#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2em4 h SER 2 N 0.00 -0.06 -5.12 1.61 0.87 -2.14 -3.48 113.55 105.24 2em4 h SER 2 Ca 0.00 -0.59 -0.06 0.00 -1.23 0.00 0.00 61.79 59.91 2em4 h SER 2 Cb 0.00 0.01 -0.13 0.00 -0.44 0.00 0.00 62.40 61.85 2em4 h SER 2 CO 0.00 0.61 -0.16 -0.44 -0.53 0.00 0.00 176.83 176.31 2em4 s SER 3 N -5.79 -0.12 0.00 6.23 0.01 -1.26 -5.15 113.70 107.63 2em4 s SER 3 Ca -0.15 -0.49 0.00 0.00 1.31 0.00 0.00 55.95 56.61 2em4 s SER 3 Cb -0.00 0.45 0.00 0.00 0.21 0.00 0.00 66.02 66.68 2em4 s SER 3 CO 0.59 -0.86 0.00 0.61 0.41 0.00 0.00 173.24 174.00 2em4 n GLY 4 N -0.20 3.80 2.70 3.44 0.00 -1.26 -5.11 105.19 108.57 2em4 n GLY 4 Ca -0.14 -0.83 -0.30 0.00 0.00 0.00 0.00 46.02 44.75 2em4 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2em4 s SER 5 N 0.00 3.90 -0.41 1.61 0.15 -1.26 -4.99 113.70 112.70 2em4 s SER 5 Ca 0.00 -1.76 0.05 0.00 0.70 0.00 0.00 55.95 54.94 2em4 s SER 5 Cb 0.00 -0.82 0.44 0.00 -1.71 0.00 0.00 66.02 63.93 2em4 s SER 5 CO 0.00 -0.39 1.30 -0.24 1.20 0.00 0.00 173.24 175.11 2em4 n SER 6 N 4.68 5.31 -2.72 5.45 2.88 -1.26 -4.72 113.62 123.24 2em4 n SER 6 Ca -0.00 -3.75 -0.09 0.00 -1.33 0.00 0.00 58.87 53.70 2em4 n SER 6 Cb 0.41 -0.48 0.08 0.00 -0.75 0.00 0.00 64.21 63.46 2em4 n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2em4 n GLY 7 N -0.65 1.44 0.09 0.46 0.00 -1.26 -4.94 105.19 100.33 2em4 n GLY 7 Ca 0.45 -0.54 -0.12 0.00 0.00 0.00 0.00 46.02 45.81 2em4 n GLY 7 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2em4 n THR 8 N -0.28 1.09 -3.41 2.61 -2.24 -1.26 -5.02 114.28 105.77 2em4 n THR 8 Ca 0.03 -0.46 -0.20 0.00 -2.27 0.00 0.00 64.05 61.15 2em4 n THR 8 Cb 0.81 -1.07 -0.00 0.00 -2.10 0.00 0.00 70.33 67.97 2em4 n THR 8 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2em4 s GLY 9 N -5.66 1.53 -0.23 3.38 0.00 -1.26 -5.12 107.32 99.96 2em4 s GLY 9 Ca -0.22 -1.32 -0.19 0.00 0.00 0.00 0.00 44.72 42.99 2em4 s GLY 9 CO 0.48 -1.22 0.60 1.20 0.00 0.00 0.00 173.10 174.16 2em4 s GLN 10 N -4.25 0.68 -0.03 2.90 -0.21 -1.26 -5.17 119.66 112.33 2em4 s GLN 10 Ca 0.44 0.91 -0.01 0.00 0.02 0.00 0.00 55.36 56.72 2em4 s GLN 10 Cb -0.10 0.27 -0.04 0.00 1.00 0.00 0.00 33.01 34.15 2em4 s GLN 10 CO 0.33 -0.10 0.08 1.03 -2.12 0.00 0.00 175.29 174.50 2em4 s ARG 11 N 0.66 3.10 0.56 2.91 1.81 -1.26 -5.00 118.95 121.72 2em4 s ARG 11 Ca -0.03 -0.43 0.34 0.00 -1.72 0.00 0.00 55.73 53.89 2em4 s ARG 11 Cb -0.05 -2.89 1.42 0.00 -0.45 0.00 0.00 34.95 32.99 2em4 s ARG 11 CO -0.04 0.67 2.00 -1.00 -0.68 0.00 0.00 175.30 176.25 2em4 h PRO 12 N 4.34 0.00 -4.28 3.54 0.13 -1.90 -3.38 132.00 130.45 2em4 h PRO 12 Ca -0.50 0.00 -0.65 0.00 -0.87 0.00 0.00 66.00 63.98 2em4 h PRO 12 Cb 1.19 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.92 2em4 h PRO 12 CO 0.61 0.00 -0.70 0.71 -0.23 0.00 0.00 178.00 178.38 2em4 s TYR 13 N -3.69 3.44 0.17 1.56 2.02 -1.26 -5.06 117.35 114.53 2em4 s TYR 13 Ca 0.01 -2.93 0.11 0.00 -0.37 0.00 0.00 57.07 53.89 2em4 s TYR 13 Cb 0.09 -2.78 -0.04 0.00 -0.40 0.00 0.00 41.96 38.82 2em4 s TYR 13 CO 0.54 -0.90 -0.25 -1.21 -1.57 0.00 0.00 175.55 172.16 2em4 s GLU 14 N 0.69 1.48 -0.32 -0.62 2.02 -1.26 -0.70 118.70 119.98 2em4 s GLU 14 Ca 0.12 -1.47 -0.18 0.00 0.02 0.00 0.00 54.97 53.47 2em4 s GLU 14 Cb -0.20 -1.85 -0.01 0.00 0.10 0.00 0.00 34.13 32.16 2em4 s GLU 14 CO -0.07 0.41 0.49 0.00 0.02 0.00 0.00 175.26 176.11 2em4 n ILE 16 N 5.34 3.10 0.01 0.00 5.41 -1.26 -3.30 119.36 128.65 2em4 n ILE 16 Ca -0.05 -2.38 0.00 0.00 1.00 0.00 0.00 62.75 61.32 2em4 n ILE 16 Cb 0.49 -1.57 0.00 0.00 -0.71 0.00 0.00 39.64 37.86 2em4 n ILE 16 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 176.55 177.76 2em4 n GLU 17 N 0.93 0.00 -0.04 0.38 4.07 -1.26 -4.98 120.64 119.74 2em4 n GLU 17 Ca 0.42 0.00 -0.08 0.00 -0.06 0.00 0.00 57.16 57.44 2em4 n GLU 17 Cb 0.60 -0.25 -0.03 0.00 -0.06 0.00 0.00 31.44 31.70 2em4 n GLU 17 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2em4 n GLY 19 N 2.71 0.23 3.02 0.00 0.00 -1.21 -5.14 105.19 104.81 2em4 n GLY 19 Ca -0.15 -0.63 -0.14 0.00 0.00 0.00 0.00 46.02 45.09 2em4 n GLY 19 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2em4 s LYS 20 N 0.00 0.50 0.05 1.61 2.36 -1.25 -5.00 119.74 118.01 2em4 s LYS 20 Ca 0.00 -0.53 0.05 0.00 -2.55 0.00 0.00 55.97 52.94 2em4 s LYS 20 Cb 0.00 -0.36 -0.04 0.00 -1.05 0.00 0.00 37.83 36.38 2em4 s LYS 20 CO 0.00 0.08 -0.10 0.00 1.55 0.00 0.00 175.35 176.88 2em4 s ALA 21 N -0.86 2.90 0.08 3.13 0.00 -1.26 -0.28 121.76 125.46 2em4 s ALA 21 Ca -0.05 -1.14 0.05 0.00 0.00 0.00 0.00 51.96 50.83 2em4 s ALA 21 Cb -0.07 -0.96 -0.03 0.00 0.00 0.00 0.00 23.12 22.07 2em4 s ALA 21 CO 0.00 0.61 -0.15 -0.06 0.00 0.00 0.00 175.76 176.17 2em4 s PHE 22 N -1.06 1.28 -0.03 0.00 0.40 0.13 -5.00 117.98 113.70 2em4 s PHE 22 Ca 0.18 -0.46 -0.26 0.00 -0.60 0.00 0.00 56.93 55.79 2em4 s PHE 22 Cb -0.11 -0.72 -0.20 0.00 0.51 0.00 0.00 43.02 42.50 2em4 s PHE 22 CO 0.09 0.08 1.24 1.57 0.70 0.00 0.00 175.22 178.90 2em4 h LYS 23 N 4.21 0.02 -5.71 0.44 2.10 -2.00 -3.35 116.57 112.27 2em4 h LYS 23 Ca -0.41 -0.01 -0.66 0.00 -2.00 0.00 0.00 60.65 57.56 2em4 h LYS 23 Cb 1.19 0.00 -0.22 0.00 -0.90 0.00 0.00 32.23 32.30 2em4 h LYS 23 CO 0.41 0.53 -0.71 0.95 -2.00 0.00 0.00 179.45 178.62 2em4 s THR 24 N -4.15 3.53 0.21 0.07 -4.23 -1.26 -4.79 115.64 105.02 2em4 s THR 24 Ca -0.16 -0.51 -0.11 0.00 -1.18 0.00 0.00 61.69 59.72 2em4 s THR 24 Cb 0.02 -2.48 0.19 0.00 1.34 0.00 0.00 72.50 71.57 2em4 s THR 24 CO 0.68 0.55 1.66 0.50 -0.54 0.00 0.00 174.62 177.47 2em4 h LYS 25 N 6.04 0.10 -0.75 3.99 1.63 -1.92 -1.30 116.57 124.36 2em4 h LYS 25 Ca -0.38 -0.01 0.14 0.00 -0.85 0.00 0.00 60.65 59.56 2em4 h LYS 25 Cb 1.19 -0.02 -0.14 0.00 -0.60 0.00 0.00 32.23 32.65 2em4 h LYS 25 CO 0.56 0.07 -0.26 1.03 -3.45 0.00 0.00 179.45 177.40 2em4 h SER 26 N 0.11 -0.94 -0.74 4.20 0.87 -1.99 0.61 113.55 115.67 2em4 h SER 26 Ca 0.31 0.24 0.02 0.00 -1.23 0.00 0.00 61.79 61.14 2em4 h SER 26 Cb 0.50 0.55 -0.04 0.00 -0.44 0.00 0.00 62.40 62.96 2em4 h SER 26 CO -0.52 -0.28 0.49 0.77 -0.53 0.00 0.00 176.83 176.76 2em4 h SER 27 N -0.05 0.81 0.51 6.23 4.64 -1.67 -2.69 113.55 121.33 2em4 h SER 27 Ca 0.33 -0.01 -0.02 0.00 -0.47 0.00 0.00 61.79 61.61 2em4 h SER 27 Cb 0.57 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 2em4 h SER 27 CO -0.79 0.57 -0.24 0.25 -0.87 0.00 0.00 176.83 175.74 2em4 h LEU 28 N 0.94 -0.58 -0.98 5.97 5.85 0.37 -3.08 115.31 123.79 2em4 h LEU 28 Ca 0.29 -0.03 0.32 0.00 0.84 0.00 0.00 57.88 59.30 2em4 h LEU 28 Cb -0.01 0.15 -0.18 0.00 0.37 0.00 0.00 40.66 40.99 2em4 h LEU 28 CO -0.08 -0.17 0.24 0.40 -0.34 0.00 0.00 178.44 178.49 2em4 h ILE 29 N -1.12 0.05 -0.63 4.05 2.04 -0.41 0.89 117.51 122.39 2em4 h ILE 29 Ca -0.07 -0.01 0.02 0.00 1.00 0.00 0.00 64.86 65.80 2em4 h ILE 29 Cb 0.57 0.01 -0.04 0.00 -0.74 0.00 0.00 36.82 36.62 2em4 h ILE 29 CO 0.11 0.01 0.39 0.00 0.00 0.00 0.00 178.15 178.67 2em4 h HIS 31 N 0.78 0.55 0.20 0.00 -0.00 0.82 -2.25 115.15 115.24 2em4 h HIS 31 Ca 0.25 -0.12 -0.01 0.00 -0.00 0.00 0.00 60.37 60.49 2em4 h HIS 31 Cb -0.00 -0.13 -0.00 0.00 -0.00 0.00 0.00 27.41 27.27 2em4 h HIS 31 CO -0.05 0.71 -0.13 0.00 -0.00 0.00 0.00 177.93 178.46 2em4 h ARG 32 N 0.43 -0.29 -0.71 5.26 2.47 -0.36 -2.68 114.38 118.50 2em4 h ARG 32 Ca 0.06 0.02 0.13 0.00 -1.26 0.00 0.00 59.98 58.93 2em4 h ARG 32 Cb 0.68 0.07 -0.05 0.00 -1.65 0.00 0.00 29.97 29.02 2em4 h ARG 32 CO 0.05 -0.20 0.47 0.07 0.56 0.00 0.00 179.97 180.93 2em4 h ARG 33 N -0.31 0.42 -0.94 0.04 0.11 -1.54 -1.08 114.38 111.09 2em4 h ARG 33 Ca -0.03 -0.03 0.16 0.00 0.10 0.00 0.00 59.98 60.19 2em4 h ARG 33 Cb 0.25 -0.10 -0.10 0.00 1.11 0.00 0.00 29.97 31.13 2em4 h ARG 33 CO 0.02 0.28 0.54 1.03 0.10 0.00 0.00 179.97 181.94 2em4 h SER 34 N 0.44 0.70 -0.96 0.08 0.87 -1.15 -2.24 113.55 111.28 2em4 h SER 34 Ca 0.34 0.09 0.12 0.00 -1.23 0.00 0.00 61.79 61.11 2em4 h SER 34 Cb 0.72 -0.03 -0.14 0.00 -0.44 0.00 0.00 62.40 62.50 2em4 h SER 34 CO -0.11 0.28 -0.47 0.45 -0.53 0.00 0.00 176.83 176.46 2em4 h HIS 35 N 0.74 -1.41 -6.83 2.24 3.86 -0.87 -3.43 115.15 109.45 2em4 h HIS 35 Ca 0.52 0.11 -0.57 0.00 -1.16 0.00 0.00 60.37 59.27 2em4 h HIS 35 Cb 0.73 0.75 -0.33 0.00 1.06 0.00 0.00 27.41 29.62 2em4 h HIS 35 CO -0.04 -0.39 -0.83 0.25 0.86 0.00 0.00 177.93 177.77 2em4 n THR 36 N -5.38 -0.12 0.00 2.45 -2.24 -0.85 -4.46 114.28 103.68 2em4 n THR 36 Ca 0.06 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2em4 n THR 36 Cb 0.34 -0.51 0.00 0.00 -2.10 0.00 0.00 70.33 68.06 2em4 n THR 36 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2em4 n GLY 37 N -1.20 2.48 3.53 3.38 0.00 -1.26 -5.10 105.19 107.03 2em4 n GLY 37 Ca 0.06 -1.67 -0.25 0.00 0.00 0.00 0.00 46.02 44.15 2em4 n GLY 37 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2em4 s GLU 38 N -4.37 1.78 -1.32 1.61 2.02 -1.26 -4.79 118.70 112.37 2em4 s GLU 38 Ca 0.00 -1.91 -0.13 0.00 0.02 0.00 0.00 54.97 52.94 2em4 s GLU 38 Cb 0.00 -1.62 0.01 0.00 0.10 0.00 0.00 34.13 32.61 2em4 s GLU 38 CO 0.00 0.13 0.51 1.63 0.02 0.00 0.00 175.26 177.55 2em4 n LYS 39 N -0.76 -1.68 -2.05 1.61 5.02 -1.26 -4.79 118.16 114.25 2em4 n LYS 39 Ca -0.05 0.29 -0.32 0.00 -2.02 0.00 0.00 58.31 56.21 2em4 n LYS 39 Cb 0.63 -3.82 -0.04 0.00 -0.02 0.00 0.00 35.03 31.78 2em4 n LYS 39 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2em4 s PRO 40 N -6.73 2.59 0.09 1.97 0.04 -1.26 -4.87 135.00 126.83 2em4 s PRO 40 Ca 0.24 0.10 -0.27 0.00 0.04 0.00 0.00 61.00 61.10 2em4 s PRO 40 Cb -0.11 -4.77 -0.11 0.00 0.04 0.00 0.00 34.50 29.56 2em4 s PRO 40 CO 0.92 -3.09 1.44 0.77 0.04 0.00 0.00 177.00 177.08 2em4 h SER 41 N 12.89 -1.36 0.00 6.66 0.02 -2.02 -3.47 113.55 126.26 2em4 h SER 41 Ca -0.06 0.16 0.00 0.00 -0.84 0.00 0.00 61.79 61.05 2em4 h SER 41 Cb 1.07 0.53 0.00 0.00 0.14 0.00 0.00 62.40 64.14 2em4 h SER 41 CO 1.21 -0.40 0.00 0.61 -1.14 0.00 0.00 176.83 177.12 2em4 n GLY 42 N -1.35 -1.39 3.77 -3.77 0.00 -1.26 -4.92 105.19 96.27 2em4 n GLY 42 Ca -0.05 -1.37 -0.32 0.00 0.00 0.00 0.00 46.02 44.28 2em4 n GLY 42 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2em4 s PRO 43 N 0.00 2.48 0.07 1.61 0.04 -1.26 -4.98 135.00 132.95 2em4 s PRO 43 Ca 0.00 1.26 -0.37 0.00 0.04 0.00 0.00 61.00 61.93 2em4 s PRO 43 Cb 0.00 -1.92 -0.20 0.00 0.04 0.00 0.00 34.50 32.43 2em4 s PRO 43 CO 0.00 -1.48 1.56 1.03 0.04 0.00 0.00 177.00 178.15 2em4 h SER 44 N -0.64 -1.25 -1.77 6.66 0.87 -2.04 -3.41 113.55 111.97 2em4 h SER 44 Ca -0.45 0.07 -0.65 0.00 -1.23 0.00 0.00 61.79 59.52 2em4 h SER 44 Cb 1.24 0.36 0.01 0.00 -0.44 0.00 0.00 62.40 63.57 2em4 h SER 44 CO 0.52 -0.77 1.12 -1.20 -0.53 0.00 0.00 176.83 175.97 2em4 n SER 45 N -5.62 3.00 0.00 6.23 7.64 -1.26 -5.25 113.62 118.37 2em4 n SER 45 Ca -0.15 0.89 0.00 0.00 1.01 0.00 0.00 58.87 60.62 2em4 n SER 45 Cb 0.51 -1.31 0.00 0.00 -1.01 0.00 0.00 64.21 62.41 2em4 n SER 45 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64