#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 1.17 -0.70 1.61 1.04 -1.26 -5.10 113.70 110.47 2em4 s SER 2 Ca 0.00 0.03 -0.27 0.00 0.48 0.00 0.00 55.95 56.19 2em4 s SER 2 Cb 0.00 -0.22 0.01 0.00 0.10 0.00 0.00 66.02 65.91 2em4 s SER 2 CO 0.00 -0.22 1.50 -0.44 0.98 0.00 0.00 173.24 175.06 2em4 s SER 3 N 2.00 5.83 0.00 7.02 0.01 -1.26 -3.82 113.70 123.47 2em4 s SER 3 Ca 0.03 -0.17 0.00 0.00 1.31 0.00 0.00 55.95 57.13 2em4 s SER 3 Cb -0.12 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.56 2em4 s SER 3 CO -0.04 -2.04 0.00 0.61 0.41 0.00 0.00 173.24 172.18 2em4 n GLY 4 N 5.52 0.82 1.58 3.44 0.00 -1.26 -5.08 105.19 110.21 2em4 n GLY 4 Ca 0.10 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.91 2em4 n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2em4 n SER 5 N 0.00 0.11 -3.79 1.61 2.88 -1.25 -4.99 113.62 108.19 2em4 n SER 5 Ca 0.00 0.11 -0.29 0.00 -1.33 0.00 0.00 58.87 57.36 2em4 n SER 5 Cb 0.00 0.03 -0.13 0.00 -0.75 0.00 0.00 64.21 63.37 2em4 n SER 5 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2em4 s SER 6 N -5.13 3.93 -0.42 -3.46 0.01 -1.26 -5.00 113.70 102.38 2em4 s SER 6 Ca 0.00 -3.19 0.04 0.00 1.31 0.00 0.00 55.95 54.11 2em4 s SER 6 Cb 0.00 -1.31 0.17 0.00 0.21 0.00 0.00 66.02 65.10 2em4 s SER 6 CO 0.00 -0.18 0.37 0.61 0.41 0.00 0.00 173.24 174.44 2em4 n GLY 7 N 2.82 2.00 0.10 3.44 0.00 -1.26 -4.93 105.19 107.36 2em4 n GLY 7 Ca 0.14 -1.21 0.06 0.00 0.00 0.00 0.00 46.02 45.01 2em4 n GLY 7 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2em4 n THR 8 N 2.80 0.82 0.00 2.61 5.66 -1.26 -4.98 114.28 119.92 2em4 n THR 8 Ca 0.29 -0.61 0.00 0.00 -3.05 0.00 0.00 64.05 60.68 2em4 n THR 8 Cb 0.49 -0.48 0.00 0.00 -1.55 0.00 0.00 70.33 68.79 2em4 n THR 8 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2em4 n GLY 9 N 1.29 2.32 3.38 1.09 0.00 -1.26 -5.11 105.19 106.90 2em4 n GLY 9 Ca -0.05 0.09 -0.45 0.00 0.00 0.00 0.00 46.02 45.61 2em4 n GLY 9 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2em4 s GLN 10 N -0.39 3.05 0.16 1.61 -0.21 -1.26 -5.03 119.66 117.59 2em4 s GLN 10 Ca 0.00 -1.28 0.09 0.00 0.02 0.00 0.00 55.36 54.19 2em4 s GLN 10 Cb 0.00 -4.21 -0.04 0.00 1.00 0.00 0.00 33.01 29.76 2em4 s GLN 10 CO 0.00 -1.35 -0.15 1.03 -2.12 0.00 0.00 175.29 172.70 2em4 s ARG 11 N 2.34 1.88 0.00 2.91 1.81 -1.26 -5.01 118.95 121.62 2em4 s ARG 11 Ca 0.10 -1.28 0.15 0.00 -1.72 0.00 0.00 55.73 52.98 2em4 s ARG 11 Cb -0.24 -2.09 0.79 0.00 -0.45 0.00 0.00 34.95 32.96 2em4 s ARG 11 CO 0.07 0.44 1.40 -0.35 -0.68 0.00 0.00 175.30 176.18 2em4 n PRO 12 N 0.34 0.27 -3.60 3.54 -0.04 -1.26 -4.45 135.00 129.80 2em4 n PRO 12 Ca -0.13 0.12 -0.23 0.00 -0.04 0.00 0.00 63.50 63.22 2em4 n PRO 12 Cb 0.55 -1.50 -0.16 0.00 -0.04 0.00 0.00 33.50 32.34 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 -2.45 0.04 -0.02 0.54 2.02 -1.25 -5.05 117.35 111.18 2em4 s TYR 13 Ca 0.16 -0.04 0.03 0.00 -0.37 0.00 0.00 57.07 56.84 2em4 s TYR 13 Cb 0.10 -0.56 0.00 0.00 -0.40 0.00 0.00 41.96 41.11 2em4 s TYR 13 CO 0.22 -0.47 -0.09 -1.21 -1.57 0.00 0.00 175.55 172.43 2em4 s GLU 14 N 2.20 0.93 -0.04 -0.62 2.02 -1.26 -0.71 118.70 121.22 2em4 s GLU 14 Ca 0.04 -0.31 -0.27 0.00 0.02 0.00 0.00 54.97 54.44 2em4 s GLU 14 Cb -0.15 -0.88 -0.03 0.00 0.10 0.00 0.00 34.13 33.17 2em4 s GLU 14 CO -0.09 0.13 0.87 0.00 0.02 0.00 0.00 175.26 176.19 2em4 n ILE 16 N 3.92 1.58 -0.14 0.00 3.06 -1.26 -2.14 119.36 124.38 2em4 n ILE 16 Ca 0.03 -0.79 -0.12 0.00 -2.50 0.00 0.00 62.75 59.37 2em4 n ILE 16 Cb 0.51 -0.99 -0.08 0.00 0.54 0.00 0.00 39.64 39.62 2em4 n ILE 16 CO 0.00 0.00 0.00 -0.33 -2.50 0.00 0.00 176.55 173.72 2em4 h GLU 17 N 0.01 -0.35 0.00 9.51 4.39 -1.99 -3.35 114.58 122.80 2em4 h GLU 17 Ca -0.35 0.02 -0.20 0.00 0.34 0.00 0.00 59.36 59.18 2em4 h GLU 17 Cb 2.06 0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 30.75 2em4 h GLU 17 CO 0.07 -0.23 -1.70 0.00 -1.16 0.00 0.00 179.01 175.99 2em4 n GLY 19 N 2.57 0.62 3.46 0.00 0.00 -0.94 -5.11 105.19 105.79 2em4 n GLY 19 Ca -0.23 -0.57 -0.23 0.00 0.00 0.00 0.00 46.02 44.99 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 1.79 -0.11 1.61 -0.14 -0.91 -4.91 119.74 117.07 2em4 s LYS 20 Ca 0.00 -2.05 -0.05 0.00 -1.36 0.00 0.00 55.97 52.50 2em4 s LYS 20 Cb 0.00 -0.57 0.05 0.00 -1.68 0.00 0.00 37.83 35.63 2em4 s LYS 20 CO 0.00 -0.40 0.25 0.00 -0.76 0.00 0.00 175.35 174.44 2em4 s ALA 21 N -3.32 -0.57 0.20 5.17 0.00 -1.26 0.46 121.76 122.45 2em4 s ALA 21 Ca 0.29 1.00 0.09 0.00 0.00 0.00 0.00 51.96 53.34 2em4 s ALA 21 Cb 0.05 -0.68 -0.05 0.00 0.00 0.00 0.00 23.12 22.44 2em4 s ALA 21 CO 0.15 -0.25 -0.17 -0.06 0.00 0.00 0.00 175.76 175.44 2em4 s PHE 22 N 1.40 1.84 -0.07 0.00 0.40 0.11 -5.00 117.98 116.66 2em4 s PHE 22 Ca -0.08 -0.50 -0.27 0.00 -0.60 0.00 0.00 56.93 55.48 2em4 s PHE 22 Cb -0.11 -0.86 -0.23 0.00 0.51 0.00 0.00 43.02 42.34 2em4 s PHE 22 CO -0.09 0.41 1.06 0.87 0.70 0.00 0.00 175.22 178.17 2em4 h LYS 23 N 2.75 0.04 -6.21 0.44 1.57 -2.00 -3.33 116.57 109.82 2em4 h LYS 23 Ca -0.40 -0.03 -0.54 0.00 -1.87 0.00 0.00 60.65 57.81 2em4 h LYS 23 Cb 1.22 0.01 -0.07 0.00 0.08 0.00 0.00 32.23 33.47 2em4 h LYS 23 CO 0.58 0.73 -0.58 0.95 -0.57 0.00 0.00 179.45 180.57 2em4 s THR 24 N -3.39 4.12 0.06 -0.16 -4.23 -1.26 -4.74 115.64 106.05 2em4 s THR 24 Ca -0.17 -1.48 -0.15 0.00 -1.18 0.00 0.00 61.69 58.70 2em4 s THR 24 Cb 0.00 -3.19 -0.21 0.00 1.34 0.00 0.00 72.50 70.44 2em4 s THR 24 CO 0.69 -0.29 1.20 0.50 -0.54 0.00 0.00 174.62 176.18 2em4 h LYS 25 N 1.87 0.65 -0.89 3.99 3.64 -1.97 -3.17 116.57 120.70 2em4 h LYS 25 Ca -0.47 -0.64 0.20 0.00 -1.27 0.00 0.00 60.65 58.47 2em4 h LYS 25 Cb 1.23 0.17 -0.12 0.00 -0.41 0.00 0.00 32.23 33.10 2em4 h LYS 25 CO 0.61 1.24 0.42 0.66 -2.27 0.00 0.00 179.45 180.11 2em4 h SER 26 N 0.31 0.42 -0.09 4.20 4.64 -2.00 0.29 113.55 121.31 2em4 h SER 26 Ca -0.09 0.13 -0.12 0.00 -0.47 0.00 0.00 61.79 61.24 2em4 h SER 26 Cb 1.50 0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 63.66 2em4 h SER 26 CO 0.17 0.07 -0.34 0.77 -0.87 0.00 0.00 176.83 176.63 2em4 h SER 27 N 0.48 0.61 0.20 4.97 4.64 -1.99 -3.24 113.55 119.22 2em4 h SER 27 Ca 0.54 -0.25 -0.01 0.00 -0.47 0.00 0.00 61.79 61.60 2em4 h SER 27 Cb 0.96 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 62.88 2em4 h SER 27 CO -0.48 0.91 -0.10 0.25 -0.87 0.00 0.00 176.83 176.55 2em4 h LEU 28 N 0.50 -0.23 -0.89 5.97 5.85 -0.56 -3.23 115.31 122.73 2em4 h LEU 28 Ca 0.05 -0.27 0.14 0.00 0.84 0.00 0.00 57.88 58.64 2em4 h LEU 28 Cb 0.83 0.06 -0.15 0.00 0.37 0.00 0.00 40.66 41.77 2em4 h LEU 28 CO 0.07 0.19 -0.33 -0.38 -0.34 0.00 0.00 178.44 177.65 2em4 n ILE 29 N -5.03 -0.46 -0.32 4.05 5.41 0.57 0.19 119.36 123.78 2em4 n ILE 29 Ca -0.09 2.07 0.11 0.00 1.00 0.00 0.00 62.75 65.85 2em4 n ILE 29 Cb 0.25 -2.75 0.33 0.00 -0.71 0.00 0.00 39.64 36.76 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 0.78 0.33 0.42 0.00 -0.00 0.21 -1.88 115.15 115.02 2em4 h HIS 31 Ca 0.50 -0.10 -0.02 0.00 -0.00 0.00 0.00 60.37 60.75 2em4 h HIS 31 Cb 0.73 -0.07 0.00 0.00 -0.00 0.00 0.00 27.41 28.08 2em4 h HIS 31 CO -0.00 0.70 -0.20 0.00 -0.00 0.00 0.00 177.93 178.43 2em4 h ARG 32 N -0.15 -0.54 -0.35 5.26 2.47 0.03 -2.48 114.38 118.62 2em4 h ARG 32 Ca 0.01 0.04 0.07 0.00 -1.26 0.00 0.00 59.98 58.84 2em4 h ARG 32 Cb 0.66 0.12 -0.02 0.00 -1.65 0.00 0.00 29.97 29.08 2em4 h ARG 32 CO 0.03 -0.32 0.24 0.07 0.56 0.00 0.00 179.97 180.55 2em4 h ARG 33 N -0.65 0.18 -0.52 0.04 -0.00 -0.70 -1.70 114.38 111.04 2em4 h ARG 33 Ca -0.06 -0.01 -0.04 0.00 -0.00 0.00 0.00 59.98 59.88 2em4 h ARG 33 Cb 0.48 -0.04 -0.02 0.00 -0.00 0.00 0.00 29.97 30.38 2em4 h ARG 33 CO 0.09 0.12 0.19 1.03 -0.00 0.00 0.00 179.97 181.40 2em4 h SER 34 N 0.19 0.74 -0.27 0.08 0.87 -0.96 0.68 113.55 114.88 2em4 h SER 34 Ca 0.16 -0.19 0.03 0.00 -1.23 0.00 0.00 61.79 60.56 2em4 h SER 34 Cb 0.39 -0.19 -0.04 0.00 -0.44 0.00 0.00 62.40 62.12 2em4 h SER 34 CO -0.03 0.73 -0.26 0.45 -0.53 0.00 0.00 176.83 177.19 2em4 h HIS 35 N 0.71 -0.80 0.00 2.24 3.86 -0.87 -2.11 115.15 118.17 2em4 h HIS 35 Ca 0.17 0.04 -0.17 0.00 -1.16 0.00 0.00 60.37 59.25 2em4 h HIS 35 Cb 0.24 0.39 -0.02 0.00 1.06 0.00 0.00 27.41 29.07 2em4 h HIS 35 CO 0.01 -0.21 -0.83 0.00 0.86 0.00 0.00 177.93 177.76 2em4 h THR 36 N -0.12 1.55 0.00 2.45 1.03 -1.64 -3.46 112.91 112.71 2em4 h THR 36 Ca 0.05 -2.90 0.00 0.00 -0.01 0.00 0.00 66.41 63.54 2em4 h THR 36 Cb 0.24 2.59 0.00 0.00 -1.07 0.00 0.00 68.15 69.91 2em4 h THR 36 CO -0.32 0.82 0.00 0.61 -0.01 0.00 0.00 175.52 176.62 2em4 n GLY 37 N 0.99 0.63 3.56 2.99 0.00 0.24 -4.57 105.19 109.04 2em4 n GLY 37 Ca -0.00 0.83 -0.45 0.00 0.00 0.00 0.00 46.02 46.40 2em4 n GLY 37 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2em4 n GLU 38 N 0.00 1.13 -3.40 1.61 4.07 -1.26 -2.46 120.64 120.33 2em4 n GLU 38 Ca 0.00 0.40 -0.17 0.00 -0.06 0.00 0.00 57.16 57.32 2em4 n GLU 38 Cb 0.00 -1.72 0.07 0.00 -0.06 0.00 0.00 31.44 29.74 2em4 n GLU 38 CO 0.00 0.00 0.00 1.17 -0.06 0.00 0.00 177.13 178.24 2em4 n LYS 39 N 0.84 -4.43 -0.77 5.31 4.81 -1.26 -5.00 118.16 117.65 2em4 n LYS 39 Ca 0.11 0.81 -0.22 0.00 -0.87 0.00 0.00 58.31 58.14 2em4 n LYS 39 Cb 0.30 -5.69 0.19 0.00 0.02 0.00 0.00 35.03 29.85 2em4 n LYS 39 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 2em4 n PRO 40 N -3.79 -2.62 -1.54 1.64 -0.04 -1.03 -4.81 135.00 122.81 2em4 n PRO 40 Ca -0.19 -1.30 -0.35 0.00 -0.04 0.00 0.00 63.50 61.61 2em4 n PRO 40 Cb 0.65 -1.22 -0.07 0.00 -0.04 0.00 0.00 33.50 32.82 2em4 n PRO 40 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2em4 n SER 41 N -4.40 1.73 -0.40 3.54 7.64 -1.26 -4.61 113.62 115.86 2em4 n SER 41 Ca 0.11 -0.44 0.05 0.00 1.01 0.00 0.00 58.87 59.60 2em4 n SER 41 Cb 0.44 -1.42 -0.02 0.00 -1.01 0.00 0.00 64.21 62.20 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 6.17 -1.72 3.69 0.23 0.00 -1.26 -4.93 105.19 107.37 2em4 n GLY 42 Ca 0.45 -1.42 -0.29 0.00 0.00 0.00 0.00 46.02 44.76 2em4 n GLY 42 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2em4 s PRO 43 N -1.74 0.77 -0.19 1.61 0.04 -1.26 -4.99 135.00 129.25 2em4 s PRO 43 Ca 0.00 0.65 -0.04 0.00 0.04 0.00 0.00 61.00 61.64 2em4 s PRO 43 Cb 0.00 -1.77 0.08 0.00 0.04 0.00 0.00 34.50 32.85 2em4 s PRO 43 CO 0.00 -2.53 0.15 0.45 0.04 0.00 0.00 177.00 175.11 2em4 s SER 44 N -3.44 1.94 0.36 6.66 0.15 -1.26 -5.06 113.70 113.05 2em4 s SER 44 Ca 0.65 -0.46 0.04 0.00 0.70 0.00 0.00 55.95 56.87 2em4 s SER 44 Cb -0.18 0.03 -0.03 0.00 -1.71 0.00 0.00 66.02 64.13 2em4 s SER 44 CO 0.57 -0.34 0.14 -0.94 1.20 0.00 0.00 173.24 173.87 2em4 s SER 45 N 2.22 2.23 0.00 5.45 1.04 -1.26 -5.22 113.70 118.16 2em4 s SER 45 Ca 0.04 -1.61 0.31 0.00 0.48 0.00 0.00 55.95 55.18 2em4 s SER 45 Cb -0.16 0.40 1.69 0.00 0.10 0.00 0.00 66.02 68.06 2em4 s SER 45 CO -0.11 -0.89 2.11 0.61 0.98 0.00 0.00 173.24 175.94