#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eor s SER 2 N 0.00 5.56 -0.21 1.61 0.15 -1.26 -4.88 113.70 114.66 2eor s SER 2 Ca 0.00 -2.85 -0.21 0.00 0.70 0.00 0.00 55.95 53.59 2eor s SER 2 Cb 0.00 -1.93 -0.19 0.00 -1.71 0.00 0.00 66.02 62.19 2eor s SER 2 CO 0.00 -0.40 0.17 -1.20 1.20 0.00 0.00 173.24 173.01 2eor n SER 3 N 3.55 1.87 -1.30 5.45 7.64 -1.26 -5.09 113.62 124.47 2eor n SER 3 Ca 0.09 0.41 0.16 0.00 1.01 0.00 0.00 58.87 60.55 2eor n SER 3 Cb 0.40 -0.95 -0.08 0.00 -1.01 0.00 0.00 64.21 62.57 2eor n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2eor n GLY 4 N 1.43 -3.02 3.73 0.23 0.00 -1.26 -5.00 105.19 101.30 2eor n GLY 4 Ca -0.34 -1.11 -0.28 0.00 0.00 0.00 0.00 46.02 44.30 2eor n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2eor s SER 5 N -6.98 4.24 0.47 1.61 1.04 -1.26 -5.16 113.70 107.66 2eor s SER 5 Ca 0.00 -1.31 0.06 0.00 0.48 0.00 0.00 55.95 55.18 2eor s SER 5 Cb 0.00 -0.11 -0.01 0.00 0.10 0.00 0.00 66.02 66.00 2eor s SER 5 CO 0.00 -0.66 0.31 -0.44 0.98 0.00 0.00 173.24 173.43 2eor s SER 6 N -3.89 4.65 0.00 7.02 0.01 -1.26 -5.15 113.70 115.08 2eor s SER 6 Ca 0.30 -1.09 0.00 0.00 1.31 0.00 0.00 55.95 56.48 2eor s SER 6 Cb 0.04 -0.10 0.00 0.00 0.21 0.00 0.00 66.02 66.17 2eor s SER 6 CO 0.17 -0.81 0.00 0.61 0.41 0.00 0.00 173.24 173.62 2eor n GLY 7 N -1.53 5.26 3.77 3.44 0.00 -1.26 -5.14 105.19 109.73 2eor n GLY 7 Ca -0.01 -1.18 -0.37 0.00 0.00 0.00 0.00 46.02 44.46 2eor n GLY 7 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2eor s THR 8 N 0.35 3.08 0.00 2.61 2.01 -1.26 -4.89 115.64 117.54 2eor s THR 8 Ca 0.00 0.82 0.00 0.00 0.31 0.00 0.00 61.69 62.82 2eor s THR 8 Cb 0.00 -3.42 0.00 0.00 0.01 0.00 0.00 72.50 69.09 2eor s THR 8 CO 0.00 -0.00 0.00 0.61 -0.69 0.00 0.00 174.62 174.54 2eor n GLY 9 N 0.47 2.85 3.48 4.40 0.00 -1.26 -5.15 105.19 109.98 2eor n GLY 9 Ca 0.07 -1.51 -0.17 0.00 0.00 0.00 0.00 46.02 44.41 2eor n GLY 9 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2eor s GLU 10 N -5.10 1.07 -0.57 1.61 2.12 -1.26 -5.12 118.70 111.45 2eor s GLU 10 Ca 0.00 0.08 -0.05 0.00 0.36 0.00 0.00 54.97 55.36 2eor s GLU 10 Cb 0.00 0.50 0.15 0.00 0.26 0.00 0.00 34.13 35.04 2eor s GLU 10 CO 0.00 -0.36 0.41 0.15 -0.54 0.00 0.00 175.26 174.92 2eor s LYS 11 N -1.69 2.54 0.00 4.30 3.01 -1.26 -4.75 119.74 121.89 2eor s LYS 11 Ca -0.09 -2.22 0.10 0.00 -1.01 0.00 0.00 55.97 52.75 2eor s LYS 11 Cb -0.00 -3.82 0.57 0.00 -1.01 0.00 0.00 37.83 33.57 2eor s LYS 11 CO 0.05 -1.17 1.02 -0.35 0.51 0.00 0.00 175.35 175.41 2eor n PRO 12 N 4.06 0.49 -4.27 -1.68 -0.04 -1.21 -4.64 135.00 127.70 2eor n PRO 12 Ca 0.03 0.00 -0.17 0.00 -0.04 0.00 0.00 63.50 63.32 2eor n PRO 12 Cb 0.40 -1.31 -0.10 0.00 -0.04 0.00 0.00 33.50 32.45 2eor n PRO 12 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2eor s TYR 13 N -2.00 1.45 0.19 0.54 2.02 -0.60 -5.01 117.35 113.94 2eor s TYR 13 Ca 0.14 -0.63 -0.23 0.00 -0.37 0.00 0.00 57.07 55.99 2eor s TYR 13 Cb 0.07 -0.72 0.05 0.00 -0.40 0.00 0.00 41.96 40.96 2eor s TYR 13 CO 0.11 0.19 0.71 -0.80 -1.57 0.00 0.00 175.55 174.18 2eor s ASN 14 N -2.95 -0.39 -0.58 2.29 0.01 -1.26 -0.18 114.94 111.88 2eor s ASN 14 Ca 0.16 -0.28 -0.05 0.00 -0.71 0.00 0.00 52.86 51.98 2eor s ASN 14 Cb -0.01 0.62 0.15 0.00 0.41 0.00 0.00 41.25 42.42 2eor s ASN 14 CO 0.03 -1.08 0.42 0.00 -1.51 0.00 0.00 177.10 174.96 2eor n GLU 16 N 3.97 0.10 -0.03 0.00 2.13 -1.26 0.15 120.64 125.70 2eor n GLU 16 Ca 0.04 0.58 -0.13 0.00 0.66 0.00 0.00 57.16 58.31 2eor n GLU 16 Cb 0.40 -1.92 -0.11 0.00 0.27 0.00 0.00 31.44 30.08 2eor n GLU 16 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 2eor h GLU 17 N 0.00 -0.02 0.00 5.31 3.07 -1.97 -3.42 114.58 117.55 2eor h GLU 17 Ca 0.00 0.00 -0.21 0.00 -0.50 0.00 0.00 59.36 58.65 2eor h GLU 17 Cb 0.19 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 28.07 2eor h GLU 17 CO 0.00 0.65 -1.72 0.00 -1.40 0.00 0.00 179.01 176.54 2eor n GLY 19 N 2.32 1.41 3.68 0.00 0.00 0.39 -5.05 105.19 107.94 2eor n GLY 19 Ca -0.25 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.42 2eor n GLY 19 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2eor s LYS 20 N 0.00 3.76 0.41 1.61 2.20 -1.24 -4.81 119.74 121.68 2eor s LYS 20 Ca 0.00 -0.32 -0.13 0.00 -0.36 0.00 0.00 55.97 55.16 2eor s LYS 20 Cb 0.00 -3.15 -0.08 0.00 -1.51 0.00 0.00 37.83 33.09 2eor s LYS 20 CO 0.00 0.41 0.82 0.00 -0.36 0.00 0.00 175.35 176.22 2eor s ALA 21 N -0.02 3.26 0.00 3.13 0.00 -1.26 0.49 121.76 127.36 2eor s ALA 21 Ca 0.06 -0.03 -0.01 0.00 0.00 0.00 0.00 51.96 51.98 2eor s ALA 21 Cb -0.12 -2.83 -0.01 0.00 0.00 0.00 0.00 23.12 20.16 2eor s ALA 21 CO 0.01 0.03 0.02 -0.06 0.00 0.00 0.00 175.76 175.75 2eor s PHE 22 N -2.33 0.10 -0.04 0.00 0.40 0.75 -4.87 117.98 111.99 2eor s PHE 22 Ca 0.54 -0.20 -0.18 0.00 -0.60 0.00 0.00 56.93 56.49 2eor s PHE 22 Cb -0.10 -0.08 -0.31 0.00 0.51 0.00 0.00 43.02 43.03 2eor s PHE 22 CO 0.27 -0.12 0.82 0.82 0.70 0.00 0.00 175.22 177.71 2eor h ILE 23 N 4.81 1.30 -3.01 0.64 2.04 -1.85 -1.58 117.51 119.86 2eor h ILE 23 Ca -0.28 -2.54 -0.64 0.00 1.00 0.00 0.00 64.86 62.39 2eor h ILE 23 Cb 1.21 3.02 -0.17 0.00 -0.74 0.00 0.00 36.82 40.14 2eor h ILE 23 CO 0.44 0.75 -0.79 -1.00 0.00 0.00 0.00 178.15 177.55 2eor s HIS 24 N -2.49 2.36 0.14 1.37 3.76 -1.26 -4.47 115.29 114.70 2eor s HIS 24 Ca -0.14 -0.33 -0.15 0.00 -0.15 0.00 0.00 55.06 54.29 2eor s HIS 24 Cb 0.03 -1.15 0.02 0.00 1.11 0.00 0.00 32.58 32.59 2eor s HIS 24 CO 0.85 0.53 1.69 0.38 -0.85 0.00 0.00 174.74 177.35 2eor h ASP 25 N 3.00 0.62 -0.96 1.40 3.04 -1.98 -2.64 116.42 118.89 2eor h ASP 25 Ca -0.46 -0.17 0.17 0.00 -3.24 0.00 0.00 57.03 53.34 2eor h ASP 25 Cb 1.22 -0.16 -0.09 0.00 -1.04 0.00 0.00 39.33 39.26 2eor h ASP 25 CO 0.51 0.61 0.61 0.28 -2.04 0.00 0.00 179.24 179.21 2eor h SER 26 N 0.58 0.69 0.51 4.15 0.02 -1.98 0.18 113.55 117.71 2eor h SER 26 Ca 0.15 0.07 -0.02 0.00 -0.84 0.00 0.00 61.79 61.14 2eor h SER 26 Cb 0.19 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 62.67 2eor h SER 26 CO -0.01 0.30 -0.24 1.56 -1.14 0.00 0.00 176.83 177.29 2eor h GLN 27 N 0.70 -0.65 -0.51 3.45 4.20 -1.90 -0.99 115.11 119.42 2eor h GLN 27 Ca 0.52 0.04 0.04 0.00 0.06 0.00 0.00 58.65 59.31 2eor h GLN 27 Cb 0.87 0.15 -0.04 0.00 0.30 0.00 0.00 27.48 28.75 2eor h GLN 27 CO -0.28 -0.35 0.26 1.25 -0.67 0.00 0.00 178.83 179.04 2eor h LEU 28 N -0.94 0.37 -1.03 1.46 5.85 -1.19 -1.93 115.31 117.90 2eor h LEU 28 Ca -0.07 0.03 0.02 0.00 0.84 0.00 0.00 57.88 58.70 2eor h LEU 28 Cb 0.61 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.54 2eor h LEU 28 CO 0.11 0.26 0.65 1.56 -0.34 0.00 0.00 178.44 180.68 2eor h GLN 29 N 0.50 1.26 0.00 1.25 1.08 -0.67 0.16 115.11 118.70 2eor h GLN 29 Ca 0.22 -0.08 0.00 0.00 -1.45 0.00 0.00 58.65 57.35 2eor h GLN 29 Cb 0.13 -0.29 0.00 0.00 -0.05 0.00 0.00 27.48 27.27 2eor h GLN 29 CO -0.16 0.84 0.00 -1.91 -0.95 0.00 0.00 178.83 176.65 2eor n GLU 30 N -4.41 0.11 -0.09 1.46 4.07 -0.38 -2.88 120.64 118.53 2eor n GLU 30 Ca 0.12 0.20 -0.14 0.00 -0.06 0.00 0.00 57.16 57.29 2eor n GLU 30 Cb 0.05 -1.50 -0.08 0.00 -0.06 0.00 0.00 31.44 29.85 2eor n GLU 30 CO 0.00 0.00 0.00 1.58 -0.06 0.00 0.00 177.13 178.65 2eor n HIS 31 N -1.37 0.00 0.20 4.31 -0.00 0.12 -4.42 115.22 114.06 2eor n HIS 31 Ca 0.05 0.00 0.11 0.00 0.46 0.00 0.00 57.72 58.35 2eor n HIS 31 Cb 0.13 -0.72 0.61 0.00 -0.12 0.00 0.00 29.99 29.89 2eor n HIS 31 CO 0.00 0.00 0.00 1.96 0.46 0.00 0.00 176.34 178.76 2eor h GLN 32 N -0.10 0.00 0.00 1.57 1.08 -0.66 0.53 115.11 117.53 2eor h GLN 32 Ca -0.43 0.00 -0.05 0.00 -1.45 0.00 0.00 58.65 56.72 2eor h GLN 32 Cb 1.62 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 29.04 2eor h GLN 32 CO -0.10 0.00 -0.22 0.07 -0.95 0.00 0.00 178.83 177.63 2eor h ARG 33 N 0.00 0.00 0.00 1.46 0.11 -1.76 -2.08 114.38 112.11 2eor h ARG 33 Ca 0.00 0.00 -0.04 0.00 0.10 0.00 0.00 59.98 60.04 2eor h ARG 33 Cb 0.28 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.35 2eor h ARG 33 CO 0.00 0.22 -0.18 -0.84 0.10 0.00 0.00 179.97 179.27 2eor h ILE 34 N 0.00 0.38 0.23 0.08 3.07 -1.17 -3.18 117.51 116.93 2eor h ILE 34 Ca -0.00 -1.17 -0.33 0.00 1.55 0.00 0.00 64.86 64.91 2eor h ILE 34 Cb 0.50 1.88 0.03 0.00 -0.27 0.00 0.00 36.82 38.97 2eor h ILE 34 CO 0.03 0.18 -1.45 0.45 -1.05 0.00 0.00 178.15 176.31 2eor h HIS 35 N 0.00 0.88 -1.00 0.16 3.86 -1.51 -3.42 115.15 114.11 2eor h HIS 35 Ca -0.00 -0.64 -0.25 0.00 -1.16 0.00 0.00 60.37 58.31 2eor h HIS 35 Cb 0.87 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 29.29 2eor h HIS 35 CO 0.00 1.51 0.79 0.95 0.86 0.00 0.00 177.93 182.05 2eor s THR 36 N -2.61 3.13 0.00 2.45 -4.23 -1.11 -4.51 115.64 108.76 2eor s THR 36 Ca -0.08 -0.04 0.00 0.00 -1.18 0.00 0.00 61.69 60.39 2eor s THR 36 Cb 0.05 -3.31 0.00 0.00 1.34 0.00 0.00 72.50 70.58 2eor s THR 36 CO 0.93 -0.30 0.00 0.61 -0.54 0.00 0.00 174.62 175.33 2eor n GLY 37 N 6.44 0.58 2.32 3.99 0.00 -1.26 -4.98 105.19 112.28 2eor n GLY 37 Ca 0.39 0.23 -0.23 0.00 0.00 0.00 0.00 46.02 46.41 2eor n GLY 37 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2eor n GLU 38 N 0.00 2.24 -3.63 1.61 4.07 -1.26 -4.82 120.64 118.85 2eor n GLU 38 Ca 0.00 -2.00 -0.06 0.00 -0.06 0.00 0.00 57.16 55.04 2eor n GLU 38 Cb 0.00 -2.04 -0.06 0.00 -0.06 0.00 0.00 31.44 29.28 2eor n GLU 38 CO 0.00 0.00 0.00 0.21 -0.06 0.00 0.00 177.13 177.28 2eor s LYS 39 N -1.26 0.29 0.67 5.31 2.20 -1.26 -5.17 119.74 120.52 2eor s LYS 39 Ca 0.56 0.26 -0.14 0.00 -0.36 0.00 0.00 55.97 56.29 2eor s LYS 39 Cb 0.35 0.14 0.01 0.00 -1.51 0.00 0.00 37.83 36.82 2eor s LYS 39 CO -0.16 -0.05 1.11 -1.25 -0.36 0.00 0.00 175.35 174.64 2eor s PRO 40 N -0.19 2.73 -1.17 4.03 0.04 -1.26 -4.85 135.00 134.34 2eor s PRO 40 Ca 0.05 1.36 -0.22 0.00 0.04 0.00 0.00 61.00 62.23 2eor s PRO 40 Cb -0.04 -1.94 -0.08 0.00 0.04 0.00 0.00 34.50 32.47 2eor s PRO 40 CO -0.09 -1.30 1.92 0.43 0.04 0.00 0.00 177.00 178.00 2eor n SER 41 N -2.55 3.15 -2.35 6.66 7.64 -1.26 -4.05 113.62 120.85 2eor n SER 41 Ca 0.10 -2.71 -0.02 0.00 1.01 0.00 0.00 58.87 57.25 2eor n SER 41 Cb 0.52 -1.70 0.00 0.00 -1.01 0.00 0.00 64.21 62.03 2eor n SER 41 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2eor n GLY 42 N 5.67 -0.94 0.27 0.23 0.00 -1.26 -4.93 105.19 104.22 2eor n GLY 42 Ca 0.45 0.42 0.15 0.00 0.00 0.00 0.00 46.02 47.05 2eor n GLY 42 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2eor h PRO 43 N 0.67 0.00 -3.40 1.61 0.13 -1.98 -3.35 132.00 125.68 2eor h PRO 43 Ca 0.00 0.00 -0.76 0.00 -0.87 0.00 0.00 66.00 64.37 2eor h PRO 43 Cb 0.81 0.00 -0.31 0.00 0.13 0.00 0.00 31.00 31.63 2eor h PRO 43 CO 0.15 0.06 0.26 -1.13 -0.23 0.00 0.00 178.00 177.11 2eor n SER 44 N -3.20 5.06 -4.71 1.44 3.41 -1.26 -5.04 113.62 109.32 2eor n SER 44 Ca 0.00 -3.11 -0.40 0.00 -0.26 0.00 0.00 58.87 55.11 2eor n SER 44 Cb 0.32 -1.24 -0.05 0.00 -0.26 0.00 0.00 64.21 62.99 2eor n SER 44 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2eor s SER 45 N 0.50 7.01 0.00 4.04 0.15 -1.26 -5.25 113.70 118.89 2eor s SER 45 Ca 0.30 1.21 0.00 0.00 0.70 0.00 0.00 55.95 58.16 2eor s SER 45 Cb -0.08 -2.42 0.00 0.00 -1.71 0.00 0.00 66.02 61.81 2eor s SER 45 CO -0.09 -0.14 0.00 0.61 1.20 0.00 0.00 173.24 174.83