#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2em4 s SER 2 N 0.00 6.53 -0.51 1.61 0.15 -1.26 -5.04 113.70 115.17 2em4 s SER 2 Ca 0.00 0.62 -0.18 0.00 0.70 0.00 0.00 55.95 57.09 2em4 s SER 2 Cb 0.00 -2.26 0.07 0.00 -1.71 0.00 0.00 66.02 62.12 2em4 s SER 2 CO 0.00 -0.09 0.59 -0.44 1.20 0.00 0.00 173.24 174.50 2em4 s SER 3 N 0.99 6.20 0.00 5.45 0.01 -1.26 -4.94 113.70 120.15 2em4 s SER 3 Ca 0.22 -1.09 0.00 0.00 1.31 0.00 0.00 55.95 56.39 2em4 s SER 3 Cb -0.15 -2.27 0.00 0.00 0.21 0.00 0.00 66.02 63.81 2em4 s SER 3 CO 0.09 -0.88 0.00 0.61 0.41 0.00 0.00 173.24 173.47 2em4 n GLY 4 N 5.20 -1.79 3.72 3.44 0.00 -1.26 -4.90 105.19 109.59 2em4 n GLY 4 Ca -0.08 -1.79 -0.40 0.00 0.00 0.00 0.00 46.02 43.75 2em4 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2em4 s SER 5 N -4.00 7.10 0.98 1.61 0.15 -1.26 -5.06 113.70 113.22 2em4 s SER 5 Ca 0.00 1.33 -0.15 0.00 0.70 0.00 0.00 55.95 57.82 2em4 s SER 5 Cb 0.00 -2.45 0.19 0.00 -1.71 0.00 0.00 66.02 62.04 2em4 s SER 5 CO 0.00 -0.13 1.21 -0.44 1.20 0.00 0.00 173.24 175.08 2em4 s SER 6 N 0.74 2.94 -1.06 5.45 0.01 -1.26 -4.92 113.70 115.60 2em4 s SER 6 Ca 0.41 0.60 -0.22 0.00 1.31 0.00 0.00 55.95 58.04 2em4 s SER 6 Cb -0.19 -0.89 0.01 0.00 0.21 0.00 0.00 66.02 65.17 2em4 s SER 6 CO 0.21 -2.87 1.69 -0.83 0.41 0.00 0.00 173.24 171.85 2em4 s GLY 7 N -4.41 0.93 -0.28 3.44 0.00 -1.26 -4.95 107.32 100.79 2em4 s GLY 7 Ca 0.69 -2.18 -0.24 0.00 0.00 0.00 0.00 44.72 42.99 2em4 s GLY 7 CO 0.53 3.00 0.81 -1.59 0.00 0.00 0.00 173.10 175.86 2em4 s THR 8 N 6.84 4.80 0.00 0.90 2.01 -1.26 -4.47 115.64 124.45 2em4 s THR 8 Ca 0.56 1.34 0.00 0.00 0.31 0.00 0.00 61.69 63.91 2em4 s THR 8 Cb -0.01 -4.14 0.00 0.00 0.01 0.00 0.00 72.50 68.35 2em4 s THR 8 CO -0.02 -0.19 0.00 0.61 -0.69 0.00 0.00 174.62 174.33 2em4 n GLY 9 N 4.03 0.13 0.11 4.40 0.00 -1.26 -4.99 105.19 107.60 2em4 n GLY 9 Ca 0.05 0.01 -0.16 0.00 0.00 0.00 0.00 46.02 45.92 2em4 n GLY 9 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2em4 h GLN 10 N 0.00 0.23 -2.48 1.61 4.15 -1.99 -3.38 115.11 113.25 2em4 h GLN 10 Ca 0.00 -0.25 -0.63 0.00 0.77 0.00 0.00 58.65 58.55 2em4 h GLN 10 Cb 0.00 0.07 -0.40 0.00 0.21 0.00 0.00 27.48 27.35 2em4 h GLN 10 CO 0.00 0.97 -0.45 2.89 -1.93 0.00 0.00 178.83 180.31 2em4 n ARG 11 N -4.44 2.58 0.00 1.69 1.85 -1.26 -4.82 116.66 112.26 2em4 n ARG 11 Ca -0.10 -4.63 0.07 0.00 -1.00 0.00 0.00 57.85 52.20 2em4 n ARG 11 Cb 0.55 -2.29 0.33 0.00 -1.05 0.00 0.00 32.46 29.99 2em4 n ARG 11 CO 0.00 0.00 0.00 -0.35 -0.01 0.00 0.00 177.63 177.27 2em4 n PRO 12 N 1.17 0.08 -3.33 2.89 -0.04 -1.26 -4.50 135.00 130.00 2em4 n PRO 12 Ca 0.27 0.21 -0.44 0.00 -0.04 0.00 0.00 63.50 63.50 2em4 n PRO 12 Cb 0.39 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.28 2em4 n PRO 12 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2em4 s TYR 13 N -2.84 3.19 0.05 0.54 2.02 -1.25 -5.05 117.35 114.02 2em4 s TYR 13 Ca 0.10 -0.81 0.06 0.00 -0.37 0.00 0.00 57.07 56.05 2em4 s TYR 13 Cb 0.10 -3.25 -0.03 0.00 -0.40 0.00 0.00 41.96 38.38 2em4 s TYR 13 CO 0.25 -0.86 -0.18 -1.21 -1.57 0.00 0.00 175.55 171.99 2em4 s GLU 14 N 1.91 1.12 -0.04 -0.62 2.02 -1.26 -0.43 118.70 121.40 2em4 s GLU 14 Ca 0.07 -0.91 -0.05 0.00 0.02 0.00 0.00 54.97 54.11 2em4 s GLU 14 Cb -0.23 -1.21 -0.04 0.00 0.10 0.00 0.00 34.13 32.75 2em4 s GLU 14 CO 0.08 0.30 0.19 0.00 0.02 0.00 0.00 175.26 175.85 2em4 n ILE 16 N 1.26 0.54 0.14 0.00 3.06 -1.26 -3.43 119.36 119.67 2em4 n ILE 16 Ca -0.13 -0.61 -0.09 0.00 -2.50 0.00 0.00 62.75 59.42 2em4 n ILE 16 Cb 0.53 -0.19 -0.05 0.00 0.54 0.00 0.00 39.64 40.48 2em4 n ILE 16 CO 0.00 0.00 0.00 -0.08 -2.50 0.00 0.00 176.55 173.97 2em4 h GLU 17 N 0.00 -0.47 0.00 9.51 4.57 -1.98 -3.39 114.58 122.82 2em4 h GLU 17 Ca -0.22 0.03 -0.40 0.00 -1.18 0.00 0.00 59.36 57.59 2em4 h GLU 17 Cb 1.45 0.11 -0.06 0.00 -0.16 0.00 0.00 28.75 30.08 2em4 h GLU 17 CO 0.01 -0.31 -2.37 0.00 -1.18 0.00 0.00 179.01 175.16 2em4 n GLY 19 N 1.61 0.43 3.21 0.00 0.00 -1.22 -5.11 105.19 104.12 2em4 n GLY 19 Ca -0.47 -0.65 -0.23 0.00 0.00 0.00 0.00 46.02 44.67 2em4 n GLY 19 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2em4 s LYS 20 N 0.00 1.13 0.04 1.61 1.02 -1.24 -4.92 119.74 117.38 2em4 s LYS 20 Ca 0.00 -0.90 0.05 0.00 0.02 0.00 0.00 55.97 55.13 2em4 s LYS 20 Cb 0.00 -1.22 -0.04 0.00 -0.52 0.00 0.00 37.83 36.05 2em4 s LYS 20 CO 0.00 0.30 -0.07 0.00 -0.92 0.00 0.00 175.35 174.66 2em4 s ALA 21 N -0.91 3.01 -0.03 5.17 0.00 -1.26 0.10 121.76 127.84 2em4 s ALA 21 Ca 0.04 -1.10 0.03 0.00 0.00 0.00 0.00 51.96 50.93 2em4 s ALA 21 Cb -0.09 -1.05 0.00 0.00 0.00 0.00 0.00 23.12 21.99 2em4 s ALA 21 CO 0.02 0.63 -0.11 -0.06 0.00 0.00 0.00 175.76 176.24 2em4 s PHE 22 N -1.09 1.18 0.13 0.00 0.40 0.42 -5.00 117.98 114.02 2em4 s PHE 22 Ca 0.19 -0.31 -0.16 0.00 -0.60 0.00 0.00 56.93 56.05 2em4 s PHE 22 Cb -0.11 -0.82 -0.01 0.00 0.51 0.00 0.00 43.02 42.59 2em4 s PHE 22 CO 0.10 -0.12 1.67 -0.22 0.70 0.00 0.00 175.22 177.36 2em4 h LYS 23 N 6.35 0.61 -5.83 0.44 3.11 -1.87 -3.33 116.57 116.04 2em4 h LYS 23 Ca -0.33 -0.12 -0.67 0.00 -2.81 0.00 0.00 60.65 56.72 2em4 h LYS 23 Cb 1.17 -0.10 -0.15 0.00 -1.00 0.00 0.00 32.23 32.16 2em4 h LYS 23 CO 0.48 0.58 -0.61 0.95 -2.81 0.00 0.00 179.45 178.05 2em4 s THR 24 N -5.51 4.40 0.12 1.00 -4.23 -1.26 -4.79 115.64 105.37 2em4 s THR 24 Ca -0.13 -0.21 -0.28 0.00 -1.18 0.00 0.00 61.69 59.89 2em4 s THR 24 Cb 0.10 -2.87 -0.08 0.00 1.34 0.00 0.00 72.50 70.99 2em4 s THR 24 CO 0.76 0.58 1.61 0.50 -0.54 0.00 0.00 174.62 177.53 2em4 h LYS 25 N 5.41 -0.52 -0.73 3.99 3.64 -1.97 -2.81 116.57 123.58 2em4 h LYS 25 Ca -0.48 0.04 0.07 0.00 -1.27 0.00 0.00 60.65 59.00 2em4 h LYS 25 Cb 1.19 0.12 -0.09 0.00 -0.41 0.00 0.00 32.23 33.04 2em4 h LYS 25 CO 0.57 -0.35 -0.42 0.43 -2.27 0.00 0.00 179.45 177.41 2em4 n SER 26 N -5.43 -0.75 -0.31 4.20 7.64 -1.26 0.11 113.62 117.82 2em4 n SER 26 Ca -0.06 1.29 0.06 0.00 1.01 0.00 0.00 58.87 61.17 2em4 n SER 26 Cb 0.34 -0.17 0.15 0.00 -1.01 0.00 0.00 64.21 63.52 2em4 n SER 26 CO 0.00 0.00 0.00 -1.28 -3.01 0.00 0.00 175.04 170.75 2em4 h SER 27 N 0.00 -0.72 -0.47 6.43 0.87 -1.92 0.40 113.55 118.14 2em4 h SER 27 Ca 0.12 0.26 -0.09 0.00 -1.23 0.00 0.00 61.79 60.85 2em4 h SER 27 Cb 0.31 0.52 -0.02 0.00 -0.44 0.00 0.00 62.40 62.77 2em4 h SER 27 CO -0.68 -0.29 -0.07 0.25 -0.53 0.00 0.00 176.83 175.51 2em4 h LEU 28 N 0.01 0.88 -0.98 2.23 5.85 0.79 -2.43 115.31 121.66 2em4 h LEU 28 Ca 0.45 -0.34 0.33 0.00 0.84 0.00 0.00 57.88 59.16 2em4 h LEU 28 Cb 0.75 -0.24 -0.16 0.00 0.37 0.00 0.00 40.66 41.38 2em4 h LEU 28 CO -0.89 1.01 0.43 0.40 -0.34 0.00 0.00 178.44 179.04 2em4 h ILE 29 N 0.72 0.17 0.08 4.05 1.08 0.21 0.55 117.51 124.38 2em4 h ILE 29 Ca 0.12 -0.06 -0.28 0.00 -0.39 0.00 0.00 64.86 64.26 2em4 h ILE 29 Cb 0.60 -0.00 -0.02 0.00 -3.07 0.00 0.00 36.82 34.33 2em4 h ILE 29 CO 0.04 0.03 -1.41 0.00 -0.69 0.00 0.00 178.15 176.11 2em4 h HIS 31 N 0.05 0.27 -0.03 0.00 -0.00 0.47 -0.70 115.15 115.21 2em4 h HIS 31 Ca -0.19 0.01 0.01 0.00 -0.00 0.00 0.00 60.37 60.20 2em4 h HIS 31 Cb 1.96 -0.08 -0.00 0.00 -0.00 0.00 0.00 27.41 29.29 2em4 h HIS 31 CO 0.04 0.15 0.30 0.00 -0.00 0.00 0.00 177.93 178.42 2em4 h ARG 32 N 0.31 0.00 0.15 5.26 3.08 -0.97 0.03 114.38 122.24 2em4 h ARG 32 Ca 0.13 0.00 -0.32 0.00 0.07 0.00 0.00 59.98 59.86 2em4 h ARG 32 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.10 2em4 h ARG 32 CO -0.09 0.00 -1.60 0.00 -1.07 0.00 0.00 179.97 177.20 2em4 h ARG 33 N 0.00 0.32 -0.60 0.04 2.47 -1.30 -3.33 114.38 111.98 2em4 h ARG 33 Ca 0.01 -0.54 0.17 0.00 -1.26 0.00 0.00 59.98 58.37 2em4 h ARG 33 Cb 0.62 0.20 -0.02 0.00 -1.65 0.00 0.00 29.97 29.12 2em4 h ARG 33 CO -0.00 1.26 0.90 0.77 0.56 0.00 0.00 179.97 183.46 2em4 h SER 34 N -0.10 0.00 -0.37 7.04 0.02 -0.50 1.57 113.55 121.22 2em4 h SER 34 Ca -0.33 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.51 2em4 h SER 34 Cb 1.93 0.00 -0.07 0.00 0.14 0.00 0.00 62.40 64.40 2em4 h SER 34 CO 0.12 0.00 0.14 1.41 -1.14 0.00 0.00 176.83 177.36 2em4 n HIS 35 N -3.19 1.22 -3.64 3.45 8.25 -1.23 -4.81 115.22 115.27 2em4 n HIS 35 Ca 0.13 -0.71 -0.10 0.00 -0.26 0.00 0.00 57.72 56.78 2em4 n HIS 35 Cb 1.09 -0.43 -0.07 0.00 1.12 0.00 0.00 29.99 31.71 2em4 n HIS 35 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 2em4 s THR 36 N -1.73 0.00 -0.35 1.59 -4.23 0.54 -5.13 115.64 106.34 2em4 s THR 36 Ca 0.27 0.00 -0.06 0.00 -1.18 0.00 0.00 61.69 60.72 2em4 s THR 36 Cb 0.21 -1.00 0.19 0.00 1.34 0.00 0.00 72.50 73.25 2em4 s THR 36 CO 0.07 0.00 0.99 -0.83 -0.54 0.00 0.00 174.62 174.31 2em4 s GLY 37 N 0.70 -1.59 -0.02 3.99 0.00 -1.26 -4.92 107.32 104.22 2em4 s GLY 37 Ca -0.02 0.89 -0.30 0.00 0.00 0.00 0.00 44.72 45.29 2em4 s GLY 37 CO -0.07 4.20 1.09 -1.83 0.00 0.00 0.00 173.10 176.49 2em4 s GLU 38 N 1.65 0.67 -0.63 2.90 -1.05 -1.26 -5.11 118.70 115.87 2em4 s GLU 38 Ca 0.18 -0.32 0.01 0.00 -0.15 0.00 0.00 54.97 54.70 2em4 s GLU 38 Cb 0.04 0.26 0.16 0.00 -0.44 0.00 0.00 34.13 34.15 2em4 s GLU 38 CO -0.12 -0.30 0.41 0.15 0.95 0.00 0.00 175.26 176.35 2em4 s LYS 39 N -2.80 2.39 -0.50 -4.83 3.01 -1.26 -5.06 119.74 110.69 2em4 s LYS 39 Ca 0.10 -2.80 -0.27 0.00 -1.01 0.00 0.00 55.97 51.99 2em4 s LYS 39 Cb 0.00 -3.53 -0.02 0.00 -1.01 0.00 0.00 37.83 33.27 2em4 s LYS 39 CO -0.04 -1.18 1.80 -1.25 0.51 0.00 0.00 175.35 175.19 2em4 s PRO 40 N -0.55 2.95 0.69 -1.68 0.04 -1.26 -4.97 135.00 130.22 2em4 s PRO 40 Ca 0.20 0.91 -0.17 0.00 0.04 0.00 0.00 61.00 61.98 2em4 s PRO 40 Cb -0.18 -4.29 0.00 0.00 0.04 0.00 0.00 34.50 30.07 2em4 s PRO 40 CO -0.05 -2.33 1.11 -1.13 0.04 0.00 0.00 177.00 174.63 2em4 n SER 41 N 11.56 1.12 -4.25 6.66 3.41 -1.26 -5.02 113.62 125.83 2em4 n SER 41 Ca 0.21 0.73 -0.25 0.00 -0.26 0.00 0.00 58.87 59.29 2em4 n SER 41 Cb 0.50 -1.47 -0.14 0.00 -0.26 0.00 0.00 64.21 62.84 2em4 n SER 41 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2em4 s GLY 42 N -1.57 1.13 0.00 5.00 0.00 -1.26 -5.01 107.32 105.61 2em4 s GLY 42 Ca 0.77 -1.07 0.15 0.00 0.00 0.00 0.00 44.72 44.57 2em4 s GLY 42 CO 0.46 -1.00 1.31 -1.55 0.00 0.00 0.00 173.10 172.32 2em4 n PRO 43 N 1.80 0.49 -3.04 2.90 -0.04 -1.26 -4.83 135.00 131.01 2em4 n PRO 43 Ca -0.17 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.16 2em4 n PRO 43 Cb 0.53 -1.48 0.04 0.00 -0.04 0.00 0.00 33.50 32.56 2em4 n PRO 43 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2em4 n SER 44 N -0.98 -3.94 -4.56 3.54 2.88 -1.26 -4.93 113.62 104.37 2em4 n SER 44 Ca 0.11 -0.30 -0.42 0.00 -1.33 0.00 0.00 58.87 56.93 2em4 n SER 44 Cb 0.05 -3.00 -0.02 0.00 -0.75 0.00 0.00 64.21 60.50 2em4 n SER 44 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2em4 s SER 45 N -3.29 6.69 0.00 -3.46 0.01 -1.26 -5.36 113.70 107.03 2em4 s SER 45 Ca 0.26 -2.00 0.00 0.00 1.31 0.00 0.00 55.95 55.52 2em4 s SER 45 Cb -0.11 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.56 2em4 s SER 45 CO 0.40 -1.29 0.00 0.61 0.41 0.00 0.00 173.24 173.37