#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 0.46 0.00 1.61 0.01 -1.04 -4.39 113.70 110.35 1p7a s SER 2 Ca 0.00 0.39 0.14 0.00 1.31 0.00 0.00 55.95 57.79 1p7a s SER 2 Cb 0.00 0.82 0.81 0.00 0.21 0.00 0.00 66.02 67.86 1p7a s SER 2 CO 0.00 -0.27 1.28 0.35 0.41 0.00 0.00 173.24 175.01 1p7a n THR 3 N 5.35 0.00 -3.69 1.44 -2.24 -0.79 -4.84 114.28 109.51 1p7a n THR 3 Ca -0.06 0.00 -0.24 0.00 -2.27 0.00 0.00 64.05 61.49 1p7a n THR 3 Cb 0.50 -0.51 0.05 0.00 -2.10 0.00 0.00 70.33 68.26 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 -0.83 -6.02 0.00 -0.78 1.74 -1.26 -4.68 116.66 104.83 1p7a n ARG 4 Ca 0.10 0.70 0.00 0.00 -0.77 0.00 0.00 57.85 57.88 1p7a n ARG 4 Cb 0.05 -5.53 0.00 0.00 -1.02 0.00 0.00 32.46 25.95 1p7a n ARG 4 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1p7a n GLY 5 N -1.62 -2.10 3.55 -0.13 0.00 -1.26 -5.07 105.19 98.56 1p7a n GLY 5 Ca -0.14 0.74 -0.39 0.00 0.00 0.00 0.00 46.02 46.23 1p7a n GLY 5 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1p7a s SER 6 N 2.00 5.40 -1.35 1.61 1.04 -1.26 -4.89 113.70 116.25 1p7a s SER 6 Ca 0.00 0.31 -0.14 0.00 0.48 0.00 0.00 55.95 56.60 1p7a s SER 6 Cb 0.00 -2.53 0.10 0.00 0.10 0.00 0.00 66.02 63.68 1p7a s SER 6 CO 0.00 -2.28 1.93 0.35 0.98 0.00 0.00 173.24 174.22 1p7a n THR 7 N 7.14 3.89 -3.93 2.02 -2.24 -1.26 -4.45 114.28 115.45 1p7a n THR 7 Ca 0.19 -3.82 -0.28 0.00 -2.27 0.00 0.00 64.05 57.87 1p7a n THR 7 Cb 0.51 -2.47 0.01 0.00 -2.10 0.00 0.00 70.33 66.28 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 4.03 -0.37 3.84 3.38 0.00 -0.78 -4.97 105.19 110.33 1p7a n GLY 8 Ca 0.46 0.16 -0.30 0.00 0.00 0.00 0.00 46.02 46.34 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 -3.56 2.73 0.33 -0.61 1.01 -1.26 -4.88 121.20 114.96 1p7a s ILE 9 Ca 0.35 0.24 0.00 0.00 0.00 0.00 0.00 60.65 61.24 1p7a s ILE 9 Cb -0.18 -3.09 0.00 0.00 0.01 0.00 0.00 42.46 39.19 1p7a s ILE 9 CO 0.86 -0.31 0.00 0.29 0.00 0.00 0.00 174.94 175.78 1p7a n LYS 10 N -3.38 -2.41 0.01 2.79 5.02 -1.26 -4.28 118.16 114.66 1p7a n LYS 10 Ca 0.07 1.86 0.03 0.00 -2.02 0.00 0.00 58.31 58.25 1p7a n LYS 10 Cb 0.58 -2.27 0.15 0.00 -0.02 0.00 0.00 35.03 33.47 1p7a n LYS 10 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 1p7a n PRO 11 N -1.91 0.01 -3.74 1.97 -0.04 -1.26 -3.98 135.00 126.06 1p7a n PRO 11 Ca 0.00 0.42 -0.30 0.00 -0.04 0.00 0.00 63.50 63.59 1p7a n PRO 11 Cb 0.22 -1.54 -0.13 0.00 -0.04 0.00 0.00 33.50 32.01 1p7a n PRO 11 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1p7a s PHE 12 N -3.04 2.08 0.14 0.54 0.08 -1.21 -5.08 117.98 111.50 1p7a s PHE 12 Ca 0.02 -2.45 0.06 0.00 0.12 0.00 0.00 56.93 54.68 1p7a s PHE 12 Cb 0.04 -1.96 -0.04 0.00 -0.57 0.00 0.00 43.02 40.48 1p7a s PHE 12 CO 0.11 -0.79 0.04 1.14 -0.10 0.00 0.00 175.22 175.63 1p7a s GLN 13 N 0.38 2.59 0.09 0.44 -2.07 -1.26 -0.60 119.66 119.25 1p7a s GLN 13 Ca 0.17 -0.95 -0.31 0.00 -1.82 0.00 0.00 55.36 52.45 1p7a s GLN 13 Cb -0.24 -2.50 -0.08 0.00 -1.09 0.00 0.00 33.01 29.10 1p7a s GLN 13 CO -0.01 0.49 1.46 0.00 -1.32 0.00 0.00 175.29 175.91 1p7a n PRO 15 N 4.45 0.39 -0.08 0.00 -0.04 -1.26 -0.53 135.00 137.93 1p7a n PRO 15 Ca 0.13 0.05 -0.11 0.00 -0.04 0.00 0.00 63.50 63.53 1p7a n PRO 15 Cb 0.42 -1.50 -0.07 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 -1.26 2.75 -0.07 3.54 2.03 -1.26 -4.68 116.55 117.60 1p7a n ASP 16 Ca 0.12 -0.07 -0.08 0.00 0.52 0.00 0.00 54.79 55.28 1p7a n ASP 16 Cb 0.18 -0.25 -0.10 0.00 -0.72 0.00 0.00 41.12 40.23 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 -2.66 -1.67 -4.40 0.00 5.75 0.31 -1.89 116.55 111.99 1p7a n ASP 18 Ca -0.25 0.00 -0.29 0.00 -0.01 0.00 0.00 54.79 54.24 1p7a n ASP 18 Cb 0.92 -0.39 0.24 0.00 -1.03 0.00 0.00 41.12 40.85 1p7a n ASP 18 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1p7a s ARG 19 N -2.37 -0.88 -0.02 0.11 0.52 -1.26 -1.86 118.95 113.20 1p7a s ARG 19 Ca 0.00 0.59 0.04 0.00 -0.52 0.00 0.00 55.73 55.84 1p7a s ARG 19 Cb 0.00 -1.58 -0.01 0.00 0.52 0.00 0.00 34.95 33.88 1p7a s ARG 19 CO 0.00 -3.63 -0.15 -1.12 0.02 0.00 0.00 175.30 170.43 1p7a s SER 20 N -2.92 1.74 -0.05 0.23 0.01 -1.26 -1.06 113.70 110.38 1p7a s SER 20 Ca 0.68 -0.27 -0.02 0.00 1.31 0.00 0.00 55.95 57.64 1p7a s SER 20 Cb -0.21 -0.26 0.03 0.00 0.21 0.00 0.00 66.02 65.79 1p7a s SER 20 CO 0.62 0.17 0.12 -0.36 0.41 0.00 0.00 173.24 174.19 1p7a s PHE 21 N -0.25 -0.12 0.24 2.43 0.40 0.23 -4.99 117.98 115.93 1p7a s PHE 21 Ca 0.04 0.38 0.02 0.00 -0.60 0.00 0.00 56.93 56.77 1p7a s PHE 21 Cb -0.07 -0.09 0.26 0.00 0.51 0.00 0.00 43.02 43.63 1p7a s PHE 21 CO -0.00 -0.13 1.59 0.66 0.70 0.00 0.00 175.22 178.04 1p7a h SER 22 N 7.03 0.41 -3.32 1.36 4.64 -1.94 -3.20 113.55 118.54 1p7a h SER 22 Ca -0.40 -0.20 -0.68 0.00 -0.47 0.00 0.00 61.79 60.03 1p7a h SER 22 Cb 1.15 -0.12 -0.15 0.00 -0.31 0.00 0.00 62.40 62.97 1p7a h SER 22 CO 0.44 0.84 -0.62 -0.13 -0.87 0.00 0.00 176.83 176.49 1p7a s ARG 23 N -4.01 2.98 0.50 4.77 0.52 -1.26 -4.79 118.95 117.66 1p7a s ARG 23 Ca -0.06 -0.41 0.23 0.00 -0.52 0.00 0.00 55.73 54.98 1p7a s ARG 23 Cb 0.12 -2.79 1.33 0.00 0.52 0.00 0.00 34.95 34.14 1p7a s ARG 23 CO 0.81 0.70 2.06 1.03 0.02 0.00 0.00 175.30 179.91 1p7a h SER 24 N 5.11 0.00 -0.66 0.23 0.87 -1.93 -0.52 113.55 116.66 1p7a h SER 24 Ca -0.51 0.00 -0.08 0.00 -1.23 0.00 0.00 61.79 59.97 1p7a h SER 24 Cb 1.19 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 63.13 1p7a h SER 24 CO 0.54 0.13 0.10 -0.78 -0.53 0.00 0.00 176.83 176.30 1p7a h ASP 25 N 0.00 1.05 -0.14 6.23 3.58 -1.97 -1.32 116.42 123.86 1p7a h ASP 25 Ca -0.00 -0.25 -0.12 0.00 0.42 0.00 0.00 57.03 57.07 1p7a h ASP 25 Cb 0.31 -0.28 -0.01 0.00 1.72 0.00 0.00 39.33 41.07 1p7a h ASP 25 CO 0.02 1.04 -0.33 0.45 -2.88 0.00 0.00 179.24 177.54 1p7a h HIS 26 N 1.02 0.74 0.54 0.28 3.86 -1.53 -2.09 115.15 117.98 1p7a h HIS 26 Ca 0.20 -0.19 -0.02 0.00 -1.16 0.00 0.00 60.37 59.20 1p7a h HIS 26 Cb 0.45 -0.17 -0.02 0.00 1.06 0.00 0.00 27.41 28.73 1p7a h HIS 26 CO 0.03 0.89 -0.48 1.25 0.86 0.00 0.00 177.93 180.48 1p7a h LEU 27 N 0.54 -1.30 -1.28 2.43 5.85 -0.94 -2.70 115.31 117.92 1p7a h LEU 27 Ca 0.06 0.10 0.11 0.00 0.84 0.00 0.00 57.88 58.99 1p7a h LEU 27 Cb 0.83 0.42 -0.06 0.00 0.37 0.00 0.00 40.66 42.22 1p7a h LEU 27 CO 0.07 -0.66 0.55 0.00 -0.34 0.00 0.00 178.44 178.06 1p7a h ALA 28 N -0.83 1.75 -0.62 1.25 0.00 -1.14 0.16 119.26 119.83 1p7a h ALA 28 Ca -0.06 0.00 0.08 0.00 0.00 0.00 0.00 54.91 54.92 1p7a h ALA 28 Cb 0.87 -0.17 -0.06 0.00 0.00 0.00 0.00 17.79 18.43 1p7a h ALA 28 CO -0.03 0.06 0.28 -0.07 0.00 0.00 0.00 179.25 179.49 1p7a h LEU 29 N 0.77 0.35 -0.19 0.00 3.38 -1.06 -0.42 115.31 118.13 1p7a h LEU 29 Ca 0.41 0.06 -0.22 0.00 0.09 0.00 0.00 57.88 58.21 1p7a h LEU 29 Cb 0.52 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.28 1p7a h LEU 29 CO -0.17 0.22 -0.92 -0.74 0.09 0.00 0.00 178.44 176.91 1p7a h HIS 30 N 0.50 0.62 0.00 1.13 -0.00 -1.01 -3.19 115.15 113.20 1p7a h HIS 30 Ca 0.30 -0.33 0.00 0.00 -0.00 0.00 0.00 60.37 60.34 1p7a h HIS 30 Cb 0.30 -0.07 0.00 0.00 -0.00 0.00 0.00 27.41 27.64 1p7a h HIS 30 CO -0.13 1.14 0.00 0.54 -0.00 0.00 0.00 177.93 179.49 1p7a n ARG 31 N -3.76 0.79 0.16 5.26 1.74 0.46 -3.14 116.66 118.17 1p7a n ARG 31 Ca -0.06 0.00 0.05 0.00 -0.77 0.00 0.00 57.85 57.07 1p7a n ARG 31 Cb 0.82 -1.46 0.52 0.00 -1.02 0.00 0.00 32.46 31.32 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 0.18 -0.13 5.56 6.56 -1.11 0.14 116.57 127.77 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 0.00 -0.04 0.00 0.00 -0.57 0.00 0.00 32.23 31.62 1p7a h LYS 32 CO 0.00 0.19 0.00 2.89 -2.06 0.00 0.00 179.45 180.47 1p7a n ARG 33 N -4.44 1.43 -0.14 3.15 1.85 -1.19 -3.03 116.66 114.29 1p7a n ARG 33 Ca -0.01 -0.66 0.06 0.00 -1.00 0.00 0.00 57.85 56.25 1p7a n ARG 33 Cb 0.14 -1.29 0.14 0.00 -1.05 0.00 0.00 32.46 30.40 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 -0.08 0.38 0.05 2.89 8.25 0.49 -3.99 115.22 123.20 1p7a n HIS 34 Ca 0.13 -0.36 -0.06 0.00 -0.26 0.00 0.00 57.72 57.17 1p7a n HIS 34 Cb 0.20 -0.02 -0.04 0.00 1.12 0.00 0.00 29.99 31.26 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 2.33 -0.22 -0.73 -0.41 2.86 -1.48 -3.42 114.93 113.86 1p7a h MET 35 Ca 0.00 0.01 -0.32 0.00 -2.06 0.00 0.00 59.70 57.33 1p7a h MET 35 Cb 0.69 0.05 -0.29 0.00 0.06 0.00 0.00 31.60 32.12 1p7a h MET 35 CO 0.00 -0.00 -0.83 1.28 1.06 0.00 0.00 176.91 178.42 1p7a n LEU 36 N -4.91 -0.28 0.00 1.22 4.32 -1.26 -5.17 117.00 110.91 1p7a n LEU 36 Ca -0.04 -3.88 0.00 0.00 -0.02 0.00 0.00 56.01 52.07 1p7a n LEU 36 Cb 0.16 0.44 0.00 0.00 -1.62 0.00 0.00 43.42 42.40 1p7a n LEU 36 CO 0.13 1.88 0.00 0.52 -1.22 0.00 0.00 177.39 178.70