#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 5.70 -0.01 1.61 0.01 -1.26 -4.83 113.70 114.92 2eor s SER 2 Ca 0.00 -0.66 -0.23 0.00 1.31 0.00 0.00 55.95 56.37 2eor s SER 2 Cb 0.00 -2.56 -0.16 0.00 0.21 0.00 0.00 66.02 63.52 2eor s SER 2 CO 0.00 -2.19 1.08 -1.28 0.41 0.00 0.00 173.24 171.26 2eor h SER 3 N 11.42 -0.33 0.00 2.44 0.87 -2.14 -3.49 113.55 122.31 2eor h SER 3 Ca -0.00 -0.21 0.00 0.00 -1.23 0.00 0.00 61.79 60.35 2eor h SER 3 Cb 1.04 0.09 0.00 0.00 -0.44 0.00 0.00 62.40 63.09 2eor h SER 3 CO 1.28 0.10 0.00 0.61 -0.53 0.00 0.00 176.83 178.29 2eor n GLY 4 N -0.01 3.30 3.72 5.77 0.00 -1.26 -5.12 105.19 111.60 2eor n GLY 4 Ca -0.09 -0.67 -0.36 0.00 0.00 0.00 0.00 46.02 44.90 2eor n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2eor s SER 5 N 0.00 4.36 0.17 1.61 0.01 -1.26 -5.04 113.70 113.56 2eor s SER 5 Ca 0.00 2.49 0.10 0.00 1.31 0.00 0.00 55.95 59.85 2eor s SER 5 Cb 0.00 -2.60 -0.04 0.00 0.21 0.00 0.00 66.02 63.58 2eor s SER 5 CO 0.00 -2.16 -0.22 -0.55 0.41 0.00 0.00 173.24 170.72 2eor s SER 6 N -1.70 3.10 0.00 2.44 0.15 -1.26 -4.91 113.70 111.51 2eor s SER 6 Ca 0.78 -0.84 0.00 0.00 0.70 0.00 0.00 55.95 56.60 2eor s SER 6 Cb -0.33 -0.21 0.00 0.00 -1.71 0.00 0.00 66.02 63.77 2eor s SER 6 CO 0.42 0.07 0.00 0.61 1.20 0.00 0.00 173.24 175.55 2eor n GLY 7 N 0.42 0.71 0.29 9.45 0.00 -1.26 -5.04 105.19 109.75 2eor n GLY 7 Ca -0.14 -0.44 -0.16 0.00 0.00 0.00 0.00 46.02 45.28 2eor n GLY 7 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2eor h THR 8 N 0.00 0.49 0.00 2.61 2.02 -2.04 -3.48 112.91 112.52 2eor h THR 8 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 2eor h THR 8 Cb 0.00 0.49 0.00 0.00 -1.74 0.00 0.00 68.15 66.90 2eor h THR 8 CO 0.00 0.00 0.00 0.61 0.37 0.00 0.00 175.52 176.50 2eor n GLY 9 N -1.38 2.90 0.29 2.16 0.00 -1.26 -4.99 105.19 102.92 2eor n GLY 9 Ca -0.11 -0.08 0.07 0.00 0.00 0.00 0.00 46.02 45.90 2eor n GLY 9 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2eor n GLU 10 N 0.00 1.37 -3.87 1.61 -0.58 -1.26 -4.78 120.64 113.13 2eor n GLU 10 Ca 0.00 -0.57 -0.14 0.00 -0.42 0.00 0.00 57.16 56.03 2eor n GLU 10 Cb 0.00 -1.25 -0.15 0.00 -0.57 0.00 0.00 31.44 29.47 2eor n GLU 10 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 2eor s LYS 11 N -1.84 0.06 0.00 3.49 1.02 -1.26 -5.00 119.74 116.20 2eor s LYS 11 Ca 0.22 0.04 0.14 0.00 0.02 0.00 0.00 55.97 56.40 2eor s LYS 11 Cb 0.11 -0.15 0.84 0.00 -0.52 0.00 0.00 37.83 38.10 2eor s LYS 11 CO 0.17 -0.05 1.26 -0.35 -0.92 0.00 0.00 175.35 175.46 2eor n PRO 12 N 3.49 0.49 -3.95 -1.68 -0.04 -1.25 -4.68 135.00 127.38 2eor n PRO 12 Ca -0.18 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.18 2eor n PRO 12 Cb 0.56 -1.45 -0.12 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 0.18 -0.12 0.54 2.02 -0.98 -5.01 117.35 111.97 2eor s TYR 13 Ca 0.21 -0.37 -0.29 0.00 -0.37 0.00 0.00 57.07 56.25 2eor s TYR 13 Cb 0.10 -0.13 0.08 0.00 -0.40 0.00 0.00 41.96 41.61 2eor s TYR 13 CO 0.16 -0.14 0.76 -0.80 -1.57 0.00 0.00 175.55 173.96 2eor s ASN 14 N -1.06 -0.61 -0.15 2.29 -0.87 -1.26 -0.71 114.94 112.57 2eor s ASN 14 Ca -0.12 0.80 -0.20 0.00 -1.57 0.00 0.00 52.86 51.78 2eor s ASN 14 Cb -0.07 0.69 -0.03 0.00 -0.02 0.00 0.00 41.25 41.81 2eor s ASN 14 CO -0.01 -0.47 0.58 0.00 -2.57 0.00 0.00 177.10 174.63 2eor n GLU 16 N 4.34 0.38 0.06 0.00 2.13 -1.26 -0.73 120.64 125.56 2eor n GLU 16 Ca -0.04 -0.14 -0.22 0.00 0.66 0.00 0.00 57.16 57.42 2eor n GLU 16 Cb 0.51 -1.50 -0.15 0.00 0.27 0.00 0.00 31.44 30.57 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 0.34 0.36 0.00 5.31 4.39 -1.98 -3.43 114.58 119.57 2eor h GLU 17 Ca 0.00 -0.61 0.00 0.00 0.34 0.00 0.00 59.36 59.09 2eor h GLU 17 Cb 0.43 0.23 0.00 0.00 -0.10 0.00 0.00 28.75 29.31 2eor h GLU 17 CO 0.00 1.29 -0.99 0.00 -1.16 0.00 0.00 179.01 178.15 2eor n GLY 19 N 3.09 0.73 3.69 0.00 0.00 0.09 -5.04 105.19 107.74 2eor n GLY 19 Ca 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.57 2eor n GLY 19 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2eor n LYS 20 N 0.00 2.42 -2.94 1.61 4.81 -1.26 -4.43 118.16 118.37 2eor n LYS 20 Ca 0.00 0.87 -0.27 0.00 -0.87 0.00 0.00 58.31 58.04 2eor n LYS 20 Cb 0.00 -2.69 -0.01 0.00 0.02 0.00 0.00 35.03 32.35 2eor n LYS 20 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2eor s ALA 21 N 1.60 3.50 -0.04 3.14 0.00 -1.26 -0.12 121.76 128.57 2eor s ALA 21 Ca 0.80 -0.57 -0.04 0.00 0.00 0.00 0.00 51.96 52.14 2eor s ALA 21 Cb -0.60 -2.45 0.01 0.00 0.00 0.00 0.00 23.12 20.08 2eor s ALA 21 CO 0.38 -0.15 0.12 -0.06 0.00 0.00 0.00 175.76 176.05 2eor s PHE 22 N -2.50 -0.11 0.14 0.00 0.40 0.12 -4.91 117.98 111.12 2eor s PHE 22 Ca 0.46 0.26 -0.02 0.00 -0.60 0.00 0.00 56.93 57.03 2eor s PHE 22 Cb -0.10 0.03 -0.07 0.00 0.51 0.00 0.00 43.02 43.39 2eor s PHE 22 CO 0.39 -0.09 1.33 0.82 0.70 0.00 0.00 175.22 178.37 2eor h ILE 23 N 4.88 1.44 -3.34 0.64 2.04 -1.95 -2.60 117.51 118.63 2eor h ILE 23 Ca -0.26 -2.54 -0.34 0.00 1.00 0.00 0.00 64.86 62.72 2eor h ILE 23 Cb 1.20 2.46 -0.15 0.00 -0.74 0.00 0.00 36.82 39.59 2eor h ILE 23 CO 0.43 0.75 -0.72 -1.00 0.00 0.00 0.00 178.15 177.61 2eor s HIS 24 N -3.22 1.31 0.03 1.37 3.76 -1.26 -4.53 115.29 112.74 2eor s HIS 24 Ca -0.04 -0.74 -0.18 0.00 -0.15 0.00 0.00 55.06 53.95 2eor s HIS 24 Cb 0.09 -0.66 -0.10 0.00 1.11 0.00 0.00 32.58 33.02 2eor s HIS 24 CO 0.85 0.11 1.21 0.22 -0.85 0.00 0.00 174.74 176.28 2eor h ASP 25 N 2.77 -0.55 -0.82 1.40 3.58 -1.95 -2.52 116.42 118.32 2eor h ASP 25 Ca -0.37 0.02 0.33 0.00 0.42 0.00 0.00 57.03 57.43 2eor h ASP 25 Cb 1.19 0.14 -0.15 0.00 1.72 0.00 0.00 39.33 42.24 2eor h ASP 25 CO 0.63 -0.38 0.40 -1.54 -2.88 0.00 0.00 179.24 175.47 2eor n SER 26 N -3.85 0.25 -0.08 2.28 3.41 -1.26 0.20 113.62 114.56 2eor n SER 26 Ca -0.08 1.37 -0.11 0.00 -0.26 0.00 0.00 58.87 59.79 2eor n SER 26 Cb 0.26 -0.65 -0.04 0.00 -0.26 0.00 0.00 64.21 63.52 2eor n SER 26 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 2eor h GLN 27 N 0.00 0.43 0.06 4.33 4.20 -1.95 -1.78 115.11 120.40 2eor h GLN 27 Ca 0.68 -0.13 -0.00 0.00 0.06 0.00 0.00 58.65 59.26 2eor h GLN 27 Cb 1.77 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 29.50 2eor h GLN 27 CO -0.65 0.58 -0.03 1.25 -0.67 0.00 0.00 178.83 179.31 2eor h LEU 28 N 0.22 -0.06 -0.76 1.46 5.85 0.27 -3.12 115.31 119.17 2eor h LEU 28 Ca 0.07 -0.32 0.13 0.00 0.84 0.00 0.00 57.88 58.60 2eor h LEU 28 Cb 0.37 0.02 -0.09 0.00 0.37 0.00 0.00 40.66 41.33 2eor h LEU 28 CO 0.01 0.29 0.35 1.56 -0.34 0.00 0.00 178.44 180.31 2eor h GLN 29 N -0.43 0.52 0.00 1.25 1.08 -0.69 0.54 115.11 117.38 2eor h GLN 29 Ca -0.01 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.16 2eor h GLN 29 Cb 0.38 -0.12 0.00 0.00 -0.05 0.00 0.00 27.48 27.69 2eor h GLN 29 CO 0.01 0.34 0.00 -1.91 -0.95 0.00 0.00 178.83 176.32 2eor n GLU 30 N -4.93 0.14 -0.12 1.46 2.13 -0.67 -2.72 120.64 115.93 2eor n GLU 30 Ca 0.14 0.59 -0.22 0.00 0.66 0.00 0.00 57.16 58.33 2eor n GLU 30 Cb 0.38 -1.92 -0.09 0.00 0.27 0.00 0.00 31.44 30.08 2eor n GLU 30 CO 0.00 0.00 0.00 1.58 -0.41 0.00 0.00 177.13 178.30 2eor n HIS 31 N -2.21 0.33 -0.30 4.31 -0.00 0.17 -4.30 115.22 113.21 2eor n HIS 31 Ca -0.01 0.14 0.32 0.00 0.46 0.00 0.00 57.72 58.63 2eor n HIS 31 Cb 0.07 -0.92 0.49 0.00 -0.12 0.00 0.00 29.99 29.50 2eor n HIS 31 CO 0.00 0.00 0.00 1.04 0.46 0.00 0.00 176.34 177.84 2eor n GLN 32 N -4.36 0.01 -0.17 1.57 6.02 -0.08 0.03 117.38 120.40 2eor n GLN 32 Ca -0.39 0.98 -0.03 0.00 -0.01 0.00 0.00 57.00 57.56 2eor n GLN 32 Cb 0.73 -2.41 0.04 0.00 1.02 0.00 0.00 30.24 29.61 2eor n GLN 32 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2eor h ARG 33 N 0.00 -0.01 -0.32 -1.09 3.08 -1.74 0.45 114.38 114.75 2eor h ARG 33 Ca 0.56 0.00 0.09 0.00 0.07 0.00 0.00 59.98 60.70 2eor h ARG 33 Cb 2.97 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 33.01 2eor h ARG 33 CO -0.01 -0.01 0.59 -0.84 -1.07 0.00 0.00 179.97 178.63 2eor h ILE 34 N -0.02 0.15 0.10 2.04 3.07 -0.69 1.20 117.51 123.36 2eor h ILE 34 Ca 0.25 0.00 -0.37 0.00 1.55 0.00 0.00 64.86 66.29 2eor h ILE 34 Cb 0.39 0.48 -0.03 0.00 -0.27 0.00 0.00 36.82 37.40 2eor h ILE 34 CO -0.54 0.00 -2.09 1.41 -1.05 0.00 0.00 178.15 175.89 2eor n HIS 35 N -3.22 0.99 -1.51 0.16 8.25 0.15 -4.33 115.22 115.71 2eor n HIS 35 Ca 0.06 0.21 -0.22 0.00 -0.26 0.00 0.00 57.72 57.51 2eor n HIS 35 Cb 0.72 -1.13 0.12 0.00 1.12 0.00 0.00 29.99 30.82 2eor n HIS 35 CO 0.00 0.00 0.00 -2.37 0.64 0.00 0.00 176.34 174.61 2eor n THR 36 N -3.47 3.01 0.00 1.59 5.66 0.50 -4.81 114.28 116.76 2eor n THR 36 Ca -0.35 -3.01 0.00 0.00 -3.05 0.00 0.00 64.05 57.64 2eor n THR 36 Cb 1.03 -0.80 0.00 0.00 -1.55 0.00 0.00 70.33 69.00 2eor n THR 36 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2eor n GLY 37 N -0.97 -2.82 3.58 1.09 0.00 0.39 -3.64 105.19 102.81 2eor n GLY 37 Ca 0.50 0.27 -0.31 0.00 0.00 0.00 0.00 46.02 46.48 2eor n GLY 37 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2eor s GLU 38 N -2.69 2.77 0.25 1.61 0.41 -1.26 -4.93 118.70 114.86 2eor s GLU 38 Ca 0.00 -1.25 -0.29 0.00 -0.41 0.00 0.00 54.97 53.02 2eor s GLU 38 Cb 0.00 -5.28 -0.15 0.00 -1.78 0.00 0.00 34.13 26.92 2eor s GLU 38 CO 0.00 -3.62 0.89 1.17 -0.49 0.00 0.00 175.26 173.21 2eor n LYS 39 N 8.35 0.96 0.00 1.61 4.81 -1.24 -4.97 118.16 127.68 2eor n LYS 39 Ca 0.45 0.34 0.00 0.00 -0.87 0.00 0.00 58.31 58.23 2eor n LYS 39 Cb 0.47 -1.62 0.00 0.00 0.02 0.00 0.00 35.03 33.89 2eor n LYS 39 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 2eor n PRO 40 N 0.90 -0.21 -3.41 1.64 -0.04 -1.26 -4.97 135.00 127.65 2eor n PRO 40 Ca 0.12 0.00 -0.45 0.00 -0.04 0.00 0.00 63.50 63.14 2eor n PRO 40 Cb 0.29 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.71 2eor n PRO 40 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2eor s SER 41 N -1.51 6.40 -0.74 3.54 1.04 -1.26 -4.74 113.70 116.43 2eor s SER 41 Ca 0.00 -2.67 -0.04 0.00 0.48 0.00 0.00 55.95 53.72 2eor s SER 41 Cb 0.00 -2.13 0.01 0.00 0.10 0.00 0.00 66.02 63.99 2eor s SER 41 CO 0.00 -0.54 0.65 0.61 0.98 0.00 0.00 173.24 174.93 2eor n GLY 42 N 3.94 -1.19 0.24 7.32 0.00 -1.26 -4.90 105.19 109.34 2eor n GLY 42 Ca 0.11 0.63 -0.09 0.00 0.00 0.00 0.00 46.02 46.67 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 0.35 0.69 -3.02 1.61 0.13 -2.00 -3.44 132.00 126.31 2eor h PRO 43 Ca -0.31 -0.36 -0.20 0.00 -0.87 0.00 0.00 66.00 64.26 2eor h PRO 43 Cb 1.20 0.01 -0.30 0.00 0.13 0.00 0.00 31.00 32.04 2eor h PRO 43 CO 0.32 0.97 -0.49 -1.12 -0.23 0.00 0.00 178.00 177.45 2eor s SER 44 N -6.85 -0.25 -0.49 1.44 0.01 -1.26 -5.09 113.70 101.20 2eor s SER 44 Ca -0.09 0.52 -0.34 0.00 1.31 0.00 0.00 55.95 57.35 2eor s SER 44 Cb 0.12 0.41 -0.13 0.00 0.21 0.00 0.00 66.02 66.62 2eor s SER 44 CO 0.84 -0.17 2.29 -1.20 0.41 0.00 0.00 173.24 175.42 2eor n SER 45 N 4.25 1.70 0.00 2.44 7.64 -1.26 -5.22 113.62 123.16 2eor n SER 45 Ca -0.25 0.29 0.00 0.00 1.01 0.00 0.00 58.87 59.92 2eor n SER 45 Cb 0.53 -1.21 0.00 0.00 -1.01 0.00 0.00 64.21 62.52 2eor n SER 45 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64