#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2em5 s SER 2 N 0.00 6.54 -0.62 1.61 0.15 -1.26 -4.97 113.70 115.15 2em5 s SER 2 Ca 0.00 0.70 -0.28 0.00 0.70 0.00 0.00 55.95 57.07 2em5 s SER 2 Cb 0.00 -2.14 -0.12 0.00 -1.71 0.00 0.00 66.02 62.06 2em5 s SER 2 CO 0.00 0.04 2.48 -1.54 1.20 0.00 0.00 173.24 175.42 2em5 n SER 3 N 0.15 1.73 -4.26 5.45 3.41 -1.26 -4.90 113.62 113.94 2em5 n SER 3 Ca -0.02 -0.23 -0.17 0.00 -0.26 0.00 0.00 58.87 58.19 2em5 n SER 3 Cb 0.52 -1.37 -0.11 0.00 -0.26 0.00 0.00 64.21 63.00 2em5 n SER 3 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2em5 s GLY 4 N 10.85 1.13 0.06 5.00 0.00 -1.26 -5.06 107.32 118.04 2em5 s GLY 4 Ca 1.10 -1.41 -0.18 0.00 0.00 0.00 0.00 44.72 44.23 2em5 s GLY 4 CO 0.35 -1.48 1.32 1.48 0.00 0.00 0.00 173.10 174.76 2em5 h SER 5 N 3.15 0.56 -1.06 1.64 4.64 -2.07 -3.45 113.55 116.96 2em5 h SER 5 Ca -0.39 -0.54 -0.67 0.00 -0.47 0.00 0.00 61.79 59.73 2em5 h SER 5 Cb 1.20 -0.16 0.11 0.00 -0.31 0.00 0.00 62.40 63.24 2em5 h SER 5 CO 0.56 0.99 -0.48 -1.54 -0.87 0.00 0.00 176.83 175.49 2em5 n SER 6 N -4.37 -1.10 0.00 4.97 3.41 -1.26 -4.97 113.62 110.30 2em5 n SER 6 Ca -0.06 1.13 0.00 0.00 -0.26 0.00 0.00 58.87 59.68 2em5 n SER 6 Cb 0.47 -0.96 0.00 0.00 -0.26 0.00 0.00 64.21 63.46 2em5 n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2em5 n GLY 7 N 1.95 4.36 2.85 5.00 0.00 -1.26 -5.12 105.19 112.97 2em5 n GLY 7 Ca 0.18 -1.67 -0.30 0.00 0.00 0.00 0.00 46.02 44.23 2em5 n GLY 7 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2em5 s SER 8 N 0.50 3.95 0.23 1.61 0.15 -1.26 -5.11 113.70 113.78 2em5 s SER 8 Ca 0.00 -1.47 -0.10 0.00 0.70 0.00 0.00 55.95 55.08 2em5 s SER 8 Cb 0.00 -1.06 -0.01 0.00 -1.71 0.00 0.00 66.02 63.24 2em5 s SER 8 CO 0.00 -0.34 0.40 -0.94 1.20 0.00 0.00 173.24 173.57 2em5 s SER 9 N 1.45 -0.04 0.10 5.45 1.04 -1.26 -5.18 113.70 115.27 2em5 s SER 9 Ca 0.03 -1.00 0.06 0.00 0.48 0.00 0.00 55.95 55.52 2em5 s SER 9 Cb -0.18 0.54 -0.03 0.00 0.10 0.00 0.00 66.02 66.44 2em5 s SER 9 CO -0.14 -1.07 -0.15 0.28 0.98 0.00 0.00 173.24 173.14 2em5 s THR 10 N -4.04 1.32 0.15 2.02 -1.32 -1.26 -5.16 115.64 107.36 2em5 s THR 10 Ca 0.25 -1.57 0.07 0.00 -1.21 0.00 0.00 61.69 59.23 2em5 s THR 10 Cb 0.01 -1.40 -0.04 0.00 -1.51 0.00 0.00 72.50 69.56 2em5 s THR 10 CO 0.09 -0.31 -0.01 -0.75 -2.21 0.00 0.00 174.62 171.43 2em5 s LYS 11 N -2.28 2.41 -0.03 7.08 2.47 -1.26 -5.06 119.74 123.07 2em5 s LYS 11 Ca 0.05 -1.04 -0.21 0.00 -1.56 0.00 0.00 55.97 53.21 2em5 s LYS 11 Cb -0.07 -2.39 -0.15 0.00 -1.46 0.00 0.00 37.83 33.76 2em5 s LYS 11 CO 0.03 0.48 0.95 0.77 0.16 0.00 0.00 175.35 177.74 2em5 h SER 12 N 2.95 -0.31 -3.62 1.43 0.02 -1.86 -3.42 113.55 108.74 2em5 h SER 12 Ca -0.47 -0.21 -0.70 0.00 -0.84 0.00 0.00 61.79 59.56 2em5 h SER 12 Cb 1.19 0.08 -0.30 0.00 0.14 0.00 0.00 62.40 63.52 2em5 h SER 12 CO 0.58 0.15 -0.58 -1.00 -1.14 0.00 0.00 176.83 174.84 2em5 s HIS 13 N -3.84 3.31 -0.06 3.45 3.76 -1.24 -5.06 115.29 115.61 2em5 s HIS 13 Ca -0.12 -1.60 0.00 0.00 -0.15 0.00 0.00 55.06 53.19 2em5 s HIS 13 Cb 0.01 -2.49 -0.03 0.00 1.11 0.00 0.00 32.58 31.17 2em5 s HIS 13 CO 0.45 -0.79 -0.04 -1.14 -0.85 0.00 0.00 174.74 172.38 2em5 s GLN 14 N 1.36 2.82 0.81 1.40 0.74 -1.26 -2.26 119.66 123.27 2em5 s GLN 14 Ca -0.00 -0.52 -0.11 0.00 0.05 0.00 0.00 55.36 54.78 2em5 s GLN 14 Cb -0.21 -2.66 0.07 0.00 1.10 0.00 0.00 33.01 31.32 2em5 s GLN 14 CO 0.01 0.67 1.09 0.00 -0.55 0.00 0.00 175.29 176.51 2em5 n HIS 16 N -3.52 0.00 -0.10 0.00 -0.00 -1.26 -3.28 115.22 107.07 2em5 n HIS 16 Ca 0.07 0.00 -0.12 0.00 0.46 0.00 0.00 57.72 58.13 2em5 n HIS 16 Cb 0.55 -0.43 -0.04 0.00 -0.12 0.00 0.00 29.99 29.96 2em5 n HIS 16 CO 0.00 0.00 0.00 0.93 0.46 0.00 0.00 176.34 177.73 2em5 h GLU 17 N 0.00 0.57 0.00 1.57 4.39 -2.00 -3.40 114.58 115.71 2em5 h GLU 17 Ca -0.20 -0.24 -0.01 0.00 0.34 0.00 0.00 59.36 59.25 2em5 h GLU 17 Cb 1.34 -0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 29.97 2em5 h GLU 17 CO 0.01 0.80 -1.03 0.00 -1.16 0.00 0.00 179.01 177.63 2em5 n GLY 19 N 3.41 1.76 3.83 0.00 0.00 -1.20 -5.02 105.19 107.96 2em5 n GLY 19 Ca -0.01 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.72 2em5 n GLY 19 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2em5 s ARG 20 N -0.60 1.37 -0.08 1.61 0.52 -1.26 -4.63 118.95 115.88 2em5 s ARG 20 Ca 0.00 0.21 0.03 0.00 -0.52 0.00 0.00 55.73 55.45 2em5 s ARG 20 Cb 0.00 -1.87 0.00 0.00 0.52 0.00 0.00 34.95 33.60 2em5 s ARG 20 CO 0.00 -2.03 -0.19 0.20 0.02 0.00 0.00 175.30 173.30 2em5 s GLY 21 N -4.23 1.11 -0.06 -3.53 0.00 -1.26 -1.60 107.32 97.75 2em5 s GLY 21 Ca 0.64 -0.75 0.01 0.00 0.00 0.00 0.00 44.72 44.61 2em5 s GLY 21 CO 0.52 -0.18 -0.06 -1.36 0.00 0.00 0.00 173.10 172.02 2em5 s PHE 22 N 0.43 1.03 0.10 1.90 0.40 -0.96 -5.03 117.98 115.85 2em5 s PHE 22 Ca -0.16 -0.37 -0.32 0.00 -0.60 0.00 0.00 56.93 55.48 2em5 s PHE 22 Cb -0.17 -0.87 -0.14 0.00 0.51 0.00 0.00 43.02 42.35 2em5 s PHE 22 CO 0.07 -0.28 1.59 1.15 0.70 0.00 0.00 175.22 178.45 2em5 h THR 23 N 6.12 0.18 -3.60 0.64 2.02 -2.00 -3.28 112.91 112.99 2em5 h THR 23 Ca -0.33 0.00 -0.51 0.00 0.77 0.00 0.00 66.41 66.34 2em5 h THR 23 Cb 1.16 0.18 -0.03 0.00 -1.74 0.00 0.00 68.15 67.71 2em5 h THR 23 CO 0.44 0.00 0.05 -0.76 0.37 0.00 0.00 175.52 175.62 2em5 s LEU 24 N -10.19 4.18 0.15 2.58 1.43 -1.26 -4.66 118.68 110.91 2em5 s LEU 24 Ca -0.17 1.24 -0.14 0.00 -1.03 0.00 0.00 54.13 54.03 2em5 s LEU 24 Cb 0.06 -3.82 0.03 0.00 0.03 0.00 0.00 46.19 42.49 2em5 s LEU 24 CO 0.62 -0.10 1.70 0.50 0.23 0.00 0.00 176.35 179.31 2em5 h LYS 25 N 2.72 0.74 -0.76 1.70 1.63 -1.96 -2.65 116.57 117.98 2em5 h LYS 25 Ca -0.48 -0.14 0.06 0.00 -0.85 0.00 0.00 60.65 59.25 2em5 h LYS 25 Cb 1.18 -0.12 -0.05 0.00 -0.60 0.00 0.00 32.23 32.64 2em5 h LYS 25 CO 0.66 0.66 0.50 0.66 -3.45 0.00 0.00 179.45 178.48 2em5 h SER 26 N 0.66 0.73 0.09 4.20 4.64 -1.96 -2.36 113.55 119.55 2em5 h SER 26 Ca 0.16 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.51 2em5 h SER 26 Cb 0.20 -0.15 -0.04 0.00 -0.31 0.00 0.00 62.40 62.10 2em5 h SER 26 CO -0.01 0.47 -0.30 0.45 -0.87 0.00 0.00 176.83 176.57 2em5 h HIS 27 N 0.83 -0.82 -0.04 4.77 3.86 -1.85 -0.87 115.15 121.02 2em5 h HIS 27 Ca 0.33 0.02 0.01 0.00 -1.16 0.00 0.00 60.37 59.57 2em5 h HIS 27 Cb 0.22 0.35 -0.02 0.00 1.06 0.00 0.00 27.41 29.03 2em5 h HIS 27 CO -0.00 -0.40 -0.04 1.25 0.86 0.00 0.00 177.93 179.59 2em5 h LEU 28 N -0.51 -0.13 -0.34 2.43 5.85 -1.46 -1.30 115.31 119.86 2em5 h LEU 28 Ca 0.04 0.03 0.07 0.00 0.84 0.00 0.00 57.88 58.86 2em5 h LEU 28 Cb 0.55 0.07 -0.09 0.00 0.37 0.00 0.00 40.66 41.56 2em5 h LEU 28 CO -0.19 -0.06 -0.34 -1.13 -0.34 0.00 0.00 178.44 176.37 2em5 h ASN 29 N -0.06 -1.12 -0.53 1.25 -0.73 -1.15 0.12 115.58 113.36 2em5 h ASN 29 Ca 0.03 0.19 0.02 0.00 1.87 0.00 0.00 56.30 58.41 2em5 h ASN 29 Cb 0.10 0.51 -0.03 0.00 0.27 0.00 0.00 38.32 39.17 2em5 h ASN 29 CO -0.08 -0.34 0.35 1.56 -0.37 0.00 0.00 177.43 178.56 2em5 h GLN 30 N -0.30 0.62 -0.01 6.67 7.50 -0.97 -2.55 115.11 126.08 2em5 h GLN 30 Ca 0.15 -0.04 -0.00 0.00 0.50 0.00 0.00 58.65 59.26 2em5 h GLN 30 Cb 0.55 -0.14 -0.00 0.00 0.05 0.00 0.00 27.48 27.94 2em5 h GLN 30 CO -0.51 0.41 0.00 1.25 -1.50 0.00 0.00 178.83 178.49 2em5 h HIS 31 N 0.64 0.01 -0.79 2.96 -0.00 0.35 -2.44 115.15 115.89 2em5 h HIS 31 Ca 0.21 -0.00 0.23 0.00 -0.00 0.00 0.00 60.37 60.81 2em5 h HIS 31 Cb 0.05 -0.00 -0.03 0.00 -0.00 0.00 0.00 27.41 27.42 2em5 h HIS 31 CO -0.00 0.17 0.89 1.96 -0.00 0.00 0.00 177.93 180.95 2em5 h GLN 32 N -0.15 0.00 0.00 5.26 4.20 -0.57 0.25 115.11 124.10 2em5 h GLN 32 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2em5 h GLN 32 Cb 0.16 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.94 2em5 h GLN 32 CO -0.00 0.00 0.45 0.00 -0.67 0.00 0.00 178.83 178.61 2em5 h ARG 33 N 0.00 0.00 0.05 1.46 3.08 -1.47 0.84 114.38 118.34 2em5 h ARG 33 Ca 0.38 0.00 -0.24 0.00 0.07 0.00 0.00 59.98 60.18 2em5 h ARG 33 Cb 2.16 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 32.19 2em5 h ARG 33 CO -0.00 0.00 -1.16 -0.84 -1.07 0.00 0.00 179.97 176.90 2em5 h ILE 34 N 0.00 1.56 0.06 2.04 3.07 -0.72 0.51 117.51 124.03 2em5 h ILE 34 Ca 0.00 -3.23 -0.29 0.00 1.55 0.00 0.00 64.86 62.89 2em5 h ILE 34 Cb 0.91 2.85 -0.03 0.00 -0.27 0.00 0.00 36.82 40.28 2em5 h ILE 34 CO 0.00 0.91 -1.57 0.45 -1.05 0.00 0.00 178.15 176.90 2em5 h HIS 35 N 0.03 0.21 0.05 0.16 3.86 0.44 -3.39 115.15 116.52 2em5 h HIS 35 Ca -0.08 -0.16 -0.36 0.00 -1.16 0.00 0.00 60.37 58.61 2em5 h HIS 35 Cb 1.87 -0.01 -0.04 0.00 1.06 0.00 0.00 27.41 30.29 2em5 h HIS 35 CO 0.02 1.23 -2.10 -2.37 0.86 0.00 0.00 177.93 175.57 2em5 n THR 36 N -3.29 1.62 -1.20 2.45 5.66 -0.26 -5.07 114.28 114.19 2em5 n THR 36 Ca -0.16 -0.49 0.01 0.00 -3.05 0.00 0.00 64.05 60.36 2em5 n THR 36 Cb 1.03 -1.71 -0.00 0.00 -1.55 0.00 0.00 70.33 68.10 2em5 n THR 36 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2em5 n GLY 37 N 1.89 -0.28 3.40 1.09 0.00 0.18 -4.07 105.19 107.39 2em5 n GLY 37 Ca -0.39 -0.27 -0.45 0.00 0.00 0.00 0.00 46.02 44.91 2em5 n GLY 37 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2em5 s GLU 38 N -0.18 3.73 0.07 1.61 2.12 -1.26 -4.98 118.70 119.80 2em5 s GLU 38 Ca 0.00 -2.27 -0.07 0.00 0.36 0.00 0.00 54.97 52.99 2em5 s GLU 38 Cb 0.00 -4.72 -0.01 0.00 0.26 0.00 0.00 34.13 29.66 2em5 s GLU 38 CO 0.00 -1.54 0.15 0.15 -0.54 0.00 0.00 175.26 173.48 2em5 s LYS 39 N 1.23 0.77 0.00 4.30 1.02 -1.26 -5.02 119.74 120.78 2em5 s LYS 39 Ca 0.28 -0.93 0.08 0.00 0.02 0.00 0.00 55.97 55.42 2em5 s LYS 39 Cb -0.07 0.31 0.48 0.00 -0.52 0.00 0.00 37.83 38.03 2em5 s LYS 39 CO -0.08 -0.23 0.93 -0.35 -0.92 0.00 0.00 175.35 174.70 2em5 n PRO 40 N 0.13 0.49 -0.02 -1.68 -0.04 -1.26 -3.85 135.00 128.77 2em5 n PRO 40 Ca -0.16 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.19 2em5 n PRO 40 Cb 0.61 -1.26 -0.05 0.00 -0.04 0.00 0.00 33.50 32.77 2em5 n PRO 40 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 2em5 h SER 41 N 0.00 -1.22 0.00 3.54 0.02 -1.93 -3.21 113.55 110.75 2em5 h SER 41 Ca 0.00 0.17 0.00 0.00 -0.84 0.00 0.00 61.79 61.12 2em5 h SER 41 Cb 0.00 0.51 0.00 0.00 0.14 0.00 0.00 62.40 63.05 2em5 h SER 41 CO 0.00 -0.40 0.00 0.61 -1.14 0.00 0.00 176.83 175.90 2em5 n GLY 42 N -1.43 -2.94 3.67 -3.77 0.00 -1.25 -4.53 105.19 94.94 2em5 n GLY 42 Ca -0.03 0.23 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 2em5 n GLY 42 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2em5 s PRO 43 N -1.97 4.22 0.21 1.61 0.04 -1.21 -4.89 135.00 133.01 2em5 s PRO 43 Ca 0.00 2.02 -0.03 0.00 0.04 0.00 0.00 61.00 63.02 2em5 s PRO 43 Cb 0.00 -3.81 0.41 0.00 0.04 0.00 0.00 34.50 31.14 2em5 s PRO 43 CO 0.00 -0.74 1.13 0.45 0.04 0.00 0.00 177.00 177.88 2em5 n SER 44 N 6.48 -0.20 -4.01 6.66 2.88 -1.26 -4.26 113.62 119.90 2em5 n SER 44 Ca 0.15 1.23 -0.18 0.00 -1.33 0.00 0.00 58.87 58.75 2em5 n SER 44 Cb 0.43 -0.40 -0.14 0.00 -0.75 0.00 0.00 64.21 63.35 2em5 n SER 44 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2em5 s SER 45 N -5.12 0.97 0.00 -3.46 0.01 -1.26 -4.97 113.70 99.87 2em5 s SER 45 Ca -0.10 -0.18 0.00 0.00 1.31 0.00 0.00 55.95 56.98 2em5 s SER 45 Cb 0.20 -0.10 0.00 0.00 0.21 0.00 0.00 66.02 66.33 2em5 s SER 45 CO 0.56 0.08 0.00 0.61 0.41 0.00 0.00 173.24 174.90