#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 -6.99 -3.48 1.61 7.64 -1.22 -4.84 113.62 106.34 1p7a n SER 2 Ca 0.00 -0.45 -0.37 0.00 1.01 0.00 0.00 58.87 59.06 1p7a n SER 2 Cb 0.00 -4.92 -0.03 0.00 -1.01 0.00 0.00 64.21 58.26 1p7a n SER 2 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1p7a n THR 3 N -2.60 2.98 0.00 0.44 -2.24 -1.26 -4.88 114.28 106.72 1p7a n THR 3 Ca -0.05 -2.18 0.00 0.00 -2.27 0.00 0.00 64.05 59.55 1p7a n THR 3 Cb 0.56 -2.42 0.00 0.00 -2.10 0.00 0.00 70.33 66.37 1p7a n THR 3 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1p7a n ARG 4 N 5.33 0.00 -0.02 -0.78 3.00 -1.26 -3.39 116.66 119.54 1p7a n ARG 4 Ca 0.56 0.00 -0.03 0.00 -0.01 0.00 0.00 57.85 58.36 1p7a n ARG 4 Cb 0.30 0.00 -0.02 0.00 0.00 0.00 0.00 32.46 32.74 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 0.00 -0.06 3.53 -0.13 0.00 -1.26 -4.83 105.19 102.44 1p7a n GLY 5 Ca 0.00 -0.02 -0.43 0.00 0.00 0.00 0.00 46.02 45.57 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 -2.87 4.97 -4.15 1.61 7.64 -1.22 -4.89 113.62 114.71 1p7a n SER 6 Ca -0.07 -2.93 -0.43 0.00 1.01 0.00 0.00 58.87 56.45 1p7a n SER 6 Cb 0.56 -1.71 0.00 0.00 -1.01 0.00 0.00 64.21 62.05 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 6.00 3.94 0.00 0.44 -2.24 -1.26 -4.00 114.28 117.16 1p7a n THR 7 Ca 0.47 -3.96 0.00 0.00 -2.27 0.00 0.00 64.05 58.29 1p7a n THR 7 Cb 0.45 -2.45 0.00 0.00 -2.10 0.00 0.00 70.33 66.23 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 4.21 0.28 3.85 3.38 0.00 -1.00 -4.94 105.19 110.96 1p7a n GLY 8 Ca 0.46 -0.20 -0.30 0.00 0.00 0.00 0.00 46.02 45.97 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 3.35 0.46 -0.61 1.01 -1.26 -4.94 121.20 119.21 1p7a s ILE 9 Ca 0.00 0.44 0.00 0.00 0.00 0.00 0.00 60.65 61.09 1p7a s ILE 9 Cb 0.00 -3.32 0.00 0.00 0.01 0.00 0.00 42.46 39.15 1p7a s ILE 9 CO 0.00 -0.57 0.00 0.29 0.00 0.00 0.00 174.94 174.66 1p7a n LYS 10 N -3.18 -3.35 0.16 2.79 5.02 -1.26 -4.15 118.16 114.19 1p7a n LYS 10 Ca 0.07 2.58 0.12 0.00 -2.02 0.00 0.00 58.31 59.05 1p7a n LYS 10 Cb 0.57 -3.15 0.59 0.00 -0.02 0.00 0.00 35.03 33.03 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 0.40 0.00 -3.18 1.97 0.13 -1.89 -3.35 132.00 126.08 1p7a h PRO 11 Ca 0.00 0.00 -0.63 0.00 -0.87 0.00 0.00 66.00 64.50 1p7a h PRO 11 Cb 0.59 0.00 -0.41 0.00 0.13 0.00 0.00 31.00 31.32 1p7a h PRO 11 CO 0.00 0.00 -0.68 -0.06 -0.23 0.00 0.00 178.00 177.03 1p7a s PHE 12 N -3.53 2.58 0.45 1.56 0.08 -1.01 -5.05 117.98 113.06 1p7a s PHE 12 Ca -0.01 -2.80 0.03 0.00 0.12 0.00 0.00 56.93 54.26 1p7a s PHE 12 Cb 0.07 -2.35 0.01 0.00 -0.57 0.00 0.00 43.02 40.18 1p7a s PHE 12 CO 0.25 -0.76 0.64 -0.65 -0.10 0.00 0.00 175.22 174.60 1p7a s GLN 13 N 0.02 2.91 0.01 0.44 -0.21 -1.26 -0.19 119.66 121.38 1p7a s GLN 13 Ca 0.17 -0.77 -0.30 0.00 0.02 0.00 0.00 55.36 54.48 1p7a s GLN 13 Cb -0.25 -2.62 -0.04 0.00 1.00 0.00 0.00 33.01 31.10 1p7a s GLN 13 CO -0.00 -0.32 1.15 0.00 -2.12 0.00 0.00 175.29 174.01 1p7a n PRO 15 N 4.29 0.02 -0.10 0.00 -0.04 -1.26 -0.88 135.00 137.03 1p7a n PRO 15 Ca 0.09 0.10 -0.14 0.00 -0.04 0.00 0.00 63.50 63.52 1p7a n PRO 15 Cb 0.47 -1.52 -0.09 0.00 -0.04 0.00 0.00 33.50 32.32 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 -1.55 2.45 -0.07 3.54 2.03 -1.26 -4.71 116.55 116.97 1p7a n ASP 16 Ca 0.06 -0.10 -0.11 0.00 0.52 0.00 0.00 54.79 55.15 1p7a n ASP 16 Cb 0.28 -0.30 -0.15 0.00 -0.72 0.00 0.00 41.12 40.24 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 -2.96 -1.50 -2.51 0.00 8.00 -0.06 -3.42 116.55 114.10 1p7a n ASP 18 Ca -0.29 -0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.20 1p7a n ASP 18 Cb 1.10 -0.90 0.00 0.00 -0.02 0.00 0.00 41.12 41.30 1p7a n ASP 18 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1p7a n ARG 19 N -1.16 -0.51 -3.68 -1.24 1.74 -1.25 -2.39 116.66 108.17 1p7a n ARG 19 Ca -0.02 0.00 -0.11 0.00 -0.77 0.00 0.00 57.85 56.95 1p7a n ARG 19 Cb 0.52 0.00 -0.11 0.00 -1.02 0.00 0.00 32.46 31.85 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 -1.37 -0.20 -0.03 0.55 1.04 -1.26 -3.14 113.70 109.28 1p7a s SER 20 Ca 0.00 0.83 0.01 0.00 0.48 0.00 0.00 55.95 57.27 1p7a s SER 20 Cb 0.00 0.94 0.01 0.00 0.10 0.00 0.00 66.02 67.08 1p7a s SER 20 CO 0.00 -0.22 -0.05 -0.36 0.98 0.00 0.00 173.24 173.60 1p7a s PHE 21 N 2.07 0.66 -0.14 5.02 0.40 0.74 -4.96 117.98 121.77 1p7a s PHE 21 Ca -0.04 -0.16 0.16 0.00 -0.60 0.00 0.00 56.93 56.28 1p7a s PHE 21 Cb -0.11 -0.55 0.12 0.00 0.51 0.00 0.00 43.02 42.99 1p7a s PHE 21 CO -0.11 -0.13 1.47 0.77 0.70 0.00 0.00 175.22 177.92 1p7a h SER 22 N 6.81 0.00 -3.55 1.36 0.02 -1.92 -2.67 113.55 113.60 1p7a h SER 22 Ca -0.36 0.00 -0.67 0.00 -0.84 0.00 0.00 61.79 59.92 1p7a h SER 22 Cb 1.16 0.00 -0.27 0.00 0.14 0.00 0.00 62.40 63.43 1p7a h SER 22 CO 0.48 0.48 -0.79 -0.13 -1.14 0.00 0.00 176.83 175.74 1p7a s ARG 23 N -3.01 3.07 0.61 3.45 0.52 -1.26 -4.78 118.95 117.55 1p7a s ARG 23 Ca 0.04 -0.72 0.38 0.00 -0.52 0.00 0.00 55.73 54.91 1p7a s ARG 23 Cb 0.08 -2.50 1.94 0.00 0.52 0.00 0.00 34.95 34.98 1p7a s ARG 23 CO 0.74 0.32 2.21 0.66 0.02 0.00 0.00 175.30 179.25 1p7a h SER 24 N 6.32 0.00 -0.18 0.23 4.64 -1.92 -0.92 113.55 121.72 1p7a h SER 24 Ca -0.31 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.00 1p7a h SER 24 Cb 1.20 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.28 1p7a h SER 24 CO 0.53 0.02 0.04 -0.78 -0.87 0.00 0.00 176.83 175.77 1p7a h ASP 25 N 0.00 0.28 -0.61 4.97 3.58 -1.98 -2.15 116.42 120.51 1p7a h ASP 25 Ca -0.00 -0.24 0.03 0.00 0.42 0.00 0.00 57.03 57.24 1p7a h ASP 25 Cb 0.21 -0.07 -0.03 0.00 1.72 0.00 0.00 39.33 41.15 1p7a h ASP 25 CO 0.00 0.45 0.41 0.45 -2.88 0.00 0.00 179.24 177.67 1p7a h HIS 26 N 0.10 0.70 0.49 0.28 3.86 -1.59 0.11 115.15 119.10 1p7a h HIS 26 Ca 0.06 0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.27 1p7a h HIS 26 Cb 0.28 -0.23 -0.02 0.00 1.06 0.00 0.00 27.41 28.50 1p7a h HIS 26 CO 0.01 0.41 -0.43 1.25 0.86 0.00 0.00 177.93 180.03 1p7a h LEU 27 N 0.73 -1.17 -0.93 2.43 5.85 -1.07 -2.08 115.31 119.07 1p7a h LEU 27 Ca 0.24 0.09 0.09 0.00 0.84 0.00 0.00 57.88 59.14 1p7a h LEU 27 Cb 0.07 0.38 -0.07 0.00 0.37 0.00 0.00 40.66 41.40 1p7a h LEU 27 CO -0.07 -0.59 0.57 0.00 -0.34 0.00 0.00 178.44 178.01 1p7a h ALA 28 N -1.09 1.33 -0.66 1.25 0.00 -0.76 0.18 119.26 119.52 1p7a h ALA 28 Ca -0.06 0.01 0.11 0.00 0.00 0.00 0.00 54.91 54.97 1p7a h ALA 28 Cb 0.77 -0.21 -0.08 0.00 0.00 0.00 0.00 17.79 18.27 1p7a h ALA 28 CO -0.02 0.25 0.24 -0.07 0.00 0.00 0.00 179.25 179.64 1p7a h LEU 29 N 0.97 0.21 -0.15 0.00 3.38 -0.52 0.12 115.31 119.32 1p7a h LEU 29 Ca 0.43 0.09 -0.23 0.00 0.09 0.00 0.00 57.88 58.27 1p7a h LEU 29 Cb 0.33 0.08 0.01 0.00 0.09 0.00 0.00 40.66 41.17 1p7a h LEU 29 CO -0.22 0.11 -0.91 -0.74 0.09 0.00 0.00 178.44 176.77 1p7a h HIS 30 N 0.40 0.83 0.00 1.13 -0.00 -0.64 -3.23 115.15 113.64 1p7a h HIS 30 Ca 0.34 -0.42 0.00 0.00 -0.00 0.00 0.00 60.37 60.29 1p7a h HIS 30 Cb 0.47 -0.11 0.00 0.00 -0.00 0.00 0.00 27.41 27.78 1p7a h HIS 30 CO -0.18 1.24 0.00 0.54 -0.00 0.00 0.00 177.93 179.53 1p7a n ARG 31 N -3.83 0.43 0.04 5.26 1.74 0.57 -2.92 116.66 117.95 1p7a n ARG 31 Ca -0.08 0.06 0.01 0.00 -0.77 0.00 0.00 57.85 57.07 1p7a n ARG 31 Cb 0.81 -1.50 0.33 0.00 -1.02 0.00 0.00 32.46 31.09 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 0.44 0.00 5.56 6.56 -0.85 0.13 116.57 128.41 1p7a h LYS 32 Ca 0.00 -0.09 0.00 0.00 -1.06 0.00 0.00 60.65 59.50 1p7a h LYS 32 Cb 0.15 -0.07 0.00 0.00 -0.57 0.00 0.00 32.23 31.74 1p7a h LYS 32 CO 0.00 0.49 0.00 2.89 -2.06 0.00 0.00 179.45 180.77 1p7a n ARG 33 N -4.29 0.54 -0.40 3.15 1.85 -1.15 -2.80 116.66 113.56 1p7a n ARG 33 Ca 0.01 0.02 0.02 0.00 -1.00 0.00 0.00 57.85 56.89 1p7a n ARG 33 Cb 0.24 -1.50 0.17 0.00 -1.05 0.00 0.00 32.46 30.32 1p7a n ARG 33 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 1p7a n HIS 34 N -1.21 0.94 1.44 2.89 8.25 0.03 -3.53 115.22 124.02 1p7a n HIS 34 Ca 0.16 -0.37 0.14 0.00 -0.26 0.00 0.00 57.72 57.39 1p7a n HIS 34 Cb 0.19 -0.30 0.67 0.00 1.12 0.00 0.00 29.99 31.67 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 0.23 0.62 -2.80 -0.41 2.81 -1.12 -3.41 117.12 113.04 1p7a n MET 35 Ca 0.13 -0.15 -0.12 0.00 -1.81 0.00 0.00 57.70 55.75 1p7a n MET 35 Cb 0.69 -1.50 0.01 0.00 -0.71 0.00 0.00 33.22 31.71 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 -1.06 1.37 0.00 4.03 4.32 -1.23 -5.21 117.00 119.22 1p7a n LEU 36 Ca 0.15 -4.09 0.00 0.00 -0.02 0.00 0.00 56.01 52.05 1p7a n LEU 36 Cb 0.26 0.48 0.00 0.00 -1.62 0.00 0.00 43.42 42.54 1p7a n LEU 36 CO 0.23 1.77 0.00 0.52 -1.22 0.00 0.00 177.39 178.69