 34.95 34.34 1p7a s ARG 23 CO 0.73 0.32 2.03 1.03 0.02 0.00 0.00 175.30 179.44 1p7a h SER 24 N 6.32 0.00 -0.77 0.23 0.87 -1.91 -1.90 113.55 116.38 1p7a h SER 24 Ca -0.30 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.25 1p7a h SER 24 Cb 1.20 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 63.12 1p7a h SER 24 CO 0.52 0.16 0.45 -0.78 -0.53 0.00 0.00 176.83 176.65 1p7a h ASP 25 N 0.00 0.95 0.08 6.23 1.82 -1.98 0.50 116.42 124.01 1p7a h ASP 25 Ca -0.00 -0.08 -0.14 0.00 -0.39 0.00 0.00 57.03 56.42 1p7a h ASP 25 Cb 0.35 -0.24 -0.01 0.00 0.68 0.00 0.00 39.33 40.11 1p7a h ASP 25 CO 0.02 0.75 -0.49 0.45 -1.61 0.00 0.00 179.24 178.36 1p7a h HIS 26 N 1.06 0.57 0.57 0.28 3.86 -1.78 -2.10 115.15 117.62 1p7a h HIS 26 Ca 0.28 -0.19 -0.02 0.00 -1.16 0.00 0.00 60.37 59.28 1p7a h HIS 26 Cb -0.01 -0.12 -0.02 0.00 1.06 0.00 0.00 27.41 28.33 1p7a h HIS 26 CO -0.00 0.87 -0.48 1.25 0.86 0.00 0.00 177.93 180.42 1p7a h LEU 27 N 0.37 -1.29 -1.14 2.43 5.85 -0.89 -2.53 115.31 118.11 1p7a h LEU 27 Ca 0.02 0.09 0.11 0.00 0.84 0.00 0.00 57.88 58.94 1p7a h LEU 27 Cb 0.99 0.41 -0.07 0.00 0.37 0.00 0.00 40.66 42.36 1p7a h LEU 27 CO 0.09 -0.67 0.60 0.00 -0.34 0.00 0.00 178.44 178.12 1p7a h ALA 28 N -1.04 1.61 -0.13 1.25 0.00 -0.85 0.25 119.26 120.36 1p7a h ALA 28 Ca -0.07 0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.86 1p7a h ALA 28 Cb 0.87 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 1p7a h ALA 28 CO -0.01 0.18 -0.02 -0.07 0.00 0.00 0.00 179.25 179.34 1p7a h LEU 29 N 0.92 -0.09 -0.94 0.00 3.38 -1.14 -1.76 115.31 115.67 1p7a h LEU 29 Ca 0.44 0.03 -0.11 0.00 0.09 0.00 0.00 57.88 58.34 1p7a h LEU 29 Cb 0.45 0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.25 1p7a h LEU 29 CO -0.21 -0.03 -0.52 1.12 0.09 0.00 0.00 178.44 178.90 1p7a h HIS 30 N 0.02 0.03 0.00 1.13 2.07 -1.00 -2.73 115.15 114.67 1p7a h HIS 30 Ca 0.06 -0.01 0.00 0.00 -2.85 0.00 0.00 60.37 57.57 1p7a h HIS 30 Cb 0.08 -0.01 0.00 0.00 2.57 0.00 0.00 27.41 30.06 1p7a h HIS 30 CO -0.16 0.54 0.00 0.54 -3.07 0.00 0.00 177.93 175.78 1p7a n ARG 31 N -3.92 0.75 0.22 5.12 1.74 0.03 -1.64 116.66 118.96 1p7a n ARG 31 Ca -0.01 0.00 0.09 0.00 -0.77 0.00 0.00 57.85 57.15 1p7a n ARG 31 Cb 0.53 -1.46 0.52 0.00 -1.02 0.00 0.00 32.46 31.03 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 -1.07 0.55 116.57 128.17 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 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.66 1p7a h LYS 32 CO 0.00 0.24 0.00 0.54 -2.06 0.00 0.00 179.45 178.17 1p7a n ARG 33 N -3.66 0.40 0.00 3.15 5.12 -0.65 -1.72 116.66 119.31 1p7a n ARG 33 Ca -0.01 0.03 0.11 0.00 -1.93 0.00 0.00 57.85 56.06 1p7a n ARG 33 Cb 0.37 -1.50 0.04 0.00 -1.16 0.00 0.00 32.46 30.21 1p7a n ARG 33 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 1p7a n HIS 34 N -1.27 0.00 -0.03 -1.55 8.25 0.17 -2.45 115.22 118.34 1p7a n HIS 34 Ca 0.13 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.37 1p7a n HIS 34 Cb 0.20 -0.02 -0.13 0.00 1.12 0.00 0.00 29.99 31.17 1p7a n HIS 34 CO 0.00 0.00 0.00 0.52 0.64 0.00 0.00 176.34 177.50 1p7a h MET 35 N 2.19 0.17 -3.01 -0.41 2.86 -1.21 -3.41 114.93 112.12 1p7a h MET 35 Ca 0.00 -0.30 -0.62 0.00 -2.06 0.00 0.00 59.70 56.72 1p7a h MET 35 Cb 0.72 0.11 -0.41 0.00 0.06 0.00 0.00 31.60 32.07 1p7a h MET 35 CO 0.00 1.14 -0.64 -0.51 1.06 0.00 0.00 176.91 177.96 1p7a s LEU 36 N -7.48 4.16 0.00 1.22 1.43 -1.04 -5.14 118.68 111.83 1p7a s LEU 36 Ca -0.23 -3.57 0.24 0.00 -1.03 0.00 0.00 54.13 49.53 1p7a s LEU 36 Cb 0.06 -1.43 1.42 0.00 0.03 0.00 0.00 46.19 46.26 1p7a s LEU 36 CO 0.71 -0.12 1.79 0.52 0.23 0.00 0.00 176.35 179.47