#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 0.00 -1.24 1.61 7.64 -1.26 -4.11 113.62 116.26 1p7a n SER 2 Ca 0.00 0.00 -0.16 0.00 1.01 0.00 0.00 58.87 59.72 1p7a n SER 2 Cb 0.00 0.00 -0.07 0.00 -1.01 0.00 0.00 64.21 63.13 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 0.00 -3.17 0.44 -1.04 -0.88 -4.93 114.28 104.70 1p7a n THR 3 Ca 0.00 0.00 -0.45 0.00 -2.04 0.00 0.00 64.05 61.56 1p7a n THR 3 Cb 0.00 -1.72 -0.03 0.00 -1.82 0.00 0.00 70.33 66.75 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 -3.34 3.37 0.00 -2.82 1.81 -1.26 -4.29 118.95 112.42 1p7a s ARG 4 Ca 0.00 -1.89 0.00 0.00 -1.72 0.00 0.00 55.73 52.12 1p7a s ARG 4 Cb 0.00 -4.48 0.00 0.00 -0.45 0.00 0.00 34.95 30.02 1p7a s ARG 4 CO 0.00 -1.48 0.00 0.41 -0.68 0.00 0.00 175.30 173.55 1p7a n GLY 5 N 4.84 2.42 3.57 -3.53 0.00 -1.26 -4.97 105.19 106.26 1p7a n GLY 5 Ca 0.06 -0.54 -0.39 0.00 0.00 0.00 0.00 46.02 45.15 1p7a n GLY 5 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1p7a s SER 6 N 0.04 5.16 -0.63 1.61 0.01 -1.26 -4.89 113.70 113.74 1p7a s SER 6 Ca 0.00 1.00 0.06 0.00 1.31 0.00 0.00 55.95 58.32 1p7a s SER 6 Cb 0.00 -2.52 0.22 0.00 0.21 0.00 0.00 66.02 63.93 1p7a s SER 6 CO 0.00 -2.34 0.62 0.35 0.41 0.00 0.00 173.24 172.28 1p7a n THR 7 N 7.59 1.66 -3.31 1.44 -2.24 -1.26 -4.60 114.28 113.56 1p7a n THR 7 Ca 0.28 -4.90 -0.23 0.00 -2.27 0.00 0.00 64.05 56.92 1p7a n THR 7 Cb 0.51 -2.09 0.00 0.00 -2.10 0.00 0.00 70.33 66.65 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 1.37 -0.49 3.85 3.38 0.00 -1.26 -4.96 105.19 107.08 1p7a n GLY 8 Ca 0.26 0.10 -0.30 0.00 0.00 0.00 0.00 46.02 46.07 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 -2.97 3.73 0.49 -0.61 1.01 -1.26 -4.91 121.20 116.67 1p7a s ILE 9 Ca 0.38 0.56 0.00 0.00 0.00 0.00 0.00 60.65 61.59 1p7a s ILE 9 Cb -0.20 -3.44 0.00 0.00 0.01 0.00 0.00 42.46 38.83 1p7a s ILE 9 CO 0.47 -0.73 0.00 0.29 0.00 0.00 0.00 174.94 174.97 1p7a n LYS 10 N -3.09 -3.42 0.20 2.79 5.02 -1.26 -4.47 118.16 113.93 1p7a n LYS 10 Ca 0.07 2.65 0.04 0.00 -2.02 0.00 0.00 58.31 59.05 1p7a n LYS 10 Cb 0.56 -3.30 0.43 0.00 -0.02 0.00 0.00 35.03 32.70 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 0.20 0.03 -3.55 1.97 0.13 -1.87 -3.38 132.00 125.52 1p7a h PRO 11 Ca 0.00 -0.01 -0.65 0.00 -0.87 0.00 0.00 66.00 64.47 1p7a h PRO 11 Cb 0.76 -0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.49 1p7a h PRO 11 CO 0.00 0.28 -0.59 -0.06 -0.23 0.00 0.00 178.00 177.39 1p7a s PHE 12 N -4.47 3.28 0.52 1.56 0.08 -0.63 -5.03 117.98 113.29 1p7a s PHE 12 Ca -0.04 -3.08 -0.03 0.00 0.12 0.00 0.00 56.93 53.90 1p7a s PHE 12 Cb 0.15 -2.90 0.00 0.00 -0.57 0.00 0.00 43.02 39.71 1p7a s PHE 12 CO 0.71 -0.78 0.79 -0.65 -0.10 0.00 0.00 175.22 175.20 1p7a s GLN 13 N -0.13 3.01 -0.04 0.44 1.11 -1.26 -0.11 119.66 122.68 1p7a s GLN 13 Ca 0.16 -0.21 -0.30 0.00 0.01 0.00 0.00 55.36 55.02 1p7a s GLN 13 Cb -0.24 -2.40 -0.03 0.00 -1.01 0.00 0.00 33.01 29.32 1p7a s GLN 13 CO -0.01 -0.49 1.19 0.00 0.01 0.00 0.00 175.29 175.99 1p7a n PRO 15 N 5.03 0.03 -0.06 0.00 -0.04 -1.26 -0.23 135.00 138.47 1p7a n PRO 15 Ca 0.11 0.23 -0.07 0.00 -0.04 0.00 0.00 63.50 63.73 1p7a n PRO 15 Cb 0.46 -1.55 -0.09 0.00 -0.04 0.00 0.00 33.50 32.29 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 -1.59 2.27 -0.09 3.54 2.03 -1.26 -4.73 116.55 116.72 1p7a n ASP 16 Ca 0.04 -0.02 -0.10 0.00 0.52 0.00 0.00 54.79 55.23 1p7a n ASP 16 Cb 0.21 0.54 -0.14 0.00 -0.72 0.00 0.00 41.12 41.00 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 -2.75 -3.17 -4.24 0.00 2.03 0.68 -2.08 116.55 107.01 1p7a n ASP 18 Ca -0.31 0.09 -0.29 0.00 0.52 0.00 0.00 54.79 54.79 1p7a n ASP 18 Cb 1.07 -1.67 0.23 0.00 -0.72 0.00 0.00 41.12 40.02 1p7a n ASP 18 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 1p7a s ARG 19 N -3.14 -0.81 -0.05 -0.67 0.52 -1.25 -4.03 118.95 109.53 1p7a s ARG 19 Ca 0.00 0.35 0.00 0.00 -0.52 0.00 0.00 55.73 55.56 1p7a s ARG 19 Cb 0.00 -1.61 0.03 0.00 0.52 0.00 0.00 34.95 33.89 1p7a s ARG 19 CO 0.00 -3.52 -0.02 -1.54 0.02 0.00 0.00 175.30 170.24 1p7a s SER 20 N -3.35 0.92 -0.01 0.23 1.04 -1.26 -1.15 113.70 110.12 1p7a s SER 20 Ca 0.68 -0.08 0.03 0.00 0.48 0.00 0.00 55.95 57.06 1p7a s SER 20 Cb -0.17 -0.36 -0.01 0.00 0.10 0.00 0.00 66.02 65.58 1p7a s SER 20 CO 0.59 -0.11 -0.11 -0.36 0.98 0.00 0.00 173.24 174.23 1p7a s PHE 21 N 1.22 0.95 -0.34 5.02 0.40 0.85 -4.95 117.98 121.13 1p7a s PHE 21 Ca -0.07 -0.18 0.21 0.00 -0.60 0.00 0.00 56.93 56.29 1p7a s PHE 21 Cb -0.14 -0.62 0.22 0.00 0.51 0.00 0.00 43.02 43.00 1p7a s PHE 21 CO -0.02 -0.02 1.47 0.77 0.70 0.00 0.00 175.22 178.12 1p7a h SER 22 N 5.89 0.00 -3.87 1.36 0.02 -1.94 -1.67 113.55 113.33 1p7a h SER 22 Ca -0.32 0.00 -0.65 0.00 -0.84 0.00 0.00 61.79 59.98 1p7a h SER 22 Cb 1.17 0.00 -0.32 0.00 0.14 0.00 0.00 62.40 63.40 1p7a h SER 22 CO 0.49 0.13 -0.87 -0.13 -1.14 0.00 0.00 176.83 175.31 1p7a s ARG 23 N -3.17 2.41 0.52 3.45 0.52 -1.26 -4.74 118.95 116.68 1p7a s ARG 23 Ca 0.05 -0.82 0.25 0.00 -0.52 0.00 0.00 55.73 54.69 1p7a s ARG 23 Cb 0.06 -2.01 1.44 0.00 0.52 0.00 0.00 34.95 34.96 1p7a s ARG 23 CO 0.71 0.31 2.11 0.66 0.02 0.00 0.00 175.30 179.10 1p7a h SER 24 N 6.23 0.00 -0.27 0.23 4.64 -1.91 -0.88 113.55 121.59 1p7a h SER 24 Ca -0.30 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.99 1p7a h SER 24 Cb 1.18 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.26 1p7a h SER 24 CO 0.47 0.10 0.07 -0.78 -0.87 0.00 0.00 176.83 175.82 1p7a h ASP 25 N 0.00 0.40 -0.27 4.97 3.58 -1.99 -2.06 116.42 121.05 1p7a h ASP 25 Ca -0.00 -0.22 -0.04 0.00 0.42 0.00 0.00 57.03 57.19 1p7a h ASP 25 Cb 0.23 -0.10 -0.02 0.00 1.72 0.00 0.00 39.33 41.16 1p7a h ASP 25 CO 0.01 0.51 0.07 0.45 -2.88 0.00 0.00 179.24 177.40 1p7a h HIS 26 N 0.26 0.53 0.54 0.28 3.86 -1.62 -1.58 115.15 117.43 1p7a h HIS 26 Ca 0.08 -0.04 -0.02 0.00 -1.16 0.00 0.00 60.37 59.24 1p7a h HIS 26 Cb 0.26 -0.16 -0.02 0.00 1.06 0.00 0.00 27.41 28.56 1p7a h HIS 26 CO 0.01 0.48 -0.48 1.25 0.86 0.00 0.00 177.93 180.05 1p7a h LEU 27 N 0.51 -1.28 -1.09 2.43 5.85 -0.85 -2.26 115.31 118.62 1p7a h LEU 27 Ca 0.12 0.10 0.11 0.00 0.84 0.00 0.00 57.88 59.04 1p7a h LEU 27 Cb 0.23 0.41 -0.07 0.00 0.37 0.00 0.00 40.66 41.60 1p7a h LEU 27 CO -0.00 -0.66 0.61 0.00 -0.34 0.00 0.00 178.44 178.06 1p7a h ALA 28 N -0.82 1.56 -0.48 1.25 0.00 -1.03 0.39 119.26 120.13 1p7a h ALA 28 Ca -0.07 0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.90 1p7a h ALA 28 Cb 0.86 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 18.39 1p7a h ALA 28 CO -0.03 0.23 0.21 -0.07 0.00 0.00 0.00 179.25 179.59 1p7a h LEU 29 N 0.97 0.28 -0.45 0.00 3.38 -0.95 -1.69 115.31 116.85 1p7a h LEU 29 Ca 0.46 0.04 -0.17 0.00 0.09 0.00 0.00 57.88 58.29 1p7a h LEU 29 Cb 0.43 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.17 1p7a h LEU 29 CO -0.22 0.20 -0.61 -0.74 0.09 0.00 0.00 178.44 177.15 1p7a h HIS 30 N 0.42 0.70 0.00 1.13 -0.00 -0.78 -3.13 115.15 113.49 1p7a h HIS 30 Ca 0.22 -0.27 0.00 0.00 -0.00 0.00 0.00 60.37 60.32 1p7a h HIS 30 Cb 0.17 -0.12 0.00 0.00 -0.00 0.00 0.00 27.41 27.45 1p7a h HIS 30 CO -0.12 1.02 0.00 0.54 -0.00 0.00 0.00 177.93 179.36 1p7a n ARG 31 N -3.93 0.46 -0.19 5.26 1.74 0.05 -2.74 116.66 117.31 1p7a n ARG 31 Ca -0.04 0.05 0.01 0.00 -0.77 0.00 0.00 57.85 57.11 1p7a n ARG 31 Cb 0.64 -1.50 0.27 0.00 -1.02 0.00 0.00 32.46 30.86 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 0.92 0.00 5.56 6.56 -1.30 0.98 116.57 129.28 1p7a h LYS 32 Ca 0.00 -0.06 0.00 0.00 -1.06 0.00 0.00 60.65 59.53 1p7a h LYS 32 Cb 0.08 -0.21 0.00 0.00 -0.57 0.00 0.00 32.23 31.53 1p7a h LYS 32 CO 0.00 0.61 0.00 0.54 -2.06 0.00 0.00 179.45 178.54 1p7a n ARG 33 N -4.43 0.37 0.01 3.15 5.12 -1.11 -1.64 116.66 118.13 1p7a n ARG 33 Ca 0.08 0.06 0.12 0.00 -1.93 0.00 0.00 57.85 56.18 1p7a n ARG 33 Cb 0.05 -1.50 0.15 0.00 -1.16 0.00 0.00 32.46 30.00 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 -1.26 0.11 0.13 -1.55 8.25 0.33 -3.61 115.22 117.61 1p7a n HIS 34 Ca 0.12 0.03 0.08 0.00 -0.26 0.00 0.00 57.72 57.68 1p7a n HIS 34 Cb 0.18 -0.29 0.03 0.00 1.12 0.00 0.00 29.99 31.02 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 0.00 0.00 -2.14 -0.41 2.86 -1.19 -3.36 114.93 110.68 1p7a h MET 35 Ca 0.00 0.00 -0.57 0.00 -2.06 0.00 0.00 59.70 57.07 1p7a h MET 35 Cb 0.57 0.00 -0.41 0.00 0.06 0.00 0.00 31.60 31.82 1p7a h MET 35 CO 0.00 0.14 -0.82 1.28 1.06 0.00 0.00 176.91 178.58 1p7a n LEU 36 N -2.93 2.70 -0.34 1.22 4.77 -1.22 -5.15 117.00 116.05 1p7a n LEU 36 Ca -0.01 -5.28 0.15 0.00 -0.03 0.00 0.00 56.01 50.84 1p7a n LEU 36 Cb 0.63 -0.13 0.65 0.00 -2.33 0.00 0.00 43.42 42.25 1p7a n LEU 36 CO 0.39 2.18 0.94 1.33 -1.33 0.00 0.00 177.39 180.90