#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 1.00 0.12 1.61 0.01 -1.26 -5.15 113.70 110.03 2em5 s SER 2 Ca 0.00 -0.26 -0.24 0.00 1.31 0.00 0.00 55.95 56.76 2em5 s SER 2 Cb 0.00 -0.08 0.08 0.00 0.21 0.00 0.00 66.02 66.23 2em5 s SER 2 CO 0.00 0.03 0.68 -0.44 0.41 0.00 0.00 173.24 173.92 2em5 s SER 3 N -0.57 -0.51 -0.32 2.44 0.01 -1.26 -5.14 113.70 108.35 2em5 s SER 3 Ca 0.00 -0.02 -0.06 0.00 1.31 0.00 0.00 55.95 57.18 2em5 s SER 3 Cb -0.05 0.55 0.19 0.00 0.21 0.00 0.00 66.02 66.92 2em5 s SER 3 CO 0.00 -0.89 0.95 -0.83 0.41 0.00 0.00 173.24 172.88 2em5 s GLY 4 N -2.69 -1.28 0.06 3.44 0.00 -1.26 -5.13 107.32 100.46 2em5 s GLY 4 Ca 0.02 1.40 -0.37 0.00 0.00 0.00 0.00 44.72 45.77 2em5 s GLY 4 CO -0.11 4.10 1.31 -1.26 0.00 0.00 0.00 173.10 177.14 2em5 n SER 5 N 4.41 1.43 -4.57 1.64 2.88 -1.26 -4.78 113.62 113.37 2em5 n SER 5 Ca 0.08 1.12 -0.31 0.00 -1.33 0.00 0.00 58.87 58.43 2em5 n SER 5 Cb 0.60 -1.15 -0.05 0.00 -0.75 0.00 0.00 64.21 62.86 2em5 n SER 5 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2em5 s SER 6 N 0.49 5.47 0.21 -3.46 1.04 -1.26 -4.65 113.70 111.54 2em5 s SER 6 Ca 0.86 -1.21 0.00 0.00 0.48 0.00 0.00 55.95 56.08 2em5 s SER 6 Cb -1.00 -2.57 0.00 0.00 0.10 0.00 0.00 66.02 62.55 2em5 s SER 6 CO 0.49 -2.51 0.00 0.61 0.98 0.00 0.00 173.24 172.81 2em5 n GLY 7 N 6.46 -4.07 3.35 7.32 0.00 -1.26 -4.83 105.19 112.16 2em5 n GLY 7 Ca 0.41 -0.77 -0.46 0.00 0.00 0.00 0.00 46.02 45.20 2em5 n GLY 7 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2em5 s SER 8 N -1.85 7.06 -0.30 1.61 0.01 -1.26 -4.93 113.70 114.05 2em5 s SER 8 Ca 0.00 -3.14 -0.16 0.00 1.31 0.00 0.00 55.95 53.95 2em5 s SER 8 Cb 0.00 -2.23 0.18 0.00 0.21 0.00 0.00 66.02 64.18 2em5 s SER 8 CO 0.00 -0.46 1.10 -0.55 0.41 0.00 0.00 173.24 173.74 2em5 s SER 9 N 1.84 -0.35 -0.15 2.44 0.15 -1.26 -5.16 113.70 111.21 2em5 s SER 9 Ca 0.27 0.52 -0.04 0.00 0.70 0.00 0.00 55.95 57.39 2em5 s SER 9 Cb -0.09 1.31 -0.03 0.00 -1.71 0.00 0.00 66.02 65.50 2em5 s SER 9 CO -0.08 -0.08 -0.01 0.28 1.20 0.00 0.00 173.24 174.55 2em5 s THR 10 N 1.87 4.12 0.21 6.45 -1.32 -1.26 -4.81 115.64 120.91 2em5 s THR 10 Ca -0.04 -0.28 0.10 0.00 -1.21 0.00 0.00 61.69 60.26 2em5 s THR 10 Cb -0.04 -2.80 -0.04 0.00 -1.51 0.00 0.00 72.50 68.11 2em5 s THR 10 CO -0.15 0.51 -0.13 -0.75 -2.21 0.00 0.00 174.62 171.89 2em5 s LYS 11 N 0.13 1.91 0.16 7.08 2.47 -1.26 -5.04 119.74 125.19 2em5 s LYS 11 Ca 0.00 -1.44 -0.25 0.00 -1.56 0.00 0.00 55.97 52.73 2em5 s LYS 11 Cb -0.13 -2.02 0.01 0.00 -1.46 0.00 0.00 37.83 34.22 2em5 s LYS 11 CO 0.02 0.40 1.38 0.43 0.16 0.00 0.00 175.35 177.74 2em5 n SER 12 N -0.18 -0.85 -4.20 1.43 7.64 -1.26 -3.45 113.62 112.74 2em5 n SER 12 Ca -0.09 1.59 -0.39 0.00 1.01 0.00 0.00 58.87 60.99 2em5 n SER 12 Cb 0.57 -0.25 -0.10 0.00 -1.01 0.00 0.00 64.21 63.42 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 -5.55 3.44 -0.16 1.43 3.76 -1.23 -5.06 115.29 111.92 2em5 s HIS 13 Ca -0.11 -1.93 -0.08 0.00 -0.15 0.00 0.00 55.06 52.78 2em5 s HIS 13 Cb 0.12 -3.17 -0.04 0.00 1.11 0.00 0.00 32.58 30.59 2em5 s HIS 13 CO 0.58 -0.93 0.12 -1.14 -0.85 0.00 0.00 174.74 172.52 2em5 s GLN 14 N 1.31 3.76 0.95 1.40 2.00 -1.22 -2.48 119.66 125.38 2em5 s GLN 14 Ca 0.05 -0.20 -0.11 0.00 -2.00 0.00 0.00 55.36 53.10 2em5 s GLN 14 Cb -0.24 -3.26 0.16 0.00 0.80 0.00 0.00 33.01 30.47 2em5 s GLN 14 CO -0.01 0.54 1.09 0.00 -0.50 0.00 0.00 175.29 176.41 2em5 n HIS 16 N -4.17 0.00 0.01 0.00 8.25 -1.26 -3.30 115.22 114.76 2em5 n HIS 16 Ca 0.08 0.00 -0.19 0.00 -0.26 0.00 0.00 57.72 57.35 2em5 n HIS 16 Cb 0.54 -0.28 -0.10 0.00 1.12 0.00 0.00 29.99 31.27 2em5 n HIS 16 CO 0.00 0.00 0.00 0.93 0.64 0.00 0.00 176.34 177.91 2em5 h GLU 17 N 0.00 0.63 0.00 -0.41 4.39 -2.00 -3.41 114.58 113.78 2em5 h GLU 17 Ca -0.08 -0.63 0.00 0.00 0.34 0.00 0.00 59.36 58.99 2em5 h GLU 17 Cb 0.81 0.17 0.00 0.00 -0.10 0.00 0.00 28.75 29.63 2em5 h GLU 17 CO 0.00 1.23 -0.95 0.00 -1.16 0.00 0.00 179.01 178.13 2em5 n GLY 19 N 3.32 1.39 3.78 0.00 0.00 -1.21 -5.00 105.19 107.47 2em5 n GLY 19 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 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 -0.31 2.40 -0.17 1.61 0.52 -1.26 -4.53 118.95 117.21 2em5 s ARG 20 Ca 0.00 1.15 -0.02 0.00 -0.52 0.00 0.00 55.73 56.34 2em5 s ARG 20 Cb 0.00 -1.91 -0.01 0.00 0.52 0.00 0.00 34.95 33.54 2em5 s ARG 20 CO 0.00 -1.53 -0.09 0.20 0.02 0.00 0.00 175.30 173.89 2em5 s GLY 21 N -3.40 1.57 -0.09 -3.53 0.00 -1.26 -0.95 107.32 99.66 2em5 s GLY 21 Ca 0.61 -1.01 0.02 0.00 0.00 0.00 0.00 44.72 44.34 2em5 s GLY 21 CO 0.55 0.09 -0.16 -1.36 0.00 0.00 0.00 173.10 172.22 2em5 s PHE 22 N 0.85 1.95 0.06 1.90 0.08 -1.03 -4.96 117.98 116.83 2em5 s PHE 22 Ca -0.03 -0.84 -0.21 0.00 0.12 0.00 0.00 56.93 55.97 2em5 s PHE 22 Cb -0.15 -1.38 -0.12 0.00 -0.57 0.00 0.00 43.02 40.80 2em5 s PHE 22 CO 0.01 -0.41 1.53 1.15 -0.10 0.00 0.00 175.22 177.39 2em5 h THR 23 N 5.91 1.22 -3.51 0.64 2.02 -1.97 -3.27 112.91 113.95 2em5 h THR 23 Ca -0.29 -0.71 -0.61 0.00 0.77 0.00 0.00 66.41 65.58 2em5 h THR 23 Cb 1.19 1.42 -0.12 0.00 -1.74 0.00 0.00 68.15 68.90 2em5 h THR 23 CO 0.48 0.21 -0.26 -0.76 0.37 0.00 0.00 175.52 175.56 2em5 s LEU 24 N -9.63 4.14 0.25 2.58 1.43 -1.26 -4.79 118.68 111.41 2em5 s LEU 24 Ca -0.14 0.42 -0.05 0.00 -1.03 0.00 0.00 54.13 53.33 2em5 s LEU 24 Cb 0.06 -2.43 0.49 0.00 0.03 0.00 0.00 46.19 44.33 2em5 s LEU 24 CO 0.71 -0.06 1.63 0.50 0.23 0.00 0.00 176.35 179.36 2em5 h LYS 25 N 7.45 0.10 -0.79 1.70 1.63 -1.96 0.19 116.57 124.89 2em5 h LYS 25 Ca -0.36 -0.01 0.18 0.00 -0.85 0.00 0.00 60.65 59.62 2em5 h LYS 25 Cb 1.16 -0.02 -0.12 0.00 -0.60 0.00 0.00 32.23 32.65 2em5 h LYS 25 CO 0.70 0.07 0.22 0.66 -3.45 0.00 0.00 179.45 177.64 2em5 h SER 26 N 0.10 0.05 0.36 4.20 4.64 -1.96 -1.15 113.55 119.79 2em5 h SER 26 Ca 0.44 0.16 -0.01 0.00 -0.47 0.00 0.00 61.79 61.91 2em5 h SER 26 Cb 0.80 0.21 -0.03 0.00 -0.31 0.00 0.00 62.40 63.07 2em5 h SER 26 CO -0.69 -0.06 -0.49 0.45 -0.87 0.00 0.00 176.83 175.17 2em5 h HIS 27 N 0.28 -1.37 -0.81 4.77 3.86 -1.01 -0.68 115.15 120.19 2em5 h HIS 27 Ca 0.47 0.02 0.16 0.00 -1.16 0.00 0.00 60.37 59.86 2em5 h HIS 27 Cb 0.84 0.55 -0.10 0.00 1.06 0.00 0.00 27.41 29.76 2em5 h HIS 27 CO -0.25 -0.62 0.34 1.25 0.86 0.00 0.00 177.93 179.52 2em5 h LEU 28 N -0.88 0.33 0.35 2.43 5.85 -1.26 0.12 115.31 122.26 2em5 h LEU 28 Ca -0.04 0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.78 2em5 h LEU 28 Cb 0.79 0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.91 2em5 h LEU 28 CO -0.13 0.10 -0.25 0.78 -0.34 0.00 0.00 178.44 178.60 2em5 h ASN 29 N 0.46 -0.66 0.00 1.25 -0.26 -0.70 -0.03 115.58 115.65 2em5 h ASN 29 Ca 0.46 0.04 0.00 0.00 -0.56 0.00 0.00 56.30 56.24 2em5 h ASN 29 Cb 0.74 0.20 0.00 0.00 -1.06 0.00 0.00 38.32 38.20 2em5 h ASN 29 CO -0.43 -0.37 0.03 1.67 -1.06 0.00 0.00 177.43 177.27 2em5 n GLN 30 N -3.88 0.13 0.10 0.81 -0.06 -0.31 -1.37 117.38 112.79 2em5 n GLN 30 Ca -0.07 0.62 -0.23 0.00 -2.00 0.00 0.00 57.00 55.33 2em5 n GLN 30 Cb 0.25 -1.95 -0.15 0.00 -4.06 0.00 0.00 30.24 24.32 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 0.78 -0.08 3.69 2.76 0.17 -3.27 115.15 119.19 2em5 h HIS 31 Ca 0.00 -0.57 0.02 0.00 -2.20 0.00 0.00 60.37 57.63 2em5 h HIS 31 Cb 0.06 -0.03 -0.00 0.00 1.55 0.00 0.00 27.41 28.99 2em5 h HIS 31 CO 0.00 1.48 0.11 1.96 -1.30 0.00 0.00 177.93 180.18 2em5 h GLN 32 N -0.08 0.00 0.00 5.26 4.20 0.23 -1.33 115.11 123.39 2em5 h GLN 32 Ca -0.23 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.48 2em5 h GLN 32 Cb 1.95 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.73 2em5 h GLN 32 CO 0.21 0.00 0.28 0.00 -0.67 0.00 0.00 178.83 178.65 2em5 h ARG 33 N 0.00 0.00 0.05 1.46 2.47 -1.60 0.21 114.38 116.97 2em5 h ARG 33 Ca 0.04 0.00 -0.27 0.00 -1.26 0.00 0.00 59.98 58.49 2em5 h ARG 33 Cb 0.25 0.00 0.02 0.00 -1.65 0.00 0.00 29.97 28.60 2em5 h ARG 33 CO -0.00 0.00 -1.12 -0.84 0.56 0.00 0.00 179.97 178.57 2em5 h ILE 34 N 0.00 1.31 0.00 2.04 3.07 -1.47 -1.48 117.51 120.98 2em5 h ILE 34 Ca 0.00 -2.40 -0.18 0.00 1.55 0.00 0.00 64.86 63.83 2em5 h ILE 34 Cb 0.55 2.54 -0.03 0.00 -0.27 0.00 0.00 36.82 39.61 2em5 h ILE 34 CO 0.00 0.73 -0.84 0.45 -1.05 0.00 0.00 178.15 177.44 2em5 h HIS 35 N 0.31 0.00 -0.70 0.16 3.86 -0.81 -3.31 115.15 114.66 2em5 h HIS 35 Ca -0.15 0.00 -0.49 0.00 -1.16 0.00 0.00 60.37 58.58 2em5 h HIS 35 Cb 1.78 0.00 -0.32 0.00 1.06 0.00 0.00 27.41 29.93 2em5 h HIS 35 CO 0.10 0.84 -0.27 -2.37 0.86 0.00 0.00 177.93 177.09 2em5 n THR 36 N -3.31 2.78 0.00 2.45 5.66 -0.76 -4.60 114.28 116.50 2em5 n THR 36 Ca 0.01 -3.60 0.00 0.00 -3.05 0.00 0.00 64.05 57.41 2em5 n THR 36 Cb 0.87 -0.95 0.00 0.00 -1.55 0.00 0.00 70.33 68.70 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 -0.86 3.39 3.76 1.09 0.00 -0.56 -4.89 105.19 107.13 2em5 n GLY 37 Ca 0.45 -0.40 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 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 2.38 2.16 -1.22 1.61 -6.30 -1.26 -3.65 118.70 112.42 2em5 s GLU 38 Ca 0.00 1.25 -0.13 0.00 -2.50 0.00 0.00 54.97 53.58 2em5 s GLU 38 Cb 0.00 -1.88 0.02 0.00 0.00 0.00 0.00 34.13 32.27 2em5 s GLU 38 CO 0.00 -1.73 0.25 0.36 0.02 0.00 0.00 175.26 174.16 2em5 n LYS 39 N -3.49 -0.67 -0.89 4.30 2.85 -1.26 -4.80 118.16 114.20 2em5 n LYS 39 Ca 0.10 0.03 -0.26 0.00 -1.05 0.00 0.00 58.31 57.13 2em5 n LYS 39 Cb 0.53 -2.62 0.22 0.00 -0.65 0.00 0.00 35.03 32.51 2em5 n LYS 39 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 177.40 177.00 2em5 n PRO 40 N -4.29 -2.85 -1.90 -1.58 -0.04 -1.24 -5.00 135.00 118.09 2em5 n PRO 40 Ca -0.20 -1.50 -0.30 0.00 -0.04 0.00 0.00 63.50 61.46 2em5 n PRO 40 Cb 0.55 -1.41 0.05 0.00 -0.04 0.00 0.00 33.50 32.66 2em5 n PRO 40 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2em5 s SER 41 N -4.04 5.40 -0.60 3.54 0.01 -1.26 -5.04 113.70 111.72 2em5 s SER 41 Ca 0.61 1.10 0.06 0.00 1.31 0.00 0.00 55.95 59.03 2em5 s SER 41 Cb -0.06 -1.88 0.24 0.00 0.21 0.00 0.00 66.02 64.53 2em5 s SER 41 CO 0.47 -1.36 0.69 0.61 0.41 0.00 0.00 173.24 174.06 2em5 n GLY 42 N -3.01 4.42 3.74 3.44 0.00 -1.26 -5.09 105.19 107.43 2em5 n GLY 42 Ca 0.07 -2.55 -0.41 0.00 0.00 0.00 0.00 46.02 43.13 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 -2.17 4.40 0.05 1.61 0.04 -1.26 -5.03 135.00 132.64 2em5 s PRO 43 Ca 0.38 2.04 -0.11 0.00 0.04 0.00 0.00 61.00 63.36 2em5 s PRO 43 Cb 0.14 -3.19 0.01 0.00 0.04 0.00 0.00 34.50 31.50 2em5 s PRO 43 CO -0.04 -0.22 0.24 0.45 0.04 0.00 0.00 177.00 177.47 2em5 s SER 44 N 0.20 -0.01 0.71 6.66 0.15 -1.26 -5.15 113.70 115.01 2em5 s SER 44 Ca 0.55 -0.36 -0.16 0.00 0.70 0.00 0.00 55.95 56.68 2em5 s SER 44 Cb -0.36 0.33 -0.03 0.00 -1.71 0.00 0.00 66.02 64.25 2em5 s SER 44 CO 0.39 -0.62 0.65 -1.54 1.20 0.00 0.00 173.24 173.32 2em5 n SER 45 N 0.47 -0.72 0.00 5.45 3.41 -1.26 -5.35 113.62 115.61 2em5 n SER 45 Ca -0.18 0.62 0.00 0.00 -0.26 0.00 0.00 58.87 59.05 2em5 n SER 45 Cb 0.60 -1.27 0.00 0.00 -0.26 0.00 0.00 64.21 63.28 2em5 n SER 45 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49