#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2em5 h SER 2 N 0.00 0.59 -3.64 1.61 4.64 -2.12 -3.43 113.55 111.20 2em5 h SER 2 Ca 0.00 -0.00 -0.47 0.00 -0.47 0.00 0.00 61.79 60.85 2em5 h SER 2 Cb 0.00 -0.13 0.21 0.00 -0.31 0.00 0.00 62.40 62.17 2em5 h SER 2 CO 0.00 0.42 0.09 -0.44 -0.87 0.00 0.00 176.83 176.02 2em5 s SER 3 N -5.66 1.65 0.00 4.97 0.01 -1.26 -4.99 113.70 108.42 2em5 s SER 3 Ca -0.13 1.81 0.00 0.00 1.31 0.00 0.00 55.95 58.94 2em5 s SER 3 Cb 0.13 -2.43 0.00 0.00 0.21 0.00 0.00 66.02 63.93 2em5 s SER 3 CO 0.75 -3.83 0.00 0.61 0.41 0.00 0.00 173.24 171.17 2em5 n GLY 4 N 0.65 1.19 3.99 3.44 0.00 -1.26 -5.17 105.19 108.03 2em5 n GLY 4 Ca 0.06 0.38 -0.23 0.00 0.00 0.00 0.00 46.02 46.24 2em5 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2em5 s SER 5 N 2.00 4.66 -1.05 1.61 1.04 -1.26 -5.00 113.70 115.70 2em5 s SER 5 Ca 0.00 -0.28 -0.21 0.00 0.48 0.00 0.00 55.95 55.94 2em5 s SER 5 Cb 0.00 -0.26 0.07 0.00 0.10 0.00 0.00 66.02 65.94 2em5 s SER 5 CO 0.00 -1.62 1.43 -0.55 0.98 0.00 0.00 173.24 173.48 2em5 s SER 6 N -4.64 6.60 0.84 7.02 0.15 -1.26 -4.91 113.70 117.50 2em5 s SER 6 Ca 0.63 -1.78 0.00 0.00 0.70 0.00 0.00 55.95 55.50 2em5 s SER 6 Cb -0.07 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.71 2em5 s SER 6 CO 0.42 -1.34 0.00 0.61 1.20 0.00 0.00 173.24 174.13 2em5 n GLY 7 N 6.27 0.77 3.69 9.45 0.00 -1.26 -4.49 105.19 119.63 2em5 n GLY 7 Ca 0.34 -0.71 -0.24 0.00 0.00 0.00 0.00 46.02 45.40 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 -4.00 4.36 -1.70 1.61 0.15 -1.26 -4.67 113.70 108.19 2em5 s SER 8 Ca 0.00 -1.00 -0.19 0.00 0.70 0.00 0.00 55.95 55.46 2em5 s SER 8 Cb 0.00 -0.54 0.19 0.00 -1.71 0.00 0.00 66.02 63.95 2em5 s SER 8 CO 0.00 -0.38 0.47 -1.54 1.20 0.00 0.00 173.24 172.99 2em5 n SER 9 N -1.11 -1.28 -0.33 5.45 3.41 -1.26 -4.74 113.62 113.76 2em5 n SER 9 Ca -0.03 -1.16 0.03 0.00 -0.26 0.00 0.00 58.87 57.45 2em5 n SER 9 Cb 0.63 -1.48 0.09 0.00 -0.26 0.00 0.00 64.21 63.19 2em5 n SER 9 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 2em5 n THR 10 N -3.88 -0.41 -4.38 6.66 -1.04 -1.26 -4.56 114.28 105.42 2em5 n THR 10 Ca 0.05 2.05 -0.19 0.00 -2.04 0.00 0.00 64.05 63.92 2em5 n THR 10 Cb 0.45 -2.79 -0.10 0.00 -1.82 0.00 0.00 70.33 66.07 2em5 n THR 10 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 2em5 s LYS 11 N -6.01 1.44 0.21 -2.82 2.20 -1.26 -5.03 119.74 108.47 2em5 s LYS 11 Ca -0.13 -1.74 -0.04 0.00 -0.36 0.00 0.00 55.97 53.70 2em5 s LYS 11 Cb 0.22 -0.83 0.39 0.00 -1.51 0.00 0.00 37.83 36.10 2em5 s LYS 11 CO 0.67 -0.06 1.16 -1.13 -0.36 0.00 0.00 175.35 175.63 2em5 n SER 12 N -0.50 -0.23 -3.85 1.43 3.41 -1.26 -3.75 113.62 108.87 2em5 n SER 12 Ca -0.05 1.27 -0.28 0.00 -0.26 0.00 0.00 58.87 59.55 2em5 n SER 12 Cb 0.64 -0.40 -0.16 0.00 -0.26 0.00 0.00 64.21 64.02 2em5 n SER 12 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 2em5 s HIS 13 N -5.87 1.53 0.04 7.33 3.76 -1.20 -5.05 115.29 115.83 2em5 s HIS 13 Ca -0.11 -1.00 0.04 0.00 -0.15 0.00 0.00 55.06 53.85 2em5 s HIS 13 Cb 0.20 -1.23 -0.04 0.00 1.11 0.00 0.00 32.58 32.63 2em5 s HIS 13 CO 0.58 -0.60 -0.05 -1.14 -0.85 0.00 0.00 174.74 172.68 2em5 s GLN 14 N 1.69 2.50 0.76 1.40 0.74 -1.25 -1.19 119.66 124.31 2em5 s GLN 14 Ca 0.00 -0.79 -0.11 0.00 0.05 0.00 0.00 55.36 54.51 2em5 s GLN 14 Cb -0.15 -2.49 0.05 0.00 1.10 0.00 0.00 33.01 31.51 2em5 s GLN 14 CO -0.07 0.57 1.08 0.00 -0.55 0.00 0.00 175.29 176.32 2em5 n HIS 16 N -3.37 0.00 0.00 0.00 -0.00 -1.26 -3.35 115.22 107.24 2em5 n HIS 16 Ca 0.07 0.00 -0.17 0.00 -0.00 0.00 0.00 57.72 57.62 2em5 n HIS 16 Cb 0.55 -0.23 -0.11 0.00 -0.00 0.00 0.00 29.99 30.20 2em5 n HIS 16 CO 0.00 0.00 0.00 0.93 -0.00 0.00 0.00 176.34 177.27 2em5 h GLU 17 N 0.00 0.39 0.00 -0.41 4.39 -1.99 -3.41 114.58 113.55 2em5 h GLU 17 Ca -0.03 -0.42 -0.09 0.00 0.34 0.00 0.00 59.36 59.16 2em5 h GLU 17 Cb 0.54 0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 29.29 2em5 h GLU 17 CO 0.00 1.09 -1.35 0.00 -1.16 0.00 0.00 179.01 177.58 2em5 n GLY 19 N 3.12 1.66 3.85 0.00 0.00 -1.21 -4.99 105.19 107.62 2em5 n GLY 19 Ca -0.11 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.62 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 -0.43 0.95 0.04 1.61 0.52 -1.26 -4.61 118.95 115.77 2em5 s ARG 20 Ca 0.00 -0.04 0.05 0.00 -0.52 0.00 0.00 55.73 55.22 2em5 s ARG 20 Cb 0.00 -1.85 -0.02 0.00 0.52 0.00 0.00 34.95 33.60 2em5 s ARG 20 CO 0.00 -2.27 -0.14 0.20 0.02 0.00 0.00 175.30 173.12 2em5 s GLY 21 N -4.46 0.77 -0.09 -3.53 0.00 -1.26 0.08 107.32 98.83 2em5 s GLY 21 Ca 0.67 -0.81 -0.04 0.00 0.00 0.00 0.00 44.72 44.54 2em5 s GLY 21 CO 0.52 -0.79 0.19 -1.36 0.00 0.00 0.00 173.10 171.66 2em5 s PHE 22 N -0.86 -0.24 0.12 1.90 0.40 -0.34 -5.00 117.98 113.97 2em5 s PHE 22 Ca 0.01 0.67 -0.25 0.00 -0.60 0.00 0.00 56.93 56.76 2em5 s PHE 22 Cb -0.08 -0.12 -0.05 0.00 0.51 0.00 0.00 43.02 43.28 2em5 s PHE 22 CO 0.01 -0.25 1.64 1.79 0.70 0.00 0.00 175.22 179.11 2em5 h THR 23 N 6.19 0.45 -3.39 0.64 1.35 -1.96 -3.17 112.91 113.03 2em5 h THR 23 Ca -0.27 0.00 -0.55 0.00 -0.55 0.00 0.00 66.41 65.05 2em5 h THR 23 Cb 1.13 0.45 -0.04 0.00 -1.73 0.00 0.00 68.15 67.96 2em5 h THR 23 CO 0.26 0.00 0.08 -0.76 -0.25 0.00 0.00 175.52 174.85 2em5 s LEU 24 N -10.36 4.56 0.34 3.87 1.02 -1.26 -4.63 118.68 112.23 2em5 s LEU 24 Ca -0.15 1.46 0.05 0.00 0.02 0.00 0.00 54.13 55.51 2em5 s LEU 24 Cb 0.09 -3.11 0.62 0.00 0.02 0.00 0.00 46.19 43.81 2em5 s LEU 24 CO 0.66 0.23 1.88 0.50 0.02 0.00 0.00 176.35 179.64 2em5 h LYS 25 N 4.47 0.51 -0.68 1.70 1.63 -1.96 -2.58 116.57 119.65 2em5 h LYS 25 Ca -0.48 -0.11 -0.06 0.00 -0.85 0.00 0.00 60.65 59.16 2em5 h LYS 25 Cb 1.21 -0.07 -0.03 0.00 -0.60 0.00 0.00 32.23 32.73 2em5 h LYS 25 CO 0.65 0.54 0.21 0.66 -3.45 0.00 0.00 179.45 178.06 2em5 h SER 26 N 0.49 0.98 0.34 4.20 4.64 -1.95 -2.79 113.55 119.46 2em5 h SER 26 Ca 0.11 -0.18 -0.01 0.00 -0.47 0.00 0.00 61.79 61.24 2em5 h SER 26 Cb 0.33 -0.26 -0.02 0.00 -0.31 0.00 0.00 62.40 62.14 2em5 h SER 26 CO 0.01 0.92 -0.36 0.45 -0.87 0.00 0.00 176.83 176.98 2em5 h HIS 27 N 1.01 -1.00 -0.18 4.77 3.86 -1.84 -2.64 115.15 119.13 2em5 h HIS 27 Ca 0.22 0.01 0.03 0.00 -1.16 0.00 0.00 60.37 59.48 2em5 h HIS 27 Cb 0.29 0.39 -0.07 0.00 1.06 0.00 0.00 27.41 29.09 2em5 h HIS 27 CO 0.02 -0.47 -0.54 1.25 0.86 0.00 0.00 177.93 179.05 2em5 h LEU 28 N -0.70 -1.72 -0.78 2.43 5.85 -1.55 -0.85 115.31 117.99 2em5 h LEU 28 Ca -0.04 0.21 0.10 0.00 0.84 0.00 0.00 57.88 58.99 2em5 h LEU 28 Cb 0.61 0.68 -0.11 0.00 0.37 0.00 0.00 40.66 42.21 2em5 h LEU 28 CO -0.05 -0.47 -0.37 -3.20 -0.34 0.00 0.00 178.44 174.01 2em5 n ASN 29 N -5.43 -0.63 -0.19 1.25 2.85 -1.06 0.20 115.26 112.26 2em5 n ASN 29 Ca -0.05 1.37 -0.02 0.00 -0.11 0.00 0.00 54.58 55.77 2em5 n ASN 29 Cb 0.37 -0.26 0.20 0.00 1.24 0.00 0.00 39.78 41.33 2em5 n ASN 29 CO 0.00 0.00 0.00 -0.61 -2.11 0.00 0.00 177.26 174.54 2em5 h GLN 30 N 0.00 0.95 -0.35 1.20 4.15 -0.99 -2.76 115.11 117.30 2em5 h GLN 30 Ca 0.21 -0.13 -0.01 0.00 0.77 0.00 0.00 58.65 59.49 2em5 h GLN 30 Cb 0.41 -0.18 -0.02 0.00 0.21 0.00 0.00 27.48 27.91 2em5 h GLN 30 CO -0.76 0.74 0.18 1.25 -1.93 0.00 0.00 178.83 178.31 2em5 h HIS 31 N 0.94 0.51 0.00 3.99 2.76 0.37 -1.95 115.15 121.77 2em5 h HIS 31 Ca 0.23 -0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.38 2em5 h HIS 31 Cb 0.11 -0.16 0.00 0.00 1.55 0.00 0.00 27.41 28.91 2em5 h HIS 31 CO 0.01 0.43 0.51 1.96 -1.30 0.00 0.00 177.93 179.54 2em5 h GLN 32 N 0.44 0.00 -0.37 5.26 4.20 -0.14 0.23 115.11 124.74 2em5 h GLN 32 Ca 0.12 0.00 0.04 0.00 0.06 0.00 0.00 58.65 58.87 2em5 h GLN 32 Cb 0.10 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.87 2em5 h GLN 32 CO -0.02 0.00 0.25 0.00 -0.67 0.00 0.00 178.83 178.39 2em5 h ARG 33 N 0.00 0.32 0.00 1.46 3.08 -1.41 0.62 114.38 118.45 2em5 h ARG 33 Ca 0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.03 2em5 h ARG 33 Cb 1.03 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 31.00 2em5 h ARG 33 CO 0.00 0.21 0.00 0.44 -1.07 0.00 0.00 179.97 179.55 2em5 n ILE 34 N -4.48 1.72 -0.04 2.04 -5.35 0.82 -1.90 119.36 112.17 2em5 n ILE 34 Ca 0.04 0.43 -0.03 0.00 -0.27 0.00 0.00 62.75 62.92 2em5 n ILE 34 Cb 0.19 -1.37 -0.06 0.00 -1.74 0.00 0.00 39.64 36.67 2em5 n ILE 34 CO 0.00 0.00 0.00 1.41 -1.76 0.00 0.00 176.55 176.20 2em5 n HIS 35 N -1.49 0.00 -1.68 4.28 8.25 0.14 -5.00 115.22 119.72 2em5 n HIS 35 Ca 0.01 0.00 -0.46 0.00 -0.26 0.00 0.00 57.72 57.01 2em5 n HIS 35 Cb 0.04 -0.37 -0.04 0.00 1.12 0.00 0.00 29.99 30.75 2em5 n HIS 35 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2em5 n THR 36 N -2.25 0.29 -3.70 1.59 -2.24 -0.78 -4.83 114.28 102.36 2em5 n THR 36 Ca -0.12 -0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 2em5 n THR 36 Cb 0.72 -1.82 0.00 0.00 -2.10 0.00 0.00 70.33 67.12 2em5 n THR 36 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2em5 n GLY 37 N 3.97 -0.75 3.50 3.38 0.00 -1.26 -4.98 105.19 109.05 2em5 n GLY 37 Ca 0.19 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 45.22 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 -1.39 0.42 0.16 1.61 2.56 -1.26 -5.14 118.70 115.66 2em5 s GLU 38 Ca 0.00 1.05 -0.33 0.00 0.00 0.00 0.00 54.97 55.69 2em5 s GLU 38 Cb 0.00 0.63 -0.16 0.00 2.00 0.00 0.00 34.13 36.60 2em5 s GLU 38 CO 0.00 -0.16 1.10 1.17 -0.56 0.00 0.00 175.26 176.82 2em5 n LYS 39 N 5.20 0.95 -2.20 4.30 4.81 -1.26 -4.87 118.16 125.10 2em5 n LYS 39 Ca -0.10 0.34 -0.42 0.00 -0.87 0.00 0.00 58.31 57.26 2em5 n LYS 39 Cb 0.51 -1.80 -0.03 0.00 0.02 0.00 0.00 35.03 33.73 2em5 n LYS 39 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 2em5 s PRO 40 N -0.39 4.32 -0.00 1.64 0.04 -1.26 -4.96 135.00 134.39 2em5 s PRO 40 Ca 0.74 2.03 -0.21 0.00 0.04 0.00 0.00 61.00 63.60 2em5 s PRO 40 Cb -0.90 -3.33 -0.11 0.00 0.04 0.00 0.00 34.50 30.19 2em5 s PRO 40 CO 0.53 -0.45 0.92 0.66 0.04 0.00 0.00 177.00 178.69 2em5 h SER 41 N 7.05 -0.63 -1.07 6.66 4.64 -2.08 -3.44 113.55 124.68 2em5 h SER 41 Ca -0.41 0.02 -0.81 0.00 -0.47 0.00 0.00 61.79 60.12 2em5 h SER 41 Cb 1.20 0.16 0.04 0.00 -0.31 0.00 0.00 62.40 63.49 2em5 h SER 41 CO 0.87 -0.28 0.30 0.61 -0.87 0.00 0.00 176.83 177.46 2em5 n GLY 42 N -0.27 -0.05 1.12 -0.77 0.00 -1.26 -4.93 105.19 99.03 2em5 n GLY 42 Ca -0.09 0.83 -0.10 0.00 0.00 0.00 0.00 46.02 46.67 2em5 n GLY 42 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2em5 n PRO 43 N 2.42 -1.71 -3.56 1.61 -0.04 -1.26 -5.10 135.00 127.36 2em5 n PRO 43 Ca 0.23 -0.56 -0.01 0.00 -0.04 0.00 0.00 63.50 63.12 2em5 n PRO 43 Cb 0.05 -0.53 -0.05 0.00 -0.04 0.00 0.00 33.50 32.93 2em5 n PRO 43 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2em5 s SER 44 N -2.45 -0.72 0.06 3.54 0.15 -1.26 -5.06 113.70 107.95 2em5 s SER 44 Ca 0.23 1.06 -0.27 0.00 0.70 0.00 0.00 55.95 57.67 2em5 s SER 44 Cb -0.02 1.60 -0.17 0.00 -1.71 0.00 0.00 66.02 65.72 2em5 s SER 44 CO 0.17 -0.16 1.54 0.77 1.20 0.00 0.00 173.24 176.77 2em5 h SER 45 N 7.07 -0.34 0.00 5.45 4.64 -2.06 -3.57 113.55 124.75 2em5 h SER 45 Ca -0.22 -0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 2em5 h SER 45 Cb 1.15 0.09 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 2em5 h SER 45 CO 0.13 -0.14 0.00 0.61 -0.87 0.00 0.00 176.83 176.56