#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 2.50 0.16 1.61 1.04 -1.26 -5.05 113.70 112.70 2em4 s SER 2 Ca 0.00 -1.26 -0.19 0.00 0.48 0.00 0.00 55.95 54.99 2em4 s SER 2 Cb 0.00 -0.12 0.07 0.00 0.10 0.00 0.00 66.02 66.07 2em4 s SER 2 CO 0.00 -0.46 1.66 0.28 0.98 0.00 0.00 173.24 175.70 2em4 h SER 3 N 2.25 -0.48 -3.33 7.02 0.02 -2.10 -3.39 113.55 113.54 2em4 h SER 3 Ca -0.40 0.12 -0.57 0.00 -0.84 0.00 0.00 61.79 60.11 2em4 h SER 3 Cb 1.23 0.28 -0.06 0.00 0.14 0.00 0.00 62.40 63.99 2em4 h SER 3 CO 0.68 -0.17 -0.01 -0.83 -1.14 0.00 0.00 176.83 175.36 2em4 s GLY 4 N -2.94 2.56 -0.30 -3.77 0.00 -1.26 -5.04 107.32 96.57 2em4 s GLY 4 Ca -0.14 0.01 -0.15 0.00 0.00 0.00 0.00 44.72 44.44 2em4 s GLY 4 CO 0.70 0.92 0.96 -0.45 0.00 0.00 0.00 173.10 175.23 2em4 s SER 5 N 0.39 -0.58 -1.50 1.64 0.15 -1.26 -4.96 113.70 107.57 2em4 s SER 5 Ca 0.32 0.85 -0.12 0.00 0.70 0.00 0.00 55.95 57.70 2em4 s SER 5 Cb -0.17 1.52 0.07 0.00 -1.71 0.00 0.00 66.02 65.73 2em4 s SER 5 CO 0.16 -0.12 0.92 -0.24 1.20 0.00 0.00 173.24 175.16 2em4 n SER 6 N 4.52 -4.12 -3.37 5.45 2.88 -1.26 -4.90 113.62 112.82 2em4 n SER 6 Ca -0.13 -0.80 -0.34 0.00 -1.33 0.00 0.00 58.87 56.27 2em4 n SER 6 Cb 0.54 -3.86 -0.02 0.00 -0.75 0.00 0.00 64.21 60.13 2em4 n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2em4 n GLY 7 N -1.68 5.69 0.34 0.46 0.00 -1.26 -4.65 105.19 104.09 2em4 n GLY 7 Ca -0.02 -2.70 -0.06 0.00 0.00 0.00 0.00 46.02 43.25 2em4 n GLY 7 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2em4 n THR 8 N 0.10 0.37 -0.75 2.61 -2.24 -1.26 -5.10 114.28 108.00 2em4 n THR 8 Ca 0.37 -0.12 0.00 0.00 -2.27 0.00 0.00 64.05 62.02 2em4 n THR 8 Cb 0.34 -1.07 0.00 0.00 -2.10 0.00 0.00 70.33 67.49 2em4 n THR 8 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2em4 n GLY 9 N 2.95 0.10 3.06 3.38 0.00 -1.26 -5.06 105.19 108.35 2em4 n GLY 9 Ca -0.12 -0.41 -0.34 0.00 0.00 0.00 0.00 46.02 45.15 2em4 n GLY 9 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2em4 s GLN 10 N -1.55 2.21 0.11 1.61 0.74 -1.26 -5.08 119.66 116.45 2em4 s GLN 10 Ca 0.00 -2.37 0.08 0.00 0.05 0.00 0.00 55.36 53.13 2em4 s GLN 10 Cb 0.00 -3.55 -0.04 0.00 1.10 0.00 0.00 33.01 30.52 2em4 s GLN 10 CO 0.00 -1.12 -0.21 1.03 -0.55 0.00 0.00 175.29 174.44 2em4 s ARG 11 N 0.18 1.16 0.53 1.67 1.81 -1.26 -5.03 118.95 118.01 2em4 s ARG 11 Ca 0.15 -1.21 0.31 0.00 -1.72 0.00 0.00 55.73 53.26 2em4 s ARG 11 Cb -0.22 -1.41 1.30 0.00 -0.45 0.00 0.00 34.95 34.18 2em4 s ARG 11 CO -0.03 0.32 1.97 -1.00 -0.68 0.00 0.00 175.30 175.88 2em4 h PRO 12 N 3.94 0.00 -4.46 3.54 0.13 -1.86 -3.41 132.00 129.88 2em4 h PRO 12 Ca -0.46 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.10 2em4 h PRO 12 Cb 1.18 0.00 -0.36 0.00 0.13 0.00 0.00 31.00 31.95 2em4 h PRO 12 CO 0.41 0.06 -0.82 0.71 -0.23 0.00 0.00 178.00 178.14 2em4 s TYR 13 N -3.72 1.90 0.02 1.56 2.02 -1.26 -5.09 117.35 112.77 2em4 s TYR 13 Ca 0.01 -1.06 0.01 0.00 -0.37 0.00 0.00 57.07 55.66 2em4 s TYR 13 Cb 0.10 -1.44 -0.01 0.00 -0.40 0.00 0.00 41.96 40.20 2em4 s TYR 13 CO 0.56 -0.61 -0.04 -1.21 -1.57 0.00 0.00 175.55 172.68 2em4 s GLU 14 N 1.57 0.34 0.21 -0.62 2.02 -1.26 -0.56 118.70 120.41 2em4 s GLU 14 Ca 0.04 -0.42 -0.20 0.00 0.02 0.00 0.00 54.97 54.41 2em4 s GLU 14 Cb -0.13 -0.17 -0.08 0.00 0.10 0.00 0.00 34.13 33.85 2em4 s GLU 14 CO -0.09 0.03 0.72 0.00 0.02 0.00 0.00 175.26 175.94 2em4 n ILE 16 N 0.86 1.33 -0.29 0.00 -0.00 -1.26 -2.60 119.36 117.41 2em4 n ILE 16 Ca -0.03 -0.64 0.01 0.00 -0.00 0.00 0.00 62.75 62.09 2em4 n ILE 16 Cb 0.51 -0.97 0.08 0.00 -0.00 0.00 0.00 39.64 39.26 2em4 n ILE 16 CO 0.00 0.00 0.00 -0.33 -0.00 0.00 0.00 176.55 176.22 2em4 h GLU 17 N 0.00 -0.03 0.00 0.38 3.07 -1.97 -3.31 114.58 112.72 2em4 h GLU 17 Ca -0.52 0.00 -0.12 0.00 -0.50 0.00 0.00 59.36 58.22 2em4 h GLU 17 Cb 1.97 0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 29.87 2em4 h GLU 17 CO -0.03 -0.02 -1.41 0.00 -1.40 0.00 0.00 179.01 176.15 2em4 n GLY 19 N 2.90 0.69 3.50 0.00 0.00 -1.11 -5.11 105.19 106.07 2em4 n GLY 19 Ca -0.14 -0.69 -0.25 0.00 0.00 0.00 0.00 46.02 44.94 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 -0.54 1.94 0.02 1.61 -0.14 -1.07 -4.92 119.74 116.64 2em4 s LYS 20 Ca 0.00 -2.18 0.03 0.00 -1.36 0.00 0.00 55.97 52.45 2em4 s LYS 20 Cb 0.00 -0.49 -0.01 0.00 -1.68 0.00 0.00 37.83 35.64 2em4 s LYS 20 CO 0.00 -0.52 -0.09 0.00 -0.76 0.00 0.00 175.35 173.98 2em4 s ALA 21 N -3.22 0.74 0.25 5.17 0.00 -1.26 -0.21 121.76 123.23 2em4 s ALA 21 Ca 0.25 -0.56 0.02 0.00 0.00 0.00 0.00 51.96 51.66 2em4 s ALA 21 Cb 0.02 -0.11 -0.05 0.00 0.00 0.00 0.00 23.12 22.98 2em4 s ALA 21 CO 0.16 0.12 0.08 -0.06 0.00 0.00 0.00 175.76 176.06 2em4 s PHE 22 N -0.67 1.54 -0.06 0.00 0.40 0.28 -4.97 117.98 114.50 2em4 s PHE 22 Ca -0.01 -1.14 -0.23 0.00 -0.60 0.00 0.00 56.93 54.96 2em4 s PHE 22 Cb -0.06 -0.90 -0.18 0.00 0.51 0.00 0.00 43.02 42.39 2em4 s PHE 22 CO 0.00 -0.29 0.92 -0.22 0.70 0.00 0.00 175.22 176.33 2em4 h LYS 23 N 2.40 -0.13 0.00 0.44 3.11 -1.99 -3.36 116.57 117.04 2em4 h LYS 23 Ca -0.38 0.01 -0.36 0.00 -2.81 0.00 0.00 60.65 57.11 2em4 h LYS 23 Cb 1.24 0.03 -0.08 0.00 -1.00 0.00 0.00 32.23 32.42 2em4 h LYS 23 CO 0.62 0.39 -0.31 -2.37 -2.81 0.00 0.00 179.45 174.96 2em4 n THR 24 N -4.86 0.00 -0.07 1.00 5.66 -1.26 -4.67 114.28 110.08 2em4 n THR 24 Ca -0.08 -1.61 -0.15 0.00 -3.05 0.00 0.00 64.05 59.15 2em4 n THR 24 Cb 0.29 0.66 -0.05 0.00 -1.55 0.00 0.00 70.33 69.68 2em4 n THR 24 CO 0.00 0.00 0.00 0.11 -3.05 0.00 0.00 175.07 172.13 2em4 h LYS 25 N 0.00 0.85 -0.90 1.09 1.57 -1.97 -2.80 116.57 114.41 2em4 h LYS 25 Ca -0.19 -0.55 0.24 0.00 -1.87 0.00 0.00 60.65 58.28 2em4 h LYS 25 Cb 0.81 0.07 -0.14 0.00 0.08 0.00 0.00 32.23 33.06 2em4 h LYS 25 CO 0.30 1.18 0.34 0.77 -0.57 0.00 0.00 179.45 181.46 2em4 h SER 26 N 0.62 0.19 0.11 0.86 0.02 -1.99 0.63 113.55 113.99 2em4 h SER 26 Ca 0.01 0.18 -0.01 0.00 -0.84 0.00 0.00 61.79 61.13 2em4 h SER 26 Cb 1.15 0.20 0.00 0.00 0.14 0.00 0.00 62.40 63.89 2em4 h SER 26 CO 0.12 -0.10 -0.05 -1.28 -1.14 0.00 0.00 176.83 174.38 2em4 h SER 27 N 0.29 -0.12 0.30 3.07 0.87 -1.98 -3.25 113.55 112.73 2em4 h SER 27 Ca 0.58 -0.43 -0.01 0.00 -1.23 0.00 0.00 61.79 60.70 2em4 h SER 27 Cb 1.16 0.03 -0.02 0.00 -0.44 0.00 0.00 62.40 63.14 2em4 h SER 27 CO -0.60 0.50 -0.35 0.25 -0.53 0.00 0.00 176.83 176.10 2em4 h LEU 28 N -0.90 -0.99 -0.73 2.23 5.85 -1.06 -2.31 115.31 117.42 2em4 h LEU 28 Ca -0.01 0.08 0.10 0.00 0.84 0.00 0.00 57.88 58.89 2em4 h LEU 28 Cb 0.54 0.33 -0.11 0.00 0.37 0.00 0.00 40.66 41.80 2em4 h LEU 28 CO 0.02 -0.45 -0.33 -0.38 -0.34 0.00 0.00 178.44 176.97 2em4 n ILE 29 N -4.51 -0.42 -0.09 4.05 5.41 0.21 0.11 119.36 124.13 2em4 n ILE 29 Ca -0.08 1.72 -0.06 0.00 1.00 0.00 0.00 62.75 65.33 2em4 n ILE 29 Cb 0.31 -2.23 0.00 0.00 -0.71 0.00 0.00 39.64 37.01 2em4 n ILE 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2em4 h HIS 31 N 0.03 -0.13 -0.94 0.00 -0.00 0.14 -2.86 115.15 111.40 2em4 h HIS 31 Ca 0.15 0.00 0.16 0.00 -0.00 0.00 0.00 60.37 60.69 2em4 h HIS 31 Cb 0.23 0.06 -0.16 0.00 -0.00 0.00 0.00 27.41 27.53 2em4 h HIS 31 CO -0.27 -0.08 -0.31 0.54 -0.00 0.00 0.00 177.93 177.81 2em4 n ARG 32 N -5.16 -0.16 -0.25 5.26 1.74 0.73 0.19 116.66 119.01 2em4 n ARG 32 Ca -0.06 1.45 0.07 0.00 -0.77 0.00 0.00 57.85 58.54 2em4 n ARG 32 Cb 0.09 -2.15 0.32 0.00 -1.02 0.00 0.00 32.46 29.70 2em4 n ARG 32 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2em4 h ARG 33 N 0.00 0.80 -1.60 5.56 3.08 -1.36 -1.87 114.38 118.99 2em4 h ARG 33 Ca 0.38 -0.05 0.46 0.00 0.07 0.00 0.00 59.98 60.84 2em4 h ARG 33 Cb 0.61 -0.18 -0.06 0.00 0.08 0.00 0.00 29.97 30.42 2em4 h ARG 33 CO -0.94 0.53 1.30 0.45 -1.07 0.00 0.00 179.97 180.24 2em4 n SER 34 N -4.51 0.00 -2.26 7.04 2.88 0.51 -0.69 113.62 116.60 2em4 n SER 34 Ca 0.14 0.88 -0.19 0.00 -1.33 0.00 0.00 58.87 58.36 2em4 n SER 34 Cb 0.29 -0.40 -0.12 0.00 -0.75 0.00 0.00 64.21 63.23 2em4 n SER 34 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 2em4 n HIS 35 N -3.61 0.74 0.00 0.66 8.25 -0.70 -4.60 115.22 115.96 2em4 n HIS 35 Ca 0.36 -1.74 -0.10 0.00 -0.26 0.00 0.00 57.72 55.98 2em4 n HIS 35 Cb 1.78 -1.54 -0.05 0.00 1.12 0.00 0.00 29.99 31.31 2em4 n HIS 35 CO 0.00 0.00 0.00 1.79 0.64 0.00 0.00 176.34 178.77 2em4 h THR 36 N 2.03 0.94 -2.35 1.59 1.35 -1.18 -3.37 112.91 111.93 2em4 h THR 36 Ca 0.30 -0.01 -0.58 0.00 -0.55 0.00 0.00 66.41 65.56 2em4 h THR 36 Cb 1.15 0.90 -0.38 0.00 -1.73 0.00 0.00 68.15 68.09 2em4 h THR 36 CO 0.55 0.01 -0.96 -0.83 -0.25 0.00 0.00 175.52 174.03 2em4 s GLY 37 N -2.35 1.11 0.16 5.82 0.00 -1.26 -5.11 107.32 105.69 2em4 s GLY 37 Ca -0.13 -2.36 -0.31 0.00 0.00 0.00 0.00 44.72 41.92 2em4 s GLY 37 CO 0.67 2.16 1.42 -0.54 0.00 0.00 0.00 173.10 176.81 2em4 s GLU 38 N 0.15 4.30 -0.52 2.90 2.02 -1.26 -4.98 118.70 121.31 2em4 s GLU 38 Ca 0.32 2.17 0.04 0.00 0.02 0.00 0.00 54.97 57.52 2em4 s GLU 38 Cb 0.02 -3.19 0.17 0.00 0.10 0.00 0.00 34.13 31.22 2em4 s GLU 38 CO -0.18 -0.43 0.39 0.21 0.02 0.00 0.00 175.26 175.26 2em4 s LYS 39 N 0.63 1.49 1.04 1.61 2.20 -1.26 -5.12 119.74 120.33 2em4 s LYS 39 Ca 0.63 -2.54 -0.13 0.00 -0.36 0.00 0.00 55.97 53.57 2em4 s LYS 39 Cb -0.39 -2.21 0.21 0.00 -1.51 0.00 0.00 37.83 33.93 2em4 s LYS 39 CO 0.34 -1.33 1.09 -1.25 -0.36 0.00 0.00 175.35 173.84 2em4 s PRO 40 N -0.46 0.09 -1.22 4.03 0.04 -1.26 -4.94 135.00 131.27 2em4 s PRO 40 Ca 0.29 0.41 -0.13 0.00 0.04 0.00 0.00 61.00 61.60 2em4 s PRO 40 Cb -0.02 -1.71 0.17 0.00 0.04 0.00 0.00 34.50 32.99 2em4 s PRO 40 CO -0.17 -2.94 1.51 0.43 0.04 0.00 0.00 177.00 175.87 2em4 n SER 41 N -4.30 5.20 -1.66 6.66 7.64 -1.26 -4.90 113.62 121.00 2em4 n SER 41 Ca 0.06 -3.00 0.00 0.00 1.01 0.00 0.00 58.87 56.94 2em4 n SER 41 Cb 0.58 -1.56 0.00 0.00 -1.01 0.00 0.00 64.21 62.21 2em4 n SER 41 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2em4 n GLY 42 N 3.93 -4.33 0.00 0.23 0.00 -1.26 -4.51 105.19 99.24 2em4 n GLY 42 Ca 0.38 -0.76 0.07 0.00 0.00 0.00 0.00 46.02 45.71 2em4 n GLY 42 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2em4 n PRO 43 N -1.98 0.13 -1.50 1.61 -0.04 -1.26 -4.85 135.00 127.12 2em4 n PRO 43 Ca 0.00 0.19 -0.42 0.00 -0.04 0.00 0.00 63.50 63.22 2em4 n PRO 43 Cb 0.31 -1.50 0.01 0.00 -0.04 0.00 0.00 33.50 32.27 2em4 n PRO 43 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2em4 n SER 44 N -1.36 -0.25 -4.96 3.54 3.41 -1.26 -4.99 113.62 107.75 2em4 n SER 44 Ca 0.06 0.97 -0.21 0.00 -0.26 0.00 0.00 58.87 59.42 2em4 n SER 44 Cb 0.14 -1.17 0.01 0.00 -0.26 0.00 0.00 64.21 62.93 2em4 n SER 44 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2em4 s SER 45 N -0.88 5.05 0.00 4.04 1.04 -1.26 -5.08 113.70 116.60 2em4 s SER 45 Ca 0.63 -0.86 0.00 0.00 0.48 0.00 0.00 55.95 56.20 2em4 s SER 45 Cb -0.62 -0.03 0.00 0.00 0.10 0.00 0.00 66.02 65.48 2em4 s SER 45 CO 0.58 -1.02 0.00 0.61 0.98 0.00 0.00 173.24 174.38