#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 -0.77 -2.55 1.61 7.64 -1.25 -4.88 113.62 113.41 1p7a n SER 2 Ca 0.00 0.00 -0.18 0.00 1.01 0.00 0.00 58.87 59.70 1p7a n SER 2 Cb 0.00 0.00 -0.00 0.00 -1.01 0.00 0.00 64.21 63.20 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 0.00 -0.95 -3.44 0.44 -1.04 -1.15 -4.94 114.28 103.20 1p7a n THR 3 Ca 0.00 0.00 -0.38 0.00 -2.04 0.00 0.00 64.05 61.63 1p7a n THR 3 Cb 0.00 -2.48 -0.09 0.00 -1.82 0.00 0.00 70.33 65.95 1p7a n THR 3 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 1p7a s ARG 4 N -5.18 4.08 1.67 -2.82 0.52 -1.05 -4.80 118.95 111.37 1p7a s ARG 4 Ca 0.06 0.03 0.00 0.00 -0.52 0.00 0.00 55.73 55.30 1p7a s ARG 4 Cb -0.03 -3.60 0.00 0.00 0.52 0.00 0.00 34.95 31.85 1p7a s ARG 4 CO 0.07 -0.14 0.00 0.41 0.02 0.00 0.00 175.30 175.67 1p7a n GLY 5 N 4.37 2.06 3.77 -3.53 0.00 -1.26 -4.72 105.19 105.88 1p7a n GLY 5 Ca -0.10 0.05 -0.39 0.00 0.00 0.00 0.00 46.02 45.58 1p7a n GLY 5 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1p7a s SER 6 N -4.00 7.18 -0.79 1.61 0.15 -1.26 -4.99 113.70 111.60 1p7a s SER 6 Ca 0.00 2.13 0.02 0.00 0.70 0.00 0.00 55.95 58.80 1p7a s SER 6 Cb 0.00 -2.61 0.24 0.00 -1.71 0.00 0.00 66.02 61.94 1p7a s SER 6 CO 0.00 -0.20 0.83 0.35 1.20 0.00 0.00 173.24 175.42 1p7a n THR 7 N 0.83 2.88 -2.67 6.45 -2.24 -1.26 -4.73 114.28 113.54 1p7a n THR 7 Ca 0.01 -5.24 -0.18 0.00 -2.27 0.00 0.00 64.05 56.36 1p7a n THR 7 Cb 0.47 -2.19 0.01 0.00 -2.10 0.00 0.00 70.33 66.52 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 1.51 -0.34 3.85 3.38 0.00 -1.26 -5.00 105.19 107.34 1p7a n GLY 8 Ca 0.25 -0.07 -0.31 0.00 0.00 0.00 0.00 46.02 45.89 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 -3.00 4.31 0.53 -0.61 1.01 -1.26 -4.90 121.20 117.28 1p7a s ILE 9 Ca 0.15 0.75 0.00 0.00 0.00 0.00 0.00 60.65 61.55 1p7a s ILE 9 Cb -0.07 -3.66 0.00 0.00 0.01 0.00 0.00 42.46 38.74 1p7a s ILE 9 CO 0.19 -0.98 0.00 0.29 0.00 0.00 0.00 174.94 174.44 1p7a n LYS 10 N -2.92 -3.89 0.18 2.79 5.02 -1.26 -4.38 118.16 113.70 1p7a n LYS 10 Ca 0.07 2.99 0.13 0.00 -2.02 0.00 0.00 58.31 59.48 1p7a n LYS 10 Cb 0.54 -3.63 0.64 0.00 -0.02 0.00 0.00 35.03 32.56 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 0.53 0.00 -3.25 1.97 0.13 -1.89 -3.36 132.00 126.13 1p7a h PRO 11 Ca 0.00 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.54 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 -0.76 -0.06 -0.23 0.00 0.00 178.00 176.95 1p7a s PHE 12 N -3.55 1.73 0.19 1.56 0.08 -1.08 -5.05 117.98 111.86 1p7a s PHE 12 Ca -0.00 -2.00 0.04 0.00 0.12 0.00 0.00 56.93 55.09 1p7a s PHE 12 Cb 0.08 -1.71 -0.03 0.00 -0.57 0.00 0.00 43.02 40.79 1p7a s PHE 12 CO 0.32 -0.84 0.31 1.14 -0.10 0.00 0.00 175.22 176.05 1p7a s GLN 13 N 1.08 3.41 0.04 0.44 -2.07 -1.26 -0.09 119.66 121.22 1p7a s GLN 13 Ca 0.14 -0.68 -0.30 0.00 -1.82 0.00 0.00 55.36 52.69 1p7a s GLN 13 Cb -0.21 -2.92 -0.06 0.00 -1.09 0.00 0.00 33.01 28.74 1p7a s GLN 13 CO -0.13 0.48 1.30 0.00 -1.32 0.00 0.00 175.29 175.62 1p7a n PRO 15 N 4.52 0.95 -0.05 0.00 -0.04 -1.26 -0.31 135.00 138.81 1p7a n PRO 15 Ca 0.11 0.00 -0.07 0.00 -0.04 0.00 0.00 63.50 63.50 1p7a n PRO 15 Cb 0.45 -1.31 -0.04 0.00 -0.04 0.00 0.00 33.50 32.56 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 -0.81 2.79 -0.08 3.54 -0.08 -1.26 -4.82 116.55 115.84 1p7a n ASP 16 Ca 0.14 -0.02 -0.09 0.00 -1.51 0.00 0.00 54.79 53.32 1p7a n ASP 16 Cb 0.06 -0.17 -0.11 0.00 2.34 0.00 0.00 41.12 43.25 1p7a n ASP 16 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1p7a n ASP 18 N -2.67 -2.05 -2.17 0.00 -0.08 0.57 -2.54 116.55 107.62 1p7a n ASP 18 Ca -0.26 -0.04 0.00 0.00 -1.51 0.00 0.00 54.79 52.98 1p7a n ASP 18 Cb 0.94 -0.83 0.00 0.00 2.34 0.00 0.00 41.12 43.57 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 -1.17 0.24 -3.67 -0.67 1.74 -1.25 -3.98 116.66 107.90 1p7a n ARG 19 Ca -0.02 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 56.97 1p7a n ARG 19 Cb 0.51 0.00 -0.10 0.00 -1.02 0.00 0.00 32.46 31.86 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 -0.53 0.01 0.55 1.04 -1.26 -2.78 113.70 109.74 1p7a s SER 20 Ca 0.00 1.04 0.03 0.00 0.48 0.00 0.00 55.95 57.50 1p7a s SER 20 Cb 0.00 1.10 -0.01 0.00 0.10 0.00 0.00 66.02 67.21 1p7a s SER 20 CO 0.00 -0.21 -0.08 -0.36 0.98 0.00 0.00 173.24 173.56 1p7a s PHE 21 N 1.87 0.74 0.07 5.02 0.40 0.87 -4.97 117.98 121.98 1p7a s PHE 21 Ca -0.07 -0.23 0.14 0.00 -0.60 0.00 0.00 56.93 56.17 1p7a s PHE 21 Cb -0.09 -0.46 0.24 0.00 0.51 0.00 0.00 43.02 43.22 1p7a s PHE 21 CO -0.14 -0.02 1.52 0.77 0.70 0.00 0.00 175.22 178.05 1p7a h SER 22 N 5.54 0.00 -3.50 1.36 0.02 -1.96 -2.85 113.55 112.16 1p7a h SER 22 Ca -0.32 0.00 -0.67 0.00 -0.84 0.00 0.00 61.79 59.96 1p7a h SER 22 Cb 1.19 0.00 -0.19 0.00 0.14 0.00 0.00 62.40 63.54 1p7a h SER 22 CO 0.47 0.60 -0.68 -0.13 -1.14 0.00 0.00 176.83 175.95 1p7a s ARG 23 N -3.20 3.04 0.45 3.45 0.52 -1.26 -4.78 118.95 117.17 1p7a s ARG 23 Ca 0.01 -0.52 0.19 0.00 -0.52 0.00 0.00 55.73 54.89 1p7a s ARG 23 Cb 0.10 -2.71 1.09 0.00 0.52 0.00 0.00 34.95 33.95 1p7a s ARG 23 CO 0.75 0.56 1.97 1.03 0.02 0.00 0.00 175.30 179.63 1p7a h SER 24 N 5.63 0.00 -0.68 0.23 0.87 -1.93 -1.96 113.55 115.72 1p7a h SER 24 Ca -0.44 0.00 -0.08 0.00 -1.23 0.00 0.00 61.79 60.04 1p7a h SER 24 Cb 1.18 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 63.11 1p7a h SER 24 CO 0.55 0.21 0.13 -0.78 -0.53 0.00 0.00 176.83 176.41 1p7a h ASP 25 N 0.00 1.06 0.15 6.23 3.58 -1.98 -1.98 116.42 123.49 1p7a h ASP 25 Ca -0.00 -0.25 -0.12 0.00 0.42 0.00 0.00 57.03 57.08 1p7a h ASP 25 Cb 0.42 -0.28 -0.01 0.00 1.72 0.00 0.00 39.33 41.18 1p7a h ASP 25 CO 0.03 1.04 -0.45 0.45 -2.88 0.00 0.00 179.24 177.43 1p7a h HIS 26 N 1.05 0.44 0.42 0.28 3.86 -1.79 -2.12 115.15 117.28 1p7a h HIS 26 Ca 0.21 -0.13 -0.01 0.00 -1.16 0.00 0.00 60.37 59.28 1p7a h HIS 26 Cb 0.42 -0.09 -0.02 0.00 1.06 0.00 0.00 27.41 28.78 1p7a h HIS 26 CO 0.03 0.75 -0.44 1.25 0.86 0.00 0.00 177.93 180.39 1p7a h LEU 27 N 0.30 -1.19 -1.07 2.43 5.85 -1.03 -2.27 115.31 118.33 1p7a h LEU 27 Ca 0.02 0.10 0.11 0.00 0.84 0.00 0.00 57.88 58.95 1p7a h LEU 27 Cb 0.91 0.40 -0.08 0.00 0.37 0.00 0.00 40.66 42.26 1p7a h LEU 27 CO 0.08 -0.59 0.62 0.00 -0.34 0.00 0.00 178.44 178.21 1p7a h ALA 28 N -0.56 1.56 -0.21 1.25 0.00 -1.22 0.68 119.26 120.75 1p7a h ALA 28 Ca -0.04 0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.91 1p7a h ALA 28 Cb 0.78 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.33 1p7a h ALA 28 CO -0.08 0.22 0.04 -0.07 0.00 0.00 0.00 179.25 179.36 1p7a h LEU 29 N 0.97 -0.00 -0.77 0.00 3.38 -0.98 -1.73 115.31 116.18 1p7a h LEU 29 Ca 0.47 0.03 -0.11 0.00 0.09 0.00 0.00 57.88 58.37 1p7a h LEU 29 Cb 0.46 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 1p7a h LEU 29 CO -0.23 0.03 -0.22 -0.74 0.09 0.00 0.00 178.44 177.37 1p7a h HIS 30 N 0.12 0.78 0.00 1.13 -0.00 -0.82 -2.82 115.15 113.54 1p7a h HIS 30 Ca 0.10 -0.17 0.00 0.00 -0.00 0.00 0.00 60.37 60.30 1p7a h HIS 30 Cb 0.10 -0.19 0.00 0.00 -0.00 0.00 0.00 27.41 27.32 1p7a h HIS 30 CO -0.15 0.85 0.00 0.54 -0.00 0.00 0.00 177.93 179.17 1p7a n ARG 31 N -4.12 0.67 0.21 5.26 1.74 0.17 -2.69 116.66 117.90 1p7a n ARG 31 Ca 0.00 0.00 0.05 0.00 -0.77 0.00 0.00 57.85 57.13 1p7a n ARG 31 Cb 0.42 -1.39 0.47 0.00 -1.02 0.00 0.00 32.46 30.94 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 -1.10 0.13 116.57 127.71 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 0.26 0.00 0.54 -2.06 0.00 0.00 179.45 178.19 1p7a n ARG 33 N -4.10 0.61 0.00 3.15 1.74 -1.09 -2.31 116.66 114.65 1p7a n ARG 33 Ca -0.02 0.01 0.11 0.00 -0.77 0.00 0.00 57.85 57.18 1p7a n ARG 33 Cb 0.32 -1.50 0.07 0.00 -1.02 0.00 0.00 32.46 30.33 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 -1.18 0.00 0.06 -1.55 8.25 0.02 -3.93 115.22 116.88 1p7a n HIS 34 Ca 0.17 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.53 1p7a n HIS 34 Cb 0.19 0.00 -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 3.97 0.08 -3.52 -0.41 2.86 -1.36 -3.39 114.93 113.15 1p7a h MET 35 Ca 0.00 -0.13 -0.62 0.00 -2.06 0.00 0.00 59.70 56.89 1p7a h MET 35 Cb 0.90 0.05 -0.40 0.00 0.06 0.00 0.00 31.60 32.21 1p7a h MET 35 CO 0.00 0.98 -0.72 -0.51 1.06 0.00 0.00 176.91 177.72 1p7a s LEU 36 N -6.72 3.30 0.00 1.22 1.02 -1.25 -5.16 118.68 111.08 1p7a s LEU 36 Ca -0.02 -2.39 0.24 0.00 0.02 0.00 0.00 54.13 51.98 1p7a s LEU 36 Cb 0.09 -1.23 1.42 0.00 0.02 0.00 0.00 46.19 46.49 1p7a s LEU 36 CO 0.84 -0.32 1.78 0.52 0.02 0.00 0.00 176.35 179.19