#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 6.16 0.28 1.61 1.04 -1.20 -3.26 113.70 118.32 1p7a s SER 2 Ca 0.00 2.00 0.05 0.00 0.48 0.00 0.00 55.95 58.49 1p7a s SER 2 Cb 0.00 -2.57 -0.06 0.00 0.10 0.00 0.00 66.02 63.50 1p7a s SER 2 CO 0.00 -0.91 -0.02 -0.89 0.98 0.00 0.00 173.24 172.39 1p7a s THR 3 N -1.92 1.43 0.00 2.02 2.01 -1.23 -4.97 115.64 112.99 1p7a s THR 3 Ca 0.69 -2.08 0.00 0.00 0.31 0.00 0.00 61.69 60.61 1p7a s THR 3 Cb -0.19 -2.49 0.00 0.00 0.01 0.00 0.00 72.50 69.83 1p7a s THR 3 CO 0.22 -0.25 0.00 0.54 -0.69 0.00 0.00 174.62 174.44 1p7a n ARG 4 N -0.57 1.00 0.00 4.92 3.00 -1.25 -4.54 116.66 119.23 1p7a n ARG 4 Ca -0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.79 1p7a n ARG 4 Cb 0.64 0.00 0.00 0.00 0.00 0.00 0.00 32.46 33.10 1p7a n ARG 4 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1p7a n GLY 5 N 5.00 1.36 0.00 -0.13 0.00 -1.26 -2.28 105.19 107.88 1p7a n GLY 5 Ca 0.00 0.21 0.00 0.00 0.00 0.00 0.00 46.02 46.23 1p7a n GLY 5 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1p7a n SER 6 N 7.37 0.45 -4.42 1.61 3.41 -1.26 -4.97 113.62 115.81 1p7a n SER 6 Ca 0.00 -1.08 -0.44 0.00 -0.26 0.00 0.00 58.87 57.10 1p7a n SER 6 Cb 0.00 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 63.91 1p7a n SER 6 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1p7a s THR 7 N -0.08 4.55 0.00 6.66 -4.23 -0.97 -4.40 115.64 117.17 1p7a s THR 7 Ca 0.00 -0.62 0.00 0.00 -1.18 0.00 0.00 61.69 59.89 1p7a s THR 7 Cb 0.00 -4.59 0.00 0.00 1.34 0.00 0.00 72.50 69.25 1p7a s THR 7 CO 0.00 -1.30 0.00 0.61 -0.54 0.00 0.00 174.62 173.39 1p7a n GLY 8 N 5.30 0.29 3.84 3.99 0.00 -1.26 -3.51 105.19 113.84 1p7a n GLY 8 Ca -0.06 -0.58 -0.30 0.00 0.00 0.00 0.00 46.02 45.08 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 1.93 0.32 -0.61 1.01 -1.26 -4.96 121.20 117.62 1p7a s ILE 9 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60.65 60.65 1p7a s ILE 9 Cb 0.00 -2.87 0.00 0.00 0.01 0.00 0.00 42.46 39.60 1p7a s ILE 9 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 174.94 175.23 1p7a n LYS 10 N -3.87 -2.51 0.10 2.79 5.02 -1.26 -4.48 118.16 113.95 1p7a n LYS 10 Ca 0.12 1.90 0.04 0.00 -2.02 0.00 0.00 58.31 58.36 1p7a n LYS 10 Cb 0.60 -2.25 0.47 0.00 -0.02 0.00 0.00 35.03 33.82 1p7a n LYS 10 CO 0.00 0.00 0.00 -1.35 -0.52 0.00 0.00 177.40 175.53 1p7a h PRO 11 N 0.54 0.33 -3.25 1.97 0.11 -1.88 -3.34 132.00 126.48 1p7a h PRO 11 Ca 0.00 -0.03 -0.65 0.00 0.11 0.00 0.00 66.00 65.43 1p7a h PRO 11 Cb 0.26 -0.07 -0.40 0.00 0.11 0.00 0.00 31.00 30.91 1p7a h PRO 11 CO 0.00 0.28 -0.48 -0.06 -0.21 0.00 0.00 178.00 177.53 1p7a s PHE 12 N -5.18 3.52 0.41 0.65 0.08 -0.22 -5.02 117.98 112.22 1p7a s PHE 12 Ca -0.07 -3.18 -0.15 0.00 0.12 0.00 0.00 56.93 53.65 1p7a s PHE 12 Cb 0.17 -2.89 -0.08 0.00 -0.57 0.00 0.00 43.02 39.65 1p7a s PHE 12 CO 0.72 -0.66 0.84 -1.14 -0.10 0.00 0.00 175.22 174.88 1p7a s GLN 13 N -1.01 3.94 -0.26 0.44 0.74 -1.25 0.20 119.66 122.46 1p7a s GLN 13 Ca 0.22 0.74 -0.29 0.00 0.05 0.00 0.00 55.36 56.08 1p7a s GLN 13 Cb -0.12 -2.31 0.00 0.00 1.10 0.00 0.00 33.01 31.68 1p7a s GLN 13 CO -0.10 -0.04 1.20 0.00 -0.55 0.00 0.00 175.29 175.80 1p7a n PRO 15 N 6.88 0.51 -0.01 0.00 -0.04 -1.26 -1.30 135.00 139.78 1p7a n PRO 15 Ca 0.13 0.04 0.08 0.00 -0.04 0.00 0.00 63.50 63.71 1p7a n PRO 15 Cb 0.46 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.30 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 -1.11 1.24 0.00 3.54 8.00 -1.26 -3.26 116.55 123.70 1p7a n ASP 16 Ca 0.13 -0.16 0.00 0.00 0.71 0.00 0.00 54.79 55.47 1p7a n ASP 16 Cb 0.10 1.59 0.00 0.00 -0.02 0.00 0.00 41.12 42.79 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 -1.65 -2.72 -4.73 0.00 2.03 -0.42 -4.66 116.55 104.41 1p7a n ASP 18 Ca 0.00 0.00 -0.29 0.00 0.52 0.00 0.00 54.79 55.02 1p7a n ASP 18 Cb 0.31 -0.45 0.14 0.00 -0.72 0.00 0.00 41.12 40.40 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 -1.08 1.15 -0.07 -0.67 0.52 -1.25 -4.53 118.95 113.02 1p7a s ARG 19 Ca 0.00 0.62 -0.05 0.00 -0.52 0.00 0.00 55.73 55.78 1p7a s ARG 19 Cb 0.00 -1.81 0.03 0.00 0.52 0.00 0.00 34.95 33.69 1p7a s ARG 19 CO 0.00 -2.26 0.18 -1.54 0.02 0.00 0.00 175.30 171.70 1p7a s SER 20 N -3.61 -0.18 0.03 0.23 1.04 -1.26 -0.82 113.70 109.13 1p7a s SER 20 Ca 0.64 0.37 0.02 0.00 0.48 0.00 0.00 55.95 57.46 1p7a s SER 20 Cb -0.17 0.31 -0.02 0.00 0.10 0.00 0.00 66.02 66.25 1p7a s SER 20 CO 0.56 -0.11 -0.08 -0.36 0.98 0.00 0.00 173.24 174.23 1p7a s PHE 21 N 0.64 0.70 -0.42 5.02 0.40 0.13 -4.94 117.98 119.50 1p7a s PHE 21 Ca -0.05 -0.34 0.23 0.00 -0.60 0.00 0.00 56.93 56.18 1p7a s PHE 21 Cb -0.06 -0.42 0.21 0.00 0.51 0.00 0.00 43.02 43.26 1p7a s PHE 21 CO -0.03 -0.04 1.27 0.77 0.70 0.00 0.00 175.22 177.89 1p7a h SER 22 N 5.07 0.00 -4.16 1.36 0.02 -1.94 -0.57 113.55 113.33 1p7a h SER 22 Ca -0.34 -0.06 -0.69 0.00 -0.84 0.00 0.00 61.79 59.86 1p7a h SER 22 Cb 1.19 0.00 -0.29 0.00 0.14 0.00 0.00 62.40 63.45 1p7a h SER 22 CO 0.44 0.03 -0.85 -0.13 -1.14 0.00 0.00 176.83 175.18 1p7a s ARG 23 N -3.26 2.46 0.48 3.45 0.52 -1.26 -4.73 118.95 116.61 1p7a s ARG 23 Ca 0.04 -0.85 0.23 0.00 -0.52 0.00 0.00 55.73 54.62 1p7a s ARG 23 Cb 0.10 -2.21 1.23 0.00 0.52 0.00 0.00 34.95 34.59 1p7a s ARG 23 CO 0.74 0.48 2.01 1.03 0.02 0.00 0.00 175.30 179.57 1p7a h SER 24 N 5.76 0.00 -0.17 0.23 0.87 -1.91 -2.26 113.55 116.07 1p7a h SER 24 Ca -0.38 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.17 1p7a h SER 24 Cb 1.16 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.11 1p7a h SER 24 CO 0.48 0.17 0.07 -0.78 -0.53 0.00 0.00 176.83 176.25 1p7a h ASP 25 N 0.00 0.23 -0.12 6.23 3.58 -1.99 -0.82 116.42 123.53 1p7a h ASP 25 Ca -0.00 -0.16 -0.08 0.00 0.42 0.00 0.00 57.03 57.21 1p7a h ASP 25 Cb 0.40 -0.06 -0.02 0.00 1.72 0.00 0.00 39.33 41.38 1p7a h ASP 25 CO 0.02 0.33 -0.16 0.45 -2.88 0.00 0.00 179.24 177.00 1p7a h HIS 26 N 0.13 0.54 0.47 0.28 3.86 -1.88 -1.28 115.15 117.27 1p7a h HIS 26 Ca 0.06 -0.09 -0.02 0.00 -1.16 0.00 0.00 60.37 59.16 1p7a h HIS 26 Cb 0.16 -0.14 -0.01 0.00 1.06 0.00 0.00 27.41 28.48 1p7a h HIS 26 CO -0.02 0.64 -0.40 1.25 0.86 0.00 0.00 177.93 180.26 1p7a h LEU 27 N 0.45 -1.07 -1.19 2.43 5.85 -1.07 -1.61 115.31 119.10 1p7a h LEU 27 Ca 0.08 0.08 0.10 0.00 0.84 0.00 0.00 57.88 58.97 1p7a h LEU 27 Cb 0.55 0.34 -0.06 0.00 0.37 0.00 0.00 40.66 41.85 1p7a h LEU 27 CO 0.04 -0.55 0.58 0.00 -0.34 0.00 0.00 178.44 178.16 1p7a h ALA 28 N -1.16 1.62 -0.15 1.25 0.00 -0.97 0.95 119.26 120.80 1p7a h ALA 28 Ca -0.06 -0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.87 1p7a h ALA 28 Cb 0.72 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 1p7a h ALA 28 CO -0.01 0.20 -0.04 -0.07 0.00 0.00 0.00 179.25 179.33 1p7a h LEU 29 N 0.90 -0.14 -0.75 0.00 3.38 -0.99 -1.98 115.31 115.72 1p7a h LEU 29 Ca 0.41 0.05 -0.10 0.00 0.09 0.00 0.00 57.88 58.33 1p7a h LEU 29 Cb 0.40 0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 1p7a h LEU 29 CO -0.18 -0.05 -0.16 -0.74 0.09 0.00 0.00 178.44 177.40 1p7a h HIS 30 N -0.00 0.87 0.00 1.13 -0.00 -0.49 -2.82 115.15 113.84 1p7a h HIS 30 Ca 0.07 -0.18 0.00 0.00 -0.00 0.00 0.00 60.37 60.27 1p7a h HIS 30 Cb 0.11 -0.22 0.00 0.00 -0.00 0.00 0.00 27.41 27.31 1p7a h HIS 30 CO -0.18 0.89 0.00 0.54 -0.00 0.00 0.00 177.93 179.17 1p7a n ARG 31 N -4.14 0.58 0.25 5.26 1.74 0.25 -2.38 116.66 118.21 1p7a n ARG 31 Ca 0.01 0.02 0.09 0.00 -0.77 0.00 0.00 57.85 57.19 1p7a n ARG 31 Cb 0.40 -1.50 0.62 0.00 -1.02 0.00 0.00 32.46 30.96 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 -1.11 0.12 116.57 127.70 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 0.04 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.70 1p7a h LYS 32 CO 0.00 0.13 -0.02 0.54 -2.06 0.00 0.00 179.45 178.04 1p7a n ARG 33 N -4.13 0.39 0.00 3.15 1.74 -1.00 -2.68 116.66 114.13 1p7a n ARG 33 Ca -0.02 -0.02 0.13 0.00 -0.77 0.00 0.00 57.85 57.16 1p7a n ARG 33 Cb 0.21 -1.50 0.28 0.00 -1.02 0.00 0.00 32.46 30.43 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 -1.29 0.00 0.51 -1.55 8.25 0.41 -3.18 115.22 118.36 1p7a n HIS 34 Ca 0.13 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.72 1p7a n HIS 34 Cb 0.26 -0.01 0.29 0.00 1.12 0.00 0.00 29.99 31.65 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 3.29 0.00 -1.83 -0.41 2.86 -1.48 -3.17 114.93 114.18 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 0.74 0.00 -0.42 0.00 0.06 0.00 0.00 31.60 31.98 1p7a h MET 35 CO 0.00 0.00 -0.75 1.28 1.06 0.00 0.00 176.91 178.50 1p7a n LEU 36 N -2.43 4.21 0.00 1.22 4.77 -1.19 -5.17 117.00 118.41 1p7a n LEU 36 Ca 0.04 -5.31 0.13 0.00 -0.03 0.00 0.00 56.01 50.85 1p7a n LEU 36 Cb 0.46 -0.38 0.79 0.00 -2.33 0.00 0.00 43.42 41.96 1p7a n LEU 36 CO 0.33 2.25 0.97 0.55 -1.33 0.00 0.00 177.39 180.15