#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 5.32 -0.29 1.61 0.01 -1.26 -5.13 113.70 113.96 2emk s SER 2 Ca 0.00 -0.63 -0.13 0.00 1.31 0.00 0.00 55.95 56.50 2emk s SER 2 Cb 0.00 -0.47 0.10 0.00 0.21 0.00 0.00 66.02 65.86 2emk s SER 2 CO 0.00 -0.80 0.66 -0.55 0.41 0.00 0.00 173.24 172.96 2emk s SER 3 N -4.30 -1.03 0.99 2.44 0.15 -1.26 -5.16 113.70 105.54 2emk s SER 3 Ca 0.52 1.53 -0.16 0.00 0.70 0.00 0.00 55.95 58.54 2emk s SER 3 Cb -0.07 1.84 -0.09 0.00 -1.71 0.00 0.00 66.02 66.00 2emk s SER 3 CO 0.31 -0.23 -0.42 0.61 1.20 0.00 0.00 173.24 174.71 2emk n GLY 4 N 4.91 -3.74 3.70 9.45 0.00 -1.26 -4.78 105.19 113.47 2emk n GLY 4 Ca -0.16 -0.77 -0.42 0.00 0.00 0.00 0.00 46.02 44.68 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 -1.34 6.49 -0.27 1.61 1.04 -1.26 -4.90 113.70 115.06 2emk s SER 5 Ca 0.46 2.69 0.18 0.00 0.48 0.00 0.00 55.95 59.76 2emk s SER 5 Cb -0.18 -2.58 0.49 0.00 0.10 0.00 0.00 66.02 63.85 2emk s SER 5 CO 0.77 -0.94 1.12 -0.24 0.98 0.00 0.00 173.24 174.94 2emk n SER 6 N 4.99 2.48 -4.41 7.02 2.88 -1.26 -4.98 113.62 120.34 2emk n SER 6 Ca 0.16 -2.54 -0.37 0.00 -1.33 0.00 0.00 58.87 54.80 2emk n SER 6 Cb 0.38 -0.45 -0.09 0.00 -0.75 0.00 0.00 64.21 63.31 2emk n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2emk n GLY 7 N -0.59 -0.26 3.84 0.46 0.00 -1.26 -4.89 105.19 102.48 2emk n GLY 7 Ca 0.17 0.13 -0.38 0.00 0.00 0.00 0.00 46.02 45.94 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 -3.82 4.99 -2.47 2.61 2.01 -1.26 -4.96 115.64 112.73 2emk s THR 8 Ca 0.41 0.85 0.00 0.00 0.31 0.00 0.00 61.69 63.26 2emk s THR 8 Cb -0.24 -3.73 0.00 0.00 0.01 0.00 0.00 72.50 68.54 2emk s THR 8 CO 1.01 0.53 0.00 0.61 -0.69 0.00 0.00 174.62 176.08 2emk n GLY 9 N 1.67 0.74 0.69 4.40 0.00 -1.26 -4.80 105.19 106.63 2emk n GLY 9 Ca -0.13 -2.07 0.07 0.00 0.00 0.00 0.00 46.02 43.89 2emk n GLY 9 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2emk n GLU 10 N 0.00 2.21 -3.85 1.61 4.07 -1.26 -4.97 120.64 118.45 2emk n GLU 10 Ca 0.00 -1.88 -0.12 0.00 -0.06 0.00 0.00 57.16 55.10 2emk n GLU 10 Cb 0.00 -1.30 -0.12 0.00 -0.06 0.00 0.00 31.44 29.97 2emk n GLU 10 CO 0.00 0.00 0.00 0.15 -0.06 0.00 0.00 177.13 177.22 2emk s LYS 11 N -1.03 0.27 0.00 5.31 1.02 -1.26 -5.02 119.74 119.03 2emk s LYS 11 Ca 0.24 -0.04 0.15 0.00 0.02 0.00 0.00 55.97 56.34 2emk s LYS 11 Cb 0.13 0.12 0.81 0.00 -0.52 0.00 0.00 37.83 38.37 2emk s LYS 11 CO 0.18 -0.05 1.38 -0.35 -0.92 0.00 0.00 175.35 175.59 2emk n PRO 12 N 2.44 0.30 -4.07 -1.68 -0.04 -1.26 -4.51 135.00 126.18 2emk n PRO 12 Ca -0.16 0.10 -0.33 0.00 -0.04 0.00 0.00 63.50 63.06 2emk n PRO 12 Cb 0.58 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 32.38 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 -2.38 3.01 0.02 0.54 2.02 -1.26 -5.01 117.35 114.29 2emk s TYR 13 Ca 0.17 -1.88 0.01 0.00 -0.37 0.00 0.00 57.07 55.00 2emk s TYR 13 Cb 0.10 -1.95 -0.01 0.00 -0.40 0.00 0.00 41.96 39.70 2emk s TYR 13 CO 0.21 -0.82 -0.03 -2.00 -1.57 0.00 0.00 175.55 171.34 2emk s GLU 14 N 1.23 0.27 -0.34 -0.62 2.12 -1.26 -1.79 118.70 118.31 2emk s GLU 14 Ca -0.01 -0.42 -0.29 0.00 0.36 0.00 0.00 54.97 54.61 2emk s GLU 14 Cb -0.16 -0.04 0.02 0.00 0.26 0.00 0.00 34.13 34.21 2emk s GLU 14 CO -0.09 -0.00 1.13 0.00 -0.54 0.00 0.00 175.26 175.76 2emk n LYS 16 N 7.13 1.07 -0.03 0.00 -0.00 -1.26 0.10 118.16 125.17 2emk n LYS 16 Ca 0.12 -0.10 -0.21 0.00 -0.00 0.00 0.00 58.31 58.12 2emk n LYS 16 Cb 0.47 -1.49 -0.13 0.00 -0.00 0.00 0.00 35.03 33.88 2emk n LYS 16 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 2emk n GLU 17 N -0.88 0.72 0.00 -1.58 1.02 -1.26 -4.78 120.64 113.88 2emk n GLU 17 Ca 0.23 0.29 0.00 0.00 -0.02 0.00 0.00 57.16 57.67 2emk n GLU 17 Cb 0.13 -1.69 0.00 0.00 -0.02 0.00 0.00 31.44 29.86 2emk n GLU 17 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2emk n GLY 19 N 2.60 0.72 2.85 0.00 0.00 0.11 -5.04 105.19 106.44 2emk n GLY 19 Ca 0.00 -0.72 -0.22 0.00 0.00 0.00 0.00 46.02 45.08 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 -1.08 0.85 -0.07 1.61 2.20 -1.23 -4.82 119.74 117.20 2emk s LYS 20 Ca 0.00 -0.04 -0.15 0.00 -0.36 0.00 0.00 55.97 55.42 2emk s LYS 20 Cb 0.00 -1.00 -0.05 0.00 -1.51 0.00 0.00 37.83 35.27 2emk s LYS 20 CO 0.00 -0.19 0.38 0.00 -0.36 0.00 0.00 175.35 175.18 2emk s ALA 21 N 1.44 3.64 0.01 3.13 0.00 -1.26 -0.04 121.76 128.68 2emk s ALA 21 Ca -0.03 -0.29 0.06 0.00 0.00 0.00 0.00 51.96 51.70 2emk s ALA 21 Cb -0.13 -2.42 -0.02 0.00 0.00 0.00 0.00 23.12 20.55 2emk s ALA 21 CO -0.03 0.30 -0.18 -0.06 0.00 0.00 0.00 175.76 175.79 2emk s PHE 22 N -0.38 1.57 0.27 0.00 0.40 -0.74 -5.00 117.98 114.11 2emk s PHE 22 Ca 0.22 -0.32 -0.03 0.00 -0.60 0.00 0.00 56.93 56.19 2emk s PHE 22 Cb -0.15 -0.98 0.36 0.00 0.51 0.00 0.00 43.02 42.76 2emk s PHE 22 CO 0.10 0.02 1.91 0.66 0.70 0.00 0.00 175.22 178.61 2emk h SER 23 N 5.35 0.99 -3.85 1.36 4.64 -1.98 -3.40 113.55 116.65 2emk h SER 23 Ca -0.38 -0.07 -0.69 0.00 -0.47 0.00 0.00 61.79 60.18 2emk h SER 23 Cb 1.16 -0.25 -0.23 0.00 -0.31 0.00 0.00 62.40 62.77 2emk h SER 23 CO 0.46 0.77 -0.75 -1.10 -0.87 0.00 0.00 176.83 175.35 2emk s GLN 24 N -5.80 2.68 0.21 4.77 -0.21 -1.26 -4.98 119.66 115.07 2emk s GLN 24 Ca -0.12 -0.65 -0.09 0.00 0.02 0.00 0.00 55.36 54.52 2emk s GLN 24 Cb 0.17 -2.47 0.25 0.00 1.00 0.00 0.00 33.01 31.97 2emk s GLN 24 CO 0.81 0.58 1.79 1.79 -2.12 0.00 0.00 175.29 178.14 2emk h THR 25 N 4.44 0.92 -0.18 -0.19 1.35 -1.98 -2.80 112.91 114.48 2emk h THR 25 Ca -0.45 -0.21 0.04 0.00 -0.55 0.00 0.00 66.41 65.24 2emk h THR 25 Cb 1.16 0.25 -0.07 0.00 -1.73 0.00 0.00 68.15 67.76 2emk h THR 25 CO 0.52 0.11 -0.48 0.71 -0.25 0.00 0.00 175.52 176.13 2emk h THR 26 N 0.62 0.07 -0.86 6.82 1.35 -1.97 -0.95 112.91 117.99 2emk h THR 26 Ca 0.30 0.00 0.22 0.00 -0.55 0.00 0.00 66.41 66.38 2emk h THR 26 Cb 0.24 0.07 -0.15 0.00 -1.73 0.00 0.00 68.15 66.58 2emk h THR 26 CO -0.21 0.00 0.05 -0.74 -0.25 0.00 0.00 175.52 174.37 2emk h HIS 27 N -0.51 0.02 -0.09 4.73 6.17 -1.91 0.20 115.15 123.76 2emk h HIS 27 Ca 0.07 0.06 0.02 0.00 0.71 0.00 0.00 60.37 61.22 2emk h HIS 27 Cb 0.65 0.13 -0.02 0.00 2.52 0.00 0.00 27.41 30.69 2emk h HIS 27 CO -0.55 -0.30 -0.02 1.25 0.71 0.00 0.00 177.93 179.01 2emk h LEU 28 N 0.09 -0.08 -0.49 0.26 5.85 -1.14 -0.79 115.31 119.01 2emk h LEU 28 Ca 0.50 0.03 0.02 0.00 0.84 0.00 0.00 57.88 59.27 2emk h LEU 28 Cb 0.97 0.06 -0.03 0.00 0.37 0.00 0.00 40.66 42.02 2emk h LEU 28 CO -0.75 -0.03 0.30 0.40 -0.34 0.00 0.00 178.44 178.01 2emk h ILE 29 N -0.00 1.07 0.00 4.05 2.04 0.13 -1.16 117.51 123.63 2emk h ILE 29 Ca 0.04 -0.21 -0.02 0.00 1.00 0.00 0.00 64.86 65.68 2emk h ILE 29 Cb 0.07 0.42 -0.00 0.00 -0.74 0.00 0.00 36.82 36.56 2emk h ILE 29 CO -0.09 0.11 -0.08 1.56 0.00 0.00 0.00 178.15 179.65 2emk h GLN 30 N 0.60 0.00 0.00 2.37 7.50 -0.55 -1.77 115.11 123.27 2emk h GLN 30 Ca 0.19 0.00 -0.19 0.00 0.50 0.00 0.00 58.65 59.15 2emk h GLN 30 Cb -0.01 0.00 -0.03 0.00 0.05 0.00 0.00 27.48 27.50 2emk h GLN 30 CO -0.08 0.08 -0.92 1.25 -1.50 0.00 0.00 178.83 177.67 2emk h HIS 31 N 0.00 0.01 0.00 2.96 -0.00 0.05 -3.13 115.15 115.04 2emk h HIS 31 Ca -0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.36 2emk h HIS 31 Cb 0.23 -0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.64 2emk h HIS 31 CO 0.00 0.92 0.00 1.04 -0.00 0.00 0.00 177.93 179.89 2emk n GLN 32 N -3.46 0.03 0.21 5.26 6.02 -0.66 -1.59 117.38 123.19 2emk n GLN 32 Ca -0.00 0.47 0.06 0.00 -0.01 0.00 0.00 57.00 57.52 2emk n GLN 32 Cb 0.87 -1.58 0.47 0.00 1.02 0.00 0.00 30.24 31.01 2emk n GLN 32 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2emk h ARG 33 N 0.00 0.00 0.00 -1.09 3.08 -1.63 -2.15 114.38 112.59 2emk h ARG 33 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2emk h ARG 33 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.11 2emk h ARG 33 CO 0.00 0.29 0.00 -0.39 -1.07 0.00 0.00 179.97 178.80 2emk h VAL 34 N 0.00 0.00 0.00 2.04 -1.51 -1.53 0.16 116.25 115.40 2emk h VAL 34 Ca -0.00 -0.83 0.00 0.00 -1.23 0.00 0.00 66.70 64.63 2emk h VAL 34 Cb 0.60 1.83 0.00 0.00 -2.13 0.00 0.00 31.29 31.59 2emk h VAL 34 CO 0.04 0.00 -0.95 1.41 -1.23 0.00 0.00 177.57 176.84 2emk n HIS 35 N -2.97 0.83 -0.05 5.19 8.25 -0.85 -4.11 115.22 121.51 2emk n HIS 35 Ca 0.04 0.24 -0.03 0.00 -0.26 0.00 0.00 57.72 57.71 2emk n HIS 35 Cb 0.47 -0.86 -0.12 0.00 1.12 0.00 0.00 29.99 30.60 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 -2.51 0.71 -2.25 1.59 5.66 -0.99 -4.60 114.28 111.89 2emk n THR 36 Ca 0.01 -0.55 -0.37 0.00 -3.05 0.00 0.00 64.05 60.09 2emk n THR 36 Cb 0.52 -0.37 0.02 0.00 -1.55 0.00 0.00 70.33 68.95 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 1.92 5.75 3.38 1.09 0.00 0.54 -4.99 105.19 112.89 2emk n GLY 37 Ca -0.18 -2.58 -0.30 0.00 0.00 0.00 0.00 46.02 42.96 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 -3.99 1.80 0.13 1.61 2.56 -1.26 -4.85 118.70 114.70 2emk s GLU 38 Ca 0.48 -1.12 0.08 0.00 0.00 0.00 0.00 54.97 54.41 2emk s GLU 38 Cb 0.37 -2.02 -0.04 0.00 2.00 0.00 0.00 34.13 34.44 2emk s GLU 38 CO -0.30 0.51 -0.19 -1.59 -0.56 0.00 0.00 175.26 173.13 2emk s LYS 39 N -1.43 1.16 -1.11 4.30 0.00 -1.26 -5.06 119.74 116.34 2emk s LYS 39 Ca 0.13 -1.26 -0.23 0.00 0.00 0.00 0.00 55.97 54.61 2emk s LYS 39 Cb -0.10 -1.31 -0.08 0.00 0.00 0.00 0.00 37.83 36.35 2emk s LYS 39 CO 0.04 0.28 1.94 -1.25 0.00 0.00 0.00 175.35 176.36 2emk s PRO 40 N -2.32 2.51 0.00 1.78 0.04 -1.26 -4.59 135.00 131.16 2emk s PRO 40 Ca 0.10 -0.94 0.00 0.00 0.04 0.00 0.00 61.00 60.20 2emk s PRO 40 Cb -0.08 -5.20 0.00 0.00 0.04 0.00 0.00 34.50 29.27 2emk s PRO 40 CO 0.05 -3.83 0.00 0.43 0.04 0.00 0.00 177.00 173.69 2emk n SER 41 N 14.29 0.00 0.00 6.66 7.64 -1.26 -5.17 113.62 135.78 2emk n SER 41 Ca 0.44 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.32 2emk n SER 41 Cb 0.47 -0.11 0.00 0.00 -1.01 0.00 0.00 64.21 63.56 2emk n SER 41 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2emk n GLY 42 N 3.07 0.93 0.27 0.23 0.00 -1.26 -4.84 105.19 103.60 2emk n GLY 42 Ca 0.00 -1.89 0.16 0.00 0.00 0.00 0.00 46.02 44.29 2emk n GLY 42 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2emk h PRO 43 N 0.00 0.00 -6.38 1.61 0.13 -2.02 -3.45 132.00 121.90 2emk h PRO 43 Ca 0.00 0.00 -0.63 0.00 -0.87 0.00 0.00 66.00 64.50 2emk h PRO 43 Cb 0.00 0.00 0.05 0.00 0.13 0.00 0.00 31.00 31.18 2emk h PRO 43 CO 0.00 0.04 0.78 0.45 -0.23 0.00 0.00 178.00 179.03 2emk n SER 44 N -3.15 2.74 -4.83 1.44 2.88 -1.26 -4.96 113.62 106.48 2emk n SER 44 Ca 0.00 1.07 -0.28 0.00 -1.33 0.00 0.00 58.87 58.34 2emk n SER 44 Cb 0.31 -1.34 0.09 0.00 -0.75 0.00 0.00 64.21 62.53 2emk n SER 44 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2emk s SER 45 N 1.59 4.46 0.00 -3.46 0.15 -1.26 -5.09 113.70 110.09 2emk s SER 45 Ca 0.84 0.59 0.00 0.00 0.70 0.00 0.00 55.95 58.08 2emk s SER 45 Cb -0.78 -1.09 0.00 0.00 -1.71 0.00 0.00 66.02 62.44 2emk s SER 45 CO 0.45 -1.89 0.00 0.61 1.20 0.00 0.00 173.24 173.61