#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2em6 n SER 2 N 0.00 6.68 -4.47 1.61 3.41 -1.26 -4.90 113.62 114.69 2em6 n SER 2 Ca 0.00 -3.78 -0.40 0.00 -0.26 0.00 0.00 58.87 54.43 2em6 n SER 2 Cb 0.00 -0.77 -0.08 0.00 -0.26 0.00 0.00 64.21 63.10 2em6 n SER 2 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2em6 n SER 3 N -0.77 -1.38 -0.13 4.04 3.41 -1.26 -4.49 113.62 113.03 2em6 n SER 3 Ca 0.55 -1.23 0.00 0.00 -0.26 0.00 0.00 58.87 57.92 2em6 n SER 3 Cb 0.69 -1.71 0.00 0.00 -0.26 0.00 0.00 64.21 62.92 2em6 n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2em6 n GLY 4 N -1.40 0.68 2.37 5.00 0.00 -1.26 -4.31 105.19 106.27 2em6 n GLY 4 Ca 0.02 -0.85 -0.16 0.00 0.00 0.00 0.00 46.02 45.03 2em6 n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2em6 n SER 5 N -3.05 3.64 -4.39 1.61 7.64 -1.26 -5.06 113.62 112.73 2em6 n SER 5 Ca 0.00 -3.15 -0.20 0.00 1.01 0.00 0.00 58.87 56.53 2em6 n SER 5 Cb 0.00 -0.41 -0.10 0.00 -1.01 0.00 0.00 64.21 62.69 2em6 n SER 5 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2em6 s SER 6 N -3.62 2.35 0.00 6.43 0.01 -1.26 -5.15 113.70 112.46 2em6 s SER 6 Ca 0.42 -1.22 0.00 0.00 1.31 0.00 0.00 55.95 56.45 2em6 s SER 6 Cb 0.39 -0.09 0.00 0.00 0.21 0.00 0.00 66.02 66.53 2em6 s SER 6 CO -0.01 -0.44 0.00 0.61 0.41 0.00 0.00 173.24 173.81 2em6 n GLY 7 N -0.53 3.60 3.34 3.44 0.00 -1.26 -5.11 105.19 108.67 2em6 n GLY 7 Ca -0.05 -0.12 -0.10 0.00 0.00 0.00 0.00 46.02 45.76 2em6 n GLY 7 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2em6 s MET 8 N -0.60 1.17 0.00 1.61 -2.45 -1.26 -5.14 119.30 112.62 2em6 s MET 8 Ca 0.00 -1.17 0.00 0.00 -1.25 0.00 0.00 55.69 53.27 2em6 s MET 8 Cb 0.00 0.38 0.00 0.00 1.25 0.00 0.00 34.83 36.46 2em6 s MET 8 CO 0.00 -0.43 0.00 0.41 1.05 0.00 0.00 175.02 176.05 2em6 n GLY 9 N -0.22 3.47 0.14 2.11 0.00 -1.26 -4.98 105.19 104.45 2em6 n GLY 9 Ca -0.07 -1.00 -0.05 0.00 0.00 0.00 0.00 46.02 44.89 2em6 n GLY 9 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2em6 h GLU 10 N 0.00 0.13 -4.29 1.61 4.39 -2.01 -3.41 114.58 111.00 2em6 h GLU 10 Ca 0.00 -0.11 -0.60 0.00 0.34 0.00 0.00 59.36 58.98 2em6 h GLU 10 Cb 0.00 0.03 -0.38 0.00 -0.10 0.00 0.00 28.75 28.29 2em6 h GLU 10 CO 0.00 0.80 -0.79 0.15 -1.16 0.00 0.00 179.01 178.01 2em6 s LYS 11 N -3.45 1.56 -0.71 2.33 3.01 -1.26 -5.06 119.74 116.15 2em6 s LYS 11 Ca -0.02 -0.92 0.00 0.00 -1.01 0.00 0.00 55.97 54.02 2em6 s LYS 11 Cb 0.11 -2.52 0.18 0.00 -1.01 0.00 0.00 37.83 34.59 2em6 s LYS 11 CO 0.80 -0.59 0.53 0.00 0.51 0.00 0.00 175.35 176.60 2em6 s TYR 13 N -0.82 2.11 -0.24 0.00 2.02 -0.73 -4.88 117.35 114.81 2em6 s TYR 13 Ca 0.22 0.29 -0.09 0.00 -0.37 0.00 0.00 57.07 57.13 2em6 s TYR 13 Cb -0.14 -4.43 -0.04 0.00 -0.40 0.00 0.00 41.96 36.95 2em6 s TYR 13 CO -0.09 -2.12 0.11 0.21 -1.57 0.00 0.00 175.55 172.09 2em6 s LYS 14 N 6.05 3.88 -0.17 -0.62 2.20 -1.26 -0.31 119.74 129.51 2em6 s LYS 14 Ca 0.48 -0.37 -0.29 0.00 -0.36 0.00 0.00 55.97 55.43 2em6 s LYS 14 Cb -0.10 -3.40 -0.04 0.00 -1.51 0.00 0.00 37.83 32.77 2em6 s LYS 14 CO 0.19 -0.01 1.82 0.00 -0.36 0.00 0.00 175.35 176.98 2em6 n ASP 16 N 8.98 5.80 0.00 0.00 8.00 -1.26 -2.62 116.55 135.45 2em6 n ASP 16 Ca 0.21 -2.73 0.00 0.00 0.71 0.00 0.00 54.79 52.99 2em6 n ASP 16 Cb 0.44 -1.20 0.00 0.00 -0.02 0.00 0.00 41.12 40.34 2em6 n ASP 16 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 2em6 n VAL 17 N 1.34 0.00 -0.01 2.53 0.31 -1.26 -4.97 118.33 116.27 2em6 n VAL 17 Ca 0.26 0.00 -0.01 0.00 -0.01 0.00 0.00 64.34 64.58 2em6 n VAL 17 Cb 0.63 -0.68 -0.01 0.00 -0.91 0.00 0.00 33.84 32.87 2em6 n VAL 17 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2em6 n GLY 19 N 3.40 0.56 2.97 0.00 0.00 -1.08 -5.10 105.19 105.95 2em6 n GLY 19 Ca -0.03 -0.53 -0.16 0.00 0.00 0.00 0.00 46.02 45.29 2em6 n GLY 19 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2em6 n LYS 20 N 0.00 0.74 -3.65 1.61 4.76 -1.24 -4.90 118.16 115.47 2em6 n LYS 20 Ca 0.00 -2.46 -0.04 0.00 -2.87 0.00 0.00 58.31 52.94 2em6 n LYS 20 Cb 0.00 -0.06 -0.06 0.00 -1.84 0.00 0.00 35.03 33.07 2em6 n LYS 20 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 2em6 s GLU 21 N -3.94 0.49 0.33 1.97 2.02 -1.26 -2.85 118.70 115.47 2em6 s GLU 21 Ca 0.41 1.27 0.04 0.00 0.02 0.00 0.00 54.97 56.70 2em6 s GLU 21 Cb -0.03 0.59 -0.06 0.00 0.10 0.00 0.00 34.13 34.73 2em6 s GLU 21 CO 0.26 -0.21 0.06 -0.06 0.02 0.00 0.00 175.26 175.33 2em6 s PHE 22 N 2.63 1.95 -0.21 1.61 0.40 0.57 -4.98 117.98 119.95 2em6 s PHE 22 Ca -0.05 -0.98 -0.11 0.00 -0.60 0.00 0.00 56.93 55.19 2em6 s PHE 22 Cb -0.11 -1.27 -0.19 0.00 0.51 0.00 0.00 43.02 41.95 2em6 s PHE 22 CO -0.17 -0.01 0.03 0.43 0.70 0.00 0.00 175.22 176.20 2em6 n SER 23 N -0.73 1.98 -4.77 1.36 7.64 -1.26 -1.78 113.62 116.07 2em6 n SER 23 Ca -0.03 0.23 -0.23 0.00 1.01 0.00 0.00 58.87 59.85 2em6 n SER 23 Cb 0.66 -0.79 -0.05 0.00 -1.01 0.00 0.00 64.21 63.02 2em6 n SER 23 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 2em6 s GLN 24 N -2.48 2.75 0.06 1.43 -1.52 -1.26 -4.60 119.66 114.04 2em6 s GLN 24 Ca -0.31 -1.12 -0.30 0.00 -1.95 0.00 0.00 55.36 51.68 2em6 s GLN 24 Cb 0.09 -2.47 -0.18 0.00 -0.22 0.00 0.00 33.01 30.23 2em6 s GLN 24 CO 0.62 0.40 1.54 0.66 -0.25 0.00 0.00 175.29 178.26 2em6 h SER 25 N 1.73 -0.63 -0.85 5.90 4.64 -1.96 -3.08 113.55 119.29 2em6 h SER 25 Ca -0.47 -0.01 0.15 0.00 -0.47 0.00 0.00 61.79 60.99 2em6 h SER 25 Cb 1.24 0.16 -0.15 0.00 -0.31 0.00 0.00 62.40 63.34 2em6 h SER 25 CO 0.61 -0.40 -0.31 0.28 -0.87 0.00 0.00 176.83 176.14 2em6 h SER 26 N -0.82 -1.13 -0.62 4.97 0.02 -1.99 0.36 113.55 114.34 2em6 h SER 26 Ca -0.08 0.27 0.08 0.00 -0.84 0.00 0.00 61.79 61.23 2em6 h SER 26 Cb 0.60 0.63 -0.11 0.00 0.14 0.00 0.00 62.40 63.67 2em6 h SER 26 CO 0.13 -0.29 -0.47 0.45 -1.14 0.00 0.00 176.83 175.50 2em6 h HIS 27 N -0.04 -1.42 0.22 3.45 3.86 -1.96 0.78 115.15 120.04 2em6 h HIS 27 Ca 0.35 0.09 0.00 0.00 -1.16 0.00 0.00 60.37 59.65 2em6 h HIS 27 Cb 0.60 0.71 -0.01 0.00 1.06 0.00 0.00 27.41 29.77 2em6 h HIS 27 CO -0.74 -0.43 -0.19 1.25 0.86 0.00 0.00 177.93 178.68 2em6 h LEU 28 N -0.22 -0.50 -0.74 2.43 5.85 -0.97 -2.38 115.31 118.77 2em6 h LEU 28 Ca 0.17 0.04 0.16 0.00 0.84 0.00 0.00 57.88 59.09 2em6 h LEU 28 Cb 0.55 0.17 -0.13 0.00 0.37 0.00 0.00 40.66 41.62 2em6 h LEU 28 CO -0.72 -0.29 -0.07 1.56 -0.34 0.00 0.00 178.44 178.58 2em6 h GLN 29 N -0.43 0.05 -0.72 1.25 7.50 -0.11 0.30 115.11 122.96 2em6 h GLN 29 Ca -0.01 -0.00 0.04 0.00 0.50 0.00 0.00 58.65 59.18 2em6 h GLN 29 Cb 0.39 -0.01 -0.05 0.00 0.05 0.00 0.00 27.48 27.86 2em6 h GLN 29 CO -0.03 0.04 0.44 1.15 -1.50 0.00 0.00 178.83 178.93 2em6 h THR 30 N 0.06 1.06 -0.38 -0.54 2.02 -0.57 -2.54 112.91 112.03 2em6 h THR 30 Ca 0.39 -0.29 -0.06 0.00 0.77 0.00 0.00 66.41 67.22 2em6 h THR 30 Cb 0.65 0.15 -0.01 0.00 -1.74 0.00 0.00 68.15 67.20 2em6 h THR 30 CO -0.70 0.15 -0.01 -0.74 0.37 0.00 0.00 175.52 174.59 2em6 h HIS 31 N 0.84 0.74 -0.67 3.16 -0.00 -0.14 -2.77 115.15 116.31 2em6 h HIS 31 Ca 0.30 -0.13 0.19 0.00 -0.00 0.00 0.00 60.37 60.73 2em6 h HIS 31 Cb 0.07 -0.19 -0.03 0.00 -0.00 0.00 0.00 27.41 27.26 2em6 h HIS 31 CO -0.05 0.77 0.99 1.96 -0.00 0.00 0.00 177.93 181.60 2em6 h GLN 32 N 0.49 0.00 -0.99 5.26 4.20 -0.13 0.31 115.11 124.25 2em6 h GLN 32 Ca 0.11 0.00 0.19 0.00 0.06 0.00 0.00 58.65 59.00 2em6 h GLN 32 Cb 0.49 0.00 -0.11 0.00 0.30 0.00 0.00 27.48 28.16 2em6 h GLN 32 CO 0.02 0.00 0.60 0.00 -0.67 0.00 0.00 178.83 178.78 2em6 h ARG 33 N 0.00 0.73 0.00 1.46 3.08 -1.52 0.37 114.38 118.50 2em6 h ARG 33 Ca 0.32 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.32 2em6 h ARG 33 Cb 2.29 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 32.17 2em6 h ARG 33 CO -0.00 0.49 0.34 -0.39 -1.07 0.00 0.00 179.97 179.33 2em6 h VAL 34 N 0.76 0.00 0.00 2.04 -1.51 -0.60 0.01 116.25 116.94 2em6 h VAL 34 Ca 0.57 0.00 -0.13 0.00 -1.23 0.00 0.00 66.70 65.91 2em6 h VAL 34 Cb 0.88 0.38 -0.03 0.00 -2.13 0.00 0.00 31.29 30.39 2em6 h VAL 34 CO -0.38 0.00 -1.50 1.41 -1.23 0.00 0.00 177.57 175.87 2em6 n HIS 35 N -2.29 0.00 -0.81 5.19 8.25 0.12 -4.93 115.22 120.74 2em6 n HIS 35 Ca -0.01 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.11 2em6 n HIS 35 Cb 0.37 -0.36 0.11 0.00 1.12 0.00 0.00 29.99 31.23 2em6 n HIS 35 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2em6 n THR 36 N -2.32 0.00 -0.31 1.59 -2.24 -0.01 -4.81 114.28 106.18 2em6 n THR 36 Ca -0.12 -0.25 0.12 0.00 -2.27 0.00 0.00 64.05 61.52 2em6 n THR 36 Cb 0.73 -0.43 0.29 0.00 -2.10 0.00 0.00 70.33 68.82 2em6 n THR 36 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2em6 h GLY 37 N -1.58 1.52 -7.30 3.38 0.00 -1.93 -3.34 103.07 93.82 2em6 h GLY 37 Ca -0.47 -0.20 -0.54 0.00 0.00 0.00 0.00 47.33 46.12 2em6 h GLY 37 CO 0.32 -0.20 1.09 -0.54 0.00 0.00 0.00 176.54 177.22 2em6 s GLU 38 N -5.90 3.17 -0.40 4.80 2.02 -1.26 -4.85 118.70 116.27 2em6 s GLU 38 Ca -0.12 -0.00 0.11 0.00 0.02 0.00 0.00 54.97 54.99 2em6 s GLU 38 Cb 0.24 -4.18 0.38 0.00 0.10 0.00 0.00 34.13 30.67 2em6 s GLU 38 CO 0.78 -2.14 0.84 0.36 0.02 0.00 0.00 175.26 175.12 2em6 n LYS 39 N 9.17 1.59 0.00 1.61 2.85 -1.26 -4.73 118.16 127.39 2em6 n LYS 39 Ca 0.07 -3.70 0.05 0.00 -1.05 0.00 0.00 58.31 53.67 2em6 n LYS 39 Cb 0.49 -1.75 0.30 0.00 -0.65 0.00 0.00 35.03 33.42 2em6 n LYS 39 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 177.40 177.00 2em6 n PRO 40 N 0.06 0.49 -3.43 -1.58 -0.04 -1.26 -4.65 135.00 124.59 2em6 n PRO 40 Ca 0.24 0.00 -0.39 0.00 -0.04 0.00 0.00 63.50 63.31 2em6 n PRO 40 Cb 0.64 -1.32 -0.09 0.00 -0.04 0.00 0.00 33.50 32.69 2em6 n PRO 40 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2em6 s SER 41 N -1.83 6.22 0.00 3.54 0.01 -1.26 -5.06 113.70 115.32 2em6 s SER 41 Ca 0.15 0.25 0.00 0.00 1.31 0.00 0.00 55.95 57.66 2em6 s SER 41 Cb 0.07 -2.19 0.00 0.00 0.21 0.00 0.00 66.02 64.11 2em6 s SER 41 CO 0.12 -0.15 0.00 0.61 0.41 0.00 0.00 173.24 174.23 2em6 n GLY 42 N 4.70 6.06 0.13 3.44 0.00 -1.26 -5.06 105.19 113.20 2em6 n GLY 42 Ca -0.10 -2.06 -0.13 0.00 0.00 0.00 0.00 46.02 43.74 2em6 n GLY 42 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2em6 h PRO 43 N 0.00 0.32 -7.11 1.61 0.13 -2.01 -3.46 132.00 121.48 2em6 h PRO 43 Ca 0.00 -0.17 -0.62 0.00 -0.87 0.00 0.00 66.00 64.35 2em6 h PRO 43 Cb 0.00 0.01 -0.32 0.00 0.13 0.00 0.00 31.00 30.82 2em6 h PRO 43 CO 0.00 0.71 -0.92 -1.13 -0.23 0.00 0.00 178.00 176.44 2em6 n SER 44 N -4.59 -0.80 -4.73 1.44 3.41 -1.26 -4.90 113.62 102.19 2em6 n SER 44 Ca -0.06 -1.24 -0.33 0.00 -0.26 0.00 0.00 58.87 56.98 2em6 n SER 44 Cb 0.35 -1.57 -0.08 0.00 -0.26 0.00 0.00 64.21 62.65 2em6 n SER 44 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2em6 s SER 45 N -3.63 5.41 0.00 4.04 1.04 -1.26 -5.32 113.70 113.98 2em6 s SER 45 Ca 0.52 0.09 0.28 0.00 0.48 0.00 0.00 55.95 57.32 2em6 s SER 45 Cb -0.31 -1.50 0.98 0.00 0.10 0.00 0.00 66.02 65.29 2em6 s SER 45 CO 1.00 0.29 1.70 0.61 0.98 0.00 0.00 173.24 177.82