#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 -2.21 -4.53 1.61 7.64 -1.26 -4.69 113.62 110.18 2em4 n SER 2 Ca 0.00 -1.09 -0.38 0.00 1.01 0.00 0.00 58.87 58.41 2em4 n SER 2 Cb 0.00 -2.45 -0.08 0.00 -1.01 0.00 0.00 64.21 60.67 2em4 n SER 2 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2em4 n SER 3 N -2.68 1.48 -2.68 6.43 2.88 -1.26 -4.63 113.62 113.17 2em4 n SER 3 Ca -0.00 -0.21 -0.02 0.00 -1.33 0.00 0.00 58.87 57.31 2em4 n SER 3 Cb 0.53 -1.31 0.13 0.00 -0.75 0.00 0.00 64.21 62.81 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 6.22 2.04 3.57 0.46 0.00 -1.26 -5.13 105.19 111.08 2em4 n GLY 4 Ca 0.49 -0.21 -0.32 0.00 0.00 0.00 0.00 46.02 45.98 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 -1.25 4.45 -0.21 1.61 0.15 -1.26 -5.04 113.70 112.15 2em4 s SER 5 Ca 0.10 -0.21 -0.15 0.00 0.70 0.00 0.00 55.95 56.39 2em4 s SER 5 Cb 0.44 -0.97 -0.08 0.00 -1.71 0.00 0.00 66.02 63.70 2em4 s SER 5 CO -0.13 0.27 -0.33 -1.20 1.20 0.00 0.00 173.24 173.06 2em4 n SER 6 N 1.51 1.84 -0.60 5.45 7.64 -1.26 -5.11 113.62 123.08 2em4 n SER 6 Ca -0.15 0.31 0.00 0.00 1.01 0.00 0.00 58.87 60.04 2em4 n SER 6 Cb 0.52 -0.73 0.00 0.00 -1.01 0.00 0.00 64.21 62.99 2em4 n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2em4 n GLY 7 N 1.50 -1.14 3.76 0.23 0.00 -1.26 -5.04 105.19 103.24 2em4 n GLY 7 Ca -0.32 -0.61 -0.40 0.00 0.00 0.00 0.00 46.02 44.69 2em4 n GLY 7 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2em4 s THR 8 N 0.00 3.35 0.00 2.61 2.01 -1.26 -4.72 115.64 117.63 2em4 s THR 8 Ca 0.00 1.29 0.00 0.00 0.31 0.00 0.00 61.69 63.29 2em4 s THR 8 Cb 0.00 -3.80 0.00 0.00 0.01 0.00 0.00 72.50 68.71 2em4 s THR 8 CO 0.00 0.26 0.00 0.61 -0.69 0.00 0.00 174.62 174.80 2em4 n GLY 9 N 0.97 -1.00 3.62 4.40 0.00 -1.26 -5.12 105.19 106.80 2em4 n GLY 9 Ca 0.00 -0.67 -0.24 0.00 0.00 0.00 0.00 46.02 45.11 2em4 n GLY 9 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2em4 s GLN 10 N -0.46 2.07 0.17 1.61 1.03 -1.26 -5.15 119.66 117.67 2em4 s GLN 10 Ca 0.00 -1.69 0.11 0.00 0.04 0.00 0.00 55.36 53.82 2em4 s GLN 10 Cb 0.00 -1.95 -0.04 0.00 0.03 0.00 0.00 33.01 31.04 2em4 s GLN 10 CO 0.00 0.20 -0.22 1.03 -2.54 0.00 0.00 175.29 173.75 2em4 s ARG 11 N -3.69 1.58 0.27 9.60 3.00 -1.26 -5.02 118.95 123.44 2em4 s ARG 11 Ca 0.34 -1.42 0.24 0.00 0.00 0.00 0.00 55.73 54.89 2em4 s ARG 11 Cb -0.02 -1.92 1.01 0.00 0.00 0.00 0.00 34.95 34.02 2em4 s ARG 11 CO 0.19 0.42 1.72 -0.35 0.00 0.00 0.00 175.30 177.29 2em4 n PRO 12 N 0.45 0.20 -3.84 3.54 -0.04 -1.26 -4.53 135.00 129.52 2em4 n PRO 12 Ca -0.14 0.44 -0.36 0.00 -0.04 0.00 0.00 63.50 63.40 2em4 n PRO 12 Cb 0.55 -1.89 -0.13 0.00 -0.04 0.00 0.00 33.50 31.98 2em4 n PRO 12 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2em4 s TYR 13 N -3.34 3.10 0.06 0.54 2.02 -1.26 -5.08 117.35 113.39 2em4 s TYR 13 Ca 0.04 -1.12 0.01 0.00 -0.37 0.00 0.00 57.07 55.62 2em4 s TYR 13 Cb 0.09 -2.18 -0.03 0.00 -0.40 0.00 0.00 41.96 39.44 2em4 s TYR 13 CO 0.39 -0.61 -0.05 -1.21 -1.57 0.00 0.00 175.55 172.50 2em4 s GLU 14 N 1.45 0.62 -0.18 -0.62 2.02 -1.26 -1.27 118.70 119.46 2em4 s GLU 14 Ca 0.02 -1.07 0.00 0.00 0.02 0.00 0.00 54.97 53.95 2em4 s GLU 14 Cb -0.17 -0.05 0.02 0.00 0.10 0.00 0.00 34.13 34.03 2em4 s GLU 14 CO -0.00 -0.04 -0.18 0.00 0.02 0.00 0.00 175.26 175.06 2em4 h ILE 16 N 5.91 1.49 -1.04 0.00 5.03 -1.95 1.13 117.51 128.09 2em4 h ILE 16 Ca -0.45 -2.74 0.37 0.00 -0.12 0.00 0.00 64.86 61.91 2em4 h ILE 16 Cb 1.14 2.60 -0.16 0.00 -3.03 0.00 0.00 36.82 37.38 2em4 h ILE 16 CO 0.63 0.80 0.60 -0.33 -0.68 0.00 0.00 178.15 179.17 2em4 h GLU 17 N 0.12 0.18 0.00 2.37 5.08 -1.97 -3.27 114.58 117.09 2em4 h GLU 17 Ca -0.07 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 2em4 h GLU 17 Cb 1.66 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.87 2em4 h GLU 17 CO 0.16 0.12 -0.56 0.00 -1.00 0.00 0.00 179.01 177.73 2em4 n GLY 19 N 2.63 1.45 3.81 0.00 0.00 0.39 -5.08 105.19 108.37 2em4 n GLY 19 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.23 2.98 0.18 1.61 -0.14 -1.01 -4.85 119.74 118.28 2em4 s LYS 20 Ca 0.00 -0.69 0.07 0.00 -1.36 0.00 0.00 55.97 54.00 2em4 s LYS 20 Cb 0.00 -2.76 -0.04 0.00 -1.68 0.00 0.00 37.83 33.35 2em4 s LYS 20 CO 0.00 0.55 -0.00 0.00 -0.76 0.00 0.00 175.35 175.14 2em4 s ALA 21 N -1.49 3.19 -0.02 5.17 0.00 -1.26 0.06 121.76 127.41 2em4 s ALA 21 Ca 0.31 -1.39 -0.01 0.00 0.00 0.00 0.00 51.96 50.87 2em4 s ALA 21 Cb -0.12 -0.97 0.02 0.00 0.00 0.00 0.00 23.12 22.05 2em4 s ALA 21 CO 0.23 0.47 0.04 -0.06 0.00 0.00 0.00 175.76 176.44 2em4 s PHE 22 N -1.76 -0.01 0.22 0.00 0.40 -0.39 -4.99 117.98 111.44 2em4 s PHE 22 Ca 0.28 0.14 0.28 0.00 -0.60 0.00 0.00 56.93 57.02 2em4 s PHE 22 Cb -0.09 -0.14 1.22 0.00 0.51 0.00 0.00 43.02 44.52 2em4 s PHE 22 CO 0.19 -0.07 1.95 1.57 0.70 0.00 0.00 175.22 179.55 2em4 h LYS 23 N 6.90 0.00 -4.32 0.44 2.10 -1.99 -3.35 116.57 116.34 2em4 h LYS 23 Ca -0.38 0.00 -0.46 0.00 -2.00 0.00 0.00 60.65 57.81 2em4 h LYS 23 Cb 1.15 0.00 -0.33 0.00 -0.90 0.00 0.00 32.23 32.15 2em4 h LYS 23 CO 0.48 0.14 -0.79 0.95 -2.00 0.00 0.00 179.45 178.23 2em4 s THR 24 N -3.81 0.84 0.14 0.07 -4.23 -1.26 -4.96 115.64 102.43 2em4 s THR 24 Ca -0.00 -0.31 -0.18 0.00 -1.18 0.00 0.00 61.69 60.01 2em4 s THR 24 Cb 0.11 -0.79 -0.03 0.00 1.34 0.00 0.00 72.50 73.13 2em4 s THR 24 CO 0.59 0.29 1.76 0.50 -0.54 0.00 0.00 174.62 177.22 2em4 h LYS 25 N 6.99 0.25 -1.18 3.99 3.64 -1.97 -2.15 116.57 126.14 2em4 h LYS 25 Ca -0.34 -0.02 0.44 0.00 -1.27 0.00 0.00 60.65 59.46 2em4 h LYS 25 Cb 1.17 -0.06 -0.16 0.00 -0.41 0.00 0.00 32.23 32.78 2em4 h LYS 25 CO 0.48 0.17 0.71 1.03 -2.27 0.00 0.00 179.45 179.56 2em4 h SER 26 N 0.26 0.28 0.09 4.20 0.87 -1.98 0.68 113.55 117.95 2em4 h SER 26 Ca 0.11 0.20 -0.17 0.00 -1.23 0.00 0.00 61.79 60.70 2em4 h SER 26 Cb 0.05 0.20 0.02 0.00 -0.44 0.00 0.00 62.40 62.23 2em4 h SER 26 CO -0.09 -0.32 -0.73 0.28 -0.53 0.00 0.00 176.83 175.43 2em4 h SER 27 N 0.04 0.49 -0.30 6.23 0.02 -1.83 -3.24 113.55 114.94 2em4 h SER 27 Ca 0.85 -0.88 0.06 0.00 -0.84 0.00 0.00 61.79 60.98 2em4 h SER 27 Cb 2.46 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 64.84 2em4 h SER 27 CO -0.61 1.33 0.21 0.25 -1.14 0.00 0.00 176.83 176.87 2em4 h LEU 28 N -0.28 0.11 -0.02 5.07 5.85 0.58 -2.14 115.31 124.47 2em4 h LEU 28 Ca -0.12 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.60 2em4 h LEU 28 Cb 1.52 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 42.52 2em4 h LEU 28 CO 0.14 0.07 0.00 0.40 -0.34 0.00 0.00 178.44 178.71 2em4 h ILE 29 N 0.13 1.23 0.00 4.05 2.04 -0.79 0.42 117.51 124.60 2em4 h ILE 29 Ca 0.14 -0.69 0.00 0.00 1.00 0.00 0.00 64.86 65.31 2em4 h ILE 29 Cb 0.39 1.65 0.00 0.00 -0.74 0.00 0.00 36.82 38.12 2em4 h ILE 29 CO -0.02 0.18 0.00 0.00 0.00 0.00 0.00 178.15 178.32 2em4 n HIS 31 N -2.77 0.08 -0.20 0.00 -0.00 -0.94 -3.25 115.22 108.14 2em4 n HIS 31 Ca -0.01 0.03 0.29 0.00 -0.00 0.00 0.00 57.72 58.03 2em4 n HIS 31 Cb 0.14 -0.22 0.53 0.00 -0.00 0.00 0.00 29.99 30.44 2em4 n HIS 31 CO 0.00 0.00 0.00 0.07 -0.00 0.00 0.00 176.34 176.41 2em4 h ARG 32 N -0.14 0.00 0.19 1.57 0.11 -0.22 1.21 114.38 117.10 2em4 h ARG 32 Ca 0.00 0.00 -0.35 0.00 0.10 0.00 0.00 59.98 59.73 2em4 h ARG 32 Cb 0.10 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.19 2em4 h ARG 32 CO 0.00 0.00 -1.74 0.07 0.10 0.00 0.00 179.97 178.40 2em4 h ARG 33 N 0.00 0.41 -0.65 0.08 0.11 -1.63 -3.32 114.38 109.38 2em4 h ARG 33 Ca 0.47 -0.69 0.19 0.00 0.10 0.00 0.00 59.98 60.05 2em4 h ARG 33 Cb 2.65 0.26 -0.03 0.00 1.11 0.00 0.00 29.97 33.96 2em4 h ARG 33 CO -0.00 1.33 0.58 0.77 0.10 0.00 0.00 179.97 182.75 2em4 h SER 34 N 0.11 0.00 -0.94 0.08 0.02 0.15 -1.15 113.55 111.82 2em4 h SER 34 Ca -0.34 0.00 0.28 0.00 -0.84 0.00 0.00 61.79 60.89 2em4 h SER 34 Cb 2.11 0.00 -0.15 0.00 0.14 0.00 0.00 62.40 64.50 2em4 h SER 34 CO 0.18 0.00 0.37 0.45 -1.14 0.00 0.00 176.83 176.70 2em4 h HIS 35 N 0.00 0.58 -1.09 3.45 3.86 -1.61 -3.40 115.15 116.94 2em4 h HIS 35 Ca 0.31 0.05 -0.80 0.00 -1.16 0.00 0.00 60.37 58.76 2em4 h HIS 35 Cb 1.47 -0.10 0.00 0.00 1.06 0.00 0.00 27.41 29.84 2em4 h HIS 35 CO 0.00 -0.23 0.89 0.25 0.86 0.00 0.00 177.93 179.70 2em4 n THR 36 N -5.18 0.13 0.00 2.45 -2.24 -0.44 -4.71 114.28 104.29 2em4 n THR 36 Ca 0.27 -0.04 0.00 0.00 -2.27 0.00 0.00 64.05 62.01 2em4 n THR 36 Cb 0.85 -0.84 0.00 0.00 -2.10 0.00 0.00 70.33 68.24 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 4.64 1.41 3.12 3.38 0.00 -1.26 -5.14 105.19 111.34 2em4 n GLY 37 Ca 0.33 0.28 -0.25 0.00 0.00 0.00 0.00 46.02 46.38 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 3.66 1.51 0.29 1.61 2.12 -1.26 -5.14 118.70 121.48 2em4 s GLU 38 Ca 0.00 -0.56 -0.22 0.00 0.36 0.00 0.00 54.97 54.55 2em4 s GLU 38 Cb 0.00 -1.37 -0.09 0.00 0.26 0.00 0.00 34.13 32.93 2em4 s GLU 38 CO 0.00 0.27 0.83 0.15 -0.54 0.00 0.00 175.26 175.97 2em4 s LYS 39 N -0.09 4.36 -0.37 4.30 1.02 -1.26 -4.99 119.74 122.71 2em4 s LYS 39 Ca -0.00 1.06 -0.28 0.00 0.02 0.00 0.00 55.97 56.77 2em4 s LYS 39 Cb -0.09 -2.75 -0.01 0.00 -0.52 0.00 0.00 37.83 34.46 2em4 s LYS 39 CO 0.01 0.29 1.71 -1.25 -0.92 0.00 0.00 175.35 175.19 2em4 s PRO 40 N -2.19 3.35 -0.16 -1.68 0.04 -1.26 -4.86 135.00 128.23 2em4 s PRO 40 Ca 0.48 1.26 -0.14 0.00 0.04 0.00 0.00 61.00 62.64 2em4 s PRO 40 Cb -0.16 -4.17 -0.23 0.00 0.04 0.00 0.00 34.50 29.98 2em4 s PRO 40 CO 0.21 -1.84 0.29 -1.13 0.04 0.00 0.00 177.00 174.56 2em4 n SER 41 N 10.08 1.99 0.00 6.66 3.41 -1.26 -5.11 113.62 129.40 2em4 n SER 41 Ca 0.21 0.32 0.00 0.00 -0.26 0.00 0.00 58.87 59.14 2em4 n SER 41 Cb 0.47 -0.92 0.00 0.00 -0.26 0.00 0.00 64.21 63.50 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 1.70 -0.62 3.62 5.00 0.00 -1.26 -4.90 105.19 108.73 2em4 n GLY 42 Ca -0.32 -1.44 -0.43 0.00 0.00 0.00 0.00 46.02 43.83 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 -4.60 3.65 -0.01 1.61 0.04 -1.26 -4.99 135.00 129.44 2em4 s PRO 43 Ca 0.00 1.53 0.01 0.00 0.04 0.00 0.00 61.00 62.58 2em4 s PRO 43 Cb 0.00 -4.08 0.01 0.00 0.04 0.00 0.00 34.50 30.47 2em4 s PRO 43 CO 0.00 -1.47 -0.03 -1.12 0.04 0.00 0.00 177.00 174.41 2em4 s SER 44 N 4.71 0.51 0.10 6.66 0.01 -1.26 -5.16 113.70 119.26 2em4 s SER 44 Ca 0.73 -0.07 0.04 0.00 1.31 0.00 0.00 55.95 57.96 2em4 s SER 44 Cb -0.23 -0.12 -0.03 0.00 0.21 0.00 0.00 66.02 65.84 2em4 s SER 44 CO 0.31 0.01 -0.12 -0.44 0.41 0.00 0.00 173.24 173.41 2em4 s SER 45 N 0.23 1.60 0.00 2.44 0.01 -1.26 -5.28 113.70 111.43 2em4 s SER 45 Ca -0.02 -0.77 0.00 0.00 1.31 0.00 0.00 55.95 56.47 2em4 s SER 45 Cb -0.05 -0.02 0.00 0.00 0.21 0.00 0.00 66.02 66.16 2em4 s SER 45 CO -0.00 -0.20 0.29 0.61 0.41 0.00 0.00 173.24 174.34