#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2emk s SER 2 N 0.00 6.12 -0.11 1.61 1.04 -1.26 -5.06 113.70 116.04 2emk s SER 2 Ca 0.00 -0.87 -0.26 0.00 0.48 0.00 0.00 55.95 55.30 2emk s SER 2 Cb 0.00 -2.17 -0.02 0.00 0.10 0.00 0.00 66.02 63.93 2emk s SER 2 CO 0.00 -0.46 0.86 -0.94 0.98 0.00 0.00 173.24 173.68 2emk s SER 3 N 1.69 7.08 0.00 7.02 1.04 -1.26 -4.92 113.70 124.36 2emk s SER 3 Ca 0.06 1.32 0.00 0.00 0.48 0.00 0.00 55.95 57.80 2emk s SER 3 Cb -0.19 -2.48 0.00 0.00 0.10 0.00 0.00 66.02 63.45 2emk s SER 3 CO 0.10 -0.34 0.00 0.61 0.98 0.00 0.00 173.24 174.60 2emk n GLY 4 N 3.24 0.17 3.16 7.32 0.00 -1.26 -5.08 105.19 112.74 2emk n GLY 4 Ca 0.04 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.72 2emk n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2emk s SER 5 N 1.00 4.47 -0.36 1.61 1.04 -1.26 -4.98 113.70 115.21 2emk s SER 5 Ca 0.00 -1.11 0.06 0.00 0.48 0.00 0.00 55.95 55.37 2emk s SER 5 Cb 0.00 -1.64 0.45 0.00 0.10 0.00 0.00 66.02 64.93 2emk s SER 5 CO 0.00 -0.18 1.27 -1.20 0.98 0.00 0.00 173.24 174.11 2emk n SER 6 N 4.60 5.20 0.00 7.02 7.64 -1.26 -4.95 113.62 131.86 2emk n SER 6 Ca -0.15 -3.75 0.00 0.00 1.01 0.00 0.00 58.87 55.98 2emk n SER 6 Cb 0.45 -0.44 0.00 0.00 -1.01 0.00 0.00 64.21 63.21 2emk n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2emk n GLY 7 N -0.68 3.15 3.29 0.23 0.00 -1.26 -5.18 105.19 104.74 2emk n GLY 7 Ca 0.45 -0.24 -0.14 0.00 0.00 0.00 0.00 46.02 46.09 2emk n GLY 7 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2emk s THR 8 N 0.00 0.04 -0.08 2.61 2.01 -1.26 -5.12 115.64 113.84 2emk s THR 8 Ca 0.00 -0.29 -0.36 0.00 0.31 0.00 0.00 61.69 61.35 2emk s THR 8 Cb 0.00 -0.65 -0.13 0.00 0.01 0.00 0.00 72.50 71.73 2emk s THR 8 CO 0.00 -0.16 1.76 0.61 -0.69 0.00 0.00 174.62 176.14 2emk n GLY 9 N 1.64 1.20 0.17 4.40 0.00 -1.26 -4.82 105.19 106.52 2emk n GLY 9 Ca -0.19 0.83 0.05 0.00 0.00 0.00 0.00 46.02 46.71 2emk n GLY 9 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2emk n GLU 10 N 5.53 1.22 -2.56 1.61 -0.58 -1.26 -4.87 120.64 119.73 2emk n GLU 10 Ca 0.22 -0.33 -0.38 0.00 -0.42 0.00 0.00 57.16 56.25 2emk n GLU 10 Cb 0.25 -1.18 -0.04 0.00 -0.57 0.00 0.00 31.44 29.90 2emk n GLU 10 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 2emk s LYS 11 N -1.90 4.36 0.00 3.49 3.01 -1.26 -4.91 119.74 122.53 2emk s LYS 11 Ca 0.16 1.56 0.12 0.00 -1.01 0.00 0.00 55.97 56.79 2emk s LYS 11 Cb 0.08 -2.77 0.69 0.00 -1.01 0.00 0.00 37.83 34.82 2emk s LYS 11 CO 0.12 0.03 1.12 -0.35 0.51 0.00 0.00 175.35 176.77 2emk n PRO 12 N 0.38 0.49 -3.83 -1.68 -0.04 -1.26 -4.60 135.00 124.46 2emk n PRO 12 Ca 0.03 0.00 -0.15 0.00 -0.04 0.00 0.00 63.50 63.34 2emk n PRO 12 Cb 0.48 -1.37 -0.16 0.00 -0.04 0.00 0.00 33.50 32.42 2emk n PRO 12 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2emk s TYR 13 N -2.00 0.10 -0.09 0.54 2.02 -1.26 -5.11 117.35 111.55 2emk s TYR 13 Ca 0.17 0.07 -0.27 0.00 -0.37 0.00 0.00 57.07 56.68 2emk s TYR 13 Cb 0.08 -0.24 0.06 0.00 -0.40 0.00 0.00 41.96 41.46 2emk s TYR 13 CO 0.13 -0.08 0.62 -2.00 -1.57 0.00 0.00 175.55 172.65 2emk s GLU 14 N 0.84 0.93 -0.22 -0.62 2.12 -1.26 -2.63 118.70 117.86 2emk s GLU 14 Ca -0.07 0.35 -0.29 0.00 0.36 0.00 0.00 54.97 55.32 2emk s GLU 14 Cb -0.11 0.44 0.01 0.00 0.26 0.00 0.00 34.13 34.73 2emk s GLU 14 CO -0.02 -0.25 1.02 0.00 -0.54 0.00 0.00 175.26 175.47 2emk n LYS 16 N 6.20 1.59 0.00 0.00 4.01 -1.26 -2.15 118.16 126.56 2emk n LYS 16 Ca 0.11 -1.34 0.00 0.00 -0.51 0.00 0.00 58.31 56.58 2emk n LYS 16 Cb 0.46 -1.52 0.00 0.00 -0.51 0.00 0.00 35.03 33.46 2emk n LYS 16 CO 0.00 0.00 0.00 0.39 -1.11 0.00 0.00 177.40 176.68 2emk n GLU 17 N -0.05 2.04 0.00 1.97 -0.58 -1.26 -4.94 120.64 117.82 2emk n GLU 17 Ca 0.26 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 57.00 2emk n GLU 17 Cb 0.90 -0.87 0.00 0.00 -0.57 0.00 0.00 31.44 30.90 2emk n GLU 17 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2emk n GLY 19 N 2.22 0.62 2.84 0.00 0.00 -0.91 -5.08 105.19 104.87 2emk n GLY 19 Ca 0.00 -0.75 -0.25 0.00 0.00 0.00 0.00 46.02 45.02 2emk n GLY 19 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2emk s LYS 20 N -0.61 1.07 -0.08 1.61 2.47 -1.25 -4.91 119.74 118.05 2emk s LYS 20 Ca 0.00 -0.13 -0.11 0.00 -1.56 0.00 0.00 55.97 54.17 2emk s LYS 20 Cb 0.00 -1.39 -0.05 0.00 -1.46 0.00 0.00 37.83 34.93 2emk s LYS 20 CO 0.00 -0.32 0.27 0.00 0.16 0.00 0.00 175.35 175.46 2emk s ALA 21 N 1.82 3.77 -0.07 3.13 0.00 -1.26 -0.94 121.76 128.21 2emk s ALA 21 Ca 0.04 -0.45 0.03 0.00 0.00 0.00 0.00 51.96 51.58 2emk s ALA 21 Cb -0.13 -2.19 0.01 0.00 0.00 0.00 0.00 23.12 20.81 2emk s ALA 21 CO -0.07 0.50 -0.15 -0.06 0.00 0.00 0.00 175.76 175.98 2emk s PHE 22 N -0.86 1.71 0.30 0.00 0.40 -1.08 -5.00 117.98 113.45 2emk s PHE 22 Ca 0.19 -0.65 0.05 0.00 -0.60 0.00 0.00 56.93 55.91 2emk s PHE 22 Cb -0.14 -1.22 0.74 0.00 0.51 0.00 0.00 43.02 42.91 2emk s PHE 22 CO 0.08 -0.31 1.74 0.66 0.70 0.00 0.00 175.22 178.09 2emk h SER 23 N 6.91 0.60 -3.00 1.36 4.64 -1.99 -3.41 113.55 118.67 2emk h SER 23 Ca -0.28 0.12 -0.62 0.00 -0.47 0.00 0.00 61.79 60.54 2emk h SER 23 Cb 1.20 0.03 -0.12 0.00 -0.31 0.00 0.00 62.40 63.20 2emk h SER 23 CO 0.47 0.15 -0.67 -1.10 -0.87 0.00 0.00 176.83 174.82 2emk s GLN 24 N -5.86 2.40 0.03 4.77 -0.21 -1.26 -4.91 119.66 114.61 2emk s GLN 24 Ca -0.11 -1.07 -0.26 0.00 0.02 0.00 0.00 55.36 53.95 2emk s GLN 24 Cb 0.25 -2.38 -0.17 0.00 1.00 0.00 0.00 33.01 31.71 2emk s GLN 24 CO 0.79 0.47 1.41 1.15 -2.12 0.00 0.00 175.29 176.99 2emk h THR 25 N 2.58 0.88 -0.95 -0.19 2.02 -1.99 -3.03 112.91 112.23 2emk h THR 25 Ca -0.47 -0.50 0.25 0.00 0.77 0.00 0.00 66.41 66.46 2emk h THR 25 Cb 1.19 1.18 -0.13 0.00 -1.74 0.00 0.00 68.15 68.65 2emk h THR 25 CO 0.58 0.11 0.48 0.00 0.37 0.00 0.00 175.52 177.06 2emk h THR 26 N -0.52 0.44 -0.71 3.16 1.03 -1.96 0.26 112.91 114.60 2emk h THR 26 Ca -0.03 -0.14 0.07 0.00 -0.01 0.00 0.00 66.41 66.30 2emk h THR 26 Cb 0.39 -0.02 -0.06 0.00 -1.07 0.00 0.00 68.15 67.39 2emk h THR 26 CO 0.05 0.08 0.39 0.45 -0.01 0.00 0.00 175.52 176.47 2emk h HIS 27 N 0.42 0.71 0.30 0.00 3.86 -1.92 -1.77 115.15 116.76 2emk h HIS 27 Ca 0.62 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.85 2emk h HIS 27 Cb 1.25 -0.21 0.00 0.00 1.06 0.00 0.00 27.41 29.51 2emk h HIS 27 CO -0.08 0.31 -0.14 1.25 0.86 0.00 0.00 177.93 180.12 2emk h LEU 28 N 0.69 -0.34 -1.05 2.43 5.85 -0.51 -1.94 115.31 120.45 2emk h LEU 28 Ca 0.33 -0.18 0.29 0.00 0.84 0.00 0.00 57.88 59.16 2emk h LEU 28 Cb 0.27 0.09 -0.13 0.00 0.37 0.00 0.00 40.66 41.25 2emk h LEU 28 CO -0.22 0.02 0.60 0.40 -0.34 0.00 0.00 178.44 178.91 2emk h ILE 29 N -0.74 0.41 -0.23 4.05 2.04 -1.08 0.26 117.51 122.22 2emk h ILE 29 Ca -0.04 -0.15 -0.17 0.00 1.00 0.00 0.00 64.86 65.50 2emk h ILE 29 Cb 0.50 -0.06 0.00 0.00 -0.74 0.00 0.00 36.82 36.52 2emk h ILE 29 CO 0.07 0.08 -0.52 1.56 0.00 0.00 0.00 178.15 179.33 2emk h GLN 30 N 0.44 0.77 -0.95 2.37 1.08 -1.24 -3.11 115.11 114.46 2emk h GLN 30 Ca 0.69 -0.51 0.22 0.00 -1.45 0.00 0.00 58.65 57.60 2emk h GLN 30 Cb 1.50 0.07 -0.07 0.00 -0.05 0.00 0.00 27.48 28.93 2emk h GLN 30 CO -0.52 1.14 0.63 1.25 -0.95 0.00 0.00 178.83 180.37 2emk h HIS 31 N 0.51 0.55 0.00 2.96 -0.00 0.33 0.26 115.15 119.76 2emk h HIS 31 Ca 0.00 0.02 0.00 0.00 -0.00 0.00 0.00 60.37 60.39 2emk h HIS 31 Cb 1.13 -0.17 0.00 0.00 -0.00 0.00 0.00 27.41 28.38 2emk h HIS 31 CO 0.08 0.12 0.40 1.96 -0.00 0.00 0.00 177.93 180.49 2emk h GLN 32 N 0.39 0.00 -0.79 5.26 1.08 -1.38 0.37 115.11 120.05 2emk h GLN 32 Ca 0.50 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.71 2emk h GLN 32 Cb 1.29 0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 28.68 2emk h GLN 32 CO -0.20 0.00 0.51 0.00 -0.95 0.00 0.00 178.83 178.19 2emk h ARG 33 N 0.00 1.04 0.00 1.46 3.08 -0.67 -0.99 114.38 118.30 2emk h ARG 33 Ca 0.00 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.98 2emk h ARG 33 Cb 0.79 -0.23 0.00 0.00 0.08 0.00 0.00 29.97 30.61 2emk h ARG 33 CO 0.00 0.70 0.09 -0.39 -1.07 0.00 0.00 179.97 179.30 2emk h VAL 34 N 1.07 0.00 0.00 2.04 -1.51 -1.12 0.28 116.25 117.01 2emk h VAL 34 Ca 0.29 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.76 2emk h VAL 34 Cb -0.10 0.84 0.00 0.00 -2.13 0.00 0.00 31.29 29.90 2emk h VAL 34 CO -0.06 0.00 -1.05 1.41 -1.23 0.00 0.00 177.57 176.64 2emk n HIS 35 N -2.92 0.27 -1.69 5.19 8.25 -0.40 -4.16 115.22 119.75 2emk n HIS 35 Ca -0.03 0.08 -0.17 0.00 -0.26 0.00 0.00 57.72 57.34 2emk n HIS 35 Cb 0.15 -0.44 0.10 0.00 1.12 0.00 0.00 29.99 30.92 2emk n HIS 35 CO 0.00 0.00 0.00 -2.37 0.64 0.00 0.00 176.34 174.61 2emk n THR 36 N -1.98 2.69 -2.12 1.59 5.66 0.97 -4.59 114.28 116.50 2emk n THR 36 Ca 0.02 -3.46 0.05 0.00 -3.05 0.00 0.00 64.05 57.60 2emk n THR 36 Cb 0.44 -0.80 0.09 0.00 -1.55 0.00 0.00 70.33 68.50 2emk n THR 36 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2emk n GLY 37 N -0.92 2.49 3.17 1.09 0.00 -1.03 -4.99 105.19 104.99 2emk n GLY 37 Ca 0.42 -0.97 -0.12 0.00 0.00 0.00 0.00 46.02 45.35 2emk n GLY 37 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2emk s GLU 38 N -1.18 0.53 0.25 1.61 2.56 -1.26 -5.09 118.70 116.12 2emk s GLU 38 Ca 0.33 -0.17 -0.19 0.00 0.00 0.00 0.00 54.97 54.95 2emk s GLU 38 Cb 0.36 0.23 -0.13 0.00 2.00 0.00 0.00 34.13 36.59 2emk s GLU 38 CO -0.12 -0.13 0.20 1.63 -0.56 0.00 0.00 175.26 176.28 2emk n LYS 39 N 1.66 0.00 -0.08 4.30 5.02 -1.26 -4.87 118.16 122.93 2emk n LYS 39 Ca -0.20 0.00 -0.13 0.00 -2.02 0.00 0.00 58.31 55.96 2emk n LYS 39 Cb 0.56 -0.78 -0.05 0.00 -0.02 0.00 0.00 35.03 34.74 2emk n LYS 39 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 2emk h PRO 40 N 0.46 0.61 -6.87 1.97 0.13 -2.00 -3.46 132.00 122.83 2emk h PRO 40 Ca -0.26 -0.32 -0.56 0.00 -0.87 0.00 0.00 66.00 63.99 2emk h PRO 40 Cb 1.13 0.01 -0.30 0.00 0.13 0.00 0.00 31.00 31.97 2emk h PRO 40 CO 0.40 0.92 -0.82 -1.13 -0.23 0.00 0.00 178.00 177.14 2emk n SER 41 N -4.35 -2.27 -3.51 1.44 3.41 -1.26 -4.88 113.62 102.20 2emk n SER 41 Ca -0.04 -1.04 -0.16 0.00 -0.26 0.00 0.00 58.87 57.37 2emk n SER 41 Cb 0.44 -1.93 -0.05 0.00 -0.26 0.00 0.00 64.21 62.40 2emk n SER 41 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2emk s GLY 42 N -3.15 -0.55 0.04 5.00 0.00 -1.26 -5.06 107.32 102.33 2emk s GLY 42 Ca 0.75 1.25 -0.20 0.00 0.00 0.00 0.00 44.72 46.52 2emk s GLY 42 CO 0.91 0.83 1.35 -0.56 0.00 0.00 0.00 173.10 175.64 2emk h PRO 43 N 2.79 0.37 -4.58 2.90 0.13 -2.05 -3.46 132.00 128.10 2emk h PRO 43 Ca -0.27 -0.19 -0.22 0.00 -0.87 0.00 0.00 66.00 64.44 2emk h PRO 43 Cb 1.17 0.01 -0.15 0.00 0.13 0.00 0.00 31.00 32.16 2emk h PRO 43 CO 0.38 0.75 -0.66 -1.54 -0.23 0.00 0.00 178.00 176.70 2emk s SER 44 N -6.14 0.73 0.19 1.44 1.04 -1.26 -5.18 113.70 104.52 2emk s SER 44 Ca -0.14 -1.17 -0.16 0.00 0.48 0.00 0.00 55.95 54.95 2emk s SER 44 Cb 0.05 0.21 0.02 0.00 0.10 0.00 0.00 66.02 66.41 2emk s SER 44 CO 0.76 -0.65 0.49 -0.44 0.98 0.00 0.00 173.24 174.38 2emk s SER 45 N -3.09 -0.23 0.00 7.02 0.01 -1.26 -5.13 113.70 111.02 2emk s SER 45 Ca 0.22 -0.51 0.00 0.00 1.31 0.00 0.00 55.95 56.98 2emk s SER 45 Cb 0.07 0.56 0.00 0.00 0.21 0.00 0.00 66.02 66.85 2emk s SER 45 CO 0.02 -1.02 0.00 0.61 0.41 0.00 0.00 173.24 173.26