#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2em6 h SER 2 N 0.00 0.00 -3.45 1.61 4.64 -2.13 -3.43 113.55 110.80 2em6 h SER 2 Ca 0.00 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 60.98 2em6 h SER 2 Cb 0.00 0.00 -0.35 0.00 -0.31 0.00 0.00 62.40 61.74 2em6 h SER 2 CO 0.00 0.00 -0.74 -0.44 -0.87 0.00 0.00 176.83 174.78 2em6 s SER 3 N -5.12 0.56 0.00 4.97 0.01 -1.26 -5.03 113.70 107.84 2em6 s SER 3 Ca 0.06 0.01 0.00 0.00 1.31 0.00 0.00 55.95 57.33 2em6 s SER 3 Cb 0.09 -0.18 0.00 0.00 0.21 0.00 0.00 66.02 66.14 2em6 s SER 3 CO 0.54 -0.15 0.00 0.61 0.41 0.00 0.00 173.24 174.65 2em6 n GLY 4 N 4.47 -0.04 3.43 3.44 0.00 -1.26 -5.14 105.19 110.09 2em6 n GLY 4 Ca -0.21 0.06 -0.34 0.00 0.00 0.00 0.00 46.02 45.54 2em6 n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2em6 n SER 5 N 0.00 -1.76 -4.31 1.61 3.41 -1.26 -4.92 113.62 106.39 2em6 n SER 5 Ca 0.00 0.44 -0.46 0.00 -0.26 0.00 0.00 58.87 58.59 2em6 n SER 5 Cb 0.00 -1.20 -0.03 0.00 -0.26 0.00 0.00 64.21 62.71 2em6 n SER 5 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2em6 s SER 6 N -1.76 6.53 0.00 4.04 0.01 -1.26 -4.70 113.70 116.56 2em6 s SER 6 Ca 0.60 -2.47 0.00 0.00 1.31 0.00 0.00 55.95 55.40 2em6 s SER 6 Cb -0.27 -2.19 0.00 0.00 0.21 0.00 0.00 66.02 63.77 2em6 s SER 6 CO 0.64 -0.63 0.00 0.61 0.41 0.00 0.00 173.24 174.26 2em6 n GLY 7 N 4.27 -1.14 3.73 3.44 0.00 -1.26 -5.03 105.19 109.21 2em6 n GLY 7 Ca 0.06 -0.39 -0.41 0.00 0.00 0.00 0.00 46.02 45.28 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 -0.41 4.53 0.00 1.61 -2.45 -1.26 -4.91 119.30 116.41 2em6 s MET 8 Ca 0.00 1.74 0.00 0.00 -1.25 0.00 0.00 55.69 56.18 2em6 s MET 8 Cb 0.00 -3.30 0.00 0.00 1.25 0.00 0.00 34.83 32.78 2em6 s MET 8 CO 0.00 -0.05 0.00 0.41 1.05 0.00 0.00 175.02 176.43 2em6 n GLY 9 N 2.44 0.74 0.15 2.11 0.00 -1.26 -4.89 105.19 104.48 2em6 n GLY 9 Ca 0.05 -1.86 0.07 0.00 0.00 0.00 0.00 46.02 44.28 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 6.68 0.00 -2.82 1.61 5.08 -2.01 -3.48 114.58 119.65 2em6 h GLU 10 Ca 0.00 0.00 0.09 0.00 -1.00 0.00 0.00 59.36 58.45 2em6 h GLU 10 Cb 0.00 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.20 2em6 h GLU 10 CO 0.00 0.21 0.31 0.15 -1.00 0.00 0.00 179.01 178.68 2em6 s LYS 11 N -3.11 1.67 -0.20 2.33 1.02 -1.26 -5.16 119.74 115.03 2em6 s LYS 11 Ca 0.03 -0.95 -0.05 0.00 0.02 0.00 0.00 55.97 55.02 2em6 s LYS 11 Cb 0.07 0.55 0.10 0.00 -0.52 0.00 0.00 37.83 38.04 2em6 s LYS 11 CO 0.74 -0.77 0.38 0.00 -0.92 0.00 0.00 175.35 174.78 2em6 s TYR 13 N 2.56 2.88 -0.07 0.00 1.51 -0.92 -4.98 117.35 118.33 2em6 s TYR 13 Ca 0.03 -0.25 -0.02 0.00 -1.01 0.00 0.00 57.07 55.83 2em6 s TYR 13 Cb -0.13 -3.89 -0.03 0.00 -0.11 0.00 0.00 41.96 37.80 2em6 s TYR 13 CO -0.13 -1.25 0.01 0.21 -1.11 0.00 0.00 175.55 173.28 2em6 s LYS 14 N 3.45 2.98 -1.15 -0.62 2.36 -1.26 -0.61 119.74 124.90 2em6 s LYS 14 Ca 0.24 -0.43 -0.10 0.00 -2.55 0.00 0.00 55.97 53.13 2em6 s LYS 14 Cb -0.15 -2.80 0.24 0.00 -1.05 0.00 0.00 37.83 34.07 2em6 s LYS 14 CO 0.16 0.69 1.27 0.00 1.55 0.00 0.00 175.35 179.03 2em6 n ASP 16 N 3.52 0.14 -0.07 0.00 9.92 -1.26 0.74 116.55 129.54 2em6 n ASP 16 Ca 0.29 1.23 -0.13 0.00 -0.53 0.00 0.00 54.79 55.65 2em6 n ASP 16 Cb 0.40 -0.61 -0.09 0.00 -0.64 0.00 0.00 41.12 40.18 2em6 n ASP 16 CO 0.00 0.00 0.00 0.58 0.13 0.00 0.00 177.20 177.91 2em6 h VAL 17 N 0.00 0.00 0.00 2.53 2.07 -1.97 -3.36 116.25 115.52 2em6 h VAL 17 Ca 0.87 0.00 -0.29 0.00 0.82 0.00 0.00 66.70 68.10 2em6 h VAL 17 Cb 3.03 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 32.75 2em6 h VAL 17 CO -0.32 0.00 -2.01 0.00 0.02 0.00 0.00 177.57 175.26 2em6 n GLY 19 N 2.10 1.23 3.90 0.00 0.00 0.23 -5.05 105.19 107.60 2em6 n GLY 19 Ca -0.34 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.39 2em6 n GLY 19 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2em6 s LYS 20 N 0.00 3.01 -0.04 1.61 1.02 -1.24 -4.77 119.74 119.34 2em6 s LYS 20 Ca 0.00 0.24 -0.01 0.00 0.02 0.00 0.00 55.97 56.22 2em6 s LYS 20 Cb 0.00 -2.18 0.03 0.00 -0.52 0.00 0.00 37.83 35.17 2em6 s LYS 20 CO 0.00 -0.76 0.06 -1.21 -0.92 0.00 0.00 175.35 172.52 2em6 s GLU 21 N -5.12 -0.03 0.12 1.68 2.02 -1.26 -0.13 118.70 115.98 2em6 s GLU 21 Ca 0.55 0.30 0.05 0.00 0.02 0.00 0.00 54.97 55.89 2em6 s GLU 21 Cb -0.11 -0.33 -0.04 0.00 0.10 0.00 0.00 34.13 33.75 2em6 s GLU 21 CO 0.48 -0.23 -0.13 -0.06 0.02 0.00 0.00 175.26 175.34 2em6 s PHE 22 N 1.54 1.34 -0.07 1.61 0.40 0.22 -5.00 117.98 118.03 2em6 s PHE 22 Ca -0.03 -0.58 -0.09 0.00 -0.60 0.00 0.00 56.93 55.62 2em6 s PHE 22 Cb -0.12 -0.70 -0.29 0.00 0.51 0.00 0.00 43.02 42.41 2em6 s PHE 22 CO -0.04 0.12 0.58 1.03 0.70 0.00 0.00 175.22 177.61 2em6 h SER 23 N 3.45 0.55 -2.86 1.36 0.87 -1.94 -2.45 113.55 112.54 2em6 h SER 23 Ca -0.39 -0.93 -0.63 0.00 -1.23 0.00 0.00 61.79 58.61 2em6 h SER 23 Cb 1.20 -0.18 -0.06 0.00 -0.44 0.00 0.00 62.40 62.92 2em6 h SER 23 CO 0.52 1.80 -0.32 -1.10 -0.53 0.00 0.00 176.83 177.20 2em6 s GLN 24 N -2.57 3.72 0.19 2.24 -1.52 -1.26 -4.77 119.66 115.69 2em6 s GLN 24 Ca -0.18 0.18 -0.12 0.00 -1.95 0.00 0.00 55.36 53.30 2em6 s GLN 24 Cb 0.06 -3.21 0.14 0.00 -0.22 0.00 0.00 33.01 29.78 2em6 s GLN 24 CO 0.83 0.73 1.84 0.66 -0.25 0.00 0.00 175.29 179.10 2em6 h SER 25 N 4.83 0.67 -0.82 5.90 4.64 -1.99 -2.34 113.55 124.43 2em6 h SER 25 Ca -0.53 -0.01 0.11 0.00 -0.47 0.00 0.00 61.79 60.89 2em6 h SER 25 Cb 1.22 -0.15 -0.08 0.00 -0.31 0.00 0.00 62.40 63.09 2em6 h SER 25 CO 0.60 0.47 0.46 0.28 -0.87 0.00 0.00 176.83 177.77 2em6 h SER 26 N 0.80 0.63 -0.48 4.97 0.02 -1.98 -1.17 113.55 116.34 2em6 h SER 26 Ca 0.25 0.06 0.10 0.00 -0.84 0.00 0.00 61.79 61.35 2em6 h SER 26 Cb -0.02 -0.06 -0.09 0.00 0.14 0.00 0.00 62.40 62.37 2em6 h SER 26 CO -0.09 0.34 -0.09 0.45 -1.14 0.00 0.00 176.83 176.30 2em6 h HIS 27 N 0.74 -0.21 -0.41 3.45 3.86 -1.83 0.24 115.15 120.99 2em6 h HIS 27 Ca 0.41 0.04 -0.12 0.00 -1.16 0.00 0.00 60.37 59.54 2em6 h HIS 27 Cb 0.43 0.17 -0.01 0.00 1.06 0.00 0.00 27.41 29.05 2em6 h HIS 27 CO -0.07 -0.19 -0.21 1.25 0.86 0.00 0.00 177.93 179.57 2em6 h LEU 28 N 0.02 0.82 -0.31 2.43 5.85 -1.34 -2.18 115.31 120.59 2em6 h LEU 28 Ca 0.23 -0.29 -0.01 0.00 0.84 0.00 0.00 57.88 58.65 2em6 h LEU 28 Cb 0.35 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.15 2em6 h LEU 28 CO -0.47 1.01 0.17 1.56 -0.34 0.00 0.00 178.44 180.37 2em6 h GLN 29 N 0.70 0.44 -0.65 1.25 1.08 0.00 0.16 115.11 118.11 2em6 h GLN 29 Ca 0.10 -0.05 -0.07 0.00 -1.45 0.00 0.00 58.65 57.18 2em6 h GLN 29 Cb 0.73 -0.09 -0.03 0.00 -0.05 0.00 0.00 27.48 28.05 2em6 h GLN 29 CO 0.06 0.38 0.13 1.15 -0.95 0.00 0.00 178.83 179.60 2em6 h THR 30 N 0.39 1.25 0.15 -0.54 2.02 -0.52 -3.17 112.91 112.50 2em6 h THR 30 Ca 0.11 -0.97 -0.01 0.00 0.77 0.00 0.00 66.41 66.32 2em6 h THR 30 Cb 0.07 0.62 0.00 0.00 -1.74 0.00 0.00 68.15 67.10 2em6 h THR 30 CO -0.02 0.36 -0.07 -0.74 0.37 0.00 0.00 175.52 175.42 2em6 h HIS 31 N 0.98 -0.19 -1.48 3.16 -0.00 -1.12 -3.03 115.15 113.46 2em6 h HIS 31 Ca 0.20 -0.00 0.43 0.00 -0.00 0.00 0.00 60.37 61.00 2em6 h HIS 31 Cb 0.38 0.06 -0.06 0.00 -0.00 0.00 0.00 27.41 27.80 2em6 h HIS 31 CO 0.03 0.19 1.21 1.04 -0.00 0.00 0.00 177.93 180.40 2em6 n GLN 32 N -4.99 0.00 -0.30 5.26 1.13 0.55 0.10 117.38 119.13 2em6 n GLN 32 Ca -0.09 0.94 0.12 0.00 -1.94 0.00 0.00 57.00 56.03 2em6 n GLN 32 Cb 0.25 -2.22 0.27 0.00 0.11 0.00 0.00 30.24 28.64 2em6 n GLN 32 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2em6 h ARG 33 N 0.00 0.14 -0.61 -1.09 3.08 -1.58 0.89 114.38 115.21 2em6 h ARG 33 Ca 0.70 -0.01 0.12 0.00 0.07 0.00 0.00 59.98 60.86 2em6 h ARG 33 Cb 3.11 -0.03 -0.04 0.00 0.08 0.00 0.00 29.97 33.09 2em6 h ARG 33 CO -0.01 0.09 0.41 -0.39 -1.07 0.00 0.00 179.97 179.01 2em6 h VAL 34 N 0.15 0.85 -0.34 2.04 -1.51 -0.58 0.65 116.25 117.51 2em6 h VAL 34 Ca 0.54 -0.12 -0.16 0.00 -1.23 0.00 0.00 66.70 65.72 2em6 h VAL 34 Cb 1.08 0.48 -0.10 0.00 -2.13 0.00 0.00 31.29 30.61 2em6 h VAL 34 CO -0.71 0.06 0.21 1.41 -1.23 0.00 0.00 177.57 177.31 2em6 n HIS 35 N -4.46 1.06 -3.59 5.19 8.25 0.31 -4.82 115.22 117.16 2em6 n HIS 35 Ca 0.11 -0.90 -0.10 0.00 -0.26 0.00 0.00 57.72 56.56 2em6 n HIS 35 Cb 0.43 -0.47 -0.05 0.00 1.12 0.00 0.00 29.99 31.02 2em6 n HIS 35 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 2em6 s THR 36 N -1.23 0.00 0.00 1.59 -1.32 0.22 -5.09 115.64 109.81 2em6 s THR 36 Ca 0.20 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.68 2em6 s THR 36 Cb 0.17 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 70.16 2em6 s THR 36 CO 0.04 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.06 2em6 n GLY 37 N 0.96 0.86 2.79 6.08 0.00 -1.26 -4.84 105.19 109.79 2em6 n GLY 37 Ca -0.11 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.77 2em6 n GLY 37 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2em6 s GLU 38 N 1.67 -0.02 -1.11 1.61 2.12 -1.26 -4.89 118.70 116.82 2em6 s GLU 38 Ca 0.00 0.21 -0.03 0.00 0.36 0.00 0.00 54.97 55.51 2em6 s GLU 38 Cb 0.00 -0.23 -0.03 0.00 0.26 0.00 0.00 34.13 34.13 2em6 s GLU 38 CO 0.00 -0.16 0.94 1.63 -0.54 0.00 0.00 175.26 177.13 2em6 n LYS 39 N 4.15 -4.64 -2.20 4.30 4.76 -1.26 -4.93 118.16 118.34 2em6 n LYS 39 Ca -0.27 0.84 -0.42 0.00 -2.87 0.00 0.00 58.31 55.59 2em6 n LYS 39 Cb 0.51 -5.77 -0.03 0.00 -1.84 0.00 0.00 35.03 27.89 2em6 n LYS 39 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 2em6 s PRO 40 N -4.91 4.33 0.29 1.97 0.04 -1.26 -5.02 135.00 130.43 2em6 s PRO 40 Ca 0.19 2.03 0.03 0.00 0.04 0.00 0.00 61.00 63.30 2em6 s PRO 40 Cb -0.03 -3.29 -0.04 0.00 0.04 0.00 0.00 34.50 31.19 2em6 s PRO 40 CO 0.72 -0.43 0.17 -1.54 0.04 0.00 0.00 177.00 175.96 2em6 s SER 41 N 1.18 1.34 0.00 6.66 1.04 -1.26 -5.11 113.70 117.55 2em6 s SER 41 Ca 0.64 -1.55 0.00 0.00 0.48 0.00 0.00 55.95 55.52 2em6 s SER 41 Cb -0.35 0.40 0.00 0.00 0.10 0.00 0.00 66.02 66.17 2em6 s SER 41 CO 0.30 -0.90 0.00 0.61 0.98 0.00 0.00 173.24 174.23 2em6 n GLY 42 N -0.54 -1.14 3.57 7.32 0.00 -1.26 -5.06 105.19 108.09 2em6 n GLY 42 Ca 0.02 0.61 -0.27 0.00 0.00 0.00 0.00 46.02 46.38 2em6 n GLY 42 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2em6 s PRO 43 N 0.48 2.53 -0.68 1.61 0.04 -1.26 -4.78 135.00 132.94 2em6 s PRO 43 Ca 0.00 -0.72 -0.02 0.00 0.04 0.00 0.00 61.00 60.30 2em6 s PRO 43 Cb 0.00 -5.15 0.44 0.00 0.04 0.00 0.00 34.50 29.83 2em6 s PRO 43 CO 0.00 -3.68 2.04 -1.13 0.04 0.00 0.00 177.00 174.27 2em6 n SER 44 N 14.18 7.69 -4.25 6.66 3.41 -1.26 -4.86 113.62 135.18 2em6 n SER 44 Ca 0.42 -3.79 -0.35 0.00 -0.26 0.00 0.00 58.87 54.89 2em6 n SER 44 Cb 0.47 -0.99 -0.04 0.00 -0.26 0.00 0.00 64.21 63.39 2em6 n SER 44 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2em6 n SER 45 N -0.87 -2.25 0.00 4.04 2.88 -1.26 -5.31 113.62 110.84 2em6 n SER 45 Ca 0.62 -1.08 0.00 0.00 -1.33 0.00 0.00 58.87 57.08 2em6 n SER 45 Cb 0.62 -2.50 0.00 0.00 -0.75 0.00 0.00 64.21 61.59 2em6 n SER 45 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42