#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2emf s SER 2 N 0.00 -0.26 0.46 1.61 0.15 -1.26 -5.17 113.70 109.24 2emf s SER 2 Ca 0.00 0.39 -0.07 0.00 0.70 0.00 0.00 55.95 56.97 2emf s SER 2 Cb 0.00 0.50 -0.05 0.00 -1.71 0.00 0.00 66.02 64.77 2emf s SER 2 CO 0.00 -0.23 0.79 -0.44 1.20 0.00 0.00 173.24 174.55 2emf s SER 3 N -0.42 6.35 -0.57 5.45 0.01 -1.26 -5.06 113.70 118.21 2emf s SER 3 Ca -0.05 1.01 0.02 0.00 1.31 0.00 0.00 55.95 58.24 2emf s SER 3 Cb -0.04 -2.28 0.14 0.00 0.21 0.00 0.00 66.02 64.06 2emf s SER 3 CO 0.02 -0.53 0.33 -0.83 0.41 0.00 0.00 173.24 172.64 2emf s GLY 4 N -3.79 2.51 -0.24 3.44 0.00 -1.26 -5.05 107.32 102.93 2emf s GLY 4 Ca 0.49 -3.33 0.02 0.00 0.00 0.00 0.00 44.72 41.90 2emf s GLY 4 CO 0.41 1.04 -0.10 -0.45 0.00 0.00 0.00 173.10 174.00 2emf s SER 5 N -0.13 4.11 0.01 1.64 0.15 -1.26 -5.11 113.70 113.10 2emf s SER 5 Ca 0.18 -1.25 0.04 0.00 0.70 0.00 0.00 55.95 55.62 2emf s SER 5 Cb -0.23 -1.40 -0.03 0.00 -1.71 0.00 0.00 66.02 62.65 2emf s SER 5 CO -0.02 -0.19 -0.10 -0.44 1.20 0.00 0.00 173.24 173.69 2emf s SER 6 N 1.23 4.41 -0.27 5.45 0.01 -1.26 -5.10 113.70 118.16 2emf s SER 6 Ca -0.07 -0.21 -0.01 0.00 1.31 0.00 0.00 55.95 56.97 2emf s SER 6 Cb -0.19 -0.96 0.13 0.00 0.21 0.00 0.00 66.02 65.20 2emf s SER 6 CO -0.06 0.28 0.30 -0.83 0.41 0.00 0.00 173.24 173.34 2emf s GLY 7 N -1.36 -0.17 -1.17 3.44 0.00 -1.26 -5.06 107.32 101.73 2emf s GLY 7 Ca 0.16 -0.03 -0.19 0.00 0.00 0.00 0.00 44.72 44.66 2emf s GLY 7 CO 0.06 2.58 1.98 -0.37 0.00 0.00 0.00 173.10 177.35 2emf n THR 8 N 5.32 2.80 0.00 0.90 5.66 -1.26 -4.44 114.28 123.27 2emf n THR 8 Ca -0.03 -2.65 0.00 0.00 -3.05 0.00 0.00 64.05 58.32 2emf n THR 8 Cb 0.48 -2.39 0.00 0.00 -1.55 0.00 0.00 70.33 66.87 2emf n THR 8 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2emf n GLY 9 N 4.81 2.18 3.77 1.09 0.00 -1.26 -4.99 105.19 110.78 2emf n GLY 9 Ca 0.49 -0.37 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 2emf n GLY 9 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2emf n GLY 10 N 0.00 1.06 2.79 -0.02 0.00 -1.26 -4.99 105.19 102.77 2emf n GLY 10 Ca 0.00 0.21 -0.30 0.00 0.00 0.00 0.00 46.02 45.93 2emf n GLY 10 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2emf s LYS 11 N -2.38 1.45 0.32 1.61 1.02 -1.26 -4.74 119.74 115.75 2emf s LYS 11 Ca 0.60 -2.12 -0.21 0.00 0.02 0.00 0.00 55.97 54.25 2emf s LYS 11 Cb -0.45 -2.63 -0.09 0.00 -0.52 0.00 0.00 37.83 34.13 2emf s LYS 11 CO 0.59 -1.13 0.85 -3.38 -0.92 0.00 0.00 175.35 171.36 2emf s HIS 12 N 0.27 3.54 -0.23 3.18 -3.43 -1.26 -4.97 115.29 112.39 2emf s HIS 12 Ca 0.17 1.53 -0.10 0.00 -0.80 0.00 0.00 55.06 55.86 2emf s HIS 12 Cb -0.24 -2.75 -0.05 0.00 -1.43 0.00 0.00 32.58 28.11 2emf s HIS 12 CO -0.01 0.16 0.14 -0.06 -2.00 0.00 0.00 174.74 172.97 2emf s PHE 13 N -1.77 3.30 -0.07 0.38 0.40 -0.95 -4.94 117.98 114.33 2emf s PHE 13 Ca 0.51 0.18 -0.03 0.00 -0.60 0.00 0.00 56.93 57.00 2emf s PHE 13 Cb -0.15 -2.23 -0.04 0.00 0.51 0.00 0.00 43.02 41.11 2emf s PHE 13 CO 0.20 0.08 0.05 -2.00 0.70 0.00 0.00 175.22 174.24 2emf s GLU 14 N 0.94 3.09 -0.28 0.44 2.56 -1.26 -1.00 118.70 123.19 2emf s GLU 14 Ca 0.07 -0.37 -0.29 0.00 0.00 0.00 0.00 54.97 54.38 2emf s GLU 14 Cb -0.13 -2.89 0.00 0.00 2.00 0.00 0.00 34.13 33.11 2emf s GLU 14 CO 0.03 0.71 1.27 0.00 -0.56 0.00 0.00 175.26 176.71 2emf n THR 16 N 6.04 0.81 -0.06 0.00 5.66 -1.26 -0.04 114.28 125.44 2emf n THR 16 Ca 0.14 0.20 -0.03 0.00 -3.05 0.00 0.00 64.05 61.32 2emf n THR 16 Cb 0.46 -1.02 -0.01 0.00 -1.55 0.00 0.00 70.33 68.22 2emf n THR 16 CO 0.00 0.00 0.00 -0.33 -3.05 0.00 0.00 175.07 171.69 2emf h GLU 17 N 0.00 0.00 0.00 1.09 3.07 -1.98 -3.45 114.58 113.31 2emf h GLU 17 Ca 0.00 0.00 -0.37 0.00 -0.50 0.00 0.00 59.36 58.49 2emf h GLU 17 Cb 0.12 0.00 -0.06 0.00 -0.84 0.00 0.00 28.75 27.97 2emf h GLU 17 CO 0.00 0.00 -2.31 0.00 -1.40 0.00 0.00 179.01 175.30 2emf n GLY 19 N 1.87 1.99 3.75 0.00 0.00 0.95 -5.00 105.19 108.75 2emf n GLY 19 Ca -0.44 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.18 2emf n GLY 19 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2emf s LYS 20 N -0.00 4.64 -0.22 1.61 2.20 -1.26 -4.55 119.74 122.17 2emf s LYS 20 Ca 0.00 1.77 -0.10 0.00 -0.36 0.00 0.00 55.97 57.29 2emf s LYS 20 Cb 0.00 -3.21 -0.05 0.00 -1.51 0.00 0.00 37.83 33.06 2emf s LYS 20 CO 0.00 0.20 0.13 0.00 -0.36 0.00 0.00 175.35 175.32 2emf s ALA 21 N -0.98 3.57 -0.07 3.13 0.00 -1.26 -0.40 121.76 125.74 2emf s ALA 21 Ca 0.45 -0.81 0.05 0.00 0.00 0.00 0.00 51.96 51.65 2emf s ALA 21 Cb -0.31 -2.18 -0.00 0.00 0.00 0.00 0.00 23.12 20.62 2emf s ALA 21 CO 0.39 -0.02 -0.23 -0.06 0.00 0.00 0.00 175.76 175.85 2emf s PHE 22 N 0.72 2.30 -1.81 0.00 0.08 -0.17 -4.99 117.98 114.12 2emf s PHE 22 Ca 0.07 -0.78 0.25 0.00 0.12 0.00 0.00 56.93 56.59 2emf s PHE 22 Cb -0.13 -1.53 1.44 0.00 -0.57 0.00 0.00 43.02 42.24 2emf s PHE 22 CO 0.02 -0.28 1.87 -2.37 -0.10 0.00 0.00 175.22 174.36 2emf n THR 23 N 3.21 0.07 -4.25 0.64 5.66 -1.26 -2.25 114.28 116.10 2emf n THR 23 Ca -0.18 0.02 -0.21 0.00 -3.05 0.00 0.00 64.05 60.63 2emf n THR 23 Cb 0.52 -0.61 -0.12 0.00 -1.55 0.00 0.00 70.33 68.57 2emf n THR 23 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 175.07 171.89 2emf s ARG 24 N -2.19 0.96 0.09 1.09 3.00 -1.26 -4.95 118.95 115.70 2emf s ARG 24 Ca 0.34 -1.00 0.11 0.00 0.00 0.00 0.00 55.73 55.17 2emf s ARG 24 Cb 0.17 -1.06 -0.17 0.00 0.00 0.00 0.00 34.95 33.89 2emf s ARG 24 CO 0.32 0.25 1.09 -0.22 0.00 0.00 0.00 175.30 176.74 2emf h LYS 25 N 4.31 0.00 0.24 3.54 3.11 -1.96 -3.23 116.57 122.58 2emf h LYS 25 Ca -0.42 0.00 -0.34 0.00 -2.81 0.00 0.00 60.65 57.08 2emf h LYS 25 Cb 1.18 0.00 0.03 0.00 -1.00 0.00 0.00 32.23 32.45 2emf h LYS 25 CO 0.40 0.71 -1.53 0.77 -2.81 0.00 0.00 179.45 177.00 2emf h SER 26 N 0.00 0.80 -0.77 4.20 0.02 -1.98 -2.86 113.55 112.96 2emf h SER 26 Ca -0.10 -0.92 0.01 0.00 -0.84 0.00 0.00 61.79 59.93 2emf h SER 26 Cb 1.76 -0.26 -0.04 0.00 0.14 0.00 0.00 62.40 64.00 2emf h SER 26 CO 0.10 1.73 0.51 0.74 -1.14 0.00 0.00 176.83 178.76 2emf h THR 27 N 0.12 1.20 0.01 -2.27 2.02 -1.99 -2.90 112.91 109.10 2emf h THR 27 Ca -0.28 -0.36 -0.00 0.00 0.77 0.00 0.00 66.41 66.55 2emf h THR 27 Cb 2.15 0.06 0.00 0.00 -1.74 0.00 0.00 68.15 68.62 2emf h THR 27 CO 0.25 0.19 -0.00 0.25 0.37 0.00 0.00 175.52 176.58 2emf h LEU 28 N 1.04 -0.01 -1.74 2.58 5.85 -1.65 -2.94 115.31 118.45 2emf h LEU 28 Ca 0.28 -0.66 0.42 0.00 0.84 0.00 0.00 57.88 58.77 2emf h LEU 28 Cb -0.12 0.00 -0.09 0.00 0.37 0.00 0.00 40.66 40.82 2emf h LEU 28 CO -0.06 0.66 0.99 0.28 -0.34 0.00 0.00 178.44 179.96 2emf h SER 29 N -0.68 0.13 0.72 1.25 0.02 -1.32 1.32 113.55 115.00 2emf h SER 29 Ca -0.00 0.05 -0.26 0.00 -0.84 0.00 0.00 61.79 60.74 2emf h SER 29 Cb 0.66 0.04 -0.01 0.00 0.14 0.00 0.00 62.40 63.23 2emf h SER 29 CO 0.00 -0.04 -1.23 0.24 -1.14 0.00 0.00 176.83 174.66 2emf h MET 30 N 0.08 0.16 -0.33 3.45 2.86 -1.50 -3.33 114.93 116.32 2emf h MET 30 Ca 0.75 -0.28 -0.16 0.00 -2.06 0.00 0.00 59.70 57.95 2emf h MET 30 Cb 2.68 0.10 -0.00 0.00 0.06 0.00 0.00 31.60 34.44 2emf h MET 30 CO -0.17 1.09 -0.41 1.25 1.06 0.00 0.00 176.91 179.73 2emf h HIS 31 N 0.04 1.04 0.00 -0.22 -0.00 0.18 -2.82 115.15 113.37 2emf h HIS 31 Ca -0.12 -0.34 0.00 0.00 -0.00 0.00 0.00 60.37 59.92 2emf h HIS 31 Cb 1.91 -0.21 0.00 0.00 -0.00 0.00 0.00 27.41 29.11 2emf h HIS 31 CO 0.04 1.15 0.17 1.96 -0.00 0.00 0.00 177.93 181.25 2emf h GLN 32 N 0.64 0.00 0.00 5.26 4.20 -0.90 0.21 115.11 124.53 2emf h GLN 32 Ca 0.04 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.75 2emf h GLN 32 Cb 1.01 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.79 2emf h GLN 32 CO 0.10 0.00 0.00 0.87 -0.67 0.00 0.00 178.83 179.13 2emf h LYS 33 N 0.00 0.00 0.00 1.46 1.57 -1.63 -2.28 116.57 115.69 2emf h LYS 33 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2emf h LYS 33 Cb 0.34 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.65 2emf h LYS 33 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 179.45 179.32 2emf n ILE 34 N -2.32 0.66 -0.05 1.86 -5.35 0.75 -3.25 119.36 111.67 2emf n ILE 34 Ca 0.02 0.08 -0.04 0.00 -0.27 0.00 0.00 62.75 62.53 2emf n ILE 34 Cb 0.23 -0.86 -0.08 0.00 -1.74 0.00 0.00 39.64 37.19 2emf n ILE 34 CO 0.00 0.00 0.00 1.41 -1.76 0.00 0.00 176.55 176.20 2emf n HIS 35 N -1.90 0.00 -0.36 4.28 8.25 -0.88 -4.58 115.22 120.03 2emf n HIS 35 Ca 0.04 0.00 -0.02 0.00 -0.26 0.00 0.00 57.72 57.48 2emf n HIS 35 Cb 0.28 -0.49 0.11 0.00 1.12 0.00 0.00 29.99 31.01 2emf n HIS 35 CO 0.00 0.00 0.00 1.79 0.64 0.00 0.00 176.34 178.77 2emf h THR 36 N 0.00 1.22 -4.46 1.59 1.35 -1.48 -3.45 112.91 107.69 2emf h THR 36 Ca -0.26 -0.44 -0.33 0.00 -0.55 0.00 0.00 66.41 64.83 2emf h THR 36 Cb 1.57 -0.16 -0.06 0.00 -1.73 0.00 0.00 68.15 67.77 2emf h THR 36 CO 0.01 0.23 -0.24 0.61 -0.25 0.00 0.00 175.52 175.89 2emf n GLY 37 N -1.36 3.85 3.56 5.82 0.00 -1.21 -4.80 105.19 111.05 2emf n GLY 37 Ca 0.11 -2.26 -0.25 0.00 0.00 0.00 0.00 46.02 43.63 2emf n GLY 37 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2emf n GLU 38 N -0.62 -6.56 -4.58 1.61 -0.58 -1.26 -4.86 120.64 103.80 2emf n GLU 38 Ca -0.10 0.77 -0.34 0.00 -0.42 0.00 0.00 57.16 57.07 2emf n GLU 38 Cb 0.32 -5.73 -0.11 0.00 -0.57 0.00 0.00 31.44 25.34 2emf n GLU 38 CO 0.00 0.00 0.00 0.21 -0.48 0.00 0.00 177.13 176.86 2emf s LYS 39 N -6.26 2.94 1.10 3.49 2.20 -1.26 -5.04 119.74 116.90 2emf s LYS 39 Ca 0.55 -0.54 -0.15 0.00 -0.36 0.00 0.00 55.97 55.47 2emf s LYS 39 Cb -0.25 -2.66 0.24 0.00 -1.51 0.00 0.00 37.83 33.64 2emf s LYS 39 CO 0.67 0.59 1.10 -1.25 -0.36 0.00 0.00 175.35 176.10 2emf s PRO 40 N -0.59 -0.38 -1.03 4.03 0.04 -1.26 -4.23 135.00 131.57 2emf s PRO 40 Ca 0.09 0.24 -0.06 0.00 0.04 0.00 0.00 61.00 61.31 2emf s PRO 40 Cb -0.12 -1.67 0.01 0.00 0.04 0.00 0.00 34.50 32.76 2emf s PRO 40 CO 0.02 -3.21 0.90 0.43 0.04 0.00 0.00 177.00 175.18 2emf n SER 41 N -4.46 -5.16 0.00 6.66 7.64 -1.26 -4.94 113.62 112.09 2emf n SER 41 Ca 0.08 -0.42 0.00 0.00 1.01 0.00 0.00 58.87 59.55 2emf n SER 41 Cb 0.58 -3.98 0.00 0.00 -1.01 0.00 0.00 64.21 59.81 2emf n SER 41 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2emf n GLY 42 N -1.63 -3.08 3.57 0.23 0.00 -1.26 -3.58 105.19 99.44 2emf n GLY 42 Ca -0.01 0.51 -0.27 0.00 0.00 0.00 0.00 46.02 46.25 2emf n GLY 42 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2emf s PRO 43 N -2.78 2.53 -0.49 1.61 0.04 -1.26 -4.81 135.00 129.83 2emf s PRO 43 Ca 0.00 -0.70 0.04 0.00 0.04 0.00 0.00 61.00 60.39 2emf s PRO 43 Cb 0.00 -5.15 0.17 0.00 0.04 0.00 0.00 34.50 29.57 2emf s PRO 43 CO 0.00 -3.66 0.39 0.43 0.04 0.00 0.00 177.00 174.20 2emf n SER 44 N 14.17 0.49 -3.60 6.66 7.64 -1.23 -5.09 113.62 132.66 2emf n SER 44 Ca 0.42 -2.61 -0.03 0.00 1.01 0.00 0.00 58.87 57.66 2emf n SER 44 Cb 0.47 -0.61 -0.02 0.00 -1.01 0.00 0.00 64.21 63.04 2emf n SER 44 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2emf s SER 45 N -0.40 -0.13 0.00 6.43 0.15 -1.26 -5.21 113.70 113.27 2emf s SER 45 Ca 0.31 -0.05 0.00 0.00 0.70 0.00 0.00 55.95 56.91 2emf s SER 45 Cb 0.02 0.17 0.00 0.00 -1.71 0.00 0.00 66.02 64.51 2emf s SER 45 CO -0.19 -0.29 0.19 0.61 1.20 0.00 0.00 173.24 174.76