#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2em4 s SER 2 N 0.00 7.15 -0.24 1.61 1.04 -1.26 -5.02 113.70 116.98 2em4 s SER 2 Ca 0.00 1.41 -0.16 0.00 0.48 0.00 0.00 55.95 57.68 2em4 s SER 2 Cb 0.00 -2.52 0.07 0.00 0.10 0.00 0.00 66.02 63.67 2em4 s SER 2 CO 0.00 -0.43 0.59 -0.55 0.98 0.00 0.00 173.24 173.84 2em4 s SER 3 N 1.11 -0.75 0.00 7.02 0.15 -1.26 -5.06 113.70 114.90 2em4 s SER 3 Ca 0.45 1.28 0.00 0.00 0.70 0.00 0.00 55.95 58.37 2em4 s SER 3 Cb -0.18 1.19 0.00 0.00 -1.71 0.00 0.00 66.02 65.32 2em4 s SER 3 CO 0.16 -0.22 0.00 0.61 1.20 0.00 0.00 173.24 174.99 2em4 n GLY 4 N 3.90 -1.07 3.03 9.45 0.00 -1.26 -5.18 105.19 114.05 2em4 n GLY 4 Ca -0.19 0.37 -0.11 0.00 0.00 0.00 0.00 46.02 46.09 2em4 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2em4 s SER 5 N 0.00 0.57 -0.87 1.61 1.04 -1.26 -5.10 113.70 109.68 2em4 s SER 5 Ca 0.00 -0.54 -0.08 0.00 0.48 0.00 0.00 55.95 55.81 2em4 s SER 5 Cb 0.00 0.07 0.22 0.00 0.10 0.00 0.00 66.02 66.41 2em4 s SER 5 CO 0.00 -0.26 0.79 -0.55 0.98 0.00 0.00 173.24 174.20 2em4 s SER 6 N -1.57 6.39 -0.40 7.02 0.15 -1.26 -5.01 113.70 119.03 2em4 s SER 6 Ca -0.12 -3.20 -0.03 0.00 0.70 0.00 0.00 55.95 53.30 2em4 s SER 6 Cb -0.10 -2.06 0.11 0.00 -1.71 0.00 0.00 66.02 62.26 2em4 s SER 6 CO -0.00 -0.37 0.20 -0.83 1.20 0.00 0.00 173.24 173.44 2em4 s GLY 7 N 1.09 1.98 -0.03 9.45 0.00 -1.26 -5.06 107.32 113.49 2em4 s GLY 7 Ca 0.23 -2.48 0.00 0.00 0.00 0.00 0.00 44.72 42.48 2em4 s GLY 7 CO -0.08 1.01 0.00 -1.08 0.00 0.00 0.00 173.10 172.95 2em4 s THR 8 N 1.17 0.16 0.02 0.90 -1.32 -1.26 -5.08 115.64 110.23 2em4 s THR 8 Ca 0.07 0.09 -0.08 0.00 -1.21 0.00 0.00 61.69 60.56 2em4 s THR 8 Cb -0.23 -0.25 -0.04 0.00 -1.51 0.00 0.00 72.50 70.47 2em4 s THR 8 CO -0.04 0.14 1.12 1.23 -2.21 0.00 0.00 174.62 174.86 2em4 h GLY 9 N 7.21 -0.93 -6.06 6.08 0.00 -2.06 -3.46 103.07 103.85 2em4 h GLY 9 Ca -0.43 0.41 -0.41 0.00 0.00 0.00 0.00 47.33 46.90 2em4 h GLY 9 CO 0.48 -0.33 -0.82 -1.06 0.00 0.00 0.00 176.54 174.81 2em4 n GLN 10 N -3.00 -5.07 -2.48 4.80 1.13 -1.26 -4.93 117.38 106.56 2em4 n GLN 10 Ca -0.02 0.64 -0.38 0.00 -1.94 0.00 0.00 57.00 55.29 2em4 n GLN 10 Cb 0.10 -5.24 -0.04 0.00 0.11 0.00 0.00 30.24 25.17 2em4 n GLN 10 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 2em4 s ARG 11 N -5.95 4.30 0.30 -1.09 3.00 -1.26 -4.93 118.95 113.32 2em4 s ARG 11 Ca 0.02 1.66 0.25 0.00 0.00 0.00 0.00 55.73 57.66 2em4 s ARG 11 Cb -0.01 -2.77 1.05 0.00 0.00 0.00 0.00 34.95 33.21 2em4 s ARG 11 CO 0.81 -0.05 1.75 -1.00 0.00 0.00 0.00 175.30 176.80 2em4 h PRO 12 N 2.95 0.00 -5.02 3.54 0.13 -1.87 -3.41 132.00 128.32 2em4 h PRO 12 Ca -0.48 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 63.99 2em4 h PRO 12 Cb 1.22 0.00 -0.32 0.00 0.13 0.00 0.00 31.00 32.03 2em4 h PRO 12 CO 0.64 0.00 -0.79 0.71 -0.23 0.00 0.00 178.00 178.33 2em4 s TYR 13 N -3.37 2.89 0.01 1.56 2.02 -1.26 -5.09 117.35 114.10 2em4 s TYR 13 Ca 0.04 -1.33 0.02 0.00 -0.37 0.00 0.00 57.07 55.42 2em4 s TYR 13 Cb 0.09 -2.01 -0.01 0.00 -0.40 0.00 0.00 41.96 39.63 2em4 s TYR 13 CO 0.41 -0.69 -0.05 -1.21 -1.57 0.00 0.00 175.55 172.44 2em4 s GLU 14 N 1.38 0.42 -0.46 -0.62 2.02 -1.26 -1.72 118.70 118.46 2em4 s GLU 14 Ca 0.05 -0.31 -0.22 0.00 0.02 0.00 0.00 54.97 54.51 2em4 s GLU 14 Cb -0.14 -0.35 0.03 0.00 0.10 0.00 0.00 34.13 33.77 2em4 s GLU 14 CO -0.08 0.09 0.74 0.00 0.02 0.00 0.00 175.26 176.03 2em4 n ILE 16 N 6.00 2.49 0.00 0.00 2.08 -1.26 -3.08 119.36 125.60 2em4 n ILE 16 Ca 0.00 -1.19 0.00 0.00 0.56 0.00 0.00 62.75 62.12 2em4 n ILE 16 Cb 0.48 -1.55 0.00 0.00 -0.75 0.00 0.00 39.64 37.81 2em4 n ILE 16 CO 0.00 0.00 0.00 1.21 0.56 0.00 0.00 176.55 178.32 2em4 n GLU 17 N 1.32 0.00 0.00 0.38 0.00 -1.26 -4.97 120.64 116.12 2em4 n GLU 17 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.36 2em4 n GLU 17 Cb 0.60 -0.54 0.00 0.00 0.00 0.00 0.00 31.44 31.50 2em4 n GLU 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2em4 n GLY 19 N 3.10 0.35 3.18 0.00 0.00 -1.18 -5.13 105.19 105.51 2em4 n GLY 19 Ca 0.00 -0.43 -0.09 0.00 0.00 0.00 0.00 46.02 45.50 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 0.00 0.76 0.12 1.61 -0.14 -1.25 -5.00 119.74 115.84 2em4 s LYS 20 Ca 0.00 -0.86 0.08 0.00 -1.36 0.00 0.00 55.97 53.83 2em4 s LYS 20 Cb 0.00 0.31 -0.04 0.00 -1.68 0.00 0.00 37.83 36.42 2em4 s LYS 20 CO 0.00 -0.22 -0.19 0.00 -0.76 0.00 0.00 175.35 174.18 2em4 s ALA 21 N -3.36 1.77 0.18 5.17 0.00 -1.26 -0.29 121.76 123.97 2em4 s ALA 21 Ca 0.01 -1.31 0.01 0.00 0.00 0.00 0.00 51.96 50.67 2em4 s ALA 21 Cb 0.03 -0.19 -0.05 0.00 0.00 0.00 0.00 23.12 22.91 2em4 s ALA 21 CO -0.08 0.27 0.03 -0.06 0.00 0.00 0.00 175.76 175.92 2em4 s PHE 22 N -1.59 1.22 -0.05 0.00 0.40 -0.70 -5.01 117.98 112.26 2em4 s PHE 22 Ca 0.09 -1.08 -0.24 0.00 -0.60 0.00 0.00 56.93 55.09 2em4 s PHE 22 Cb -0.08 -0.69 -0.19 0.00 0.51 0.00 0.00 43.02 42.57 2em4 s PHE 22 CO 0.05 -0.28 1.05 0.87 0.70 0.00 0.00 175.22 177.60 2em4 h LYS 23 N 2.66 -0.11 -4.78 0.44 1.79 -1.98 -3.36 116.57 111.23 2em4 h LYS 23 Ca -0.37 0.01 -0.27 0.00 -2.18 0.00 0.00 60.65 57.84 2em4 h LYS 23 Cb 1.21 0.02 -0.15 0.00 -1.58 0.00 0.00 32.23 31.74 2em4 h LYS 23 CO 0.62 0.40 -0.68 0.95 -1.08 0.00 0.00 179.45 179.67 2em4 s THR 24 N -3.71 0.71 0.14 -0.16 -4.23 -1.26 -4.74 115.64 102.40 2em4 s THR 24 Ca -0.15 -1.97 -0.26 0.00 -1.18 0.00 0.00 61.69 58.13 2em4 s THR 24 Cb 0.01 -1.99 -0.01 0.00 1.34 0.00 0.00 72.50 71.85 2em4 s THR 24 CO 0.59 -0.60 1.61 0.11 -0.54 0.00 0.00 174.62 175.79 2em4 h LYS 25 N 2.77 -0.36 -0.73 3.99 1.57 -1.98 -1.11 116.57 120.73 2em4 h LYS 25 Ca -0.36 0.02 0.27 0.00 -1.87 0.00 0.00 60.65 58.71 2em4 h LYS 25 Cb 1.19 0.08 -0.13 0.00 0.08 0.00 0.00 32.23 33.45 2em4 h LYS 25 CO 0.63 -0.24 0.25 0.43 -0.57 0.00 0.00 179.45 179.96 2em4 n SER 26 N -5.41 0.13 -0.02 0.86 7.64 -1.26 0.46 113.62 116.02 2em4 n SER 26 Ca -0.02 1.22 -0.10 0.00 1.01 0.00 0.00 58.87 60.97 2em4 n SER 26 Cb 0.33 -0.54 -0.08 0.00 -1.01 0.00 0.00 64.21 62.91 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 -0.06 0.20 6.43 0.02 -1.65 -3.23 113.55 115.26 2em4 h SER 27 Ca 0.55 -0.55 0.01 0.00 -0.84 0.00 0.00 61.79 60.96 2em4 h SER 27 Cb 1.37 0.02 -0.04 0.00 0.14 0.00 0.00 62.40 63.88 2em4 h SER 27 CO -0.61 0.66 -0.45 0.25 -1.14 0.00 0.00 176.83 175.54 2em4 h LEU 28 N -0.92 -1.31 -0.91 5.07 5.85 0.68 -2.48 115.31 121.28 2em4 h LEU 28 Ca -0.01 0.14 0.16 0.00 0.84 0.00 0.00 57.88 59.00 2em4 h LEU 28 Cb 0.61 0.48 -0.16 0.00 0.37 0.00 0.00 40.66 41.96 2em4 h LEU 28 CO 0.01 -0.53 -0.33 0.40 -0.34 0.00 0.00 178.44 177.64 2em4 h ILE 29 N -0.74 0.05 -0.95 4.05 2.04 -0.29 1.23 117.51 122.90 2em4 h ILE 29 Ca -0.00 0.00 0.24 0.00 1.00 0.00 0.00 64.86 66.10 2em4 h ILE 29 Cb 0.73 0.05 -0.07 0.00 -0.74 0.00 0.00 36.82 36.79 2em4 h ILE 29 CO -0.21 0.00 0.64 0.00 0.00 0.00 0.00 178.15 178.58 2em4 h HIS 31 N 0.30 0.00 0.21 0.00 -0.00 0.16 -3.08 115.15 112.74 2em4 h HIS 31 Ca 0.50 0.00 -0.27 0.00 -0.00 0.00 0.00 60.37 60.59 2em4 h HIS 31 Cb 1.42 0.00 0.03 0.00 -0.00 0.00 0.00 27.41 28.86 2em4 h HIS 31 CO -0.00 0.00 -1.20 0.00 -0.00 0.00 0.00 177.93 176.72 2em4 h ARG 32 N 0.00 0.44 -0.14 5.26 3.08 0.28 -3.28 114.38 120.02 2em4 h ARG 32 Ca 0.00 -0.74 -0.17 0.00 0.07 0.00 0.00 59.98 59.13 2em4 h ARG 32 Cb 0.88 0.28 -0.00 0.00 0.08 0.00 0.00 29.97 31.20 2em4 h ARG 32 CO 0.00 1.36 -0.63 0.07 -1.07 0.00 0.00 179.97 179.69 2em4 h ARG 33 N -0.08 0.51 -0.88 0.04 0.11 -1.18 -3.17 114.38 109.72 2em4 h ARG 33 Ca -0.21 -0.36 0.11 0.00 0.10 0.00 0.00 59.98 59.62 2em4 h ARG 33 Cb 1.94 0.06 -0.08 0.00 1.11 0.00 0.00 29.97 33.00 2em4 h ARG 33 CO 0.22 0.98 0.52 0.77 0.10 0.00 0.00 179.97 182.55 2em4 h SER 34 N 0.37 0.74 -1.00 0.08 0.02 -1.65 -1.92 113.55 110.19 2em4 h SER 34 Ca -0.01 0.05 0.31 0.00 -0.84 0.00 0.00 61.79 61.30 2em4 h SER 34 Cb 1.19 -0.09 -0.18 0.00 0.14 0.00 0.00 62.40 63.46 2em4 h SER 34 CO 0.12 0.40 0.14 1.41 -1.14 0.00 0.00 176.83 177.76 2em4 n HIS 35 N -4.72 0.75 -2.99 3.45 8.25 -1.20 -3.46 115.22 115.31 2em4 n HIS 35 Ca 0.15 1.20 -0.44 0.00 -0.26 0.00 0.00 57.72 58.37 2em4 n HIS 35 Cb 0.31 -1.32 -0.04 0.00 1.12 0.00 0.00 29.99 30.06 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 -5.89 4.59 0.00 1.59 -4.23 -0.72 -4.52 115.64 106.46 2em4 s THR 36 Ca -0.12 -0.57 0.00 0.00 -1.18 0.00 0.00 61.69 59.82 2em4 s THR 36 Cb 0.30 -4.55 0.00 0.00 1.34 0.00 0.00 72.50 69.60 2em4 s THR 36 CO 0.78 -1.22 0.00 0.61 -0.54 0.00 0.00 174.62 174.25 2em4 n GLY 37 N 5.27 0.40 3.55 3.99 0.00 -1.22 -5.01 105.19 112.17 2em4 n GLY 37 Ca -0.06 -0.06 -0.25 0.00 0.00 0.00 0.00 46.02 45.65 2em4 n GLY 37 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2em4 s GLU 38 N 0.00 1.85 -0.13 1.61 -6.30 -1.24 -4.86 118.70 109.63 2em4 s GLU 38 Ca 0.00 0.99 -0.21 0.00 -2.50 0.00 0.00 54.97 53.24 2em4 s GLU 38 Cb 0.00 -4.68 0.05 0.00 0.00 0.00 0.00 34.13 29.50 2em4 s GLU 38 CO 0.00 -3.84 0.53 -1.59 0.02 0.00 0.00 175.26 170.38 2em4 s LYS 39 N 8.58 0.75 -0.21 4.30 0.00 -1.26 -4.98 119.74 126.92 2em4 s LYS 39 Ca 0.95 0.44 -0.29 0.00 0.00 0.00 0.00 55.97 57.08 2em4 s LYS 39 Cb -0.15 0.36 -0.03 0.00 0.00 0.00 0.00 37.83 38.01 2em4 s LYS 39 CO 0.18 -0.16 1.60 -1.25 0.00 0.00 0.00 175.35 175.71 2em4 s PRO 40 N -0.41 3.85 -0.05 1.78 0.04 -1.26 -4.96 135.00 133.99 2em4 s PRO 40 Ca -0.05 1.69 -0.29 0.00 0.04 0.00 0.00 61.00 62.39 2em4 s PRO 40 Cb -0.03 -4.02 0.10 0.00 0.04 0.00 0.00 34.50 30.60 2em4 s PRO 40 CO 0.04 -1.23 0.89 0.45 0.04 0.00 0.00 177.00 177.18 2em4 s SER 41 N 4.03 -0.41 -0.69 6.66 0.15 -1.26 -5.11 113.70 117.07 2em4 s SER 41 Ca 0.70 0.19 0.03 0.00 0.70 0.00 0.00 55.95 57.57 2em4 s SER 41 Cb -0.25 0.39 0.17 0.00 -1.71 0.00 0.00 66.02 64.61 2em4 s SER 41 CO 0.28 -0.56 0.49 -0.83 1.20 0.00 0.00 173.24 173.83 2em4 s GLY 42 N -1.96 2.83 0.00 9.45 0.00 -1.26 -4.90 107.32 111.48 2em4 s GLY 42 Ca 0.01 -3.68 0.11 0.00 0.00 0.00 0.00 44.72 41.16 2em4 s GLY 42 CO -0.04 1.09 1.11 -1.55 0.00 0.00 0.00 173.10 173.70 2em4 n PRO 43 N 2.38 0.49 -0.80 2.90 -0.04 -1.26 -3.80 135.00 134.87 2em4 n PRO 43 Ca 0.16 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.53 2em4 n PRO 43 Cb 0.35 -1.36 -0.12 0.00 -0.04 0.00 0.00 33.50 32.33 2em4 n PRO 43 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2em4 n SER 44 N -0.86 4.70 -4.27 3.54 7.64 -1.26 -4.69 113.62 118.42 2em4 n SER 44 Ca 0.08 -2.35 -0.32 0.00 1.01 0.00 0.00 58.87 57.29 2em4 n SER 44 Cb 0.04 -1.22 -0.09 0.00 -1.01 0.00 0.00 64.21 61.93 2em4 n SER 44 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2em4 n SER 45 N 2.35 0.20 0.00 6.43 3.41 -1.26 -5.32 113.62 119.44 2em4 n SER 45 Ca 0.31 -1.20 0.00 0.00 -0.26 0.00 0.00 58.87 57.71 2em4 n SER 45 Cb 0.75 -1.51 0.00 0.00 -0.26 0.00 0.00 64.21 63.19 2em4 n SER 45 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49