#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2em4 n SER 2 N 0.00 5.55 -2.86 1.61 3.41 -1.26 -4.88 113.62 115.19 2em4 n SER 2 Ca 0.00 -3.64 -0.34 0.00 -0.26 0.00 0.00 58.87 54.63 2em4 n SER 2 Cb 0.00 -0.84 -0.01 0.00 -0.26 0.00 0.00 64.21 63.09 2em4 n SER 2 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2em4 n SER 3 N 0.09 7.09 -1.34 4.04 2.88 -1.26 -5.01 113.62 120.11 2em4 n SER 3 Ca 0.36 -3.44 0.17 0.00 -1.33 0.00 0.00 58.87 54.63 2em4 n SER 3 Cb 0.34 -1.19 -0.04 0.00 -0.75 0.00 0.00 64.21 62.57 2em4 n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2em4 n GLY 4 N 0.46 -1.84 3.44 0.46 0.00 -1.26 -5.02 105.19 101.44 2em4 n GLY 4 Ca 0.52 -1.16 -0.16 0.00 0.00 0.00 0.00 46.02 45.22 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 -6.67 1.20 -0.24 1.61 0.15 -1.26 -5.12 113.70 103.37 2em4 s SER 5 Ca 0.00 -1.59 -0.29 0.00 0.70 0.00 0.00 55.95 54.77 2em4 s SER 5 Cb 0.00 0.65 0.17 0.00 -1.71 0.00 0.00 66.02 65.13 2em4 s SER 5 CO 0.00 -1.27 1.22 -0.44 1.20 0.00 0.00 173.24 173.95 2em4 s SER 6 N -3.29 -0.17 0.00 5.45 0.01 -1.26 -5.14 113.70 109.31 2em4 s SER 6 Ca 0.33 0.19 0.00 0.00 1.31 0.00 0.00 55.95 57.79 2em4 s SER 6 Cb 0.00 0.15 0.00 0.00 0.21 0.00 0.00 66.02 66.38 2em4 s SER 6 CO 0.23 -0.15 0.00 0.61 0.41 0.00 0.00 173.24 174.34 2em4 n GLY 7 N 0.67 -1.92 0.14 3.44 0.00 -1.26 -4.83 105.19 101.43 2em4 n GLY 7 Ca -0.04 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.74 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 0.00 1.47 0.00 2.61 -2.24 -1.26 -4.99 114.28 109.87 2em4 n THR 8 Ca 0.00 -0.47 0.00 0.00 -2.27 0.00 0.00 64.05 61.31 2em4 n THR 8 Cb 0.00 -1.64 0.00 0.00 -2.10 0.00 0.00 70.33 66.59 2em4 n THR 8 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2em4 n GLY 9 N 1.78 1.44 0.28 3.38 0.00 -1.26 -4.80 105.19 106.01 2em4 n GLY 9 Ca -0.49 -0.11 0.09 0.00 0.00 0.00 0.00 46.02 45.51 2em4 n GLY 9 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2em4 n GLN 10 N 0.00 -0.07 -3.48 1.61 -0.06 -1.26 -4.20 117.38 109.92 2em4 n GLN 10 Ca 0.00 1.23 -0.36 0.00 -2.00 0.00 0.00 57.00 55.87 2em4 n GLN 10 Cb 0.00 -1.90 -0.06 0.00 -4.06 0.00 0.00 30.24 24.23 2em4 n GLN 10 CO 0.00 0.00 0.00 1.03 -0.20 0.00 0.00 177.06 177.89 2em4 s ARG 11 N -5.87 3.88 0.47 3.69 1.81 -1.26 -4.99 118.95 116.67 2em4 s ARG 11 Ca -0.11 0.34 0.25 0.00 -1.72 0.00 0.00 55.73 54.49 2em4 s ARG 11 Cb 0.23 -3.03 1.07 0.00 -0.45 0.00 0.00 34.95 32.77 2em4 s ARG 11 CO 0.63 0.56 1.89 -1.00 -0.68 0.00 0.00 175.30 176.70 2em4 h PRO 12 N 3.89 0.00 -3.57 3.54 0.13 -1.81 -3.37 132.00 130.81 2em4 h PRO 12 Ca -0.49 0.00 -0.70 0.00 -0.87 0.00 0.00 66.00 63.94 2em4 h PRO 12 Cb 1.20 0.00 -0.35 0.00 0.13 0.00 0.00 31.00 31.97 2em4 h PRO 12 CO 0.65 0.19 -0.36 0.71 -0.23 0.00 0.00 178.00 178.96 2em4 s TYR 13 N -3.78 3.40 0.22 1.56 2.02 -1.26 -5.06 117.35 114.45 2em4 s TYR 13 Ca -0.00 -2.74 0.03 0.00 -0.37 0.00 0.00 57.07 53.99 2em4 s TYR 13 Cb 0.11 -3.19 -0.05 0.00 -0.40 0.00 0.00 41.96 38.43 2em4 s TYR 13 CO 0.62 -0.84 0.01 -1.83 -1.57 0.00 0.00 175.55 171.94 2em4 s GLU 14 N -0.11 1.28 0.28 -0.62 -1.05 -1.26 0.59 118.70 117.81 2em4 s GLU 14 Ca 0.17 -1.64 0.06 0.00 -0.15 0.00 0.00 54.97 53.41 2em4 s GLU 14 Cb -0.20 -0.49 -0.03 0.00 -0.44 0.00 0.00 34.13 32.97 2em4 s GLU 14 CO -0.03 -0.12 0.33 0.00 0.95 0.00 0.00 175.26 176.38 2em4 n ILE 16 N -1.39 0.05 0.06 0.00 0.13 -1.26 -3.78 119.36 113.16 2em4 n ILE 16 Ca -0.06 -0.03 -0.14 0.00 -1.10 0.00 0.00 62.75 61.42 2em4 n ILE 16 Cb 0.58 -0.77 -0.07 0.00 -0.84 0.00 0.00 39.64 38.53 2em4 n ILE 16 CO 0.00 0.00 0.00 -0.33 2.80 0.00 0.00 176.55 179.02 2em4 h GLU 17 N 0.00 -0.57 0.00 9.51 3.07 -1.99 -3.36 114.58 121.24 2em4 h GLU 17 Ca -0.02 0.04 -0.35 0.00 -0.50 0.00 0.00 59.36 58.53 2em4 h GLU 17 Cb 0.91 0.13 -0.05 0.00 -0.84 0.00 0.00 28.75 28.90 2em4 h GLU 17 CO 0.00 -0.38 -2.17 0.00 -1.40 0.00 0.00 179.01 175.07 2em4 n GLY 19 N 1.78 0.66 2.75 0.00 0.00 -1.26 -5.02 105.19 104.10 2em4 n GLY 19 Ca -0.41 -0.67 -0.17 0.00 0.00 0.00 0.00 46.02 44.77 2em4 n GLY 19 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2em4 s LYS 20 N -0.02 -0.04 0.13 1.61 1.02 -1.25 -4.89 119.74 116.31 2em4 s LYS 20 Ca 0.00 0.28 -0.04 0.00 0.02 0.00 0.00 55.97 56.22 2em4 s LYS 20 Cb 0.00 -0.33 -0.05 0.00 -0.52 0.00 0.00 37.83 36.92 2em4 s LYS 20 CO 0.00 -0.23 0.36 0.00 -0.92 0.00 0.00 175.35 174.56 2em4 s ALA 21 N 1.49 3.81 0.30 5.17 0.00 -1.26 0.07 121.76 131.34 2em4 s ALA 21 Ca -0.04 -0.58 0.03 0.00 0.00 0.00 0.00 51.96 51.37 2em4 s ALA 21 Cb -0.13 -2.10 -0.05 0.00 0.00 0.00 0.00 23.12 20.84 2em4 s ALA 21 CO -0.03 0.68 0.09 -0.06 0.00 0.00 0.00 175.76 176.44 2em4 s PHE 22 N -1.63 1.72 -0.03 0.00 0.40 0.20 -4.95 117.98 113.69 2em4 s PHE 22 Ca 0.40 -1.14 0.19 0.00 -0.60 0.00 0.00 56.93 55.79 2em4 s PHE 22 Cb -0.12 -1.06 -0.30 0.00 0.51 0.00 0.00 43.02 42.05 2em4 s PHE 22 CO 0.25 -0.24 0.42 0.36 0.70 0.00 0.00 175.22 176.71 2em4 n LYS 23 N -0.61 0.59 -4.18 0.44 2.85 -1.26 -4.14 118.16 111.85 2em4 n LYS 23 Ca -0.01 -0.17 -0.21 0.00 -1.05 0.00 0.00 58.31 56.87 2em4 n LYS 23 Cb 0.66 -1.46 -0.16 0.00 -0.65 0.00 0.00 35.03 33.42 2em4 n LYS 23 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 177.40 178.30 2em4 s THR 24 N -3.33 0.59 0.07 0.58 -4.23 -1.26 -4.92 115.64 103.13 2em4 s THR 24 Ca -0.07 -0.15 -0.18 0.00 -1.18 0.00 0.00 61.69 60.11 2em4 s THR 24 Cb 0.12 -0.61 -0.07 0.00 1.34 0.00 0.00 72.50 73.28 2em4 s THR 24 CO 0.80 0.24 1.30 0.50 -0.54 0.00 0.00 174.62 176.92 2em4 h LYS 25 N 7.23 -0.27 -0.49 3.99 3.64 -1.91 -2.28 116.57 126.47 2em4 h LYS 25 Ca -0.36 0.02 0.04 0.00 -1.27 0.00 0.00 60.65 59.08 2em4 h LYS 25 Cb 1.15 0.06 -0.06 0.00 -0.41 0.00 0.00 32.23 32.98 2em4 h LYS 25 CO 0.46 -0.18 -0.29 0.43 -2.27 0.00 0.00 179.45 177.60 2em4 n SER 26 N -4.11 -0.52 -0.34 4.20 7.64 -1.26 0.20 113.62 119.42 2em4 n SER 26 Ca -0.03 1.13 0.22 0.00 1.01 0.00 0.00 58.87 61.20 2em4 n SER 26 Cb 0.20 -0.24 0.45 0.00 -1.01 0.00 0.00 64.21 63.61 2em4 n SER 26 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2em4 h SER 27 N 0.00 0.57 0.61 6.43 0.02 -1.91 0.73 113.55 120.00 2em4 h SER 27 Ca 0.08 0.15 -0.16 0.00 -0.84 0.00 0.00 61.79 61.02 2em4 h SER 27 Cb 0.20 0.08 -0.02 0.00 0.14 0.00 0.00 62.40 62.81 2em4 h SER 27 CO -0.46 -0.01 -0.73 0.25 -1.14 0.00 0.00 176.83 174.73 2em4 h LEU 28 N 0.43 0.12 -0.18 5.07 5.85 0.29 -3.27 115.31 123.61 2em4 h LEU 28 Ca 0.69 -0.08 0.05 0.00 0.84 0.00 0.00 57.88 59.37 2em4 h LEU 28 Cb 1.51 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 42.45 2em4 h LEU 28 CO -0.51 0.81 -0.17 0.40 -0.34 0.00 0.00 178.44 178.63 2em4 h ILE 29 N 0.06 0.55 -0.92 4.05 1.08 0.49 0.23 117.51 123.06 2em4 h ILE 29 Ca -0.02 0.00 0.13 0.00 -0.39 0.00 0.00 64.86 64.58 2em4 h ILE 29 Cb 1.30 0.55 -0.07 0.00 -3.07 0.00 0.00 36.82 35.52 2em4 h ILE 29 CO 0.10 0.00 0.59 0.00 -0.69 0.00 0.00 178.15 178.15 2em4 h HIS 31 N 0.80 0.29 0.74 0.00 -0.00 -1.31 -0.09 115.15 115.58 2em4 h HIS 31 Ca 0.46 -0.11 -0.04 0.00 -0.00 0.00 0.00 60.37 60.68 2em4 h HIS 31 Cb 0.61 -0.05 0.01 0.00 -0.00 0.00 0.00 27.41 27.98 2em4 h HIS 31 CO -0.00 0.76 -0.36 0.00 -0.00 0.00 0.00 177.93 178.33 2em4 h ARG 32 N -0.26 -0.96 -0.40 5.26 3.08 0.14 -2.27 114.38 118.97 2em4 h ARG 32 Ca 0.00 0.07 -0.02 0.00 0.07 0.00 0.00 59.98 60.09 2em4 h ARG 32 Cb 0.75 0.22 -0.02 0.00 0.08 0.00 0.00 29.97 31.00 2em4 h ARG 32 CO 0.03 -0.63 0.16 0.07 -1.07 0.00 0.00 179.97 178.54 2em4 h ARG 33 N -1.05 0.57 -0.46 0.04 -0.00 -0.74 -2.66 114.38 110.08 2em4 h ARG 33 Ca -0.10 -0.07 0.05 0.00 -0.00 0.00 0.00 59.98 59.85 2em4 h ARG 33 Cb 0.78 -0.11 -0.04 0.00 -0.00 0.00 0.00 29.97 30.60 2em4 h ARG 33 CO 0.17 0.47 0.21 1.03 -0.00 0.00 0.00 179.97 181.85 2em4 h SER 34 N 0.57 0.27 -0.72 0.08 0.87 -0.82 -2.45 113.55 111.35 2em4 h SER 34 Ca 0.14 0.03 0.24 0.00 -1.23 0.00 0.00 61.79 60.97 2em4 h SER 34 Cb 0.12 -0.01 -0.13 0.00 -0.44 0.00 0.00 62.40 61.93 2em4 h SER 34 CO -0.01 0.20 0.16 1.41 -0.53 0.00 0.00 176.83 178.05 2em4 n HIS 35 N -4.94 0.61 -3.14 2.24 8.25 -0.87 -2.80 115.22 114.57 2em4 n HIS 35 Ca 0.03 0.86 -0.45 0.00 -0.26 0.00 0.00 57.72 57.91 2em4 n HIS 35 Cb 0.14 -1.13 -0.03 0.00 1.12 0.00 0.00 29.99 30.08 2em4 n HIS 35 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 2em4 s THR 36 N -5.43 5.08 -0.26 1.59 -4.23 -0.92 -4.83 115.64 106.63 2em4 s THR 36 Ca -0.08 -1.69 0.17 0.00 -1.18 0.00 0.00 61.69 58.91 2em4 s THR 36 Cb 0.23 -4.57 0.49 0.00 1.34 0.00 0.00 72.50 69.99 2em4 s THR 36 CO 0.56 -1.20 1.14 0.61 -0.54 0.00 0.00 174.62 175.19 2em4 n GLY 37 N 4.89 3.53 3.64 3.99 0.00 -1.12 -5.02 105.19 115.11 2em4 n GLY 37 Ca 0.08 -1.66 -0.03 0.00 0.00 0.00 0.00 46.02 44.42 2em4 n GLY 37 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2em4 s GLU 38 N -3.63 0.29 0.06 1.61 -1.05 -1.26 -5.17 118.70 109.55 2em4 s GLU 38 Ca 0.36 0.45 -0.11 0.00 -0.15 0.00 0.00 54.97 55.53 2em4 s GLU 38 Cb 0.36 0.09 -0.06 0.00 -0.44 0.00 0.00 34.13 34.08 2em4 s GLU 38 CO -0.01 -0.05 0.39 0.15 0.95 0.00 0.00 175.26 176.69 2em4 s LYS 39 N 0.91 3.78 0.00 -4.83 1.02 -1.26 -4.97 119.74 114.39 2em4 s LYS 39 Ca -0.05 0.21 0.14 0.00 0.02 0.00 0.00 55.97 56.30 2em4 s LYS 39 Cb -0.04 -3.05 0.66 0.00 -0.52 0.00 0.00 37.83 34.88 2em4 s LYS 39 CO -0.12 0.59 1.44 -0.35 -0.92 0.00 0.00 175.35 175.99 2em4 n PRO 40 N 1.12 0.08 -2.36 -1.68 -0.04 -1.26 -2.90 135.00 127.95 2em4 n PRO 40 Ca -0.10 0.22 -0.20 0.00 -0.04 0.00 0.00 63.50 63.38 2em4 n PRO 40 Cb 0.52 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 32.50 2em4 n PRO 40 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2em4 n SER 41 N -1.42 4.01 -0.71 3.54 3.41 -1.26 -5.10 113.62 116.08 2em4 n SER 41 Ca 0.05 -3.39 0.09 0.00 -0.26 0.00 0.00 58.87 55.36 2em4 n SER 41 Cb 0.15 -0.42 -0.03 0.00 -0.26 0.00 0.00 64.21 63.64 2em4 n SER 41 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2em4 n GLY 42 N -0.54 -2.34 1.72 5.00 0.00 -1.14 -4.95 105.19 102.93 2em4 n GLY 42 Ca 0.33 -1.30 -0.15 0.00 0.00 0.00 0.00 46.02 44.91 2em4 n GLY 42 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2em4 n PRO 43 N -3.38 -2.07 -0.07 1.61 -0.04 -1.26 -4.48 135.00 125.31 2em4 n PRO 43 Ca -0.02 -0.86 -0.05 0.00 -0.04 0.00 0.00 63.50 62.53 2em4 n PRO 43 Cb 0.33 -0.80 -0.02 0.00 -0.04 0.00 0.00 33.50 32.97 2em4 n PRO 43 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2em4 n SER 44 N -3.92 1.66 -4.62 3.54 2.88 -1.26 -4.96 113.62 106.94 2em4 n SER 44 Ca 0.07 0.53 -0.34 0.00 -1.33 0.00 0.00 58.87 57.80 2em4 n SER 44 Cb 0.29 -0.81 -0.11 0.00 -0.75 0.00 0.00 64.21 62.83 2em4 n SER 44 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2em4 s SER 45 N -5.56 4.87 0.00 -3.46 1.04 -1.26 -5.29 113.70 104.03 2em4 s SER 45 Ca -0.16 0.04 0.00 0.00 0.48 0.00 0.00 55.95 56.30 2em4 s SER 45 Cb 0.02 -1.30 0.00 0.00 0.10 0.00 0.00 66.02 64.84 2em4 s SER 45 CO 0.24 0.36 0.06 0.61 0.98 0.00 0.00 173.24 175.49