#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 1.00 -0.21 1.61 0.15 -1.26 -5.01 113.70 109.97 2yto s SER 2 Ca 0.00 1.30 -0.05 0.00 0.70 0.00 0.00 55.95 57.90 2yto s SER 2 Cb 0.00 -2.01 -0.02 0.00 -1.71 0.00 0.00 66.02 62.29 2yto s SER 2 CO 0.00 -4.16 -0.02 -0.94 1.20 0.00 0.00 173.24 169.33 2yto s SER 3 N -2.85 4.57 0.00 5.45 1.04 -1.26 -4.84 113.70 115.81 2yto s SER 3 Ca 0.68 -0.31 0.00 0.00 0.48 0.00 0.00 55.95 56.80 2yto s SER 3 Cb -0.22 -1.79 0.00 0.00 0.10 0.00 0.00 66.02 64.12 2yto s SER 3 CO 0.62 0.01 0.00 0.61 0.98 0.00 0.00 173.24 175.46 2yto n GLY 4 N 4.60 -0.73 3.47 7.32 0.00 -1.26 -5.09 105.19 113.50 2yto n GLY 4 Ca -0.18 0.27 -0.48 0.00 0.00 0.00 0.00 46.02 45.64 2yto n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2yto n SER 5 N 0.00 2.19 0.00 1.61 3.41 -1.26 -4.85 113.62 114.72 2yto n SER 5 Ca 0.00 0.30 -0.02 0.00 -0.26 0.00 0.00 58.87 58.89 2yto n SER 5 Cb 0.00 -1.31 -0.01 0.00 -0.26 0.00 0.00 64.21 62.63 2yto n SER 5 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 2yto h SER 6 N 13.30 -0.10 0.00 4.04 0.87 -1.98 -3.49 113.55 126.19 2yto h SER 6 Ca -0.27 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.29 2yto h SER 6 Cb 1.31 0.03 0.00 0.00 -0.44 0.00 0.00 62.40 63.29 2yto h SER 6 CO 1.04 0.37 0.00 0.61 -0.53 0.00 0.00 176.83 178.32 2yto n GLY 7 N 1.49 0.00 3.35 5.77 0.00 -1.26 -5.11 105.19 109.42 2yto n GLY 7 Ca -0.01 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.55 2yto n GLY 7 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2yto s THR 8 N 0.00 5.12 0.00 2.61 2.01 -1.26 -4.88 115.64 119.23 2yto s THR 8 Ca 0.00 -1.53 0.00 0.00 0.31 0.00 0.00 61.69 60.47 2yto s THR 8 Cb 0.00 -4.46 0.00 0.00 0.01 0.00 0.00 72.50 68.05 2yto s THR 8 CO 0.00 -1.05 0.00 0.61 -0.69 0.00 0.00 174.62 173.49 2yto n GLY 9 N 5.01 -1.66 3.07 4.40 0.00 -1.26 -4.97 105.19 109.77 2yto n GLY 9 Ca -0.04 -1.20 -0.34 0.00 0.00 0.00 0.00 46.02 44.44 2yto n GLY 9 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2yto s GLU 10 N -5.05 2.14 0.18 1.61 -6.30 -1.26 -5.09 118.70 104.93 2yto s GLU 10 Ca 0.00 -2.24 -0.18 0.00 -2.50 0.00 0.00 54.97 50.05 2yto s GLU 10 Cb 0.00 -3.54 -0.08 0.00 0.00 0.00 0.00 34.13 30.51 2yto s GLU 10 CO 0.00 -1.10 0.65 0.15 0.02 0.00 0.00 175.26 174.98 2yto s LYS 11 N 0.39 4.17 0.39 4.30 1.02 -1.26 -4.98 119.74 123.77 2yto s LYS 11 Ca 0.13 0.74 0.18 0.00 0.02 0.00 0.00 55.97 57.04 2yto s LYS 11 Cb -0.22 -2.96 0.79 0.00 -0.52 0.00 0.00 37.83 34.92 2yto s LYS 11 CO -0.04 0.46 1.80 -1.00 -0.92 0.00 0.00 175.35 175.66 2yto h PRO 12 N 3.65 0.00 -4.89 -1.68 0.13 -1.93 -3.41 132.00 123.87 2yto h PRO 12 Ca -0.48 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 63.99 2yto h PRO 12 Cb 1.20 0.00 -0.23 0.00 0.13 0.00 0.00 31.00 32.10 2yto h PRO 12 CO 0.65 0.35 -0.60 0.71 -0.23 0.00 0.00 178.00 178.88 2yto s TYR 13 N -3.85 3.12 -0.23 1.56 2.02 -1.25 -5.06 117.35 113.66 2yto s TYR 13 Ca -0.01 -0.50 -0.04 0.00 -0.37 0.00 0.00 57.07 56.15 2yto s TYR 13 Cb 0.12 -2.28 0.08 0.00 -0.40 0.00 0.00 41.96 39.48 2yto s TYR 13 CO 0.68 -0.40 0.10 0.21 -1.57 0.00 0.00 175.55 174.57 2yto s LYS 14 N 1.61 0.29 0.72 -0.62 2.47 -1.26 -1.47 119.74 121.47 2yto s LYS 14 Ca 0.06 -0.42 -0.16 0.00 -1.56 0.00 0.00 55.97 53.89 2yto s LYS 14 Cb -0.16 -1.65 -0.01 0.00 -1.46 0.00 0.00 37.83 34.55 2yto s LYS 14 CO 0.05 -0.83 0.83 0.00 0.16 0.00 0.00 175.35 175.55 2yto n SER 16 N -1.25 2.34 -0.21 0.00 2.88 -1.26 -3.14 113.62 112.98 2yto n SER 16 Ca 0.12 -0.03 0.02 0.00 -1.33 0.00 0.00 58.87 57.64 2yto n SER 16 Cb 0.50 0.40 0.11 0.00 -0.75 0.00 0.00 64.21 64.47 2yto n SER 16 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 2yto h ASP 17 N 0.00 -0.27 0.00 -3.46 3.32 -2.00 -3.34 116.42 110.66 2yto h ASP 17 Ca -0.33 0.16 -0.01 0.00 0.02 0.00 0.00 57.03 56.86 2yto h ASP 17 Cb 1.66 0.28 -0.00 0.00 0.22 0.00 0.00 39.33 41.48 2yto h ASP 17 CO -0.01 -0.12 -1.05 0.00 -1.72 0.00 0.00 179.24 176.34 2yto n GLY 19 N 3.33 0.70 3.45 0.00 0.00 -1.19 -5.09 105.19 106.40 2yto n GLY 19 Ca -0.02 -0.36 -0.33 0.00 0.00 0.00 0.00 46.02 45.31 2yto n GLY 19 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2yto s LYS 20 N -0.18 3.05 0.02 1.61 1.02 -1.24 -4.88 119.74 119.15 2yto s LYS 20 Ca 0.00 -0.65 -0.09 0.00 0.02 0.00 0.00 55.97 55.25 2yto s LYS 20 Cb 0.00 -2.58 -0.05 0.00 -0.52 0.00 0.00 37.83 34.68 2yto s LYS 20 CO 0.00 0.41 0.33 0.00 -0.92 0.00 0.00 175.35 175.17 2yto s ALA 21 N -0.16 3.78 0.01 5.17 0.00 -1.26 -0.98 121.76 128.32 2yto s ALA 21 Ca 0.00 -0.44 0.02 0.00 0.00 0.00 0.00 51.96 51.54 2yto s ALA 21 Cb -0.13 -2.19 -0.01 0.00 0.00 0.00 0.00 23.12 20.78 2yto s ALA 21 CO 0.03 0.58 -0.06 -0.06 0.00 0.00 0.00 175.76 176.25 2yto s PHE 22 N -1.27 0.54 -0.00 0.00 0.40 -0.54 -5.01 117.98 112.09 2yto s PHE 22 Ca 0.28 -0.23 0.03 0.00 -0.60 0.00 0.00 56.93 56.41 2yto s PHE 22 Cb -0.14 -0.34 -0.25 0.00 0.51 0.00 0.00 43.02 42.81 2yto s PHE 22 CO 0.15 -0.03 0.83 1.15 0.70 0.00 0.00 175.22 178.02 2yto h THR 23 N 4.84 1.11 -5.48 0.64 2.02 -1.98 -3.34 112.91 110.72 2yto h THR 23 Ca -0.31 -2.84 -0.38 0.00 0.77 0.00 0.00 66.41 63.66 2yto h THR 23 Cb 1.20 2.65 0.05 0.00 -1.74 0.00 0.00 68.15 70.30 2yto h THR 23 CO 0.47 0.75 0.03 0.54 0.37 0.00 0.00 175.52 177.68 2yto n ARG 24 N -3.31 0.30 -0.11 6.66 1.74 -1.26 -4.94 116.66 115.73 2yto n ARG 24 Ca -0.15 -2.30 -0.22 0.00 -0.77 0.00 0.00 57.85 54.41 2yto n ARG 24 Cb 1.03 -0.39 -0.09 0.00 -1.02 0.00 0.00 32.46 31.99 2yto n ARG 24 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2yto n LYS 25 N -2.28 0.56 -0.27 5.56 4.01 -1.26 -4.41 118.16 120.07 2yto n LYS 25 Ca 0.13 0.40 0.06 0.00 -0.51 0.00 0.00 58.31 58.39 2yto n LYS 25 Cb 0.47 -1.60 0.29 0.00 -0.51 0.00 0.00 35.03 33.68 2yto n LYS 25 CO 0.00 0.00 0.00 0.77 -1.11 0.00 0.00 177.40 177.06 2yto h SER 26 N -1.00 0.80 -1.01 4.39 0.02 -1.99 -1.77 113.55 113.00 2yto h SER 26 Ca -0.43 0.01 0.25 0.00 -0.84 0.00 0.00 61.79 60.79 2yto h SER 26 Cb 1.32 -0.16 -0.13 0.00 0.14 0.00 0.00 62.40 63.58 2yto h SER 26 CO -0.26 0.50 0.60 1.23 -1.14 0.00 0.00 176.83 177.76 2yto h GLY 27 N 0.90 1.90 0.82 -3.77 0.00 -2.00 0.04 103.07 100.97 2yto h GLY 27 Ca 0.38 -0.30 -0.27 0.00 0.00 0.00 0.00 47.33 47.14 2yto h GLY 27 CO -0.15 -0.26 -1.29 -2.00 0.00 0.00 0.00 176.54 172.83 2yto h LEU 28 N 0.55 0.56 -0.31 3.11 5.85 -1.55 -2.98 115.31 120.55 2yto h LEU 28 Ca 0.65 -0.92 0.07 0.00 0.84 0.00 0.00 57.88 58.53 2yto h LEU 28 Cb 1.28 -0.18 -0.07 0.00 0.37 0.00 0.00 40.66 42.05 2yto h LEU 28 CO -0.48 1.60 -0.19 0.45 -0.34 0.00 0.00 178.44 179.48 2yto h HIS 29 N -0.15 -0.48 -0.00 1.25 3.86 -0.72 0.16 115.15 119.07 2yto h HIS 29 Ca -0.25 0.04 -0.00 0.00 -1.16 0.00 0.00 60.37 59.00 2yto h HIS 29 Cb 1.88 0.26 -0.00 0.00 1.06 0.00 0.00 27.41 30.61 2yto h HIS 29 CO 0.15 -0.26 0.00 0.82 0.86 0.00 0.00 177.93 179.49 2yto h ILE 30 N -0.15 1.20 0.05 2.45 2.04 -1.18 -3.23 117.51 118.68 2yto h ILE 30 Ca 0.16 -0.59 0.02 0.00 1.00 0.00 0.00 64.86 65.45 2yto h ILE 30 Cb 0.40 1.60 -0.05 0.00 -0.74 0.00 0.00 36.82 38.03 2yto h ILE 30 CO -0.40 0.16 -0.48 -0.74 0.00 0.00 0.00 178.15 176.69 2yto h HIS 31 N -0.25 -1.37 -0.84 1.37 -0.00 -1.29 -1.77 115.15 111.00 2yto h HIS 31 Ca 0.00 0.04 0.22 0.00 -0.00 0.00 0.00 60.37 60.63 2yto h HIS 31 Cb 0.25 0.59 -0.16 0.00 -0.00 0.00 0.00 27.41 28.10 2yto h HIS 31 CO 0.01 -0.55 -0.02 1.04 -0.00 0.00 0.00 177.93 178.42 2yto n GLN 32 N -5.47 -0.07 -0.25 5.26 6.02 0.52 0.15 117.38 123.55 2yto n GLN 32 Ca -0.07 1.27 0.05 0.00 -0.01 0.00 0.00 57.00 58.24 2yto n GLN 32 Cb 0.39 -1.99 0.18 0.00 1.02 0.00 0.00 30.24 29.83 2yto n GLN 32 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 177.06 178.01 2yto h GLN 33 N 0.00 0.25 -1.59 -1.09 1.08 -1.34 0.17 115.11 112.60 2yto h GLN 33 Ca 0.49 -0.01 0.47 0.00 -1.45 0.00 0.00 58.65 58.15 2yto h GLN 33 Cb 0.99 -0.06 -0.08 0.00 -0.05 0.00 0.00 27.48 28.28 2yto h GLN 33 CO -0.80 0.16 1.12 1.03 -0.95 0.00 0.00 178.83 179.39 2yto h SER 34 N 0.25 0.07 -0.05 1.46 0.87 0.14 -2.30 113.55 114.00 2yto h SER 34 Ca 0.41 0.04 -0.67 0.00 -1.23 0.00 0.00 61.79 60.33 2yto h SER 34 Cb 0.70 0.03 0.02 0.00 -0.44 0.00 0.00 62.40 62.71 2yto h SER 34 CO -0.52 -0.04 3.79 1.41 -0.53 0.00 0.00 176.83 180.94 2yto n HIS 35 N -4.21 2.46 0.00 2.24 8.25 0.60 -3.92 115.22 120.64 2yto n HIS 35 Ca 0.37 -3.09 0.00 0.00 -0.26 0.00 0.00 57.72 54.75 2yto n HIS 35 Cb 1.64 -2.47 0.00 0.00 1.12 0.00 0.00 29.99 30.28 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 3.55 0.00 0.00 1.59 -2.24 -0.87 -5.03 114.28 111.28 2yto n THR 36 Ca 0.78 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.56 2yto n THR 36 Cb 0.24 -0.70 0.00 0.00 -2.10 0.00 0.00 70.33 67.77 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 2.67 1.17 3.59 3.38 0.00 -1.25 -4.91 105.19 109.83 2yto n GLY 37 Ca 0.00 -0.02 -0.49 0.00 0.00 0.00 0.00 46.02 45.51 2yto n GLY 37 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2yto n GLU 38 N 0.00 1.27 -3.23 1.61 0.28 -1.26 -4.93 120.64 114.39 2yto n GLU 38 Ca 0.00 0.46 -0.39 0.00 -0.16 0.00 0.00 57.16 57.07 2yto n GLU 38 Cb 0.00 -2.02 -0.06 0.00 1.43 0.00 0.00 31.44 30.79 2yto n GLU 38 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 177.13 177.47 2yto s ARG 39 N -0.06 4.34 -0.19 3.44 3.52 -1.26 -5.06 118.95 123.68 2yto s ARG 39 Ca 0.76 0.62 -0.09 0.00 -0.13 0.00 0.00 55.73 56.90 2yto s ARG 39 Cb -0.86 -3.41 -0.05 0.00 -1.56 0.00 0.00 34.95 29.08 2yto s ARG 39 CO 0.50 0.20 0.12 -3.38 -0.81 0.00 0.00 175.30 171.93 2yto s HIS 40 N 0.41 3.40 0.13 5.12 -3.43 -1.26 -5.10 115.29 114.56 2yto s HIS 40 Ca 0.30 0.30 0.04 0.00 -0.80 0.00 0.00 55.06 54.90 2yto s HIS 40 Cb -0.17 -2.13 -0.04 0.00 -1.43 0.00 0.00 32.58 28.81 2yto s HIS 40 CO 0.14 0.30 0.14 -1.12 -2.00 0.00 0.00 174.74 172.20 2yto s SER 41 N 0.26 5.65 0.67 7.38 0.01 -1.26 -5.09 113.70 121.33 2yto s SER 41 Ca 0.08 -0.04 -0.17 0.00 1.31 0.00 0.00 55.95 57.13 2yto s SER 41 Cb -0.11 -1.53 0.01 0.00 0.21 0.00 0.00 66.02 64.59 2yto s SER 41 CO -0.01 0.11 1.24 -0.83 0.41 0.00 0.00 173.24 174.15 2yto s GLY 42 N -2.85 2.62 0.61 3.44 0.00 -1.26 -4.98 107.32 104.90 2yto s GLY 42 Ca 0.31 1.04 -0.17 0.00 0.00 0.00 0.00 44.72 45.90 2yto s GLY 42 CO 0.24 1.45 1.12 2.56 0.00 0.00 0.00 173.10 178.46 2yto s PRO 43 N -3.59 3.03 -0.14 2.90 0.04 -1.26 -5.03 135.00 130.95 2yto s PRO 43 Ca 0.78 1.48 -0.10 0.00 0.04 0.00 0.00 61.00 63.21 2yto s PRO 43 Cb -0.33 -1.97 -0.05 0.00 0.04 0.00 0.00 34.50 32.19 2yto s PRO 43 CO 0.41 -1.08 0.19 -1.54 0.04 0.00 0.00 177.00 175.02 2yto s SER 44 N -2.24 6.38 0.26 6.66 1.04 -1.26 -5.10 113.70 119.43 2yto s SER 44 Ca 0.69 0.45 0.07 0.00 0.48 0.00 0.00 55.95 57.64 2yto s SER 44 Cb -0.22 -2.11 -0.03 0.00 0.10 0.00 0.00 66.02 63.75 2yto s SER 44 CO 0.35 0.28 0.22 -0.44 0.98 0.00 0.00 173.24 174.63 2yto s SER 45 N -0.34 5.61 0.00 7.02 0.01 -1.26 -5.34 113.70 119.40 2yto s SER 45 Ca 0.14 -0.23 0.00 0.00 1.31 0.00 0.00 55.95 57.17 2yto s SER 45 Cb -0.12 -1.43 0.00 0.00 0.21 0.00 0.00 66.02 64.68 2yto s SER 45 CO 0.03 -0.06 0.01 0.61 0.41 0.00 0.00 173.24 174.24