#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2em5 n SER 2 N 0.00 1.89 -3.87 1.61 7.64 -1.26 -4.95 113.62 114.68 2em5 n SER 2 Ca 0.00 0.42 -0.31 0.00 1.01 0.00 0.00 58.87 59.98 2em5 n SER 2 Cb 0.00 -0.88 -0.07 0.00 -1.01 0.00 0.00 64.21 62.25 2em5 n SER 2 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2em5 n SER 3 N -4.40 -0.96 -4.21 6.43 3.41 -1.26 -4.82 113.62 107.80 2em5 n SER 3 Ca -0.34 -0.97 -0.41 0.00 -0.26 0.00 0.00 58.87 56.88 2em5 n SER 3 Cb 0.67 -1.24 -0.05 0.00 -0.26 0.00 0.00 64.21 63.34 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 -3.02 2.80 -0.22 5.00 0.00 -1.26 -4.99 107.32 105.63 2em5 s GLY 4 Ca 0.51 -3.51 -0.03 0.00 0.00 0.00 0.00 44.72 41.70 2em5 s GLY 4 CO 0.79 1.21 0.06 -0.56 0.00 0.00 0.00 173.10 174.60 2em5 s SER 5 N 1.09 3.08 0.74 1.64 0.01 -1.26 -5.14 113.70 113.85 2em5 s SER 5 Ca 0.22 -0.96 -0.05 0.00 1.31 0.00 0.00 55.95 56.46 2em5 s SER 5 Cb -0.12 -0.57 0.11 0.00 0.21 0.00 0.00 66.02 65.64 2em5 s SER 5 CO -0.08 -0.34 1.03 -0.55 0.41 0.00 0.00 173.24 173.72 2em5 s SER 6 N 1.88 4.39 0.00 2.44 0.15 -1.26 -4.85 113.70 116.45 2em5 s SER 6 Ca 0.02 0.07 0.00 0.00 0.70 0.00 0.00 55.95 56.74 2em5 s SER 6 Cb -0.17 -0.54 0.00 0.00 -1.71 0.00 0.00 66.02 63.60 2em5 s SER 6 CO -0.13 -1.85 0.00 0.61 1.20 0.00 0.00 173.24 173.07 2em5 n GLY 7 N -2.97 0.75 2.69 9.45 0.00 -1.26 -5.11 105.19 108.74 2em5 n GLY 7 Ca 0.12 -0.62 -0.24 0.00 0.00 0.00 0.00 46.02 45.28 2em5 n GLY 7 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2em5 s SER 8 N -2.22 1.91 -1.54 1.61 1.04 -1.26 -4.85 113.70 108.38 2em5 s SER 8 Ca 0.00 -0.31 -0.10 0.00 0.48 0.00 0.00 55.95 56.01 2em5 s SER 8 Cb 0.00 -0.33 0.08 0.00 0.10 0.00 0.00 66.02 65.87 2em5 s SER 8 CO 0.00 -0.27 0.73 -1.54 0.98 0.00 0.00 173.24 173.14 2em5 n SER 9 N 5.21 -2.68 -4.11 7.02 3.41 -1.26 -4.94 113.62 116.27 2em5 n SER 9 Ca -0.06 -0.93 -0.33 0.00 -0.26 0.00 0.00 58.87 57.29 2em5 n SER 9 Cb 0.49 -3.27 -0.14 0.00 -0.26 0.00 0.00 64.21 61.03 2em5 n SER 9 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2em5 s THR 10 N -3.52 2.55 0.39 6.66 -4.23 -1.26 -2.25 115.64 113.98 2em5 s THR 10 Ca 0.44 -1.64 0.08 0.00 -1.18 0.00 0.00 61.69 59.39 2em5 s THR 10 Cb -0.23 -2.54 -0.07 0.00 1.34 0.00 0.00 72.50 71.00 2em5 s THR 10 CO 0.88 -0.15 -0.01 -0.75 -0.54 0.00 0.00 174.62 174.05 2em5 s LYS 11 N 1.14 1.94 0.12 3.99 2.20 -1.26 -4.99 119.74 122.88 2em5 s LYS 11 Ca -0.05 -2.01 -0.20 0.00 -0.36 0.00 0.00 55.97 53.35 2em5 s LYS 11 Cb -0.20 -1.70 0.00 0.00 -1.51 0.00 0.00 37.83 34.42 2em5 s LYS 11 CO -0.04 0.02 1.09 0.45 -0.36 0.00 0.00 175.35 176.50 2em5 n SER 12 N -0.94 -0.68 -4.36 1.43 2.88 -1.26 -2.08 113.62 108.61 2em5 n SER 12 Ca -0.05 1.25 -0.45 0.00 -1.33 0.00 0.00 58.87 58.29 2em5 n SER 12 Cb 0.65 -0.19 -0.01 0.00 -0.75 0.00 0.00 64.21 63.92 2em5 n SER 12 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 2em5 s HIS 13 N -5.42 4.01 -0.09 0.66 3.76 -1.25 -5.02 115.29 111.93 2em5 s HIS 13 Ca -0.09 -2.41 -0.10 0.00 -0.15 0.00 0.00 55.06 52.31 2em5 s HIS 13 Cb 0.09 -3.92 -0.05 0.00 1.11 0.00 0.00 32.58 29.82 2em5 s HIS 13 CO 0.45 -1.05 0.23 -1.14 -0.85 0.00 0.00 174.74 172.39 2em5 s GLN 14 N -0.39 3.67 0.72 1.40 0.74 -0.88 -3.02 119.66 121.89 2em5 s GLN 14 Ca 0.30 0.04 -0.11 0.00 0.05 0.00 0.00 55.36 55.64 2em5 s GLN 14 Cb -0.09 -3.23 0.02 0.00 1.10 0.00 0.00 33.01 30.82 2em5 s GLN 14 CO -0.07 0.69 1.07 0.00 -0.55 0.00 0.00 175.29 176.43 2em5 n HIS 16 N -3.25 0.00 0.05 0.00 -0.00 -1.26 -3.17 115.22 107.60 2em5 n HIS 16 Ca 0.08 0.00 -0.10 0.00 0.46 0.00 0.00 57.72 58.16 2em5 n HIS 16 Cb 0.53 -0.21 0.03 0.00 -0.12 0.00 0.00 29.99 30.22 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 0.39 0.00 1.57 4.39 -2.00 -3.41 114.58 115.52 2em5 h GLU 17 Ca -0.00 -0.32 0.00 0.00 0.34 0.00 0.00 59.36 59.38 2em5 h GLU 17 Cb 0.43 0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.15 2em5 h GLU 17 CO 0.00 0.96 -0.43 0.00 -1.16 0.00 0.00 179.01 178.38 2em5 n GLY 19 N 2.36 0.78 3.85 0.00 0.00 -1.19 -5.04 105.19 105.95 2em5 n GLY 19 Ca 0.00 -0.58 -0.32 0.00 0.00 0.00 0.00 46.02 45.11 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 -1.07 3.23 -0.34 1.61 0.52 -1.26 -4.80 118.95 116.84 2em5 s ARG 20 Ca 0.00 -0.46 -0.12 0.00 -0.52 0.00 0.00 55.73 54.63 2em5 s ARG 20 Cb 0.00 -2.95 -0.01 0.00 0.52 0.00 0.00 34.95 32.51 2em5 s ARG 20 CO 0.00 0.64 0.23 0.20 0.02 0.00 0.00 175.30 176.38 2em5 s GLY 21 N -2.07 1.95 -0.08 -3.53 0.00 -0.95 -1.80 107.32 100.84 2em5 s GLY 21 Ca 0.28 -1.45 0.02 0.00 0.00 0.00 0.00 44.72 43.57 2em5 s GLY 21 CO 0.20 0.78 -0.15 -1.36 0.00 0.00 0.00 173.10 172.57 2em5 s PHE 22 N 1.68 2.72 -0.04 1.90 0.08 -1.17 -4.83 117.98 118.32 2em5 s PHE 22 Ca 0.05 -0.40 -0.26 0.00 0.12 0.00 0.00 56.93 56.45 2em5 s PHE 22 Cb -0.18 -1.71 -0.21 0.00 -0.57 0.00 0.00 43.02 40.36 2em5 s PHE 22 CO 0.09 -0.00 1.17 1.15 -0.10 0.00 0.00 175.22 177.53 2em5 h THR 23 N 4.82 1.47 -3.15 0.64 2.02 -1.97 -3.32 112.91 113.41 2em5 h THR 23 Ca -0.37 -1.42 -0.60 0.00 0.77 0.00 0.00 66.41 64.80 2em5 h THR 23 Cb 1.18 2.40 -0.07 0.00 -1.74 0.00 0.00 68.15 69.92 2em5 h THR 23 CO 0.52 0.37 -0.19 -0.76 0.37 0.00 0.00 175.52 175.83 2em5 s LEU 24 N -9.00 4.39 0.26 2.58 1.43 -1.26 -4.83 118.68 112.25 2em5 s LEU 24 Ca -0.16 0.88 -0.02 0.00 -1.03 0.00 0.00 54.13 53.79 2em5 s LEU 24 Cb 0.01 -2.61 0.50 0.00 0.03 0.00 0.00 46.19 44.12 2em5 s LEU 24 CO 0.69 0.20 1.77 0.50 0.23 0.00 0.00 176.35 179.74 2em5 h LYS 25 N 5.54 0.64 -0.01 1.70 1.63 -1.95 -1.94 116.57 122.17 2em5 h LYS 25 Ca -0.47 -0.04 0.02 0.00 -0.85 0.00 0.00 60.65 59.31 2em5 h LYS 25 Cb 1.20 -0.14 -0.03 0.00 -0.60 0.00 0.00 32.23 32.66 2em5 h LYS 25 CO 0.67 0.42 -0.12 1.03 -3.45 0.00 0.00 179.45 178.00 2em5 h SER 26 N 0.65 -0.35 -0.50 4.20 0.87 -1.98 -2.37 113.55 114.07 2em5 h SER 26 Ca 0.44 0.05 0.05 0.00 -1.23 0.00 0.00 61.79 61.10 2em5 h SER 26 Cb 0.58 0.15 -0.06 0.00 -0.44 0.00 0.00 62.40 62.63 2em5 h SER 26 CO -0.34 -0.17 -0.30 1.41 -0.53 0.00 0.00 176.83 176.91 2em5 n HIS 27 N -5.25 -0.22 -0.04 2.24 8.25 -0.73 -0.97 115.22 118.50 2em5 n HIS 27 Ca -0.05 0.63 -0.09 0.00 -0.26 0.00 0.00 57.72 57.95 2em5 n HIS 27 Cb 0.17 -0.53 -0.02 0.00 1.12 0.00 0.00 29.99 30.73 2em5 n HIS 27 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 2em5 h LEU 28 N 0.00 -0.78 -0.78 2.41 5.85 -1.52 -0.47 115.31 120.02 2em5 h LEU 28 Ca 0.08 0.14 0.07 0.00 0.84 0.00 0.00 57.88 59.01 2em5 h LEU 28 Cb 0.21 0.36 -0.10 0.00 0.37 0.00 0.00 40.66 41.49 2em5 h LEU 28 CO -0.47 -0.28 -0.55 -1.13 -0.34 0.00 0.00 178.44 175.67 2em5 h ASN 29 N -0.26 -1.96 -0.63 1.25 -1.24 -0.51 0.52 115.58 112.74 2em5 h ASN 29 Ca 0.13 0.29 0.02 0.00 0.71 0.00 0.00 56.30 57.44 2em5 h ASN 29 Cb 0.46 0.85 -0.03 0.00 0.73 0.00 0.00 38.32 40.33 2em5 h ASN 29 CO -0.37 -0.27 0.42 1.56 -1.29 0.00 0.00 177.43 177.48 2em5 h GLN 30 N -0.11 0.79 0.10 6.67 1.08 -0.78 -2.67 115.11 120.18 2em5 h GLN 30 Ca 0.13 -0.05 -0.00 0.00 -1.45 0.00 0.00 58.65 57.27 2em5 h GLN 30 Cb 0.44 -0.18 0.00 0.00 -0.05 0.00 0.00 27.48 27.69 2em5 h GLN 30 CO -0.79 0.52 -0.05 1.25 -0.95 0.00 0.00 178.83 178.82 2em5 h HIS 31 N 0.81 -0.12 -1.10 2.96 -0.00 0.15 -2.20 115.15 115.65 2em5 h HIS 31 Ca 0.24 -0.00 0.32 0.00 -0.00 0.00 0.00 60.37 60.92 2em5 h HIS 31 Cb -0.03 0.04 -0.04 0.00 -0.00 0.00 0.00 27.41 27.37 2em5 h HIS 31 CO -0.00 -0.03 1.13 1.96 -0.00 0.00 0.00 177.93 180.99 2em5 h GLN 32 N -0.18 0.00 -0.70 5.26 4.20 -0.06 0.50 115.11 124.13 2em5 h GLN 32 Ca -0.01 0.00 0.09 0.00 0.06 0.00 0.00 58.65 58.79 2em5 h GLN 32 Cb 0.15 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 27.86 2em5 h GLN 32 CO 0.02 0.00 0.35 0.00 -0.67 0.00 0.00 178.83 178.53 2em5 h ARG 33 N 0.00 0.57 -0.10 1.46 3.08 -1.46 0.72 114.38 118.65 2em5 h ARG 33 Ca 0.52 -0.03 0.03 0.00 0.07 0.00 0.00 59.98 60.57 2em5 h ARG 33 Cb 2.77 -0.13 -0.00 0.00 0.08 0.00 0.00 29.97 32.69 2em5 h ARG 33 CO -0.01 0.38 0.54 -0.84 -1.07 0.00 0.00 179.97 178.97 2em5 h ILE 34 N 0.59 0.05 0.00 2.04 3.07 -0.16 0.78 117.51 123.88 2em5 h ILE 34 Ca 0.34 0.00 -0.18 0.00 1.55 0.00 0.00 64.86 66.57 2em5 h ILE 34 Cb 0.36 0.48 -0.03 0.00 -0.27 0.00 0.00 36.82 37.36 2em5 h ILE 34 CO -0.27 0.00 -2.07 1.41 -1.05 0.00 0.00 178.15 176.18 2em5 n HIS 35 N -2.92 0.16 -0.38 0.16 8.25 0.20 -4.37 115.22 116.33 2em5 n HIS 35 Ca 0.01 0.05 0.31 0.00 -0.26 0.00 0.00 57.72 57.83 2em5 n HIS 35 Cb 0.60 -0.81 0.58 0.00 1.12 0.00 0.00 29.99 31.49 2em5 n HIS 35 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2em5 h THR 36 N 0.00 0.16 0.00 1.59 1.03 0.11 -3.47 112.91 112.33 2em5 h THR 36 Ca -0.26 -0.05 0.00 0.00 -0.01 0.00 0.00 66.41 66.09 2em5 h THR 36 Cb 1.62 0.00 0.00 0.00 -1.07 0.00 0.00 68.15 68.70 2em5 h THR 36 CO 0.02 0.03 0.00 0.61 -0.01 0.00 0.00 175.52 176.17 2em5 n GLY 37 N -1.39 -2.03 3.83 2.99 0.00 -1.24 -4.77 105.19 102.58 2em5 n GLY 37 Ca 0.35 -1.49 -0.38 0.00 0.00 0.00 0.00 46.02 44.51 2em5 n GLY 37 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2em5 s GLU 38 N -3.14 3.84 -1.21 1.61 8.01 -1.26 -4.44 118.70 122.12 2em5 s GLU 38 Ca 0.00 0.23 -0.15 0.00 0.01 0.00 0.00 54.97 55.06 2em5 s GLU 38 Cb 0.00 -3.24 0.02 0.00 -4.31 0.00 0.00 34.13 26.60 2em5 s GLU 38 CO 0.00 0.65 0.28 1.17 0.01 0.00 0.00 175.26 177.37 2em5 n LYS 39 N 2.11 -0.64 0.00 1.61 4.81 -1.26 -4.74 118.16 120.05 2em5 n LYS 39 Ca -0.15 0.03 0.07 0.00 -0.87 0.00 0.00 58.31 57.38 2em5 n LYS 39 Cb 0.53 -2.57 0.39 0.00 0.02 0.00 0.00 35.03 33.39 2em5 n LYS 39 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 2em5 n PRO 40 N -4.32 0.49 -1.68 1.64 -0.04 -1.26 -4.82 135.00 125.01 2em5 n PRO 40 Ca -0.20 0.00 -0.48 0.00 -0.04 0.00 0.00 63.50 62.78 2em5 n PRO 40 Cb 0.55 -1.42 -0.05 0.00 -0.04 0.00 0.00 33.50 32.55 2em5 n PRO 40 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2em5 n SER 41 N -0.92 3.18 -4.31 3.54 3.41 -1.26 -4.92 113.62 112.35 2em5 n SER 41 Ca 0.10 1.02 -0.32 0.00 -0.26 0.00 0.00 58.87 59.41 2em5 n SER 41 Cb 0.04 -1.36 0.18 0.00 -0.26 0.00 0.00 64.21 62.81 2em5 n SER 41 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2em5 n GLY 42 N 3.99 -2.42 3.57 5.00 0.00 -1.26 -4.81 105.19 109.26 2em5 n GLY 42 Ca 0.21 -0.83 -0.41 0.00 0.00 0.00 0.00 46.02 44.99 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 -3.56 3.00 0.35 1.61 0.04 -1.26 -4.96 135.00 130.21 2em5 s PRO 43 Ca 0.57 0.94 0.03 0.00 0.04 0.00 0.00 61.00 62.59 2em5 s PRO 43 Cb -0.14 -4.27 -0.05 0.00 0.04 0.00 0.00 34.50 30.08 2em5 s PRO 43 CO 0.66 -2.27 0.09 -1.54 0.04 0.00 0.00 177.00 173.98 2em5 s SER 44 N 6.84 2.39 0.12 6.66 1.04 -1.26 -5.12 113.70 124.37 2em5 s SER 44 Ca 0.71 -1.49 -0.30 0.00 0.48 0.00 0.00 55.95 55.35 2em5 s SER 44 Cb -0.16 0.17 -0.07 0.00 0.10 0.00 0.00 66.02 66.06 2em5 s SER 44 CO 0.27 -0.74 1.17 -0.94 0.98 0.00 0.00 173.24 173.97 2em5 s SER 45 N -3.51 7.13 0.00 7.02 1.04 -1.26 -5.26 113.70 118.86 2em5 s SER 45 Ca 0.32 2.08 0.00 0.00 0.48 0.00 0.00 55.95 58.83 2em5 s SER 45 Cb 0.06 -2.59 0.00 0.00 0.10 0.00 0.00 66.02 63.59 2em5 s SER 45 CO 0.15 -0.38 0.00 0.61 0.98 0.00 0.00 173.24 174.60