#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yto s SER 2 N 0.00 1.29 -0.19 1.61 0.15 -1.26 -5.05 113.70 110.25 2yto s SER 2 Ca 0.00 -0.20 -0.19 0.00 0.70 0.00 0.00 55.95 56.26 2yto s SER 2 Cb 0.00 -0.32 -0.15 0.00 -1.71 0.00 0.00 66.02 63.83 2yto s SER 2 CO 0.00 0.08 0.13 0.28 1.20 0.00 0.00 173.24 174.93 2yto h SER 3 N 6.32 0.00 -2.23 5.45 0.02 -2.14 -3.51 113.55 117.46 2yto h SER 3 Ca -0.33 -0.39 0.00 0.00 -0.84 0.00 0.00 61.79 60.23 2yto h SER 3 Cb 1.17 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.71 2yto h SER 3 CO 0.49 1.30 0.00 0.61 -1.14 0.00 0.00 176.83 178.09 2yto n GLY 4 N 1.48 -0.13 2.82 -3.77 0.00 -1.26 -5.00 105.19 99.34 2yto n GLY 4 Ca -0.26 -2.24 -0.27 0.00 0.00 0.00 0.00 46.02 43.26 2yto n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2yto s SER 5 N -4.00 2.61 0.21 1.61 1.04 -1.26 -5.12 113.70 108.79 2yto s SER 5 Ca 0.00 -0.60 -0.30 0.00 0.48 0.00 0.00 55.95 55.54 2yto s SER 5 Cb 0.00 -0.73 -0.08 0.00 0.10 0.00 0.00 66.02 65.31 2yto s SER 5 CO 0.00 -0.22 1.07 -0.44 0.98 0.00 0.00 173.24 174.63 2yto s SER 6 N 1.76 7.32 0.00 7.02 0.01 -1.26 -4.57 113.70 123.99 2yto s SER 6 Ca 0.01 2.11 0.00 0.00 1.31 0.00 0.00 55.95 59.38 2yto s SER 6 Cb -0.15 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.47 2yto s SER 6 CO -0.07 -0.15 0.00 0.61 0.41 0.00 0.00 173.24 174.04 2yto n GLY 7 N 1.74 0.64 3.11 3.44 0.00 -1.26 -5.10 105.19 107.76 2yto n GLY 7 Ca 0.01 -0.80 -0.36 0.00 0.00 0.00 0.00 46.02 44.87 2yto n GLY 7 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2yto n THR 8 N 0.00 0.00 -2.92 2.61 -2.24 -1.26 -4.86 114.28 105.61 2yto n THR 8 Ca 0.00 -0.23 -0.41 0.00 -2.27 0.00 0.00 64.05 61.14 2yto n THR 8 Cb 0.00 -0.20 0.00 0.00 -2.10 0.00 0.00 70.33 68.04 2yto n THR 8 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2yto n GLY 9 N 2.96 5.47 1.60 3.38 0.00 -1.26 -4.82 105.19 112.52 2yto n GLY 9 Ca -0.00 -2.66 -0.08 0.00 0.00 0.00 0.00 46.02 43.28 2yto n GLY 9 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2yto n GLU 10 N 0.79 1.41 -3.62 1.61 0.00 -1.26 -4.89 120.64 114.67 2yto n GLU 10 Ca 0.33 -0.84 -0.35 0.00 0.00 0.00 0.00 57.16 56.30 2yto n GLU 10 Cb 0.32 -1.33 -0.05 0.00 0.00 0.00 0.00 31.44 30.37 2yto n GLU 10 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.13 177.28 2yto s LYS 11 N -0.96 3.73 0.18 3.44 1.02 -1.26 -5.01 119.74 120.89 2yto s LYS 11 Ca 0.16 0.14 -0.06 0.00 0.02 0.00 0.00 55.97 56.23 2yto s LYS 11 Cb 0.13 -3.05 0.09 0.00 -0.52 0.00 0.00 37.83 34.49 2yto s LYS 11 CO 0.01 0.60 1.53 -1.00 -0.92 0.00 0.00 175.35 175.57 2yto h PRO 12 N 3.93 0.73 -6.14 -1.68 0.13 -1.91 -3.44 132.00 123.62 2yto h PRO 12 Ca -0.50 -0.38 -0.58 0.00 -0.87 0.00 0.00 66.00 63.67 2yto h PRO 12 Cb 1.20 0.01 -0.04 0.00 0.13 0.00 0.00 31.00 32.31 2yto h PRO 12 CO 0.65 1.00 -0.33 0.71 -0.23 0.00 0.00 178.00 179.81 2yto s TYR 13 N -4.28 3.48 -0.22 1.56 2.02 -1.25 -5.05 117.35 113.60 2yto s TYR 13 Ca -0.09 0.51 -0.27 0.00 -0.37 0.00 0.00 57.07 56.86 2yto s TYR 13 Cb 0.12 -1.97 0.11 0.00 -0.40 0.00 0.00 41.96 39.81 2yto s TYR 13 CO 0.85 0.45 0.93 0.21 -1.57 0.00 0.00 175.55 176.41 2yto s LYS 14 N -2.67 0.65 -0.49 -0.62 2.20 -1.26 -2.52 119.74 115.02 2yto s LYS 14 Ca 0.40 0.53 -0.27 0.00 -0.36 0.00 0.00 55.97 56.27 2yto s LYS 14 Cb -0.12 0.31 0.03 0.00 -1.51 0.00 0.00 37.83 36.54 2yto s LYS 14 CO 0.25 -0.13 1.06 0.00 -0.36 0.00 0.00 175.35 176.17 2yto n SER 16 N 7.66 5.48 0.03 0.00 2.88 -1.26 -2.74 113.62 125.68 2yto n SER 16 Ca 0.09 -2.52 0.00 0.00 -1.33 0.00 0.00 58.87 55.11 2yto n SER 16 Cb 0.49 -1.18 0.00 0.00 -0.75 0.00 0.00 64.21 62.77 2yto n SER 16 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 2yto n ASP 17 N 1.55 0.08 -0.05 -3.46 2.03 -1.26 -4.98 116.55 110.46 2yto n ASP 17 Ca 0.13 0.10 -0.09 0.00 0.52 0.00 0.00 54.79 55.45 2yto n ASP 17 Cb 0.59 0.04 -0.04 0.00 -0.72 0.00 0.00 41.12 40.99 2yto n ASP 17 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2yto n GLY 19 N 2.62 0.21 2.97 0.00 0.00 -1.11 -5.10 105.19 104.78 2yto n GLY 19 Ca -0.18 -0.63 -0.28 0.00 0.00 0.00 0.00 46.02 44.93 2yto n GLY 19 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2yto s LYS 20 N 0.00 1.94 0.21 1.61 2.20 -1.25 -4.94 119.74 119.51 2yto s LYS 20 Ca 0.00 -0.42 -0.07 0.00 -0.36 0.00 0.00 55.97 55.12 2yto s LYS 20 Cb 0.00 -1.85 -0.06 0.00 -1.51 0.00 0.00 37.83 34.41 2yto s LYS 20 CO 0.00 -0.24 0.50 0.00 -0.36 0.00 0.00 175.35 175.25 2yto s ALA 21 N 1.54 3.65 0.28 3.13 0.00 -1.26 -0.14 121.76 128.95 2yto s ALA 21 Ca 0.04 -0.42 0.02 0.00 0.00 0.00 0.00 51.96 51.61 2yto s ALA 21 Cb -0.13 -2.31 -0.04 0.00 0.00 0.00 0.00 23.12 20.64 2yto s ALA 21 CO -0.09 0.51 0.15 -0.06 0.00 0.00 0.00 175.76 176.26 2yto s PHE 22 N -1.82 1.51 -0.10 0.00 0.40 -1.05 -4.96 117.98 111.96 2yto s PHE 22 Ca 0.45 -1.34 0.04 0.00 -0.60 0.00 0.00 56.93 55.48 2yto s PHE 22 Cb -0.11 -0.81 -0.09 0.00 0.51 0.00 0.00 43.02 42.52 2yto s PHE 22 CO 0.24 -0.52 -0.04 2.41 0.70 0.00 0.00 175.22 178.01 2yto n THR 23 N -0.50 0.65 -4.33 0.64 -1.04 -1.26 -3.93 114.28 104.51 2yto n THR 23 Ca 0.01 -0.32 -0.34 0.00 -2.04 0.00 0.00 64.05 61.36 2yto n THR 23 Cb 0.65 -0.84 -0.09 0.00 -1.82 0.00 0.00 70.33 68.23 2yto n THR 23 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2yto s ARG 24 N -2.23 2.96 0.17 -2.82 1.70 -1.26 -4.89 118.95 112.57 2yto s ARG 24 Ca -0.11 -0.45 -0.21 0.00 -0.47 0.00 0.00 55.73 54.50 2yto s ARG 24 Cb 0.03 -2.78 0.08 0.00 -0.57 0.00 0.00 34.95 31.71 2yto s ARG 24 CO 0.32 0.69 1.62 -0.22 -1.08 0.00 0.00 175.30 176.62 2yto h LYS 25 N 4.92 -0.19 -0.79 3.89 1.63 -2.01 -1.00 116.57 123.03 2yto h LYS 25 Ca -0.50 0.01 0.01 0.00 -0.85 0.00 0.00 60.65 59.31 2yto h LYS 25 Cb 1.19 0.04 -0.04 0.00 -0.60 0.00 0.00 32.23 32.82 2yto h LYS 25 CO 0.55 -0.12 0.51 0.77 -3.45 0.00 0.00 179.45 177.71 2yto h SER 26 N -0.19 0.91 -1.04 4.20 0.02 -1.98 -1.72 113.55 113.75 2yto h SER 26 Ca 0.18 -0.03 0.34 0.00 -0.84 0.00 0.00 61.79 61.43 2yto h SER 26 Cb 0.48 -0.23 -0.15 0.00 0.14 0.00 0.00 62.40 62.64 2yto h SER 26 CO -0.48 0.67 0.60 1.23 -1.14 0.00 0.00 176.83 177.71 2yto h GLY 27 N 1.07 1.97 0.00 -3.77 0.00 -1.59 -1.11 103.07 99.64 2yto h GLY 27 Ca 0.29 -0.22 -0.10 0.00 0.00 0.00 0.00 47.33 47.30 2yto h GLY 27 CO -0.06 -0.49 -0.65 -2.00 0.00 0.00 0.00 176.54 173.34 2yto h LEU 28 N 0.28 0.00 -0.90 3.11 5.85 -1.30 -3.28 115.31 119.07 2yto h LEU 28 Ca 0.74 -0.42 0.28 0.00 0.84 0.00 0.00 57.88 59.33 2yto h LEU 28 Cb 1.79 0.00 -0.17 0.00 0.37 0.00 0.00 40.66 42.66 2yto h LEU 28 CO -0.58 1.08 0.15 1.57 -0.34 0.00 0.00 178.44 180.31 2yto n HIS 29 N -4.56 0.70 -0.06 1.25 -0.00 -0.69 0.11 115.22 111.97 2yto n HIS 29 Ca -0.17 1.08 -0.11 0.00 0.46 0.00 0.00 57.72 58.97 2yto n HIS 29 Cb 0.45 -1.26 -0.05 0.00 -0.12 0.00 0.00 29.99 29.01 2yto n HIS 29 CO 0.00 0.00 0.00 0.82 0.46 0.00 0.00 176.34 177.62 2yto h ILE 30 N 0.00 1.25 -0.86 3.57 2.04 -1.39 -3.06 117.51 119.07 2yto h ILE 30 Ca 0.61 -0.86 0.04 0.00 1.00 0.00 0.00 64.86 65.65 2yto h ILE 30 Cb 1.37 1.43 -0.06 0.00 -0.74 0.00 0.00 36.82 38.83 2yto h ILE 30 CO -0.81 0.26 0.55 -0.74 0.00 0.00 0.00 178.15 177.41 2yto h HIS 31 N 0.11 1.02 -0.74 1.37 -0.00 0.69 -2.22 115.15 115.37 2yto h HIS 31 Ca 0.06 0.03 0.14 0.00 -0.00 0.00 0.00 60.37 60.59 2yto h HIS 31 Cb 0.39 -0.34 -0.09 0.00 -0.00 0.00 0.00 27.41 27.37 2yto h HIS 31 CO 0.03 0.56 0.28 1.96 -0.00 0.00 0.00 177.93 180.77 2yto h GLN 32 N 1.04 0.41 -0.94 5.26 4.20 -0.72 -0.13 115.11 124.23 2yto h GLN 32 Ca 0.36 -0.02 0.21 0.00 0.06 0.00 0.00 58.65 59.25 2yto h GLN 32 Cb 0.07 -0.09 -0.11 0.00 0.30 0.00 0.00 27.48 27.64 2yto h GLN 32 CO -0.14 0.27 0.50 1.96 -0.67 0.00 0.00 178.83 180.76 2yto h GLN 33 N 0.42 0.55 -0.89 1.46 4.20 -1.36 0.34 115.11 119.84 2yto h GLN 33 Ca 0.41 -0.03 0.26 0.00 0.06 0.00 0.00 58.65 59.34 2yto h GLN 33 Cb 0.61 -0.12 -0.04 0.00 0.30 0.00 0.00 27.48 28.23 2yto h GLN 33 CO -0.40 0.36 0.66 1.03 -0.67 0.00 0.00 178.83 179.81 2yto h SER 34 N 0.57 0.00 -0.25 1.46 0.87 -1.07 -1.50 113.55 113.62 2yto h SER 34 Ca 0.57 0.00 -0.21 0.00 -1.23 0.00 0.00 61.79 60.91 2yto h SER 34 Cb 0.99 0.00 -0.08 0.00 -0.44 0.00 0.00 62.40 62.87 2yto h SER 34 CO -0.45 0.00 -0.05 1.41 -0.53 0.00 0.00 176.83 177.21 2yto n HIS 35 N -4.21 0.47 -1.67 2.24 8.25 0.12 -4.94 115.22 115.49 2yto n HIS 35 Ca 0.18 -1.51 -0.47 0.00 -0.26 0.00 0.00 57.72 55.66 2yto n HIS 35 Cb 0.97 -1.21 -0.04 0.00 1.12 0.00 0.00 29.99 30.83 2yto n HIS 35 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2yto n THR 36 N 1.69 0.16 0.00 1.59 -2.24 -0.57 -4.80 114.28 110.12 2yto n THR 36 Ca 0.32 -0.03 0.00 0.00 -2.27 0.00 0.00 64.05 62.07 2yto n THR 36 Cb 0.71 -1.58 0.00 0.00 -2.10 0.00 0.00 70.33 67.36 2yto n THR 36 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2yto n GLY 37 N 3.64 1.93 3.09 3.38 0.00 -1.26 -5.19 105.19 110.78 2yto n GLY 37 Ca 0.19 -0.05 -0.09 0.00 0.00 0.00 0.00 46.02 46.07 2yto n GLY 37 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2yto s GLU 38 N 0.00 0.57 0.22 1.61 -1.05 -1.26 -5.05 118.70 113.73 2yto s GLU 38 Ca 0.00 -0.86 -0.09 0.00 -0.15 0.00 0.00 54.97 53.88 2yto s GLU 38 Cb 0.00 0.21 0.24 0.00 -0.44 0.00 0.00 34.13 34.14 2yto s GLU 38 CO 0.00 -0.13 1.84 -0.09 0.95 0.00 0.00 175.26 177.83 2yto h ARG 39 N 3.64 0.81 -5.80 -4.83 2.43 -2.03 -3.30 114.38 105.31 2yto h ARG 39 Ca -0.33 -0.05 -0.68 0.00 -0.81 0.00 0.00 59.98 58.11 2yto h ARG 39 Cb 1.18 -0.18 -0.09 0.00 -0.42 0.00 0.00 29.97 30.46 2yto h ARG 39 CO 0.53 0.54 2.16 -1.58 -1.51 0.00 0.00 179.97 180.11 2yto s HIS 40 N -6.10 2.82 -0.25 2.20 2.46 -1.26 -4.85 115.29 110.31 2yto s HIS 40 Ca -0.13 -1.66 -0.26 0.00 0.47 0.00 0.00 55.06 53.48 2yto s HIS 40 Cb 0.16 -4.73 0.12 0.00 -0.13 0.00 0.00 32.58 28.00 2yto s HIS 40 CO 0.77 -1.79 1.03 0.45 -2.47 0.00 0.00 174.74 172.73 2yto s SER 41 N 4.15 -0.43 0.44 9.88 0.15 -1.24 -5.14 113.70 121.51 2yto s SER 41 Ca 0.53 0.73 -0.23 0.00 0.70 0.00 0.00 55.95 57.69 2yto s SER 41 Cb 0.04 0.71 -0.08 0.00 -1.71 0.00 0.00 66.02 64.98 2yto s SER 41 CO 0.07 -0.20 1.10 -0.83 1.20 0.00 0.00 173.24 174.58 2yto s GLY 42 N -0.14 2.72 0.21 9.45 0.00 -1.26 -4.96 107.32 113.35 2yto s GLY 42 Ca 0.02 0.80 -0.02 0.00 0.00 0.00 0.00 44.72 45.52 2yto s GLY 42 CO -0.04 1.22 1.58 -0.56 0.00 0.00 0.00 173.10 175.30 2yto h PRO 43 N 2.14 0.57 -6.15 2.90 0.13 -2.00 -3.40 132.00 126.19 2yto h PRO 43 Ca -0.49 -0.30 -0.52 0.00 -0.87 0.00 0.00 66.00 63.82 2yto h PRO 43 Cb 1.23 0.01 -0.07 0.00 0.13 0.00 0.00 31.00 32.30 2yto h PRO 43 CO 0.61 0.89 1.18 -1.12 -0.23 0.00 0.00 178.00 179.33 2yto s SER 44 N -6.86 5.88 0.00 1.44 0.01 -1.26 -4.57 113.70 108.34 2yto s SER 44 Ca -0.07 -0.43 0.00 0.00 1.31 0.00 0.00 55.95 56.76 2yto s SER 44 Cb 0.12 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.80 2yto s SER 44 CO 0.83 -2.02 0.00 -1.54 0.41 0.00 0.00 173.24 170.92 2yto n SER 45 N 10.65 0.84 0.00 2.44 3.41 -1.26 -5.24 113.62 124.45 2yto n SER 45 Ca 0.16 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.77 2yto n SER 45 Cb 0.50 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.45 2yto n SER 45 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49