#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2f8b h SER 2 N 0.00 0.24 0.00 1.61 4.64 -2.12 -3.46 113.55 114.45 2f8b h SER 2 Ca 0.00 -0.34 0.00 0.00 -0.47 0.00 0.00 61.79 60.98 2f8b h SER 2 Cb 0.00 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.03 2f8b h SER 2 CO 0.00 0.52 0.00 1.41 -0.87 0.00 0.00 176.83 177.89 2f8b n HIS 3 N -4.75 0.00 -1.75 4.77 -0.00 -1.26 -4.89 115.22 107.34 2f8b n HIS 3 Ca -0.06 0.00 -0.42 0.00 -0.00 0.00 0.00 57.72 57.25 2f8b n HIS 3 Cb 0.23 0.00 -0.01 0.00 -0.00 0.00 0.00 29.99 30.21 2f8b n HIS 3 CO 0.00 0.00 0.00 -0.12 -0.00 0.00 0.00 176.34 176.22 2f8b n MET 4 N 0.00 2.67 -3.82 -0.41 0.00 -1.26 -5.03 117.12 109.26 2f8b n MET 4 Ca 0.00 0.94 -0.09 0.00 -0.00 0.00 0.00 57.70 58.55 2f8b n MET 4 Cb 0.00 -2.70 -0.04 0.00 0.00 0.00 0.00 33.22 30.47 2f8b n MET 4 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2f8b s ALA 5 N -0.36 -0.72 0.22 -5.12 0.00 -1.26 -5.18 121.76 109.34 2f8b s ALA 5 Ca 0.61 -0.43 -0.12 0.00 0.00 0.00 0.00 51.96 52.01 2f8b s ALA 5 Cb -0.50 0.89 -0.07 0.00 0.00 0.00 0.00 23.12 23.44 2f8b s ALA 5 CO 0.53 -0.82 0.58 -1.21 0.00 0.00 0.00 175.76 174.85 2f8b s GLU 6 N -3.92 3.89 -1.29 0.00 8.01 -1.26 -4.96 118.70 119.18 2f8b s GLU 6 Ca 0.13 0.40 -0.08 0.00 0.01 0.00 0.00 54.97 55.43 2f8b s GLU 6 Cb -0.01 -2.70 -0.10 0.00 -4.31 0.00 0.00 34.13 27.01 2f8b s GLU 6 CO 0.01 0.34 2.79 -0.35 0.01 0.00 0.00 175.26 178.06 2f8b n PRO 7 N 0.12 3.12 0.09 0.39 -0.04 -1.26 -3.72 135.00 133.69 2f8b n PRO 7 Ca -0.01 -1.88 0.00 0.00 -0.04 0.00 0.00 63.50 61.57 2f8b n PRO 7 Cb 0.52 -2.63 0.00 0.00 -0.04 0.00 0.00 33.50 31.36 2f8b n PRO 7 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 2f8b n GLN 8 N 3.62 0.00 -1.55 0.54 -0.06 -1.26 -4.30 117.38 114.37 2f8b n GLN 8 Ca 0.66 0.00 -0.19 0.00 -2.00 0.00 0.00 57.00 55.48 2f8b n GLN 8 Cb 0.27 0.00 -0.08 0.00 -4.06 0.00 0.00 30.24 26.36 2f8b n GLN 8 CO 0.00 0.00 0.00 -2.13 -0.20 0.00 0.00 177.06 174.73 2f8b n ARG 9 N -2.93 0.57 -4.60 3.69 0.00 -1.24 0.36 116.66 112.49 2f8b n ARG 9 Ca 0.00 -0.59 -0.24 0.00 -0.00 0.00 0.00 57.85 57.02 2f8b n ARG 9 Cb 0.00 -3.31 -0.14 0.00 0.00 0.00 0.00 32.46 29.00 2f8b n ARG 9 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.63 176.62 2f8b s HIS 10 N 12.71 1.65 -0.48 -0.14 3.76 -0.53 -4.97 115.29 127.29 2f8b s HIS 10 Ca 0.99 -0.36 0.03 0.00 -0.15 0.00 0.00 55.06 55.57 2f8b s HIS 10 Cb -0.25 -0.99 0.13 0.00 1.11 0.00 0.00 32.58 32.59 2f8b s HIS 10 CO 0.18 0.06 0.25 0.15 -0.85 0.00 0.00 174.74 174.53 2f8b s LYS 11 N -1.06 1.60 -0.59 1.40 1.02 -1.26 -0.75 119.74 120.09 2f8b s LYS 11 Ca 0.06 -2.29 -0.26 0.00 0.02 0.00 0.00 55.97 53.51 2f8b s LYS 11 Cb -0.08 -2.78 0.04 0.00 -0.52 0.00 0.00 37.83 34.49 2f8b s LYS 11 CO 0.01 -1.14 1.06 0.42 -0.92 0.00 0.00 175.35 174.79 2f8b s ILE 12 N 0.06 4.18 -0.21 2.17 1.01 0.31 -4.78 121.20 123.94 2f8b s ILE 12 Ca 0.17 0.42 -0.29 0.00 0.00 0.00 0.00 60.65 60.96 2f8b s ILE 12 Cb -0.25 -4.66 -0.04 0.00 0.01 0.00 0.00 42.46 37.52 2f8b s ILE 12 CO 0.00 -1.31 1.84 -0.22 0.00 0.00 0.00 174.94 175.25 2f8b s LEU 13 N 4.49 3.77 0.00 2.97 0.20 -1.26 -0.22 118.68 128.63 2f8b s LEU 13 Ca 0.34 1.75 0.01 0.00 0.69 0.00 0.00 54.13 56.91 2f8b s LEU 13 Cb -0.11 -3.53 0.01 0.00 -0.43 0.00 0.00 46.19 42.13 2f8b s LEU 13 CO 0.20 -1.49 0.06 0.00 -0.29 0.00 0.00 176.35 174.82 2f8b s VAL 15 N -2.02 2.50 -0.38 0.00 -7.23 -1.26 -0.74 120.40 111.26 2f8b s VAL 15 Ca 0.05 -2.24 -0.22 0.00 -1.81 0.00 0.00 61.98 57.76 2f8b s VAL 15 Cb -0.00 -2.54 0.01 0.00 0.56 0.00 0.00 36.38 34.41 2f8b s VAL 15 CO 0.03 -0.30 0.75 0.00 -0.31 0.00 0.00 175.10 175.27 2f8b n LYS 18 N -0.69 0.68 0.00 0.00 -0.00 -1.26 -4.81 118.16 112.08 2f8b n LYS 18 Ca 0.08 -0.09 0.00 0.00 -0.00 0.00 0.00 58.31 58.30 2f8b n LYS 18 Cb 0.04 -1.29 0.00 0.00 -0.00 0.00 0.00 35.03 33.77 2f8b n LYS 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2f8b n ASP 20 N -0.04 -2.61 -4.89 0.00 2.03 0.76 -4.97 116.55 106.83 2f8b n ASP 20 Ca 0.00 -1.04 -0.32 0.00 0.52 0.00 0.00 54.79 53.95 2f8b n ASP 20 Cb 0.31 -2.66 -0.05 0.00 -0.72 0.00 0.00 41.12 38.01 2f8b n ASP 20 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 2f8b s GLY 21 N -3.48 2.25 0.19 0.27 0.00 -1.25 -4.83 107.32 100.47 2f8b s GLY 21 Ca 0.62 -0.55 -0.31 0.00 0.00 0.00 0.00 44.72 44.48 2f8b s GLY 21 CO 0.93 -0.44 1.54 -1.60 0.00 0.00 0.00 173.10 173.53 2f8b s ARG 22 N -2.44 4.23 -0.13 2.90 3.00 -1.26 -0.19 118.95 125.06 2f8b s ARG 22 Ca 0.38 2.35 -0.00 0.00 -1.00 0.00 0.00 55.73 57.46 2f8b s ARG 22 Cb -0.13 -3.14 0.02 0.00 0.00 0.00 0.00 34.95 31.71 2f8b s ARG 22 CO 0.23 -0.56 -0.10 0.42 0.00 0.00 0.00 175.30 175.29 2f8b s ILE 23 N 0.84 1.23 -0.45 4.11 1.01 0.08 -4.87 121.20 123.15 2f8b s ILE 23 Ca 0.67 -0.43 -0.29 0.00 0.00 0.00 0.00 60.65 60.60 2f8b s ILE 23 Cb -0.43 -1.22 0.02 0.00 0.01 0.00 0.00 42.46 40.84 2f8b s ILE 23 CO 0.34 0.39 1.27 -0.70 0.00 0.00 0.00 174.94 176.24 2f8b s GLU 24 N 1.62 3.64 -0.82 2.79 -6.30 -1.26 -0.12 118.70 118.26 2f8b s GLU 24 Ca 0.05 0.72 -0.21 0.00 -2.50 0.00 0.00 54.97 53.03 2f8b s GLU 24 Cb -0.13 -3.97 0.10 0.00 0.00 0.00 0.00 34.13 30.13 2f8b s GLU 24 CO -0.09 -1.48 1.09 -0.51 0.02 0.00 0.00 175.26 174.28 2f8b s LEU 25 N 4.94 4.61 -0.27 2.70 1.43 0.69 -4.91 118.68 127.86 2f8b s LEU 25 Ca 0.54 -1.52 -0.29 0.00 -1.03 0.00 0.00 54.13 51.83 2f8b s LEU 25 Cb -0.10 -2.42 -0.00 0.00 0.03 0.00 0.00 46.19 43.69 2f8b s LEU 25 CO 0.32 -1.27 1.35 -0.89 0.23 0.00 0.00 176.35 176.09 2f8b s THR 26 N 3.51 4.08 -0.03 5.49 2.01 -1.26 -0.53 115.64 128.91 2f8b s THR 26 Ca 0.29 1.22 0.05 0.00 0.31 0.00 0.00 61.69 63.56 2f8b s THR 26 Cb -0.10 -4.07 -0.01 0.00 0.01 0.00 0.00 72.50 68.34 2f8b s THR 26 CO -0.01 -0.42 -0.18 0.68 -0.69 0.00 0.00 174.62 174.01 2f8b s VAL 27 N 4.44 1.43 -0.64 3.82 -7.23 0.07 -4.96 120.40 117.32 2f8b s VAL 27 Ca 0.59 -0.75 -0.15 0.00 -1.81 0.00 0.00 61.98 59.86 2f8b s VAL 27 Cb -0.18 -1.21 0.16 0.00 0.56 0.00 0.00 36.38 35.71 2f8b s VAL 27 CO 0.23 0.41 0.59 -0.70 -0.31 0.00 0.00 175.10 175.32 2f8b s GLU 28 N -0.21 3.18 -0.19 4.82 2.12 -1.26 -1.45 118.70 125.71 2f8b s GLU 28 Ca 0.02 -2.00 -0.12 0.00 0.36 0.00 0.00 54.97 53.23 2f8b s GLU 28 Cb -0.09 -4.32 0.06 0.00 0.26 0.00 0.00 34.13 30.04 2f8b s GLU 28 CO 0.01 -1.31 0.46 -1.12 -0.54 0.00 0.00 175.26 172.76 2f8b s SER 29 N 2.99 -0.56 0.45 -1.70 0.01 0.16 -4.83 113.70 110.21 2f8b s SER 29 Ca 0.09 0.99 -0.25 0.00 1.31 0.00 0.00 55.95 58.08 2f8b s SER 29 Cb -0.23 0.90 -0.08 0.00 0.21 0.00 0.00 66.02 66.82 2f8b s SER 29 CO -0.02 -0.19 1.42 -1.20 0.41 0.00 0.00 173.24 173.66 2f8b n SER 30 N 3.89 3.24 -0.24 2.44 7.64 -1.26 -4.39 113.62 124.94 2f8b n SER 30 Ca -0.20 1.11 0.16 0.00 1.01 0.00 0.00 58.87 60.95 2f8b n SER 30 Cb 0.56 -1.60 0.46 0.00 -1.01 0.00 0.00 64.21 62.62 2f8b n SER 30 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2f8b h ALA 31 N 2.23 2.04 0.00 -0.43 0.00 -1.94 0.33 119.26 121.50 2f8b h ALA 31 Ca -0.51 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.42 2f8b h ALA 31 Cb 1.27 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2f8b h ALA 31 CO 0.61 -0.30 -1.57 -1.91 0.00 0.00 0.00 179.25 176.08 2f8b n GLU 32 N -4.53 0.44 -0.14 0.00 2.13 -1.26 -1.10 120.64 116.19 2f8b n GLU 32 Ca 0.18 -0.12 -0.12 0.00 0.66 0.00 0.00 57.16 57.76 2f8b n GLU 32 Cb 0.58 -1.50 -0.02 0.00 0.27 0.00 0.00 31.44 30.78 2f8b n GLU 32 CO 0.00 0.00 0.00 0.22 -0.41 0.00 0.00 177.13 176.94 2f8b h ASP 33 N 0.00 0.92 -0.42 4.31 1.82 -1.69 0.09 116.42 121.45 2f8b h ASP 33 Ca 0.00 -0.42 -0.01 0.00 -0.39 0.00 0.00 57.03 56.21 2f8b h ASP 33 Cb 0.78 -0.26 -0.02 0.00 0.68 0.00 0.00 39.33 40.51 2f8b h ASP 33 CO 0.00 1.14 0.23 0.25 -1.61 0.00 0.00 179.24 179.24 2f8b h LEU 34 N 0.71 0.54 -0.23 2.28 6.46 -0.38 0.03 115.31 124.72 2f8b h LEU 34 Ca 0.09 -0.10 0.04 0.00 -0.12 0.00 0.00 57.88 57.78 2f8b h LEU 34 Cb 0.81 -0.14 -0.03 0.00 -0.73 0.00 0.00 40.66 40.57 2f8b h LEU 34 CO 0.07 0.48 0.01 -0.09 -0.62 0.00 0.00 178.44 178.29 2f8b h ARG 35 N 0.55 0.09 0.03 1.25 2.43 -1.06 0.34 114.38 118.01 2f8b h ARG 35 Ca 0.15 -0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.33 2f8b h ARG 35 Cb 0.07 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.58 2f8b h ARG 35 CO -0.02 0.06 -0.14 1.15 -1.51 0.00 0.00 179.97 179.50 2f8b h THR 36 N 0.09 0.65 -0.17 0.20 2.02 -0.51 0.18 112.91 115.38 2f8b h THR 36 Ca 0.11 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.29 2f8b h THR 36 Cb 0.13 0.65 -0.01 0.00 -1.74 0.00 0.00 68.15 67.19 2f8b h THR 36 CO -0.17 0.00 0.11 0.17 0.37 0.00 0.00 175.52 176.00 2f8b h LEU 37 N -0.26 0.19 -0.88 2.58 8.10 -0.65 0.33 115.31 124.72 2f8b h LEU 37 Ca 0.04 -0.00 -0.08 0.00 0.11 0.00 0.00 57.88 57.95 2f8b h LEU 37 Cb 0.30 -0.05 -0.01 0.00 -0.44 0.00 0.00 40.66 40.46 2f8b h LEU 37 CO -0.12 0.13 -0.36 -0.61 -4.11 0.00 0.00 178.44 173.37 2f8b h GLN 38 N 0.22 0.00 -0.08 0.17 4.15 0.81 -1.56 115.11 118.81 2f8b h GLN 38 Ca 0.06 0.00 -0.14 0.00 0.77 0.00 0.00 58.65 59.34 2f8b h GLN 38 Cb -0.01 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.66 2f8b h GLN 38 CO -0.01 0.36 -0.57 1.96 -1.93 0.00 0.00 178.83 178.64 2f8b h GLN 39 N 0.00 0.24 -0.23 1.69 1.08 0.14 0.21 115.11 118.24 2f8b h GLN 39 Ca -0.00 -0.16 0.05 0.00 -1.45 0.00 0.00 58.65 57.08 2f8b h GLN 39 Cb 0.92 0.02 -0.04 0.00 -0.05 0.00 0.00 27.48 28.32 2f8b h GLN 39 CO 0.05 0.75 -0.06 -0.07 -0.95 0.00 0.00 178.83 178.55 2f8b h LEU 40 N 0.19 -0.21 -0.75 1.46 3.38 -0.71 0.17 115.31 118.83 2f8b h LEU 40 Ca -0.00 0.07 0.04 0.00 0.09 0.00 0.00 57.88 58.08 2f8b h LEU 40 Cb 1.06 0.14 -0.05 0.00 0.09 0.00 0.00 40.66 41.90 2f8b h LEU 40 CO 0.09 -0.08 0.46 -0.26 0.09 0.00 0.00 178.44 178.74 2f8b h PHE 41 N -0.00 0.85 -0.06 1.13 -1.00 -0.74 -0.90 116.94 116.23 2f8b h PHE 41 Ca 0.11 0.02 -0.01 0.00 2.81 0.00 0.00 57.97 60.90 2f8b h PHE 41 Cb 0.17 -0.27 -0.00 0.00 3.61 0.00 0.00 35.95 39.45 2f8b h PHE 41 CO -0.24 0.46 -0.02 1.25 -1.61 0.00 0.00 178.31 178.15 2f8b h LEU 42 N 0.87 0.07 0.00 1.54 6.46 -0.35 -2.94 115.31 120.95 2f8b h LEU 42 Ca 0.31 -0.00 0.00 0.00 -0.12 0.00 0.00 57.88 58.07 2f8b h LEU 42 Cb 0.09 -0.02 0.00 0.00 -0.73 0.00 0.00 40.66 40.00 2f8b h LEU 42 CO -0.14 0.10 0.00 -0.24 -0.62 0.00 0.00 178.44 177.54 2f8b n SER 43 N -4.47 0.00 0.00 1.25 2.88 0.02 -4.89 113.62 108.41 2f8b n SER 43 Ca -0.02 0.72 0.00 0.00 -1.33 0.00 0.00 58.87 58.23 2f8b n SER 43 Cb 0.13 -0.48 0.00 0.00 -0.75 0.00 0.00 64.21 63.10 2f8b n SER 43 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 2f8b n THR 44 N -1.95 0.00 -2.63 2.46 -2.24 -0.74 -5.11 114.28 104.07 2f8b n THR 44 Ca 0.00 0.00 -0.36 0.00 -2.27 0.00 0.00 64.05 61.42 2f8b n THR 44 Cb 0.00 0.40 -0.05 0.00 -2.10 0.00 0.00 70.33 68.58 2f8b n THR 44 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2f8b s LEU 45 N 0.00 4.09 0.31 3.22 1.02 -0.82 -4.96 118.68 121.54 2f8b s LEU 45 Ca 0.00 1.92 -0.01 0.00 0.02 0.00 0.00 54.13 56.06 2f8b s LEU 45 Cb 0.00 -4.28 -0.01 0.00 0.02 0.00 0.00 46.19 41.92 2f8b s LEU 45 CO 0.00 -0.44 0.39 -0.94 0.02 0.00 0.00 176.35 175.38 2f8b s SER 46 N -1.75 0.87 0.22 2.29 1.04 -1.26 -4.38 113.70 110.72 2f8b s SER 46 Ca 0.59 -1.47 0.11 0.00 0.48 0.00 0.00 55.95 55.65 2f8b s SER 46 Cb -0.18 0.60 -0.04 0.00 0.10 0.00 0.00 66.02 66.49 2f8b s SER 46 CO 0.23 -1.17 -0.17 0.12 0.98 0.00 0.00 173.24 173.23 2f8b s PHE 47 N -3.38 2.42 -0.30 5.02 2.19 -1.26 -5.01 117.98 117.65 2f8b s PHE 47 Ca 0.33 -0.30 0.01 0.00 0.33 0.00 0.00 56.93 57.30 2f8b s PHE 47 Cb 0.01 -1.15 0.09 0.00 -1.31 0.00 0.00 43.02 40.66 2f8b s PHE 47 CO 0.20 0.56 0.05 0.14 1.83 0.00 0.00 175.22 178.00 2f8b s VAL 48 N -1.92 1.47 0.54 3.12 -7.23 -1.26 -3.57 120.40 111.54 2f8b s VAL 48 Ca 0.25 -1.65 -0.19 0.00 -1.81 0.00 0.00 61.98 58.58 2f8b s VAL 48 Cb -0.07 -2.01 -0.10 0.00 0.56 0.00 0.00 36.38 34.76 2f8b s VAL 48 CO 0.13 -0.51 0.50 0.00 -0.31 0.00 0.00 175.10 174.92 2f8b h PRO 50 N 0.34 0.00 0.34 0.00 0.13 -2.00 0.30 132.00 131.11 2f8b h PRO 50 Ca -0.45 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2f8b h PRO 50 Cb 1.40 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.50 2f8b h PRO 50 CO 0.48 0.00 -0.48 2.35 -0.23 0.00 0.00 178.00 180.11 2f8b h TRP 51 N 0.00 -1.37 0.00 1.56 7.01 -1.99 -1.67 115.95 119.49 2f8b h TRP 51 Ca 0.10 0.02 0.00 0.00 2.11 0.00 0.00 58.89 61.12 2f8b h TRP 51 Cb 0.45 0.55 0.00 0.00 -2.10 0.00 0.00 29.16 28.06 2f8b h TRP 51 CO 0.00 -0.61 0.00 0.00 -2.79 0.00 0.00 178.44 175.04 2f8b h ALA 53 N 2.04 -0.11 -0.05 0.00 0.00 -0.51 -0.38 119.26 120.25 2f8b h ALA 53 Ca 0.00 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 2f8b h ALA 53 Cb 0.82 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.66 2f8b h ALA 53 CO 0.00 -0.55 -0.10 1.15 0.00 0.00 0.00 179.25 179.75 2f8b h THR 54 N -0.13 1.42 -0.26 0.00 2.02 -0.83 -3.26 112.91 111.87 2f8b h THR 54 Ca -0.01 -1.41 -0.11 0.00 0.77 0.00 0.00 66.41 65.65 2f8b h THR 54 Cb 0.10 2.25 -0.01 0.00 -1.74 0.00 0.00 68.15 68.75 2f8b h THR 54 CO 0.02 0.39 -0.29 0.78 0.37 0.00 0.00 175.52 176.79 2f8b h ASN 55 N -0.35 0.54 0.00 4.18 -0.26 -0.79 -3.51 115.58 115.39 2f8b h ASN 55 Ca 0.00 -0.20 0.00 0.00 -0.56 0.00 0.00 56.30 55.54 2f8b h ASN 55 Cb 0.68 -0.15 0.00 0.00 -1.06 0.00 0.00 38.32 37.79 2f8b h ASN 55 CO 0.02 0.81 0.00 1.67 -1.06 0.00 0.00 177.43 178.87