#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2em6 s SER 2 N 0.00 5.37 -0.31 1.61 0.15 -1.26 -5.05 113.70 114.22 2em6 s SER 2 Ca 0.00 -1.16 0.00 0.00 0.70 0.00 0.00 55.95 55.49 2em6 s SER 2 Cb 0.00 -1.89 0.10 0.00 -1.71 0.00 0.00 66.02 62.52 2em6 s SER 2 CO 0.00 -0.35 0.09 -0.44 1.20 0.00 0.00 173.24 173.74 2em6 s SER 3 N 1.47 4.14 -0.29 5.45 0.01 -1.26 -5.09 113.70 118.13 2em6 s SER 3 Ca -0.01 -1.71 -0.23 0.00 1.31 0.00 0.00 55.95 55.31 2em6 s SER 3 Cb -0.20 -1.00 0.17 0.00 0.21 0.00 0.00 66.02 65.20 2em6 s SER 3 CO 0.03 -0.40 1.29 -0.83 0.41 0.00 0.00 173.24 173.73 2em6 s GLY 4 N 1.49 0.24 0.00 3.44 0.00 -1.26 -5.03 107.32 106.20 2em6 s GLY 4 Ca 0.10 3.33 -0.25 0.00 0.00 0.00 0.00 44.72 47.90 2em6 s GLY 4 CO -0.22 2.07 1.15 0.23 0.00 0.00 0.00 173.10 176.33 2em6 h SER 5 N 3.86 -0.46 0.00 1.64 0.87 -2.06 -3.41 113.55 113.98 2em6 h SER 5 Ca -0.27 -0.12 -0.16 0.00 -1.23 0.00 0.00 61.79 60.00 2em6 h SER 5 Cb 1.19 0.12 -0.03 0.00 -0.44 0.00 0.00 62.40 63.24 2em6 h SER 5 CO 0.17 -0.08 -1.55 -1.54 -0.53 0.00 0.00 176.83 173.29 2em6 n SER 6 N -5.19 1.52 0.00 6.23 3.41 -1.26 -5.14 113.62 113.19 2em6 n SER 6 Ca -0.10 0.07 0.00 0.00 -0.26 0.00 0.00 58.87 58.58 2em6 n SER 6 Cb 0.29 -0.25 0.00 0.00 -0.26 0.00 0.00 64.21 63.99 2em6 n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2em6 n GLY 7 N 2.59 0.33 0.17 5.00 0.00 -1.26 -4.91 105.19 107.10 2em6 n GLY 7 Ca -0.19 -0.70 -0.14 0.00 0.00 0.00 0.00 46.02 44.99 2em6 n GLY 7 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2em6 n MET 8 N 0.00 0.41 0.00 1.61 0.00 -1.26 -5.03 117.12 112.85 2em6 n MET 8 Ca 0.00 0.12 0.00 0.00 -0.00 0.00 0.00 57.70 57.82 2em6 n MET 8 Cb 0.00 -1.29 0.00 0.00 0.00 0.00 0.00 33.22 31.93 2em6 n MET 8 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2em6 n GLY 9 N 2.49 2.09 3.40 -5.12 0.00 -1.26 -4.74 105.19 102.05 2em6 n GLY 9 Ca -0.31 -0.23 -0.21 0.00 0.00 0.00 0.00 46.02 45.26 2em6 n GLY 9 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2em6 n GLU 10 N 0.00 -7.15 -1.55 1.61 -0.58 -1.26 -4.83 120.64 106.88 2em6 n GLU 10 Ca 0.00 0.77 -0.20 0.00 -0.42 0.00 0.00 57.16 57.31 2em6 n GLU 10 Cb 0.00 -5.63 -0.06 0.00 -0.57 0.00 0.00 31.44 25.18 2em6 n GLU 10 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2em6 n LYS 11 N -4.52 0.68 -1.04 3.49 4.01 -1.26 -4.78 118.16 114.74 2em6 n LYS 11 Ca -0.05 -0.57 -0.18 0.00 -0.51 0.00 0.00 58.31 57.00 2em6 n LYS 11 Cb 0.58 -3.53 -0.00 0.00 -0.51 0.00 0.00 35.03 31.56 2em6 n LYS 11 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2em6 n TYR 13 N 0.69 0.27 -3.69 0.00 4.01 -1.19 -4.61 117.16 112.64 2em6 n TYR 13 Ca 0.34 0.76 -0.18 0.00 -0.16 0.00 0.00 57.90 58.66 2em6 n TYR 13 Cb 0.59 -1.50 -0.17 0.00 -0.31 0.00 0.00 39.34 37.94 2em6 n TYR 13 CO 0.00 0.00 0.00 0.21 -0.46 0.00 0.00 176.86 176.61 2em6 s LYS 14 N -0.17 -0.05 0.53 -0.72 2.20 -1.26 -0.41 119.74 119.85 2em6 s LYS 14 Ca 0.62 0.36 -0.20 0.00 -0.36 0.00 0.00 55.97 56.39 2em6 s LYS 14 Cb -0.87 -0.42 -0.06 0.00 -1.51 0.00 0.00 37.83 34.97 2em6 s LYS 14 CO 0.41 -0.29 1.14 0.00 -0.36 0.00 0.00 175.35 176.26 2em6 n ASP 16 N -1.18 1.79 -0.21 0.00 -0.08 -1.26 -2.85 116.55 112.76 2em6 n ASP 16 Ca 0.11 -0.11 -0.08 0.00 -1.51 0.00 0.00 54.79 53.20 2em6 n ASP 16 Cb 0.50 -0.16 -0.03 0.00 2.34 0.00 0.00 41.12 43.77 2em6 n ASP 16 CO 0.00 0.00 0.00 0.58 0.12 0.00 0.00 177.20 177.90 2em6 h VAL 17 N 0.00 0.08 0.00 5.18 2.07 -1.99 -3.32 116.25 118.27 2em6 h VAL 17 Ca -0.54 0.00 -0.28 0.00 0.82 0.00 0.00 66.70 66.70 2em6 h VAL 17 Cb 1.90 0.08 -0.05 0.00 -1.52 0.00 0.00 31.29 31.71 2em6 h VAL 17 CO -0.07 0.00 -1.98 0.00 0.02 0.00 0.00 177.57 175.54 2em6 n GLY 19 N 2.33 1.10 3.92 0.00 0.00 -1.13 -5.09 105.19 106.31 2em6 n GLY 19 Ca -0.32 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.43 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 -0.02 2.12 -0.07 1.61 2.20 -1.21 -4.81 119.74 119.56 2em6 s LYS 20 Ca 0.00 -0.12 -0.03 0.00 -0.36 0.00 0.00 55.97 55.46 2em6 s LYS 20 Cb 0.00 -2.09 0.04 0.00 -1.51 0.00 0.00 37.83 34.27 2em6 s LYS 20 CO 0.00 -1.36 0.15 -1.21 -0.36 0.00 0.00 175.35 172.57 2em6 s GLU 21 N -5.36 0.06 0.41 4.03 2.02 -1.26 -0.95 118.70 117.65 2em6 s GLU 21 Ca 0.61 0.47 0.04 0.00 0.02 0.00 0.00 54.97 56.11 2em6 s GLU 21 Cb -0.11 -0.23 -0.05 0.00 0.10 0.00 0.00 34.13 33.84 2em6 s GLU 21 CO 0.46 -0.24 0.03 -0.06 0.02 0.00 0.00 175.26 175.47 2em6 s PHE 22 N 1.77 2.14 -0.25 1.61 0.40 0.45 -5.00 117.98 119.09 2em6 s PHE 22 Ca -0.03 -0.88 -0.04 0.00 -0.60 0.00 0.00 56.93 55.38 2em6 s PHE 22 Cb -0.12 -1.55 -0.14 0.00 0.51 0.00 0.00 43.02 41.72 2em6 s PHE 22 CO -0.06 0.20 -0.27 0.43 0.70 0.00 0.00 175.22 176.23 2em6 n SER 23 N -1.01 1.99 -4.87 1.36 7.64 -1.26 -3.18 113.62 114.28 2em6 n SER 23 Ca -0.08 0.06 -0.21 0.00 1.01 0.00 0.00 58.87 59.65 2em6 n SER 23 Cb 0.67 -0.55 -0.03 0.00 -1.01 0.00 0.00 64.21 63.29 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 -2.49 2.72 0.02 1.43 -1.52 -1.26 -4.38 119.66 114.18 2em6 s GLN 24 Ca -0.35 -1.31 -0.21 0.00 -1.95 0.00 0.00 55.36 51.54 2em6 s GLN 24 Cb 0.11 -2.49 -0.12 0.00 -0.22 0.00 0.00 33.01 30.29 2em6 s GLN 24 CO 0.52 0.03 1.09 1.03 -0.25 0.00 0.00 175.29 177.72 2em6 h SER 25 N 1.16 -0.64 -0.94 5.90 0.87 -1.95 -3.23 113.55 114.72 2em6 h SER 25 Ca -0.44 0.02 0.15 0.00 -1.23 0.00 0.00 61.79 60.29 2em6 h SER 25 Cb 1.26 0.17 -0.16 0.00 -0.44 0.00 0.00 62.40 63.23 2em6 h SER 25 CO 0.57 -0.38 -0.35 -1.20 -0.53 0.00 0.00 176.83 174.94 2em6 n SER 26 N -4.46 -0.58 -0.32 6.23 7.64 -1.26 0.63 113.62 121.50 2em6 n SER 26 Ca -0.09 1.64 0.11 0.00 1.01 0.00 0.00 58.87 61.53 2em6 n SER 26 Cb 0.30 -0.39 0.23 0.00 -1.01 0.00 0.00 64.21 63.33 2em6 n SER 26 CO 0.00 0.00 0.00 0.45 -3.01 0.00 0.00 175.04 172.48 2em6 h HIS 27 N 0.00 -0.13 0.31 1.43 3.86 -1.98 0.21 115.15 118.84 2em6 h HIS 27 Ca 0.34 0.07 -0.02 0.00 -1.16 0.00 0.00 60.37 59.61 2em6 h HIS 27 Cb 0.58 0.21 0.00 0.00 1.06 0.00 0.00 27.41 29.26 2em6 h HIS 27 CO -0.81 -0.38 -0.15 1.25 0.86 0.00 0.00 177.93 178.70 2em6 h LEU 28 N 0.03 -0.35 -0.88 2.43 5.85 0.17 -2.84 115.31 119.72 2em6 h LEU 28 Ca 0.53 -0.17 0.23 0.00 0.84 0.00 0.00 57.88 59.31 2em6 h LEU 28 Cb 1.01 0.09 -0.15 0.00 0.37 0.00 0.00 40.66 41.98 2em6 h LEU 28 CO -0.88 0.11 0.09 1.56 -0.34 0.00 0.00 178.44 178.99 2em6 h GLN 29 N -0.95 0.10 0.11 1.25 4.20 0.03 0.10 115.11 119.95 2em6 h GLN 29 Ca -0.04 -0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.66 2em6 h GLN 29 Cb 0.50 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.26 2em6 h GLN 29 CO 0.07 0.07 -0.05 1.15 -0.67 0.00 0.00 178.83 179.39 2em6 h THR 30 N 0.10 0.90 -0.84 -0.54 2.02 -0.68 -2.75 112.91 111.13 2em6 h THR 30 Ca 0.53 -0.05 0.18 0.00 0.77 0.00 0.00 66.41 67.85 2em6 h THR 30 Cb 1.05 0.93 -0.11 0.00 -1.74 0.00 0.00 68.15 68.28 2em6 h THR 30 CO -0.75 0.01 0.35 -0.74 0.37 0.00 0.00 175.52 174.75 2em6 h HIS 31 N -0.17 0.58 -0.51 3.16 -0.00 -0.57 0.36 115.15 118.00 2em6 h HIS 31 Ca -0.02 0.04 0.15 0.00 -0.00 0.00 0.00 60.37 60.54 2em6 h HIS 31 Cb 0.13 -0.13 -0.02 0.00 -0.00 0.00 0.00 27.41 27.39 2em6 h HIS 31 CO -0.06 0.01 0.70 1.96 -0.00 0.00 0.00 177.93 180.53 2em6 h GLN 32 N 0.42 0.00 0.00 5.26 1.08 -1.02 0.24 115.11 121.10 2em6 h GLN 32 Ca 0.49 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.69 2em6 h GLN 32 Cb 0.85 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.28 2em6 h GLN 32 CO -0.48 0.00 0.25 0.00 -0.95 0.00 0.00 178.83 177.66 2em6 h ARG 33 N 0.00 0.00 0.00 1.46 3.08 -0.35 0.73 114.38 119.30 2em6 h ARG 33 Ca 0.24 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 60.16 2em6 h ARG 33 Cb 1.65 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.67 2em6 h ARG 33 CO -0.00 0.00 -1.32 1.33 -1.07 0.00 0.00 179.97 178.91 2em6 n VAL 34 N -2.27 1.08 -0.06 2.04 0.24 0.84 -4.17 118.33 116.02 2em6 n VAL 34 Ca -0.01 -0.66 -0.10 0.00 -2.04 0.00 0.00 64.34 61.53 2em6 n VAL 34 Cb 0.28 -0.66 -0.15 0.00 -1.47 0.00 0.00 33.84 31.84 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 -2.85 0.49 -0.87 6.34 8.25 0.22 -4.96 115.22 121.84 2em6 n HIS 35 Ca -0.08 0.17 -0.35 0.00 -0.26 0.00 0.00 57.72 57.21 2em6 n HIS 35 Cb 0.78 -1.09 0.09 0.00 1.12 0.00 0.00 29.99 30.89 2em6 n HIS 35 CO 0.00 0.00 0.00 -2.37 0.64 0.00 0.00 176.34 174.61 2em6 n THR 36 N -2.92 0.00 -1.27 1.59 5.66 0.85 -4.59 114.28 113.60 2em6 n THR 36 Ca -0.26 -0.29 -0.49 0.00 -3.05 0.00 0.00 64.05 59.95 2em6 n THR 36 Cb 1.10 -0.33 -0.07 0.00 -1.55 0.00 0.00 70.33 69.49 2em6 n THR 36 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2em6 n GLY 37 N 2.51 0.10 2.15 1.09 0.00 -1.26 -4.92 105.19 104.86 2em6 n GLY 37 Ca 0.02 0.72 -0.17 0.00 0.00 0.00 0.00 46.02 46.59 2em6 n GLY 37 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2em6 n GLU 38 N 2.73 0.79 -3.25 1.61 0.28 -1.26 -4.91 120.64 116.64 2em6 n GLU 38 Ca 0.22 -2.21 -0.15 0.00 -0.16 0.00 0.00 57.16 54.86 2em6 n GLU 38 Cb -0.03 1.10 0.08 0.00 1.43 0.00 0.00 31.44 34.01 2em6 n GLU 38 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 2em6 n LYS 39 N -0.62 -4.17 -2.06 3.44 5.02 -1.26 -4.86 118.16 113.66 2em6 n LYS 39 Ca -0.05 0.81 -0.27 0.00 -2.02 0.00 0.00 58.31 56.77 2em6 n LYS 39 Cb 0.39 -5.63 -0.06 0.00 -0.02 0.00 0.00 35.03 29.72 2em6 n LYS 39 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2em6 s PRO 40 N -4.79 2.52 0.10 1.97 0.04 -1.26 -4.95 135.00 128.63 2em6 s PRO 40 Ca 0.22 -0.78 -0.11 0.00 0.04 0.00 0.00 61.00 60.37 2em6 s PRO 40 Cb -0.03 -5.16 -0.06 0.00 0.04 0.00 0.00 34.50 29.29 2em6 s PRO 40 CO 0.69 -3.73 0.44 -1.12 0.04 0.00 0.00 177.00 173.33 2em6 s SER 41 N 7.18 6.67 0.00 6.66 0.01 -1.26 -4.95 113.70 128.01 2em6 s SER 41 Ca 0.69 0.85 0.00 0.00 1.31 0.00 0.00 55.95 58.80 2em6 s SER 41 Cb -0.03 -2.20 0.00 0.00 0.21 0.00 0.00 66.02 64.00 2em6 s SER 41 CO 0.07 0.14 0.00 0.61 0.41 0.00 0.00 173.24 174.47 2em6 n GLY 42 N 0.79 -1.47 3.72 3.44 0.00 -1.26 -5.00 105.19 105.41 2em6 n GLY 42 Ca -0.07 -1.95 -0.30 0.00 0.00 0.00 0.00 46.02 43.70 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 0.00 1.31 0.12 1.61 0.04 -1.26 -4.95 135.00 131.86 2em6 s PRO 43 Ca 0.00 0.83 -0.29 0.00 0.04 0.00 0.00 61.00 61.59 2em6 s PRO 43 Cb 0.00 -1.81 -0.09 0.00 0.04 0.00 0.00 34.50 32.63 2em6 s PRO 43 CO 0.00 -2.21 1.48 0.77 0.04 0.00 0.00 177.00 177.08 2em6 h SER 44 N -1.53 -1.68 -2.31 6.66 0.02 -1.96 -3.39 113.55 109.36 2em6 h SER 44 Ca -0.49 0.23 -0.57 0.00 -0.84 0.00 0.00 61.79 60.12 2em6 h SER 44 Cb 1.28 0.70 0.04 0.00 0.14 0.00 0.00 62.40 64.56 2em6 h SER 44 CO 0.54 -0.33 1.04 -1.20 -1.14 0.00 0.00 176.83 175.74 2em6 n SER 45 N -5.03 3.65 0.00 3.07 7.64 -1.26 -5.09 113.62 116.60 2em6 n SER 45 Ca -0.02 1.00 0.00 0.00 1.01 0.00 0.00 58.87 60.86 2em6 n SER 45 Cb 0.29 -1.47 0.00 0.00 -1.01 0.00 0.00 64.21 62.02 2em6 n SER 45 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64