#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 5.18 -0.29 1.61 1.04 -1.26 -4.80 113.70 115.18 2em5 s SER 2 Ca 0.00 -1.33 -0.18 0.00 0.48 0.00 0.00 55.95 54.92 2em5 s SER 2 Cb 0.00 -2.58 0.14 0.00 0.10 0.00 0.00 66.02 63.68 2em5 s SER 2 CO 0.00 -2.84 0.98 -0.55 0.98 0.00 0.00 173.24 171.81 2em5 s SER 3 N 6.92 -0.51 0.00 7.02 0.15 -1.26 -5.17 113.70 120.85 2em5 s SER 3 Ca 0.68 0.85 0.00 0.00 0.70 0.00 0.00 55.95 58.18 2em5 s SER 3 Cb -0.03 1.13 0.00 0.00 -1.71 0.00 0.00 66.02 65.41 2em5 s SER 3 CO 0.07 -0.14 0.00 0.61 1.20 0.00 0.00 173.24 174.99 2em5 n GLY 4 N 3.38 1.32 3.98 9.45 0.00 -1.26 -5.11 105.19 116.95 2em5 n GLY 4 Ca -0.17 -1.07 -0.20 0.00 0.00 0.00 0.00 46.02 44.58 2em5 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2em5 s SER 5 N -1.00 5.96 -0.01 1.61 0.15 -1.26 -5.10 113.70 114.05 2em5 s SER 5 Ca 0.00 -0.03 -0.13 0.00 0.70 0.00 0.00 55.95 56.50 2em5 s SER 5 Cb 0.00 -1.38 0.02 0.00 -1.71 0.00 0.00 66.02 62.95 2em5 s SER 5 CO 0.00 -0.48 0.27 -0.55 1.20 0.00 0.00 173.24 173.68 2em5 s SER 6 N -4.17 -0.14 0.00 5.45 0.15 -1.26 -5.08 113.70 108.65 2em5 s SER 6 Ca 0.45 0.02 0.00 0.00 0.70 0.00 0.00 55.95 57.12 2em5 s SER 6 Cb -0.10 0.29 0.00 0.00 -1.71 0.00 0.00 66.02 64.50 2em5 s SER 6 CO 0.33 -0.42 0.00 0.61 1.20 0.00 0.00 173.24 174.95 2em5 n GLY 7 N 1.34 5.41 0.40 9.45 0.00 -1.26 -4.77 105.19 115.76 2em5 n GLY 7 Ca -0.22 -1.23 -0.04 0.00 0.00 0.00 0.00 46.02 44.53 2em5 n GLY 7 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2em5 n SER 8 N 0.00 2.13 0.00 1.61 7.64 -1.26 -5.02 113.62 118.71 2em5 n SER 8 Ca 0.00 0.02 0.00 0.00 1.01 0.00 0.00 58.87 59.90 2em5 n SER 8 Cb 0.00 -0.11 0.00 0.00 -1.01 0.00 0.00 64.21 63.09 2em5 n SER 8 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2em5 n SER 9 N -2.92 0.00 -4.11 6.43 7.64 -1.26 -5.16 113.62 114.25 2em5 n SER 9 Ca -0.09 0.00 -0.11 0.00 1.01 0.00 0.00 58.87 59.68 2em5 n SER 9 Cb 0.58 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.70 2em5 n SER 9 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2em5 s THR 10 N -0.90 0.02 0.01 0.44 -4.23 -1.26 -5.17 115.64 104.55 2em5 s THR 10 Ca 0.00 -1.76 0.01 0.00 -1.18 0.00 0.00 61.69 58.76 2em5 s THR 10 Cb 0.00 -2.27 -0.01 0.00 1.34 0.00 0.00 72.50 71.56 2em5 s THR 10 CO 0.00 -0.11 -0.03 -0.75 -0.54 0.00 0.00 174.62 173.20 2em5 s LYS 11 N -4.08 0.21 -0.01 3.99 2.20 -1.26 -4.49 119.74 116.30 2em5 s LYS 11 Ca 0.30 -0.24 0.00 0.00 -0.36 0.00 0.00 55.97 55.67 2em5 s LYS 11 Cb 0.05 -0.10 -0.01 0.00 -1.51 0.00 0.00 37.83 36.26 2em5 s LYS 11 CO 0.08 0.02 -0.00 0.43 -0.36 0.00 0.00 175.35 175.52 2em5 n SER 12 N 2.58 4.33 -4.32 1.43 7.64 -1.26 -5.00 113.62 119.02 2em5 n SER 12 Ca -0.16 -0.00 -0.32 0.00 1.01 0.00 0.00 58.87 59.40 2em5 n SER 12 Cb 0.58 0.23 -0.16 0.00 -1.01 0.00 0.00 64.21 63.86 2em5 n SER 12 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 2em5 s HIS 13 N -2.02 2.59 0.11 1.43 3.76 -1.14 -5.06 115.29 114.96 2em5 s HIS 13 Ca -0.01 -0.67 0.08 0.00 -0.15 0.00 0.00 55.06 54.31 2em5 s HIS 13 Cb 0.00 -1.68 -0.04 0.00 1.11 0.00 0.00 32.58 31.98 2em5 s HIS 13 CO 0.03 -0.18 -0.19 -1.14 -0.85 0.00 0.00 174.74 172.40 2em5 s GLN 14 N -0.06 1.12 0.62 1.40 0.74 -1.26 -1.09 119.66 121.14 2em5 s GLN 14 Ca -0.05 -1.20 -0.09 0.00 0.05 0.00 0.00 55.36 54.07 2em5 s GLN 14 Cb -0.14 -1.30 -0.01 0.00 1.10 0.00 0.00 33.01 32.66 2em5 s GLN 14 CO 0.04 0.29 0.99 0.00 -0.55 0.00 0.00 175.29 176.06 2em5 n HIS 16 N -2.74 0.00 0.08 0.00 -0.00 -1.26 -3.48 115.22 107.83 2em5 n HIS 16 Ca 0.05 0.00 -0.22 0.00 0.46 0.00 0.00 57.72 58.01 2em5 n HIS 16 Cb 0.56 -0.09 -0.13 0.00 -0.12 0.00 0.00 29.99 30.21 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 0.62 0.00 1.57 4.39 -1.99 -3.41 114.58 115.77 2em5 h GLU 17 Ca 0.00 -0.81 0.00 0.00 0.34 0.00 0.00 59.36 58.89 2em5 h GLU 17 Cb 0.20 0.26 0.00 0.00 -0.10 0.00 0.00 28.75 29.11 2em5 h GLU 17 CO 0.00 1.36 -0.93 0.00 -1.16 0.00 0.00 179.01 178.29 2em5 n GLY 19 N 3.06 1.30 3.78 0.00 0.00 -1.23 -5.05 105.19 107.06 2em5 n GLY 19 Ca 0.00 0.00 -0.30 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 -0.24 1.94 -0.08 1.61 0.52 -1.26 -4.63 118.95 116.81 2em5 s ARG 20 Ca 0.00 0.73 0.05 0.00 -0.52 0.00 0.00 55.73 55.99 2em5 s ARG 20 Cb 0.00 -1.89 -0.00 0.00 0.52 0.00 0.00 34.95 33.57 2em5 s ARG 20 CO 0.00 -1.75 -0.22 0.20 0.02 0.00 0.00 175.30 173.55 2em5 s GLY 21 N -3.75 1.22 -0.07 -3.53 0.00 -1.26 -0.38 107.32 99.55 2em5 s GLY 21 Ca 0.61 -0.91 -0.00 0.00 0.00 0.00 0.00 44.72 44.42 2em5 s GLY 21 CO 0.55 -0.39 -0.03 -1.36 0.00 0.00 0.00 173.10 171.87 2em5 s PHE 22 N 0.18 0.87 0.07 1.90 0.08 -0.25 -4.96 117.98 115.86 2em5 s PHE 22 Ca -0.12 -0.30 -0.24 0.00 0.12 0.00 0.00 56.93 56.39 2em5 s PHE 22 Cb -0.16 -0.85 -0.16 0.00 -0.57 0.00 0.00 43.02 41.28 2em5 s PHE 22 CO 0.06 -0.32 1.64 1.15 -0.10 0.00 0.00 175.22 177.65 2em5 h THR 23 N 6.23 1.07 -3.42 0.64 2.02 -1.82 -3.02 112.91 114.61 2em5 h THR 23 Ca -0.28 -0.24 -0.55 0.00 0.77 0.00 0.00 66.41 66.12 2em5 h THR 23 Cb 1.14 1.23 -0.04 0.00 -1.74 0.00 0.00 68.15 68.74 2em5 h THR 23 CO 0.36 0.06 0.16 -0.76 0.37 0.00 0.00 175.52 175.71 2em5 s LEU 24 N -9.99 4.44 0.33 2.58 1.02 -1.26 -4.42 118.68 111.39 2em5 s LEU 24 Ca -0.14 1.43 0.03 0.00 0.02 0.00 0.00 54.13 55.48 2em5 s LEU 24 Cb 0.05 -3.22 0.64 0.00 0.02 0.00 0.00 46.19 43.68 2em5 s LEU 24 CO 0.66 0.00 1.94 0.50 0.02 0.00 0.00 176.35 179.47 2em5 h LYS 25 N 5.76 0.86 -0.56 1.70 1.63 -1.97 -1.98 116.57 122.00 2em5 h LYS 25 Ca -0.44 -0.05 -0.01 0.00 -0.85 0.00 0.00 60.65 59.31 2em5 h LYS 25 Cb 1.20 -0.19 -0.03 0.00 -0.60 0.00 0.00 32.23 32.61 2em5 h LYS 25 CO 0.71 0.57 0.33 0.77 -3.45 0.00 0.00 179.45 178.38 2em5 h SER 26 N 0.88 0.69 0.26 4.20 0.02 -1.96 -2.32 113.55 115.32 2em5 h SER 26 Ca 0.34 -0.07 0.00 0.00 -0.84 0.00 0.00 61.79 61.23 2em5 h SER 26 Cb 0.22 -0.17 -0.04 0.00 0.14 0.00 0.00 62.40 62.55 2em5 h SER 26 CO -0.12 0.55 -0.49 0.45 -1.14 0.00 0.00 176.83 176.08 2em5 h HIS 27 N 0.76 -1.40 -0.63 3.45 3.86 -1.75 0.13 115.15 119.57 2em5 h HIS 27 Ca 0.20 0.03 0.12 0.00 -1.16 0.00 0.00 60.37 59.56 2em5 h HIS 27 Cb 0.00 0.58 -0.09 0.00 1.06 0.00 0.00 27.41 28.96 2em5 h HIS 27 CO -0.02 -0.61 0.15 1.25 0.86 0.00 0.00 177.93 179.56 2em5 h LEU 28 N -0.82 0.03 0.41 2.43 5.85 -1.45 0.39 115.31 122.15 2em5 h LEU 28 Ca -0.02 0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.80 2em5 h LEU 28 Cb 0.78 0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.96 2em5 h LEU 28 CO -0.20 0.02 -0.29 -1.13 -0.34 0.00 0.00 178.44 176.50 2em5 h ASN 29 N 0.28 -0.73 0.19 1.25 -1.24 -0.87 -0.06 115.58 114.41 2em5 h ASN 29 Ca 0.34 0.05 0.00 0.00 0.71 0.00 0.00 56.30 57.40 2em5 h ASN 29 Cb 0.51 0.23 0.00 0.00 0.73 0.00 0.00 38.32 39.78 2em5 h ASN 29 CO -0.42 -0.44 0.00 1.67 -1.29 0.00 0.00 177.43 176.96 2em5 n GLN 30 N -5.41 0.02 0.00 6.67 -0.06 0.40 -1.98 117.38 117.00 2em5 n GLN 30 Ca -0.11 0.42 -0.22 0.00 -2.00 0.00 0.00 57.00 55.10 2em5 n GLN 30 Cb 0.32 -1.54 -0.14 0.00 -4.06 0.00 0.00 30.24 24.82 2em5 n GLN 30 CO 0.00 0.00 0.00 1.25 -0.20 0.00 0.00 177.06 178.11 2em5 h HIS 31 N 0.00 0.45 0.00 3.69 2.76 0.45 -3.33 115.15 119.17 2em5 h HIS 31 Ca 0.00 -0.33 0.00 0.00 -2.20 0.00 0.00 60.37 57.84 2em5 h HIS 31 Cb 0.10 -0.02 0.00 0.00 1.55 0.00 0.00 27.41 29.04 2em5 h HIS 31 CO 0.00 1.72 0.05 1.04 -1.30 0.00 0.00 177.93 179.44 2em5 n GLN 32 N -3.66 0.05 0.27 5.26 6.02 -0.17 -1.26 117.38 123.88 2em5 n GLN 32 Ca -0.31 0.52 0.18 0.00 -0.01 0.00 0.00 57.00 57.39 2em5 n GLN 32 Cb 0.99 -1.70 0.90 0.00 1.02 0.00 0.00 30.24 31.45 2em5 n GLN 32 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2em5 h ARG 33 N 0.00 0.00 0.00 -1.09 2.47 -1.67 -0.34 114.38 113.75 2em5 h ARG 33 Ca 0.00 0.00 -0.18 0.00 -1.26 0.00 0.00 59.98 58.54 2em5 h ARG 33 Cb 0.09 0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 28.38 2em5 h ARG 33 CO 0.00 0.00 -0.91 -0.84 0.56 0.00 0.00 179.97 178.78 2em5 h ILE 34 N 0.00 1.31 0.00 2.04 3.07 -1.45 -3.20 117.51 119.27 2em5 h ILE 34 Ca 0.00 -2.90 -0.28 0.00 1.55 0.00 0.00 64.86 63.23 2em5 h ILE 34 Cb 0.19 2.63 -0.05 0.00 -0.27 0.00 0.00 36.82 39.32 2em5 h ILE 34 CO 0.00 0.74 -1.70 1.41 -1.05 0.00 0.00 178.15 177.55 2em5 n HIS 35 N -3.26 0.96 0.23 0.16 8.25 -0.58 -3.98 115.22 116.99 2em5 n HIS 35 Ca -0.01 0.34 0.09 0.00 -0.26 0.00 0.00 57.72 57.88 2em5 n HIS 35 Cb 0.87 -1.17 0.52 0.00 1.12 0.00 0.00 29.99 31.34 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 0.75 -0.99 1.59 1.03 -1.20 -3.00 112.91 111.10 2em5 h THR 36 Ca -0.28 -0.99 0.08 0.00 -0.01 0.00 0.00 66.41 65.21 2em5 h THR 36 Cb 1.97 1.62 -0.07 0.00 -1.07 0.00 0.00 68.15 70.60 2em5 h THR 36 CO 0.07 0.23 0.64 1.23 -0.01 0.00 0.00 175.52 177.68 2em5 h GLY 37 N 1.41 1.53 -1.29 2.99 0.00 -1.68 -3.43 103.07 102.60 2em5 h GLY 37 Ca -0.00 -0.45 -0.46 0.00 0.00 0.00 0.00 47.33 46.42 2em5 h GLY 37 CO 0.03 0.28 0.18 -0.54 0.00 0.00 0.00 176.54 176.49 2em5 s GLU 38 N -5.99 1.48 -0.52 4.80 2.02 -1.13 -5.04 118.70 114.32 2em5 s GLU 38 Ca -0.12 -0.91 -0.18 0.00 0.02 0.00 0.00 54.97 53.78 2em5 s GLU 38 Cb 0.21 -2.22 0.08 0.00 0.10 0.00 0.00 34.13 32.30 2em5 s GLU 38 CO 0.81 -1.64 0.57 0.21 0.02 0.00 0.00 175.26 175.23 2em5 s LYS 39 N -5.31 3.06 -0.54 1.61 2.36 -1.26 -5.02 119.74 114.64 2em5 s LYS 39 Ca 0.68 -1.18 -0.27 0.00 -2.55 0.00 0.00 55.97 52.65 2em5 s LYS 39 Cb -0.05 -4.16 -0.02 0.00 -1.05 0.00 0.00 37.83 32.55 2em5 s LYS 39 CO 0.46 -1.25 1.82 -1.25 1.55 0.00 0.00 175.35 176.68 2em5 s PRO 40 N 2.29 2.83 -0.49 4.03 0.04 -1.26 -4.93 135.00 137.51 2em5 s PRO 40 Ca 0.10 0.79 0.03 0.00 0.04 0.00 0.00 61.00 61.96 2em5 s PRO 40 Cb -0.23 -4.33 0.14 0.00 0.04 0.00 0.00 34.50 30.13 2em5 s PRO 40 CO 0.09 -2.48 0.28 0.45 0.04 0.00 0.00 177.00 175.37 2em5 s SER 41 N 7.42 3.83 0.33 6.66 0.15 -1.26 -5.10 113.70 125.73 2em5 s SER 41 Ca 0.69 -2.88 0.06 0.00 0.70 0.00 0.00 55.95 54.53 2em5 s SER 41 Cb -0.15 -1.22 -0.07 0.00 -1.71 0.00 0.00 66.02 62.88 2em5 s SER 41 CO 0.24 -0.23 -0.00 -0.83 1.20 0.00 0.00 173.24 173.61 2em5 s GLY 42 N -0.02 2.12 0.00 9.45 0.00 -1.26 -5.01 107.32 112.60 2em5 s GLY 42 Ca 0.19 -2.08 0.15 0.00 0.00 0.00 0.00 44.72 42.98 2em5 s GLY 42 CO -0.03 -1.91 1.38 -1.55 0.00 0.00 0.00 173.10 170.99 2em5 n PRO 43 N -0.73 0.33 -2.55 2.90 -0.04 -1.26 -4.61 135.00 129.03 2em5 n PRO 43 Ca -0.04 0.08 -0.41 0.00 -0.04 0.00 0.00 63.50 63.09 2em5 n PRO 43 Cb 0.65 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.59 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 -2.33 6.24 1.07 3.54 0.15 -1.26 -5.01 113.70 116.10 2em5 s SER 44 Ca 0.18 -0.26 -0.17 0.00 0.70 0.00 0.00 55.95 56.40 2em5 s SER 44 Cb 0.10 -2.56 0.23 0.00 -1.71 0.00 0.00 66.02 62.09 2em5 s SER 44 CO 0.21 -1.74 1.19 -0.55 1.20 0.00 0.00 173.24 173.55 2em5 s SER 45 N 3.57 2.13 0.00 5.45 0.15 -1.26 -5.13 113.70 118.60 2em5 s SER 45 Ca 0.38 0.55 0.00 0.00 0.70 0.00 0.00 55.95 57.58 2em5 s SER 45 Cb -0.08 -0.78 0.00 0.00 -1.71 0.00 0.00 66.02 63.46 2em5 s SER 45 CO 0.18 -3.37 0.00 0.61 1.20 0.00 0.00 173.24 171.87