#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 6.45 -3.79 1.61 2.88 -1.26 -4.93 113.62 114.58 2em6 n SER 2 Ca 0.00 -3.77 -0.23 0.00 -1.33 0.00 0.00 58.87 53.54 2em6 n SER 2 Cb 0.00 -0.71 -0.17 0.00 -0.75 0.00 0.00 64.21 62.58 2em6 n SER 2 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2em6 s SER 3 N -2.57 1.52 0.00 -3.46 0.01 -1.26 -4.96 113.70 102.98 2em6 s SER 3 Ca 0.58 -0.09 0.00 0.00 1.31 0.00 0.00 55.95 57.75 2em6 s SER 3 Cb 0.46 -0.45 0.00 0.00 0.21 0.00 0.00 66.02 66.24 2em6 s SER 3 CO -0.03 -0.18 0.00 0.61 0.41 0.00 0.00 173.24 174.05 2em6 n GLY 4 N 5.03 3.43 4.29 3.44 0.00 -1.26 -4.95 105.19 115.18 2em6 n GLY 4 Ca -0.09 -0.60 -0.37 0.00 0.00 0.00 0.00 46.02 44.96 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 -1.03 -0.01 1.61 3.41 -1.26 -4.74 113.62 111.59 2em6 n SER 5 Ca 0.00 -1.17 -0.03 0.00 -0.26 0.00 0.00 58.87 57.41 2em6 n SER 5 Cb 0.00 -1.48 -0.01 0.00 -0.26 0.00 0.00 64.21 62.46 2em6 n SER 5 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2em6 n SER 6 N -2.34 0.89 -0.08 4.04 2.88 -1.26 -4.79 113.62 112.96 2em6 n SER 6 Ca 0.00 0.03 -0.14 0.00 -1.33 0.00 0.00 58.87 57.43 2em6 n SER 6 Cb 0.48 -0.08 -0.06 0.00 -0.75 0.00 0.00 64.21 63.80 2em6 n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2em6 n GLY 7 N 2.92 -0.23 2.00 0.46 0.00 -1.26 -4.62 105.19 104.46 2em6 n GLY 7 Ca -0.06 -0.09 -0.18 0.00 0.00 0.00 0.00 46.02 45.70 2em6 n GLY 7 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 2em6 n MET 8 N -3.32 1.89 -4.32 1.61 -0.00 -1.26 -4.90 117.12 106.82 2em6 n MET 8 Ca -0.29 -1.60 -0.34 0.00 -0.00 0.00 0.00 57.70 55.47 2em6 n MET 8 Cb 0.75 -1.71 -0.11 0.00 -0.00 0.00 0.00 33.22 32.15 2em6 n MET 8 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 2em6 s GLY 9 N 0.42 1.79 0.06 3.17 0.00 -1.26 -4.86 107.32 106.64 2em6 s GLY 9 Ca 0.37 -0.80 -0.09 0.00 0.00 0.00 0.00 44.72 44.20 2em6 s GLY 9 CO -0.05 -0.17 0.36 -0.54 0.00 0.00 0.00 173.10 172.70 2em6 s GLU 10 N 0.06 3.70 -0.46 2.90 0.41 -1.26 -5.03 118.70 119.02 2em6 s GLU 10 Ca 0.01 0.09 -0.03 0.00 -0.41 0.00 0.00 54.97 54.63 2em6 s GLU 10 Cb -0.13 -3.02 0.12 0.00 -1.78 0.00 0.00 34.13 29.32 2em6 s GLU 10 CO 0.02 0.59 0.26 0.15 -0.49 0.00 0.00 175.26 175.79 2em6 s LYS 11 N -1.88 2.13 -0.57 1.61 -0.14 -1.26 -4.98 119.74 114.65 2em6 s LYS 11 Ca 0.31 -1.99 0.07 0.00 -1.36 0.00 0.00 55.97 53.00 2em6 s LYS 11 Cb -0.14 -3.61 0.27 0.00 -1.68 0.00 0.00 37.83 32.67 2em6 s LYS 11 CO 0.18 -1.10 0.73 0.00 -0.76 0.00 0.00 175.35 174.40 2em6 n TYR 13 N 0.77 0.39 -4.76 0.00 4.02 -1.23 -4.76 117.16 111.60 2em6 n TYR 13 Ca 0.28 0.27 -0.33 0.00 -0.01 0.00 0.00 57.90 58.11 2em6 n TYR 13 Cb 0.44 -1.70 -0.13 0.00 -0.02 0.00 0.00 39.34 37.93 2em6 n TYR 13 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 176.86 176.06 2em6 s LYS 14 N 6.75 3.09 -0.56 -0.72 2.20 -1.26 -1.33 119.74 127.91 2em6 s LYS 14 Ca 1.04 -0.66 -0.24 0.00 -0.36 0.00 0.00 55.97 55.75 2em6 s LYS 14 Cb -0.94 -2.58 0.04 0.00 -1.51 0.00 0.00 37.83 32.84 2em6 s LYS 14 CO 0.38 0.39 0.95 0.00 -0.36 0.00 0.00 175.35 176.71 2em6 h ASP 16 N 9.35 0.25 -0.21 0.00 3.58 -1.94 0.66 116.42 128.11 2em6 h ASP 16 Ca -0.26 -0.11 0.03 0.00 0.42 0.00 0.00 57.03 57.10 2em6 h ASP 16 Cb 1.07 -0.07 -0.05 0.00 1.72 0.00 0.00 39.33 42.00 2em6 h ASP 16 CO 1.10 0.66 -0.40 0.58 -2.88 0.00 0.00 179.24 178.31 2em6 h VAL 17 N 0.20 0.00 0.00 2.25 2.07 -1.97 -3.34 116.25 115.46 2em6 h VAL 17 Ca 0.02 0.00 -0.41 0.00 0.82 0.00 0.00 66.70 67.13 2em6 h VAL 17 Cb 0.86 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 30.56 2em6 h VAL 17 CO 0.07 0.00 -2.48 0.00 0.02 0.00 0.00 177.57 175.18 2em6 n GLY 19 N 1.92 1.86 3.97 0.00 0.00 0.23 -5.10 105.19 108.08 2em6 n GLY 19 Ca -0.48 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.30 2em6 n GLY 19 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2em6 s LYS 20 N 0.00 1.99 -0.06 1.61 2.20 -0.94 -4.83 119.74 119.71 2em6 s LYS 20 Ca 0.00 -0.83 -0.11 0.00 -0.36 0.00 0.00 55.97 54.67 2em6 s LYS 20 Cb 0.00 -2.33 0.02 0.00 -1.51 0.00 0.00 37.83 34.01 2em6 s LYS 20 CO 0.00 -1.23 0.27 -1.21 -0.36 0.00 0.00 175.35 172.83 2em6 s GLU 21 N -5.08 0.46 0.01 4.03 2.02 -1.26 0.18 118.70 119.07 2em6 s GLU 21 Ca 0.63 0.10 -0.03 0.00 0.02 0.00 0.00 54.97 55.68 2em6 s GLU 21 Cb -0.08 0.21 -0.01 0.00 0.10 0.00 0.00 34.13 34.36 2em6 s GLU 21 CO 0.43 -0.10 0.05 -0.06 0.02 0.00 0.00 175.26 175.60 2em6 s PHE 22 N -0.54 0.14 -1.08 1.61 0.40 -0.44 -5.00 117.98 113.07 2em6 s PHE 22 Ca -0.06 -0.31 0.14 0.00 -0.60 0.00 0.00 56.93 56.09 2em6 s PHE 22 Cb -0.04 -0.11 0.58 0.00 0.51 0.00 0.00 43.02 43.96 2em6 s PHE 22 CO 0.02 -0.21 1.45 -1.13 0.70 0.00 0.00 175.22 176.04 2em6 n SER 23 N 1.67 4.01 -3.70 1.36 3.41 -1.26 -3.56 113.62 115.55 2em6 n SER 23 Ca -0.22 -2.42 -0.14 0.00 -0.26 0.00 0.00 58.87 55.83 2em6 n SER 23 Cb 0.56 -0.54 -0.14 0.00 -0.26 0.00 0.00 64.21 63.83 2em6 n SER 23 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 2em6 s GLN 24 N -1.89 0.12 0.43 4.33 -1.52 -1.26 -5.02 119.66 114.85 2em6 s GLN 24 Ca 0.41 0.58 0.22 0.00 -1.95 0.00 0.00 55.36 54.62 2em6 s GLN 24 Cb 0.27 -0.14 1.19 0.00 -0.22 0.00 0.00 33.01 34.11 2em6 s GLN 24 CO 0.18 -0.24 1.80 0.66 -0.25 0.00 0.00 175.29 177.44 2em6 h SER 25 N 7.84 0.34 -0.26 5.90 4.64 -1.97 0.19 113.55 130.24 2em6 h SER 25 Ca -0.26 0.06 -0.18 0.00 -0.47 0.00 0.00 61.79 60.94 2em6 h SER 25 Cb 1.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 2em6 h SER 25 CO 0.25 0.08 -0.52 -1.28 -0.87 0.00 0.00 176.83 174.49 2em6 h SER 26 N 0.31 0.91 -0.63 4.97 0.87 -1.99 -2.92 113.55 115.08 2em6 h SER 26 Ca 0.55 -0.54 0.12 0.00 -1.23 0.00 0.00 61.79 60.69 2em6 h SER 26 Cb 1.56 -0.26 -0.09 0.00 -0.44 0.00 0.00 62.40 63.17 2em6 h SER 26 CO -0.21 1.28 0.16 0.45 -0.53 0.00 0.00 176.83 177.98 2em6 h HIS 27 N 0.58 0.26 0.78 2.24 3.86 -1.03 -0.61 115.15 121.23 2em6 h HIS 27 Ca 0.01 0.04 -0.04 0.00 -1.16 0.00 0.00 60.37 59.22 2em6 h HIS 27 Cb 1.13 -0.02 0.01 0.00 1.06 0.00 0.00 27.41 29.59 2em6 h HIS 27 CO 0.08 -0.01 -0.38 1.25 0.86 0.00 0.00 177.93 179.73 2em6 h LEU 28 N 0.30 -0.89 -0.92 2.43 5.85 -1.50 -2.34 115.31 118.23 2em6 h LEU 28 Ca 0.33 0.03 0.27 0.00 0.84 0.00 0.00 57.88 59.35 2em6 h LEU 28 Cb 0.49 0.23 -0.15 0.00 0.37 0.00 0.00 40.66 41.59 2em6 h LEU 28 CO -0.40 -0.53 0.27 1.56 -0.34 0.00 0.00 178.44 179.00 2em6 h GLN 29 N -1.26 0.16 -0.44 1.25 4.20 -1.29 0.93 115.11 118.66 2em6 h GLN 29 Ca -0.11 -0.01 -0.05 0.00 0.06 0.00 0.00 58.65 58.54 2em6 h GLN 29 Cb 0.81 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.53 2em6 h GLN 29 CO 0.18 0.11 0.07 1.15 -0.67 0.00 0.00 178.83 179.66 2em6 h THR 30 N 0.17 1.21 -0.09 -0.54 2.02 -1.04 -2.97 112.91 111.67 2em6 h THR 30 Ca 0.61 -0.78 -0.10 0.00 0.77 0.00 0.00 66.41 66.91 2em6 h THR 30 Cb 1.31 0.80 0.00 0.00 -1.74 0.00 0.00 68.15 68.53 2em6 h THR 30 CO -0.71 0.28 -0.33 -0.74 0.37 0.00 0.00 175.52 174.39 2em6 h HIS 31 N 0.65 0.51 0.00 3.16 -0.00 0.13 -3.05 115.15 116.55 2em6 h HIS 31 Ca 0.14 -0.21 0.00 0.00 -0.00 0.00 0.00 60.37 60.30 2em6 h HIS 31 Cb 0.30 -0.08 0.00 0.00 -0.00 0.00 0.00 27.41 27.63 2em6 h HIS 31 CO 0.01 0.95 0.46 1.96 -0.00 0.00 0.00 177.93 181.31 2em6 h GLN 32 N -0.08 0.00 0.00 5.26 1.08 -0.58 0.22 115.11 121.01 2em6 h GLN 32 Ca -0.02 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.18 2em6 h GLN 32 Cb 0.97 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.40 2em6 h GLN 32 CO 0.07 0.00 0.02 0.00 -0.95 0.00 0.00 178.83 177.97 2em6 h ARG 33 N 0.00 0.00 0.00 1.46 3.08 -1.51 0.21 114.38 117.62 2em6 h ARG 33 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2em6 h ARG 33 Cb 0.92 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.97 2em6 h ARG 33 CO 0.00 0.00 -0.94 1.33 -1.07 0.00 0.00 179.97 179.29 2em6 n VAL 34 N -2.43 0.43 0.04 2.04 0.24 0.76 -3.95 118.33 115.46 2em6 n VAL 34 Ca -0.02 -0.41 0.07 0.00 -2.04 0.00 0.00 64.34 61.94 2em6 n VAL 34 Cb 0.06 -0.16 -0.08 0.00 -1.47 0.00 0.00 33.84 32.19 2em6 n VAL 34 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 2em6 n HIS 35 N -2.36 0.63 -2.73 6.34 8.25 0.66 -4.90 115.22 121.11 2em6 n HIS 35 Ca 0.01 0.19 -0.41 0.00 -0.26 0.00 0.00 57.72 57.26 2em6 n HIS 35 Cb 0.50 -0.87 -0.05 0.00 1.12 0.00 0.00 29.99 30.69 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 -3.23 4.42 0.00 1.59 -1.32 -0.76 -4.68 115.64 111.66 2em6 s THR 36 Ca -0.04 2.08 0.00 0.00 -1.21 0.00 0.00 61.69 62.52 2em6 s THR 36 Cb 0.10 -4.33 0.00 0.00 -1.51 0.00 0.00 72.50 66.77 2em6 s THR 36 CO 0.83 0.35 0.00 0.61 -2.21 0.00 0.00 174.62 174.20 2em6 n GLY 37 N 2.11 -0.49 0.53 6.08 0.00 -1.26 -4.90 105.19 107.25 2em6 n GLY 37 Ca 0.01 -0.25 0.01 0.00 0.00 0.00 0.00 46.02 45.79 2em6 n GLY 37 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2em6 n GLU 38 N 0.00 1.41 0.26 1.61 -0.58 -1.26 -4.28 120.64 117.81 2em6 n GLU 38 Ca 0.00 -0.38 -0.18 0.00 -0.42 0.00 0.00 57.16 56.18 2em6 n GLU 38 Cb 0.00 -1.45 -0.10 0.00 -0.57 0.00 0.00 31.44 29.32 2em6 n GLU 38 CO 0.00 0.00 0.00 -0.22 -0.48 0.00 0.00 177.13 176.43 2em6 h LYS 39 N 0.51 -0.94 -0.11 3.49 1.63 -1.91 -2.87 116.57 116.38 2em6 h LYS 39 Ca 0.00 0.06 -0.12 0.00 -0.85 0.00 0.00 60.65 59.75 2em6 h LYS 39 Cb 0.52 0.21 -0.01 0.00 -0.60 0.00 0.00 32.23 32.35 2em6 h LYS 39 CO 0.04 -0.63 -0.46 -1.00 -3.45 0.00 0.00 179.45 173.96 2em6 h PRO 40 N -0.97 0.26 -3.63 1.90 0.13 -1.93 -3.44 132.00 124.30 2em6 h PRO 40 Ca -0.05 -0.13 -0.23 0.00 -0.87 0.00 0.00 66.00 64.71 2em6 h PRO 40 Cb 0.86 0.00 -0.29 0.00 0.13 0.00 0.00 31.00 31.71 2em6 h PRO 40 CO -0.11 0.67 -0.69 -1.54 -0.23 0.00 0.00 178.00 176.10 2em6 s SER 41 N -6.88 -0.02 0.03 1.44 1.04 -1.09 -5.16 113.70 103.06 2em6 s SER 41 Ca -0.04 0.06 0.02 0.00 0.48 0.00 0.00 55.95 56.47 2em6 s SER 41 Cb 0.13 0.05 -0.02 0.00 0.10 0.00 0.00 66.02 66.28 2em6 s SER 41 CO 0.78 -0.03 -0.08 -0.83 0.98 0.00 0.00 173.24 174.06 2em6 s GLY 42 N 0.16 0.47 0.00 7.32 0.00 -1.23 -4.06 107.32 109.98 2em6 s GLY 42 Ca -0.01 -0.61 0.14 0.00 0.00 0.00 0.00 44.72 44.24 2em6 s GLY 42 CO -0.00 -0.62 1.44 -1.55 0.00 0.00 0.00 173.10 172.36 2em6 n PRO 43 N 1.98 0.09 -3.96 2.90 -0.04 -1.26 -4.73 135.00 129.97 2em6 n PRO 43 Ca -0.19 0.21 -0.29 0.00 -0.04 0.00 0.00 63.50 63.19 2em6 n PRO 43 Cb 0.56 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.48 2em6 n PRO 43 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2em6 s SER 44 N -2.82 6.16 -0.03 3.54 1.04 -1.26 -5.11 113.70 115.22 2em6 s SER 44 Ca 0.10 0.16 -0.01 0.00 0.48 0.00 0.00 55.95 56.68 2em6 s SER 44 Cb 0.10 -1.83 0.03 0.00 0.10 0.00 0.00 66.02 64.42 2em6 s SER 44 CO 0.25 0.12 0.04 -0.94 0.98 0.00 0.00 173.24 173.69 2em6 s SER 45 N -2.78 0.40 0.00 7.02 1.04 -1.26 -5.17 113.70 112.95 2em6 s SER 45 Ca 0.34 0.07 0.00 0.00 0.48 0.00 0.00 55.95 56.83 2em6 s SER 45 Cb -0.12 -0.08 0.00 0.00 0.10 0.00 0.00 66.02 65.92 2em6 s SER 45 CO 0.27 -0.17 0.00 0.61 0.98 0.00 0.00 173.24 174.93