#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 6.46 -0.94 1.61 0.01 -1.26 -2.50 113.70 117.08 1p7a s SER 2 Ca 0.00 2.70 -0.04 0.00 1.31 0.00 0.00 55.95 59.92 1p7a s SER 2 Cb 0.00 -2.56 -0.05 0.00 0.21 0.00 0.00 66.02 63.62 1p7a s SER 2 CO 0.00 -0.99 0.84 0.41 0.41 0.00 0.00 173.24 173.91 1p7a n THR 3 N 4.83 -9.53 0.25 1.44 -1.04 -1.26 -4.88 114.28 104.08 1p7a n THR 3 Ca 0.18 -0.96 0.13 0.00 -2.04 0.00 0.00 64.05 61.35 1p7a n THR 3 Cb 0.39 -6.67 0.58 0.00 -1.82 0.00 0.00 70.33 62.81 1p7a n THR 3 CO 0.00 0.00 0.00 0.08 -0.64 0.00 0.00 175.07 174.51 1p7a h ARG 4 N -0.54 0.00 0.00 -2.82 0.11 -1.87 -3.42 114.38 105.84 1p7a h ARG 4 Ca -0.39 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.69 1p7a h ARG 4 Cb 1.20 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.28 1p7a h ARG 4 CO 0.39 0.12 0.00 0.41 0.10 0.00 0.00 179.97 180.99 1p7a n GLY 5 N 0.01 -1.95 5.02 0.08 0.00 -1.26 -4.96 105.19 102.12 1p7a n GLY 5 Ca 0.00 0.92 0.00 0.00 0.00 0.00 0.00 46.02 46.94 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 0.00 0.00 -3.60 1.61 7.64 -1.26 -3.82 113.62 114.18 1p7a n SER 6 Ca 0.00 0.00 -0.29 0.00 1.01 0.00 0.00 58.87 59.59 1p7a n SER 6 Cb 0.00 0.00 -0.14 0.00 -1.01 0.00 0.00 64.21 63.06 1p7a n SER 6 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1p7a s THR 7 N 0.00 0.49 0.00 0.44 -4.23 -1.26 -4.77 115.64 106.30 1p7a s THR 7 Ca 0.00 -1.49 0.00 0.00 -1.18 0.00 0.00 61.69 59.02 1p7a s THR 7 Cb 0.00 -1.37 0.00 0.00 1.34 0.00 0.00 72.50 72.47 1p7a s THR 7 CO 0.00 -0.81 0.00 0.61 -0.54 0.00 0.00 174.62 173.88 1p7a n GLY 8 N 4.53 -1.17 3.85 3.99 0.00 -1.25 -4.85 105.19 110.29 1p7a n GLY 8 Ca 0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.73 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 4.47 0.51 -0.61 1.01 -1.26 -4.91 121.20 120.41 1p7a s ILE 9 Ca 0.00 0.93 0.00 0.00 0.00 0.00 0.00 60.65 61.58 1p7a s ILE 9 Cb 0.00 -3.71 0.00 0.00 0.01 0.00 0.00 42.46 38.76 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 -2.45 -3.67 0.30 2.79 5.02 -1.26 -4.29 118.16 114.60 1p7a n LYS 10 Ca 0.07 2.83 0.18 0.00 -2.02 0.00 0.00 58.31 59.36 1p7a n LYS 10 Cb 0.54 -3.55 0.94 0.00 -0.02 0.00 0.00 35.03 32.94 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 0.42 0.00 -2.98 1.97 0.13 -1.87 -3.36 132.00 126.30 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 0.69 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.42 1p7a h PRO 11 CO 0.00 0.04 -0.77 -0.06 -0.23 0.00 0.00 178.00 176.98 1p7a s PHE 12 N -4.15 1.59 0.24 1.56 0.08 -1.00 -4.99 117.98 111.32 1p7a s PHE 12 Ca -0.03 -2.08 0.05 0.00 0.12 0.00 0.00 56.93 54.99 1p7a s PHE 12 Cb 0.13 -1.60 -0.03 0.00 -0.57 0.00 0.00 43.02 40.95 1p7a s PHE 12 CO 0.51 -0.81 0.36 1.14 -0.10 0.00 0.00 175.22 176.31 1p7a s GLN 13 N 0.79 3.40 -0.01 0.44 -2.07 -1.26 0.26 119.66 121.21 1p7a s GLN 13 Ca 0.16 -0.78 -0.30 0.00 -1.82 0.00 0.00 55.36 52.62 1p7a s GLN 13 Cb -0.23 -2.87 -0.05 0.00 -1.09 0.00 0.00 33.01 28.77 1p7a s GLN 13 CO -0.05 0.41 1.29 0.00 -1.32 0.00 0.00 175.29 175.63 1p7a n PRO 15 N 5.07 0.51 -0.09 0.00 -0.04 -1.26 -0.68 135.00 138.51 1p7a n PRO 15 Ca 0.12 0.02 -0.12 0.00 -0.04 0.00 0.00 63.50 63.48 1p7a n PRO 15 Cb 0.45 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.31 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 -1.21 2.00 -0.09 3.54 2.03 -1.26 -4.51 116.55 117.05 1p7a n ASP 16 Ca 0.15 -0.07 -0.09 0.00 0.52 0.00 0.00 54.79 55.30 1p7a n ASP 16 Cb 0.19 0.11 -0.12 0.00 -0.72 0.00 0.00 41.12 40.58 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 -2.71 -1.66 -3.04 0.00 2.03 0.14 -4.46 116.55 106.86 1p7a n ASP 18 Ca -0.29 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.02 1p7a n ASP 18 Cb 1.01 -0.48 0.00 0.00 -0.72 0.00 0.00 41.12 40.93 1p7a n ASP 18 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1p7a n ARG 19 N -0.61 1.09 -3.59 -0.67 1.74 -1.22 -4.80 116.66 108.59 1p7a n ARG 19 Ca 0.00 0.00 -0.02 0.00 -0.77 0.00 0.00 57.85 57.06 1p7a n ARG 19 Cb 0.48 0.00 -0.06 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 -1.04 -0.75 0.04 0.55 1.04 -1.26 -3.41 113.70 108.87 1p7a s SER 20 Ca 0.00 1.12 0.03 0.00 0.48 0.00 0.00 55.95 57.58 1p7a s SER 20 Cb 0.00 1.55 -0.02 0.00 0.10 0.00 0.00 66.02 67.65 1p7a s SER 20 CO 0.00 -0.17 -0.09 -0.36 0.98 0.00 0.00 173.24 173.60 1p7a s PHE 21 N 1.94 0.78 0.01 5.02 0.40 0.14 -4.95 117.98 121.32 1p7a s PHE 21 Ca -0.07 -0.43 0.11 0.00 -0.60 0.00 0.00 56.93 55.94 1p7a s PHE 21 Cb -0.06 -0.46 -0.05 0.00 0.51 0.00 0.00 43.02 42.96 1p7a s PHE 21 CO -0.17 -0.04 1.37 0.66 0.70 0.00 0.00 175.22 177.74 1p7a h SER 22 N 4.69 0.00 -3.99 1.36 4.64 -1.96 -2.67 113.55 115.62 1p7a h SER 22 Ca -0.36 0.00 -0.68 0.00 -0.47 0.00 0.00 61.79 60.28 1p7a h SER 22 Cb 1.20 0.00 -0.31 0.00 -0.31 0.00 0.00 62.40 62.97 1p7a h SER 22 CO 0.42 0.76 -0.88 -0.13 -0.87 0.00 0.00 176.83 176.13 1p7a s ARG 23 N -2.87 2.50 0.54 4.77 0.52 -1.26 -4.72 118.95 118.43 1p7a s ARG 23 Ca 0.02 -0.88 0.27 0.00 -0.52 0.00 0.00 55.73 54.62 1p7a s ARG 23 Cb 0.09 -2.12 1.56 0.00 0.52 0.00 0.00 34.95 35.00 1p7a s ARG 23 CO 0.78 0.37 2.14 0.66 0.02 0.00 0.00 175.30 179.27 1p7a h SER 24 N 6.09 0.00 -0.63 0.23 4.64 -1.91 -0.63 113.55 121.35 1p7a h SER 24 Ca -0.32 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 60.95 1p7a h SER 24 Cb 1.18 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.24 1p7a h SER 24 CO 0.47 0.07 0.19 -0.78 -0.87 0.00 0.00 176.83 175.91 1p7a h ASP 25 N 0.00 0.92 0.04 4.97 3.58 -1.99 -1.51 116.42 122.43 1p7a h ASP 25 Ca -0.00 -0.21 -0.10 0.00 0.42 0.00 0.00 57.03 57.13 1p7a h ASP 25 Cb 0.19 -0.24 -0.01 0.00 1.72 0.00 0.00 39.33 40.99 1p7a h ASP 25 CO 0.01 0.89 -0.32 0.45 -2.88 0.00 0.00 179.24 177.39 1p7a h HIS 26 N 0.90 0.48 0.53 0.28 3.86 -1.55 -1.52 115.15 118.13 1p7a h HIS 26 Ca 0.20 -0.11 -0.02 0.00 -1.16 0.00 0.00 60.37 59.28 1p7a h HIS 26 Cb 0.30 -0.11 -0.02 0.00 1.06 0.00 0.00 27.41 28.64 1p7a h HIS 26 CO 0.02 0.70 -0.49 1.25 0.86 0.00 0.00 177.93 180.27 1p7a h LEU 27 N 0.36 -1.33 -1.23 2.43 5.85 -0.92 -2.11 115.31 118.37 1p7a h LEU 27 Ca 0.04 0.10 0.12 0.00 0.84 0.00 0.00 57.88 58.98 1p7a h LEU 27 Cb 0.75 0.43 -0.07 0.00 0.37 0.00 0.00 40.66 42.14 1p7a h LEU 27 CO 0.06 -0.67 0.57 0.00 -0.34 0.00 0.00 178.44 178.07 1p7a h ALA 28 N -0.84 1.71 -0.59 1.25 0.00 -1.06 0.15 119.26 119.88 1p7a h ALA 28 Ca -0.06 0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.88 1p7a h ALA 28 Cb 0.87 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.45 1p7a h ALA 28 CO -0.04 0.07 0.36 -0.07 0.00 0.00 0.00 179.25 179.58 1p7a h LEU 29 N 0.80 0.59 -0.37 0.00 3.38 -0.89 -1.43 115.31 117.40 1p7a h LEU 29 Ca 0.43 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 58.22 1p7a h LEU 29 Cb 0.54 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.17 1p7a h LEU 29 CO -0.19 0.41 -0.67 -0.74 0.09 0.00 0.00 178.44 177.34 1p7a h HIS 30 N 0.71 0.78 0.00 1.13 -0.00 -0.58 -3.09 115.15 114.11 1p7a h HIS 30 Ca 0.24 -0.32 0.00 0.00 -0.00 0.00 0.00 60.37 60.29 1p7a h HIS 30 Cb 0.02 -0.13 0.00 0.00 -0.00 0.00 0.00 27.41 27.30 1p7a h HIS 30 CO -0.06 1.09 0.00 0.54 -0.00 0.00 0.00 177.93 179.51 1p7a n ARG 31 N -3.92 0.24 0.17 5.26 1.74 0.43 -2.07 116.66 118.51 1p7a n ARG 31 Ca -0.05 0.13 0.05 0.00 -0.77 0.00 0.00 57.85 57.21 1p7a n ARG 31 Cb 0.68 -1.50 0.50 0.00 -1.02 0.00 0.00 32.46 31.12 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 0.15 0.00 5.56 6.56 -1.20 0.67 116.57 128.31 1p7a h LYS 32 Ca 0.00 -0.02 0.00 0.00 -1.06 0.00 0.00 60.65 59.57 1p7a h LYS 32 Cb 0.16 -0.03 0.00 0.00 -0.57 0.00 0.00 32.23 31.80 1p7a h LYS 32 CO 0.00 0.21 0.00 0.00 -2.06 0.00 0.00 179.45 177.60 1p7a h ARG 33 N 0.15 0.00 -0.05 3.15 2.47 -1.64 -2.69 114.38 115.78 1p7a h ARG 33 Ca 0.04 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.76 1p7a h ARG 33 Cb 0.18 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.50 1p7a h ARG 33 CO 0.01 0.00 0.00 0.72 0.56 0.00 0.00 179.97 181.26 1p7a n HIS 34 N -2.44 0.05 1.01 3.04 8.25 0.23 -2.63 115.22 122.73 1p7a n HIS 34 Ca 0.03 -0.03 0.13 0.00 -0.26 0.00 0.00 57.72 57.60 1p7a n HIS 34 Cb 0.33 0.00 0.60 0.00 1.12 0.00 0.00 29.99 32.04 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 -0.24 0.09 -2.75 -0.41 2.81 -1.01 -3.01 117.12 112.59 1p7a n MET 35 Ca 0.19 0.04 -0.14 0.00 -1.81 0.00 0.00 57.70 55.98 1p7a n MET 35 Cb 0.24 -1.50 0.01 0.00 -0.71 0.00 0.00 33.22 31.26 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 -1.45 1.83 0.00 4.03 4.32 -1.08 -5.18 117.00 119.47 1p7a n LEU 36 Ca 0.08 -4.22 0.00 0.00 -0.02 0.00 0.00 56.01 51.85 1p7a n LEU 36 Cb 0.29 0.34 0.00 0.00 -1.62 0.00 0.00 43.42 42.43 1p7a n LEU 36 CO 0.24 1.82 0.00 0.52 -1.22 0.00 0.00 177.39 178.75