data_1cmb_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 1cmb _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.884 0 CA-C-O 121.762 0.792 . . . . 99.99 111.553 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -71.0 -35.85 72.23 Favored 'General case' 0 C--O 1.247 0.948 0 N-CA-C 117.673 2.471 . . . . 97.77 117.673 -179.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 21.0 t90 -81.87 122.69 28.05 Favored 'General case' 0 C--N 1.315 -0.933 0 C-N-CA 125.706 1.602 . . . . 50.81 110.92 179.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 75.0 p -68.99 -22.59 64.08 Favored 'General case' 0 C--N 1.298 -1.66 0 C-N-CA 128.097 2.559 . . . . 38.73 115.59 178.577 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 96.3 0.65 61.26 Favored Glycine 0 N--CA 1.48 1.613 0 N-CA-C 109.716 -1.353 . . . . 23.58 109.716 -179.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -86.05 88.22 7.55 Favored 'General case' 0 C--N 1.307 -1.24 0 O-C-N 116.579 -3.895 . . . . 76.16 108.949 179.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -57.48 131.92 51.59 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 117.585 -1.198 . . . . 23.75 114.127 -177.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 77.0 mt -120.96 129.2 75.95 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.064 1 O-C-N 130.53 4.894 . . . . 28.27 105.686 176.319 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.4 t -71.23 128.25 90.51 Favored Pre-proline 0 N--CA 1.49 1.556 0 O-C-N 126.592 2.432 . . . . 16.65 110.594 178.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -78.79 -8.39 15.71 Favored 'Trans proline' 0 C--N 1.32 -0.938 0 O-C-N 119.584 -0.798 . . . . 19.59 110.913 176.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -101.21 154.42 18.77 Favored 'General case' 0 C--O 1.257 1.497 1 C-N-CA 131.881 4.072 . . . . 22.44 115.399 -176.89 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.71 -31.83 52.53 Favored 'General case' 0 N--CA 1.484 1.254 0 O-C-N 118.317 -2.739 . . . . 32.56 115.79 -177.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -133.77 152.28 51.83 Favored 'General case' 0 CA--C 1.505 -0.77 0 CA-C-O 122.544 1.164 . . . . 85.95 113.492 -177.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 42.6 p-80 -169.99 131.7 1.05 Allowed 'General case' 0 C--O 1.25 1.105 0 CA-C-N 112.848 -1.978 . . . . 37.59 105.76 178.267 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 61.43 -124.36 34.59 Favored Glycine 0 N--CA 1.471 0.989 0 N-CA-C 109.356 -1.498 . . . . 33.86 109.356 -179.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -101.11 -0.75 35.62 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-O 124.192 1.949 . . . . 66.0 113.768 179.75 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 38.3 mttm -91.09 136.34 33.15 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-O 125.864 2.745 . . . . 57.6 108.011 -179.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.4 t -141.16 111.43 6.78 Favored 'General case' 0 N--CA 1.478 0.962 0 CA-C-N 110.891 -2.868 . . . . 60.13 107.159 -178.332 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -81.5 146.51 30.16 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 127.067 2.729 . . . . 85.32 109.572 -179.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -74.02 138.15 43.9 Favored 'General case' 0 C--O 1.257 1.49 0 N-CA-C 102.636 -3.098 . . . . 56.38 102.636 176.021 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 6.1 m -121.79 155.64 26.16 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 CA-C-O 125.674 2.654 . . . . 40.2 110.099 179.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 18.2 mttp -123.27 131.66 53.74 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 109.679 -3.419 . . . . 51.91 106.026 177.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 72.9 mttt -98.74 127.24 44.6 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 103.897 -2.631 . . . . 73.78 103.897 178.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 19.7 pt -127.77 153.62 37.29 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.562 0 N-CA-C 105.295 -2.113 . . . . 21.34 105.295 179.201 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 97.9 m -102.39 130.56 49.18 Favored 'General case' 0 C--N 1.305 -1.364 0 O-C-N 128.144 3.403 . . . . 34.74 107.925 175.514 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 44.9 t -110.99 129.46 66.2 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.358 0 C-N-CA 129.275 3.03 . . . . 30.37 114.055 -179.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 72.9 m -85.91 125.79 33.6 Favored 'General case' 0 C--O 1.251 1.157 0 N-CA-C 102.011 -3.329 . . . . 36.28 102.011 174.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . 0.25 6.9 tt -130.41 122.72 20.07 Favored Pre-proline 0 C--N 1.314 -0.943 0 C-N-CA 124.796 1.238 . . . . 20.76 113.702 -177.058 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -55.61 148.61 53.14 Favored 'Trans proline' 0 C--O 1.263 1.771 0 N-CA-C 104.561 -2.9 . . . . 19.69 104.561 177.116 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 32.4 tp -55.94 -46.68 78.46 Favored 'General case' 0 C--O 1.262 1.741 0 N-CA-C 114.295 1.22 . . . . 53.28 114.295 178.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 25.2 mtpt -58.64 -37.78 76.67 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.742 1.015 . . . . 82.21 113.742 179.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 61.4 t -69.53 -41.9 80.6 Favored 'Isoleucine or valine' 0 C--O 1.257 1.454 0 CA-C-O 123.735 1.731 . . . . 14.68 110.958 178.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 51.4 tp -62.91 -35.72 80.99 Favored 'General case' 0 N--CA 1.488 1.434 0 CA-C-O 115.806 -2.045 . . . . 23.81 110.432 -178.106 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.4 tptt -63.27 -41.55 99.03 Favored 'General case' 0 C--N 1.299 -1.601 0 O-C-N 127.494 2.996 . . . . 53.2 108.451 177.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 79.7 mt -69.11 -37.86 77.29 Favored 'Isoleucine or valine' 0 C--O 1.272 2.277 0 CA-C-O 125.792 2.71 . . . . 20.03 112.38 178.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 45.0 tp -64.47 -50.08 68.89 Favored 'General case' 0 C--N 1.323 -0.567 1 O-C-N 116.012 -4.18 . . . . 16.79 108.982 179.545 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 54.7 m -59.03 -43.48 91.63 Favored 'General case' 0 C--O 1.248 0.996 0 C-N-CA 126.861 2.065 . . . . 18.69 111.001 -179.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 88.1 m-20 -59.75 -45.04 93.46 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-O 116.344 -1.789 . . . . 45.54 108.772 176.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 53.7 tp10 -71.59 -36.03 70.73 Favored 'General case' 0 C--O 1.251 1.151 0 C-N-CA 113.053 -3.459 . . . . 28.5 110.017 -179.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 8.4 ttm180 -62.1 -48.74 78.81 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-N 119.393 0.997 . . . . 30.99 108.977 -179.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 22.6 p -66.7 -35.23 79.65 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 125.575 1.797 . . . . 15.51 114.192 178.45 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 19.8 ttp85 -62.45 -42.6 99.58 Favored 'General case' 0 C--O 1.261 1.667 0 O-C-N 118.516 -2.615 . . . . 25.17 107.397 177.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 83.3 mtt180 -63.31 -53.16 57.14 Favored 'General case' 0 C--O 1.241 0.618 1 O-C-N 116.176 -4.077 . . . . 16.19 110.791 177.415 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 -53.71 -48.56 69.46 Favored 'General case' 0 C--O 1.253 1.257 0 CA-C-O 113.831 -2.985 . . . . 50.81 111.332 -178.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . 0.356 2.9 m -71.02 -18.58 20.74 Favored 'Isoleucine or valine' 0 C--O 1.244 0.772 0 CA-C-O 112.54 -3.6 . . . . 27.53 111.538 -178.704 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 -100.56 3.5 42.76 Favored 'General case' 0 C--N 1.307 -1.246 0 O-C-N 125.772 1.92 . . . . 46.32 113.405 178.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 66.58 30.2 8.55 Favored 'General case' 0 C--O 1.242 0.694 0 N-CA-C 115.781 1.771 . . . . 59.65 115.781 177.365 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 96.6 mt -88.3 147.86 24.58 Favored 'General case' 0 C--O 1.252 1.197 1 O-C-N 130.428 4.83 . . . . 26.51 107.435 -179.854 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ARG . . . . . 0.51 ' NH2' ' O ' ' A' ' 80' ' ' ARG . 73.8 mtt-85 -75.43 162.54 28.27 Favored 'General case' 0 C--O 1.251 1.159 0 CA-C-O 123.822 1.772 . . . . 52.89 107.191 177.477 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 60.86 47.25 7.9 Favored 'General case' 0 C--O 1.259 1.562 0 CA-C-N 112.395 -2.184 . . . . 20.62 113.702 175.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -93.33 67.76 4.12 Favored 'General case' 0 C--O 1.256 1.446 0 CA-C-N 109.877 -3.329 . . . . 23.35 111.019 -179.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 65.1 p -145.01 151.5 38.67 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-O 115.464 -2.208 . . . . 18.57 108.264 -179.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -57.49 -42.43 82.67 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 128.679 3.737 . . . . 15.41 108.107 179.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 75.1 m -57.2 -52.77 63.96 Favored 'General case' 0 C--N 1.299 -1.611 0 C-N-CA 124.097 0.959 . . . . 23.69 112.253 -179.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -62.15 -45.6 92.71 Favored 'General case' 0 C--N 1.315 -0.893 0 O-C-N 127.272 2.857 . . . . 19.12 111.096 -179.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 56.9 mt -61.54 -42.63 99.12 Favored 'General case' 0 C--O 1.256 1.42 0 CA-C-O 116.538 -1.696 . . . . 11.19 110.669 177.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 22.6 mt -67.12 -34.85 78.49 Favored 'General case' 0 C--N 1.286 -2.157 0 C-N-CA 125.213 1.405 . . . . 16.4 112.279 -179.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 63.6 m -74.01 -46.29 44.5 Favored 'General case' 0 C--N 1.294 -1.808 0 N-CA-C 106.158 -1.793 . . . . 22.79 106.158 -179.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 65.9 mt-10 -56.77 -49.53 75.0 Favored 'General case' 0 C--O 1.269 2.091 0 O-C-N 126.748 2.53 . . . . 14.9 109.279 177.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.78 -51.39 69.96 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 125.099 1.36 . . . . 11.91 109.937 -178.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -55.7 -51.07 68.55 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-O 115.154 -2.355 . . . . 14.18 110.613 179.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 50.5 mt -59.51 -40.31 86.66 Favored 'General case' 0 C--N 1.295 -1.778 0 CA-C-N 122.419 2.372 . . . . 12.95 109.929 177.91 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 49.1 t-80 -59.52 -55.85 29.43 Favored 'General case' 0 C--O 1.259 1.584 0 O-C-N 124.33 1.019 . . . . 19.34 113.514 179.766 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -67.06 -43.13 83.46 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-O 115.661 -2.114 . . . . 17.76 113.375 -177.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . 0.362 90.0 m-85 -95.18 -15.4 23.32 Favored 'General case' 0 C--O 1.253 1.28 0 CA-C-O 113.09 -3.338 . . . . 31.77 115.834 -177.043 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.6 p -121.83 -16.08 7.72 Favored 'General case' 0 C--O 1.247 0.961 0 O-C-N 125.925 2.016 . . . . 21.95 109.921 178.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.81 12.77 83.14 Favored Glycine 0 C--O 1.243 0.666 0 C-N-CA 125.024 1.297 . . . . 14.46 111.174 179.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 38.0 tt0 -67.54 128.37 93.56 Favored Pre-proline 0 N--CA 1.5 2.071 0 CA-C-O 116.507 -1.711 . . . . 22.47 109.438 -179.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_exo -54.55 140.83 75.08 Favored 'Trans proline' 0 C--N 1.312 -1.385 0 O-C-N 125.449 2.289 . . . . 14.67 117.297 -179.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 28.3 mt -80.16 156.03 74.4 Favored Pre-proline 0 CA--C 1.542 0.664 0 O-C-N 124.853 1.346 . . . . 27.87 108.478 175.173 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -72.8 149.32 47.83 Favored 'Trans proline' 0 C--O 1.247 0.958 0 C-N-CA 120.463 0.775 . . . . 26.36 112.064 175.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.31 0.4 OUTLIER -101.66 169.96 8.49 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 102.815 -3.032 . . . . 69.77 102.815 176.448 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -47.73 -50.64 24.75 Favored 'General case' 0 C--O 1.252 1.225 0 N-CA-C 114.852 1.427 . . . . 33.39 114.852 -179.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -50.03 -36.88 30.59 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 122.898 1.332 . . . . 31.54 113.241 -179.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 74.7 m-20 -68.33 -29.52 68.29 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 127.17 2.188 . . . . 25.22 110.071 -179.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 84.9 mt -97.64 4.64 50.08 Favored 'General case' 0 C--O 1.257 1.464 0 N-CA-C 117.256 2.317 . . . . 32.7 117.256 -178.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 28.1 mmt180 -67.52 141.52 56.86 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 108.466 -0.939 . . . . 83.37 108.466 178.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 67.2 mttt -71.02 -12.93 61.8 Favored 'General case' 0 C--O 1.248 1.006 0 CA-C-O 116.197 -1.859 . . . . 76.29 111.22 -179.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -86.11 -1.97 57.9 Favored 'General case' 0 C--O 1.254 1.311 0 CA-C-N 120.906 1.684 . . . . 99.99 112.39 179.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ARG . . . . . 0.51 ' O ' ' NH2' ' A' ' 49' ' ' ARG . 39.1 ttt-85 -108.59 149.36 29.0 Favored 'General case' 0 C--O 1.249 1.069 0 N-CA-C 104.766 -2.309 . . . . 67.1 104.766 178.979 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 15.9 m -73.07 153.19 40.94 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 103.578 -2.749 . . . . 67.27 103.578 178.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -80.09 86.38 5.55 Favored 'General case' 0 C--N 1.317 -0.821 0 O-C-N 125.711 1.882 . . . . 42.99 109.434 179.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLU . . . . . 0.445 ' OE1' ' NZ ' ' A' ' 89' ' ' LYS . 4.1 mt-10 -121.89 -172.71 2.49 Favored 'General case' 0 C--N 1.32 -0.697 0 O-C-N 126.37 2.294 . . . . 71.93 111.728 179.857 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 58.6 mt -59.42 137.77 89.05 Favored Pre-proline 0 C--N 1.313 -1.009 0 C-N-CA 126.751 2.021 . . . . 27.26 110.576 176.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_exo -50.07 140.7 31.84 Favored 'Trans proline' 0 C--N 1.325 -0.678 0 C-N-CA 122.933 2.422 . . . . 20.36 107.278 178.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -57.97 -43.16 86.33 Favored 'General case' 0 C--O 1.252 1.212 0 O-C-N 124.944 1.402 . . . . 43.08 110.292 -179.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.31 -30.78 70.71 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 120.723 -1.236 . . . . 41.23 111.591 -179.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.08 -44.75 65.08 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 106.669 -1.604 . . . . 23.86 106.669 179.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LYS . . . . . 0.445 ' NZ ' ' OE1' ' A' ' 83' ' ' GLU . 83.3 mttt -57.32 -43.12 83.03 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 125.483 1.739 . . . . 34.04 108.23 179.273 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -52.7 -53.95 40.39 Favored 'General case' 0 C--O 1.249 1.058 0 O-C-N 128.636 3.71 . . . . 71.51 113.056 -178.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 26.7 mt -63.4 -38.3 81.8 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.566 0 CA-C-O 113.623 -3.084 . . . . 33.7 113.192 179.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 36.4 mtp -62.15 -46.66 88.01 Favored 'General case' 0 CA--C 1.543 0.674 1 O-C-N 129.737 4.398 . . . . 19.2 107.47 179.949 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ARG . . . . . 0.717 ' NH1' ' O ' ' A' ' 125' ' ' HOH . 31.9 mtm-85 -63.48 -38.33 90.71 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-O 116.79 -1.576 . . . . 47.98 112.804 -179.189 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 88.3 mt-10 -64.58 -24.76 67.7 Favored 'General case' 0 C--N 1.311 -1.097 0 O-C-N 126.616 2.448 . . . . 48.97 111.848 178.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 79.3 mtp -100.91 10.88 40.59 Favored 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 124.618 1.167 . . . . 52.94 110.494 178.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 70.68 27.67 72.09 Favored Glycine 0 C--O 1.248 0.988 0 C-N-CA 126.221 1.867 . . . . 32.84 116.917 -179.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 30.8 mt -106.17 129.39 59.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 N-CA-C 103.018 -2.956 . . . . 30.53 103.018 179.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -84.26 113.91 51.38 Favored Pre-proline 0 N--CA 1.481 1.081 0 O-C-N 128.203 3.439 . . . . 46.21 107.595 177.708 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -65.24 -26.12 56.93 Favored 'Trans proline' 0 C--N 1.313 -1.298 0 O-C-N 125.828 2.488 . . . . 30.26 115.239 -179.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -71.74 -24.82 61.85 Favored 'General case' 0 C--N 1.313 -1.001 0 C-N-CA 127.347 2.259 . . . . 78.97 113.337 -178.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 35.8 p -112.64 5.75 17.93 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 116.39 -1.766 . . . . 31.89 107.764 -178.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' TRP . . . . . . . . . . . . . 73.1 t-105 -73.42 135.25 44.17 Favored 'General case' 0 N--CA 1.484 1.241 0 O-C-N 127.695 3.122 . . . . 29.53 109.5 179.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -112.88 133.86 54.67 Favored 'General case' 0 C--N 1.319 -0.74 0 O-C-N 126.162 2.163 . . . . 99.99 108.366 -178.333 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 36.2 p90 . . . . . 0 N--CA 1.493 1.725 1 O-C-N 129.411 4.195 . . . . 37.55 111.769 -178.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.927 0 N-CA-C 109.805 -0.443 . . . . 96.31 109.805 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -119.03 -177.67 3.39 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-O 126.015 2.817 . . . . 79.92 113.177 179.961 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' TRP . . . . . . . . . . . . . 23.1 t90 -72.55 148.82 44.59 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 100.752 -3.795 . . . . 54.85 100.752 177.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 81.1 p -79.77 -8.75 59.45 Favored 'General case' 0 C--N 1.297 -1.675 0 O-C-N 124.092 0.87 . . . . 38.51 112.608 -179.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 92.13 -2.83 75.9 Favored Glycine 0 N--CA 1.478 1.458 0 CA-C-O 114.412 -3.438 . . . . 12.17 108.602 -177.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -86.89 90.36 8.3 Favored 'General case' 0 N--CA 1.51 2.537 0 CA-C-O 126.012 2.815 . . . . 48.17 112.242 177.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' TYR . . . . . 0.432 ' OH ' ' OE2' ' B' ' 83' ' ' GLU . 72.5 t80 -63.04 130.69 45.78 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 126.172 1.789 . . . . 18.71 114.048 -176.944 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' ILE . . . . . . . . . . . . . 58.2 mt -124.53 124.78 69.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-N 112.987 -1.915 . . . . 24.16 105.835 179.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 39.0 t -71.48 132.19 85.86 Favored Pre-proline 0 N--CA 1.478 0.949 0 O-C-N 128.72 3.763 . . . . 13.52 112.662 176.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -79.65 -11.61 14.05 Favored 'Trans proline' 0 N--CA 1.434 -2.013 0 C-N-CA 124.296 3.33 . . . . 11.18 109.973 177.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -100.72 132.65 46.01 Favored 'General case' 0 C--O 1.222 -0.382 0 O-C-N 127.104 2.752 . . . . 23.61 115.587 -173.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -81.06 73.37 8.1 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 110.851 -2.886 . . . . 80.48 112.864 -178.123 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 50.5 mm-40 -148.44 140.81 24.24 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 126.94 3.257 . . . . 99.99 112.396 -179.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' HIS . . . . . 0.69 ' O ' ' N ' ' B' ' 16' ' ' LYS . 0.0 OUTLIER -166.25 -18.03 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 101.583 -3.488 . . . . 99.99 101.583 179.886 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' GLY . . . . . 0.419 ' C ' ' O ' ' B' ' 14' ' ' HIS . . . -9.85 64.25 0.0 OUTLIER Glycine 0 CA--C 1.528 0.894 0 CA-C-N 111.276 -2.693 . . . . 99.99 112.374 178.998 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' LYS . . . . . 0.69 ' N ' ' O ' ' B' ' 14' ' ' HIS . 35.3 mttt -133.05 -75.39 0.49 Allowed 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 112.23 -1.985 . . . . 99.99 106.829 179.628 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 29.0 ttmt -109.1 -64.39 1.25 Allowed 'General case' 0 C--O 1.247 0.935 0 CA-C-O 123.694 1.711 . . . . 99.99 113.857 179.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -97.42 165.52 11.97 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 117.828 2.529 . . . . 99.99 117.828 -177.308 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -118.81 73.61 0.93 Allowed 'General case' 0 C--O 1.239 0.524 0 CA-C-N 111.122 -2.763 . . . . 99.99 111.259 179.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -68.12 29.31 0.03 OUTLIER 'General case' 0 C--O 1.245 0.822 0 C-N-CA 129.372 3.069 . . . . 99.99 113.311 179.83 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 39.4 t -130.5 142.38 43.84 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 CA-C-N 113.353 -1.749 . . . . 52.94 113.203 -177.191 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 24.0 mmtt -110.09 165.86 11.41 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 112.152 -2.295 . . . . 68.01 105.934 177.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 13.2 mttp -121.59 140.25 52.48 Favored 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 103.532 -2.766 . . . . 49.59 103.532 -179.209 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 49.6 pt -139.17 157.67 28.44 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.778 0 N-CA-C 102.619 -3.104 . . . . 17.25 102.619 178.106 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 62.7 m -115.71 133.62 55.85 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 112.98 -1.918 . . . . 17.23 106.91 179.191 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 27.5 m -130.31 148.76 33.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 O-C-N 128.342 3.526 . . . . 14.67 111.351 178.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 6.2 m -98.81 117.11 32.54 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 111.238 -2.71 . . . . 31.51 107.708 176.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 39.4 mt -116.49 119.91 35.39 Favored Pre-proline 0 C--O 1.25 1.102 0 CA-C-O 123.012 1.387 . . . . 29.2 109.596 179.514 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_exo -59.74 143.58 99.6 Favored 'Trans proline' 0 C--O 1.257 1.426 0 C-N-CA 123.676 2.918 . . . . 16.17 106.51 175.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -49.55 -39.48 34.82 Favored 'General case' 0 C--O 1.257 1.473 0 N-CA-C 120.225 3.417 . . . . 47.4 120.225 -177.617 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.84 -36.45 83.28 Favored 'General case' 0 C--N 1.281 -2.387 0 C-N-CA 131.534 3.933 . . . . 79.5 111.203 -179.638 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 82.9 t -80.44 -38.42 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 CA-C-O 123.483 1.611 . . . . 17.19 106.665 -179.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 50.4 tp -59.88 -41.17 90.97 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 112.905 -1.952 . . . . 17.81 109.044 179.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' LYS . . . . . . . . . . . . . 49.0 tptt -54.38 -50.28 67.88 Favored 'General case' 0 C--N 1.319 -0.717 0 O-C-N 121.046 -1.034 . . . . 70.08 110.722 179.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' ILE . . . . . . . . . . . . . 57.8 mt -57.95 -43.27 84.41 Favored 'Isoleucine or valine' 0 C--O 1.259 1.556 0 O-C-N 120.238 -1.538 . . . . 27.89 109.656 178.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 21.2 tp -62.57 -46.77 86.8 Favored 'General case' 0 C--O 1.249 1.037 0 O-C-N 124.553 1.158 . . . . 15.69 113.256 -179.219 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' THR . . . . . . . . . . . . . 99.3 m -65.47 -38.36 89.57 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 119.636 -1.915 . . . . 24.32 110.12 178.273 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -59.57 -47.92 83.68 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 124.488 1.115 . . . . 28.49 108.96 177.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 52.3 tp10 -68.23 -37.72 81.11 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 124.547 2.118 . . . . 27.92 110.831 179.442 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' ARG . . . . . 0.597 ' NH2' ' O ' ' B' ' 143' ' ' HOH . 37.5 ttp-105 -64.4 -45.47 87.49 Favored 'General case' 0 N--CA 1.47 0.542 1 O-C-N 116.071 -4.143 . . . . 40.05 109.968 -178.792 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 86.2 m -63.66 -41.05 98.24 Favored 'General case' 0 C--O 1.257 1.474 0 O-C-N 126.794 2.559 . . . . 20.33 111.192 -179.331 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 49.3 ttp85 -58.9 -41.34 86.99 Favored 'General case' 0 C--O 1.264 1.865 0 C-N-CA 127.467 2.307 . . . . 31.05 111.249 178.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 78.2 mtt180 -67.6 -50.91 55.96 Favored 'General case' 0 C--O 1.226 -0.133 0 C-N-CA 126.116 1.766 . . . . 22.49 108.211 177.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -56.8 -50.95 70.79 Favored 'General case' 0 C--O 1.25 1.105 0 CA-C-N 114.419 -1.264 . . . . 66.74 110.638 179.657 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . 0.298 4.3 m -67.57 -30.58 49.24 Favored 'Isoleucine or valine' 0 C--O 1.247 0.94 0 CA-C-O 112.172 -3.775 . . . . 30.15 112.009 -179.418 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 67.9 m-80 -89.88 9.96 25.61 Favored 'General case' 0 N--CA 1.489 1.481 1 O-C-N 129.191 4.057 . . . . 36.11 110.442 -179.949 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 2.8 m120 56.61 41.3 28.68 Favored 'General case' 0 C--O 1.257 1.45 0 CA-C-O 115.922 -1.989 . . . . 69.13 109.465 179.24 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 83.9 mt -95.18 158.54 15.42 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 127.279 2.862 . . . . 18.28 107.565 176.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 48.9 mtt-85 -77.93 166.16 23.2 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 107.798 -1.186 . . . . 62.41 107.798 178.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' HIS . . . . . . . . . . . . . 63.5 m-70 55.77 45.68 23.89 Favored 'General case' 0 C--O 1.255 1.369 0 CA-C-O 126.107 2.861 . . . . 20.83 117.398 177.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -93.57 56.69 2.44 Favored 'General case' 0 C--O 1.241 0.634 0 C-N-CA 127.149 2.18 . . . . 20.95 110.612 179.647 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 37.0 p -136.36 157.25 47.25 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-O 115.863 -2.018 . . . . 19.72 106.372 177.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -55.92 -44.1 77.98 Favored 'General case' 0 C--N 1.316 -0.872 0 O-C-N 126.628 2.455 . . . . 27.55 111.372 -179.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' SER . . . . . . . . . . . . . 66.1 m -61.26 -46.27 91.05 Favored 'General case' 0 C--N 1.299 -1.621 0 CA-C-O 113.743 -3.027 . . . . 11.74 114.543 -178.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -69.58 -38.1 77.23 Favored 'General case' 0 N--CA 1.486 1.356 0 O-C-N 127.534 3.021 . . . . 19.4 108.274 -176.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 79.9 mt -63.99 -43.94 94.19 Favored 'General case' 0 C--N 1.32 -0.706 1 O-C-N 129.417 4.198 . . . . 11.29 112.367 177.618 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 54.4 mt -64.38 -38.9 92.65 Favored 'General case' 0 C--O 1.253 1.276 0 CA-C-O 117.679 -1.153 . . . . 15.35 109.965 178.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' CYS . . . . . . . . . . . . . 72.1 m -72.02 -38.92 69.5 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 116.533 -1.699 . . . . 12.61 110.395 -179.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -62.04 -44.19 97.22 Favored 'General case' 0 C--N 1.354 0.776 0 O-C-N 126.384 2.302 . . . . 10.84 108.763 177.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -66.01 -40.32 90.99 Favored 'General case' 0 C--O 1.248 0.985 0 O-C-N 128.599 3.687 . . . . 11.14 112.565 -177.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' PHE . . . . . . . . . . . . . 92.8 t80 -63.34 -45.37 91.55 Favored 'General case' 0 N--CA 1.496 1.848 0 CA-C-O 124.448 2.07 . . . . 14.25 111.998 -177.411 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 33.4 mt -67.52 -33.76 75.73 Favored 'General case' 0 C--N 1.307 -1.277 0 O-C-N 120.357 -1.464 . . . . 19.88 109.558 -177.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' HIS . . . . . . . . . . . . . 61.1 t60 -71.78 -50.22 31.86 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 125.52 1.762 . . . . 20.49 106.727 -178.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -65.4 -46.82 78.52 Favored 'General case' 0 C--O 1.257 1.471 0 N-CA-C 114.903 1.445 . . . . 13.27 114.903 -178.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' PHE . . . . . . . . . . . . 0.436 96.7 m-85 -89.07 -12.87 40.0 Favored 'General case' 0 C--O 1.249 1.072 0 CA-C-O 113.153 -3.308 . . . . 34.88 115.534 -176.767 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 8.6 p -128.86 -8.25 4.97 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 123.38 2.809 . . . . 19.68 115.341 178.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' GLY . . . . . . . . . . . . . . . 87.77 -2.41 85.88 Favored Glycine 0 C--N 1.314 -0.644 0 O-C-N 125.356 1.66 . . . . 15.6 112.562 -177.124 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -59.9 125.54 80.88 Favored Pre-proline 0 C--O 1.255 1.355 0 CA-C-O 126.253 2.93 . . . . 17.5 113.205 -178.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -57.64 146.32 85.36 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 CA-C-O 125.405 2.169 . . . . 18.83 110.64 177.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 38.5 mt -88.22 152.06 49.78 Favored Pre-proline 0 C--O 1.253 1.278 0 CA-C-N 111.775 -2.466 . . . . 18.35 107.055 176.259 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -71.25 141.84 40.18 Favored 'Trans proline' 0 C--N 1.311 -1.429 0 C-N-CA 122.107 1.871 . . . . 15.05 111.912 176.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -82.9 156.95 23.27 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 102.239 -3.245 . . . . 46.04 102.239 175.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -57.24 -29.4 63.76 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-N 120.032 1.287 . . . . 20.12 111.261 178.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.34 -39.15 92.03 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-O 116.961 -1.495 . . . . 15.47 108.868 176.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -64.88 -30.58 71.59 Favored 'General case' 0 C--O 1.255 1.348 0 CA-C-N 119.939 1.245 . . . . 13.0 112.552 178.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 95.7 mt -79.75 -0.18 33.22 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 112.841 -1.981 . . . . 30.01 114.912 -177.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' ARG . . . . . 0.449 ' NH1' ' O ' ' B' ' 145' ' ' HOH . 15.1 mtm180 -97.74 -46.01 6.14 Favored 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 104.32 -2.474 . . . . 69.82 104.32 177.81 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' LYS . . . . . . . . . . . . . 32.0 mtmt -14.34 -126.44 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.181 1 C-N-CA 134.291 5.036 . . . . 74.3 121.257 -179.578 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' GLU . . . . . 0.613 ' O ' ' O ' ' B' ' 82' ' ' ASP . 3.7 mm-40 -152.18 140.01 19.97 Favored 'General case' 0 C--O 1.245 0.819 0 C-N-CA 130.48 3.512 . . . . 99.99 111.814 -178.859 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.78 -17.5 64.04 Favored 'General case' 0 C--O 1.247 0.924 0 CA-C-O 124.111 1.91 . . . . 99.99 110.056 178.73 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.57 -19.33 38.72 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-N 112.514 -2.13 . . . . 81.05 108.622 178.3 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' ASP . . . . . 0.613 ' O ' ' O ' ' B' ' 79' ' ' GLU . 28.0 t0 -141.79 78.45 1.63 Allowed 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 111.484 -2.598 . . . . 67.37 105.423 -179.537 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' GLU . . . . . 0.432 ' OE2' ' OH ' ' B' ' 7' ' ' TYR . 6.8 pt-20 -107.33 -13.06 15.2 Favored 'General case' 0 C--O 1.254 1.326 0 CA-C-O 115.708 -2.091 . . . . 39.24 110.623 -178.177 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 59.6 mt -65.95 128.2 93.66 Favored Pre-proline 0 C--O 1.257 1.464 0 C-N-CA 113.886 -3.126 . . . . 24.59 109.515 -179.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_exo -51.16 144.32 29.67 Favored 'Trans proline' 0 C--N 1.312 -1.346 0 O-C-N 126.158 2.662 . . . . 18.56 106.169 178.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 -65.53 -37.4 86.63 Favored 'General case' 0 C--O 1.248 0.975 0 O-C-N 121.875 -0.516 . . . . 26.61 111.285 178.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.15 -37.63 85.9 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-O 117.257 -1.354 . . . . 14.5 108.027 176.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.38 -45.23 88.57 Favored 'General case' 0 C--N 1.309 -1.18 0 C-N-CA 128.885 2.874 . . . . 16.68 110.348 176.534 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' LYS . . . . . 0.464 ' NZ ' ' OD1' ' B' ' 82' ' ' ASP . 83.8 mttt -63.43 -37.16 86.23 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 107.653 -1.24 . . . . 24.31 107.653 178.527 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' GLU . . . . . . . . . . . . . 29.2 tp10 -66.65 -42.05 87.29 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 116.49 -2.084 . . . . 41.81 110.712 -179.655 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' ILE . . . . . . . . . . . . . 67.2 mt -64.77 -39.92 87.3 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 120.85 1.659 . . . . 15.0 110.591 178.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' MET . . . . . . . . . . . . . 94.5 mtp -59.78 -50.33 74.22 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 107.123 -1.436 . . . . 15.02 107.123 177.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' ARG . . . . . . . . . . . . . 42.8 mtt180 -56.85 -43.03 80.73 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 119.013 -1.075 . . . . 24.46 113.232 177.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 81.1 mt-10 -62.8 -23.66 67.36 Favored 'General case' 0 N--CA 1.443 -0.79 0 N-CA-C 115.26 1.578 . . . . 36.1 115.26 177.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' MET . . . . . . . . . . . . . 3.2 mmt -96.84 2.05 51.34 Favored 'General case' 0 C--O 1.249 1.039 0 C-N-CA 126.872 2.069 . . . . 28.86 110.518 -179.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 81.52 21.03 62.84 Favored Glycine 0 C--N 1.294 -1.805 0 C-N-CA 125.886 1.708 . . . . 24.24 114.775 178.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 13.4 mt -108.19 126.98 64.79 Favored 'Isoleucine or valine' 0 C--O 1.253 1.244 0 C-N-CA 125.219 1.408 . . . . 30.3 108.632 178.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -90.87 117.21 67.76 Favored Pre-proline 0 CA--C 1.536 0.437 0 O-C-N 126.047 2.092 . . . . 44.63 109.843 -179.443 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -57.83 -33.93 97.6 Favored 'Trans proline' 0 C--O 1.257 1.463 0 O-C-N 127.693 3.47 . . . . 28.44 115.38 179.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -63.92 -29.63 70.79 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 129.835 3.254 . . . . 55.89 116.185 -179.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 57.8 p -116.29 2.54 13.27 Favored 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 126.332 1.853 . . . . 31.31 112.085 179.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' TRP . . . . . . . . . . . . . 76.6 t-105 -79.15 129.36 34.38 Favored 'General case' 0 C--O 1.255 1.37 0 CA-C-O 123.417 1.579 . . . . 31.12 107.797 -179.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -104.29 121.73 43.95 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 110.942 -2.844 . . . . 90.23 109.164 179.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' TYR . . . . . . . . . . . . . 27.5 p90 . . . . . 0 C--O 1.262 1.752 0 O-C-N 126.524 2.39 . . . . 56.75 110.121 178.485 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' HOH . . . . . 0.717 ' O ' ' NH1' ' A' ' 93' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 143' ' ' HOH . . . . . 0.597 ' O ' ' NH2' ' B' ' 40' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 145' ' ' HOH . . . . . 0.449 ' O ' ' NH1' ' B' ' 77' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.884 0 CA-C-O 121.762 0.792 . . . . 99.99 111.553 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -71.0 -35.85 72.23 Favored 'General case' 0 C--O 1.247 0.948 0 N-CA-C 117.673 2.471 . . . . 97.77 117.673 -179.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 21.0 t90 -81.87 122.69 28.05 Favored 'General case' 0 C--N 1.315 -0.933 0 C-N-CA 125.706 1.602 . . . . 50.81 110.92 179.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 75.0 p -68.99 -22.59 64.08 Favored 'General case' 0 C--N 1.298 -1.66 0 C-N-CA 128.097 2.559 . . . . 38.73 115.59 178.577 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 96.3 0.65 61.26 Favored Glycine 0 N--CA 1.48 1.613 0 N-CA-C 109.716 -1.353 . . . . 23.58 109.716 -179.192 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -86.05 88.22 7.55 Favored 'General case' 0 C--N 1.307 -1.24 0 O-C-N 116.579 -3.895 . . . . 76.16 108.949 179.228 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -57.48 131.92 51.59 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 117.585 -1.198 . . . . 23.75 114.127 -177.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 77.0 mt -120.96 129.2 75.95 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.064 1 O-C-N 130.53 4.894 . . . . 28.27 105.686 176.319 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.4 t -71.23 128.25 90.51 Favored Pre-proline 0 N--CA 1.49 1.556 0 O-C-N 126.592 2.432 . . . . 16.65 110.594 178.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -78.79 -8.39 15.71 Favored 'Trans proline' 0 C--N 1.32 -0.938 0 O-C-N 119.584 -0.798 . . . . 19.59 110.913 176.552 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -101.21 154.42 18.77 Favored 'General case' 0 C--O 1.257 1.497 1 C-N-CA 131.881 4.072 . . . . 22.44 115.399 -176.89 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.71 -31.83 52.53 Favored 'General case' 0 N--CA 1.484 1.254 0 O-C-N 118.317 -2.739 . . . . 32.56 115.79 -177.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -133.77 152.28 51.83 Favored 'General case' 0 CA--C 1.505 -0.77 0 CA-C-O 122.544 1.164 . . . . 85.95 113.492 -177.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 42.6 p-80 -169.99 131.7 1.05 Allowed 'General case' 0 C--O 1.25 1.105 0 CA-C-N 112.848 -1.978 . . . . 37.59 105.76 178.267 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 61.43 -124.36 34.59 Favored Glycine 0 N--CA 1.471 0.989 0 N-CA-C 109.356 -1.498 . . . . 33.86 109.356 -179.396 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -101.11 -0.75 35.62 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-O 124.192 1.949 . . . . 66.0 113.768 179.75 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 38.3 mttm -91.09 136.34 33.15 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-O 125.864 2.745 . . . . 57.6 108.011 -179.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.4 t -141.16 111.43 6.78 Favored 'General case' 0 N--CA 1.478 0.962 0 CA-C-N 110.891 -2.868 . . . . 60.13 107.159 -178.332 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -81.5 146.51 30.16 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 127.067 2.729 . . . . 85.32 109.572 -179.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 39.2 tt0 -74.02 138.15 43.9 Favored 'General case' 0 C--O 1.257 1.49 0 N-CA-C 102.636 -3.098 . . . . 56.38 102.636 176.021 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 6.1 m -121.79 155.64 26.16 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 CA-C-O 125.674 2.654 . . . . 40.2 110.099 179.402 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 18.2 mttp -123.27 131.66 53.74 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 109.679 -3.419 . . . . 51.91 106.026 177.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 72.9 mttt -98.74 127.24 44.6 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 103.897 -2.631 . . . . 73.78 103.897 178.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 19.7 pt -127.77 153.62 37.29 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.562 0 N-CA-C 105.295 -2.113 . . . . 21.34 105.295 179.201 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 97.9 m -102.39 130.56 49.18 Favored 'General case' 0 C--N 1.305 -1.364 0 O-C-N 128.144 3.403 . . . . 34.74 107.925 175.514 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 44.9 t -110.99 129.46 66.2 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.358 0 C-N-CA 129.275 3.03 . . . . 30.37 114.055 -179.891 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' SER . . . . . 0.401 ' HB3' HG11 ' B' ' 21' ' ' VAL . 72.9 m -85.91 125.79 33.6 Favored 'General case' 0 C--O 1.251 1.157 0 N-CA-C 102.011 -3.329 . . . . 36.28 102.011 174.934 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . 0.25 6.9 tt -130.41 122.72 20.07 Favored Pre-proline 0 C--N 1.314 -0.943 0 C-N-CA 124.796 1.238 . . . . 20.76 113.702 -177.058 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -55.61 148.61 53.14 Favored 'Trans proline' 0 C--O 1.263 1.771 0 N-CA-C 104.561 -2.9 . . . . 19.69 104.561 177.116 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 32.4 tp -55.94 -46.68 78.46 Favored 'General case' 0 C--O 1.262 1.741 0 N-CA-C 114.295 1.22 . . . . 53.28 114.295 178.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LYS . . . . . 0.434 ' HE2' ' HB3' ' A' ' 31' ' ' LYS . 25.2 mtpt -58.64 -37.78 76.67 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.742 1.015 . . . . 82.21 113.742 179.731 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 61.4 t -69.53 -41.9 80.6 Favored 'Isoleucine or valine' 0 C--O 1.257 1.454 0 CA-C-O 123.735 1.731 . . . . 14.68 110.958 178.028 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 51.4 tp -62.91 -35.72 80.99 Favored 'General case' 0 N--CA 1.488 1.434 0 CA-C-O 115.806 -2.045 . . . . 23.81 110.432 -178.106 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.4 tptt -63.27 -41.55 99.03 Favored 'General case' 0 C--N 1.299 -1.601 0 O-C-N 127.494 2.996 . . . . 53.2 108.451 177.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 79.7 mt -69.11 -37.86 77.29 Favored 'Isoleucine or valine' 0 C--O 1.272 2.277 0 CA-C-O 125.792 2.71 . . . . 20.03 112.38 178.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 45.0 tp -64.47 -50.08 68.89 Favored 'General case' 0 C--N 1.323 -0.567 1 O-C-N 116.012 -4.18 . . . . 16.79 108.982 179.545 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 54.7 m -59.03 -43.48 91.63 Favored 'General case' 0 C--O 1.248 0.996 0 C-N-CA 126.861 2.065 . . . . 18.69 111.001 -179.573 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 88.1 m-20 -59.75 -45.04 93.46 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-O 116.344 -1.789 . . . . 45.54 108.772 176.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 53.7 tp10 -71.59 -36.03 70.73 Favored 'General case' 0 C--O 1.251 1.151 0 C-N-CA 113.053 -3.459 . . . . 28.5 110.017 -179.856 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 8.4 ttm180 -62.1 -48.74 78.81 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-N 119.393 0.997 . . . . 30.99 108.977 -179.004 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 22.6 p -66.7 -35.23 79.65 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 125.575 1.797 . . . . 15.51 114.192 178.45 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 19.8 ttp85 -62.45 -42.6 99.58 Favored 'General case' 0 C--O 1.261 1.667 0 O-C-N 118.516 -2.615 . . . . 25.17 107.397 177.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 83.3 mtt180 -63.31 -53.16 57.14 Favored 'General case' 0 C--O 1.241 0.618 1 O-C-N 116.176 -4.077 . . . . 16.19 110.791 177.415 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLN . . . . . 0.518 ' HG3' ' HB1' ' A' ' 51' ' ' ALA . 58.6 mt-30 -53.71 -48.56 69.46 Favored 'General case' 0 C--O 1.253 1.257 0 CA-C-O 113.831 -2.985 . . . . 50.81 111.332 -178.944 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . 0.356 2.9 m -71.02 -18.58 20.74 Favored 'Isoleucine or valine' 0 C--O 1.244 0.772 0 CA-C-O 112.54 -3.6 . . . . 27.53 111.538 -178.704 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 -100.56 3.5 42.76 Favored 'General case' 0 C--N 1.307 -1.246 0 O-C-N 125.772 1.92 . . . . 46.32 113.405 178.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 66.58 30.2 8.55 Favored 'General case' 0 C--O 1.242 0.694 0 N-CA-C 115.781 1.771 . . . . 59.65 115.781 177.365 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 96.6 mt -88.3 147.86 24.58 Favored 'General case' 0 C--O 1.252 1.197 1 O-C-N 130.428 4.83 . . . . 26.51 107.435 -179.854 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 73.8 mtt-85 -75.43 162.54 28.27 Favored 'General case' 0 C--O 1.251 1.159 0 CA-C-O 123.822 1.772 . . . . 52.89 107.191 177.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 60.86 47.25 7.9 Favored 'General case' 0 C--O 1.259 1.562 0 CA-C-N 112.395 -2.184 . . . . 20.62 113.702 175.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ALA . . . . . 0.518 ' HB1' ' HG3' ' A' ' 44' ' ' GLN . . . -93.33 67.76 4.12 Favored 'General case' 0 C--O 1.256 1.446 0 CA-C-N 109.877 -3.329 . . . . 23.35 111.019 -179.851 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 65.1 p -145.01 151.5 38.67 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-O 115.464 -2.208 . . . . 18.57 108.264 -179.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -57.49 -42.43 82.67 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 128.679 3.737 . . . . 15.41 108.107 179.825 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 75.1 m -57.2 -52.77 63.96 Favored 'General case' 0 C--N 1.299 -1.611 0 C-N-CA 124.097 0.959 . . . . 23.69 112.253 -179.115 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -62.15 -45.6 92.71 Favored 'General case' 0 C--N 1.315 -0.893 0 O-C-N 127.272 2.857 . . . . 19.12 111.096 -179.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 56.9 mt -61.54 -42.63 99.12 Favored 'General case' 0 C--O 1.256 1.42 0 CA-C-O 116.538 -1.696 . . . . 11.19 110.669 177.661 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' LEU . . . . . 0.442 HD12 HG11 ' B' ' 26' ' ' VAL . 22.6 mt -67.12 -34.85 78.49 Favored 'General case' 0 C--N 1.286 -2.157 0 C-N-CA 125.213 1.405 . . . . 16.4 112.279 -179.547 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 63.6 m -74.01 -46.29 44.5 Favored 'General case' 0 C--N 1.294 -1.808 0 N-CA-C 106.158 -1.793 . . . . 22.79 106.158 -179.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 65.9 mt-10 -56.77 -49.53 75.0 Favored 'General case' 0 C--O 1.269 2.091 0 O-C-N 126.748 2.53 . . . . 14.9 109.279 177.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.78 -51.39 69.96 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 125.099 1.36 . . . . 11.91 109.937 -178.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -55.7 -51.07 68.55 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-O 115.154 -2.355 . . . . 14.18 110.613 179.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 50.5 mt -59.51 -40.31 86.66 Favored 'General case' 0 C--N 1.295 -1.778 0 CA-C-N 122.419 2.372 . . . . 12.95 109.929 177.91 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 49.1 t-80 -59.52 -55.85 29.43 Favored 'General case' 0 C--O 1.259 1.584 0 O-C-N 124.33 1.019 . . . . 19.34 113.514 179.766 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ALA . . . . . 0.433 ' HB1' HD11 ' B' ' 70' ' ' LEU . . . -67.06 -43.13 83.46 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-O 115.661 -2.114 . . . . 17.76 113.375 -177.402 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . 0.362 90.0 m-85 -95.18 -15.4 23.32 Favored 'General case' 0 C--O 1.253 1.28 0 CA-C-O 113.09 -3.338 . . . . 31.77 115.834 -177.043 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.6 p -121.83 -16.08 7.72 Favored 'General case' 0 C--O 1.247 0.961 0 O-C-N 125.925 2.016 . . . . 21.95 109.921 178.356 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLY . . . . . 0.478 ' HA2' ' O ' ' A' ' 146' ' ' HOH . . . 79.81 12.77 83.14 Favored Glycine 0 C--O 1.243 0.666 0 C-N-CA 125.024 1.297 . . . . 14.46 111.174 179.54 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 38.0 tt0 -67.54 128.37 93.56 Favored Pre-proline 0 N--CA 1.5 2.071 0 CA-C-O 116.507 -1.711 . . . . 22.47 109.438 -179.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_exo -54.55 140.83 75.08 Favored 'Trans proline' 0 C--N 1.312 -1.385 0 O-C-N 125.449 2.289 . . . . 14.67 117.297 -179.591 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 28.3 mt -80.16 156.03 74.4 Favored Pre-proline 0 CA--C 1.542 0.664 0 O-C-N 124.853 1.346 . . . . 27.87 108.478 175.173 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -72.8 149.32 47.83 Favored 'Trans proline' 0 C--O 1.247 0.958 0 C-N-CA 120.463 0.775 . . . . 26.36 112.064 175.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.31 0.4 OUTLIER -101.66 169.96 8.49 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 102.815 -3.032 . . . . 69.77 102.815 176.448 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -47.73 -50.64 24.75 Favored 'General case' 0 C--O 1.252 1.225 0 N-CA-C 114.852 1.427 . . . . 33.39 114.852 -179.312 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -50.03 -36.88 30.59 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 122.898 1.332 . . . . 31.54 113.241 -179.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 74.7 m-20 -68.33 -29.52 68.29 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 127.17 2.188 . . . . 25.22 110.071 -179.468 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 84.9 mt -97.64 4.64 50.08 Favored 'General case' 0 C--O 1.257 1.464 0 N-CA-C 117.256 2.317 . . . . 32.7 117.256 -178.564 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 28.1 mmt180 -67.52 141.52 56.86 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 108.466 -0.939 . . . . 83.37 108.466 178.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 67.2 mttt -71.02 -12.93 61.8 Favored 'General case' 0 C--O 1.248 1.006 0 CA-C-O 116.197 -1.859 . . . . 76.29 111.22 -179.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -86.11 -1.97 57.9 Favored 'General case' 0 C--O 1.254 1.311 0 CA-C-N 120.906 1.684 . . . . 99.99 112.39 179.251 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ARG . . . . . 0.602 ' HG2' ' O ' ' A' ' 81' ' ' SER . 39.1 ttt-85 -108.59 149.36 29.0 Favored 'General case' 0 C--O 1.249 1.069 0 N-CA-C 104.766 -2.309 . . . . 67.1 104.766 178.979 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' SER . . . . . 0.602 ' O ' ' HG2' ' A' ' 80' ' ' ARG . 15.9 m -73.07 153.19 40.94 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 103.578 -2.749 . . . . 67.27 103.578 178.84 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -80.09 86.38 5.55 Favored 'General case' 0 C--N 1.317 -0.821 0 O-C-N 125.711 1.882 . . . . 42.99 109.434 179.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -121.89 -172.71 2.49 Favored 'General case' 0 C--N 1.32 -0.697 0 O-C-N 126.37 2.294 . . . . 71.93 111.728 179.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 58.6 mt -59.42 137.77 89.05 Favored Pre-proline 0 C--N 1.313 -1.009 0 C-N-CA 126.751 2.021 . . . . 27.26 110.576 176.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_exo -50.07 140.7 31.84 Favored 'Trans proline' 0 C--N 1.325 -0.678 0 C-N-CA 122.933 2.422 . . . . 20.36 107.278 178.794 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -57.97 -43.16 86.33 Favored 'General case' 0 C--O 1.252 1.212 0 O-C-N 124.944 1.402 . . . . 43.08 110.292 -179.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.31 -30.78 70.71 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 120.723 -1.236 . . . . 41.23 111.591 -179.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.08 -44.75 65.08 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 106.669 -1.604 . . . . 23.86 106.669 179.382 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -57.32 -43.12 83.03 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 125.483 1.739 . . . . 34.04 108.23 179.273 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -52.7 -53.95 40.39 Favored 'General case' 0 C--O 1.249 1.058 0 O-C-N 128.636 3.71 . . . . 71.51 113.056 -178.117 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 26.7 mt -63.4 -38.3 81.8 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.566 0 CA-C-O 113.623 -3.084 . . . . 33.7 113.192 179.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 36.4 mtp -62.15 -46.66 88.01 Favored 'General case' 0 CA--C 1.543 0.674 1 O-C-N 129.737 4.398 . . . . 19.2 107.47 179.949 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ARG . . . . . 0.515 ' NH1' ' O ' ' A' ' 125' ' ' HOH . 31.9 mtm-85 -63.48 -38.33 90.71 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-O 116.79 -1.576 . . . . 47.98 112.804 -179.189 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 88.3 mt-10 -64.58 -24.76 67.7 Favored 'General case' 0 C--N 1.311 -1.097 0 O-C-N 126.616 2.448 . . . . 48.97 111.848 178.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 79.3 mtp -100.91 10.88 40.59 Favored 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 124.618 1.167 . . . . 52.94 110.494 178.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 70.68 27.67 72.09 Favored Glycine 0 C--O 1.248 0.988 0 C-N-CA 126.221 1.867 . . . . 32.84 116.917 -179.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 30.8 mt -106.17 129.39 59.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 N-CA-C 103.018 -2.956 . . . . 30.53 103.018 179.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 46.6 t-20 -84.26 113.91 51.38 Favored Pre-proline 0 N--CA 1.481 1.081 0 O-C-N 128.203 3.439 . . . . 46.21 107.595 177.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -65.24 -26.12 56.93 Favored 'Trans proline' 0 C--N 1.313 -1.298 0 O-C-N 125.828 2.488 . . . . 30.26 115.239 -179.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -71.74 -24.82 61.85 Favored 'General case' 0 C--N 1.313 -1.001 0 C-N-CA 127.347 2.259 . . . . 78.97 113.337 -178.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 35.8 p -112.64 5.75 17.93 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 116.39 -1.766 . . . . 31.89 107.764 -178.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' TRP . . . . . . . . . . . . . 73.1 t-105 -73.42 135.25 44.17 Favored 'General case' 0 N--CA 1.484 1.241 0 O-C-N 127.695 3.122 . . . . 29.53 109.5 179.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -112.88 133.86 54.67 Favored 'General case' 0 C--N 1.319 -0.74 0 O-C-N 126.162 2.163 . . . . 99.99 108.366 -178.333 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 36.2 p90 . . . . . 0 N--CA 1.493 1.725 1 O-C-N 129.411 4.195 . . . . 37.55 111.769 -178.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.927 0 N-CA-C 109.805 -0.443 . . . . 96.31 109.805 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 2' ' ' GLU . . . . . 0.503 ' CD ' ' H ' ' B' ' 3' ' ' TRP . 0.0 OUTLIER -119.03 -177.67 3.39 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-O 126.015 2.817 . . . . 79.92 113.177 179.961 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 3' ' ' TRP . . . . . 0.503 ' H ' ' CD ' ' B' ' 2' ' ' GLU . 23.1 t90 -72.55 148.82 44.59 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 100.752 -3.795 . . . . 54.85 100.752 177.737 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 81.1 p -79.77 -8.75 59.45 Favored 'General case' 0 C--N 1.297 -1.675 0 O-C-N 124.092 0.87 . . . . 38.51 112.608 -179.098 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' GLY . . . . . 0.412 ' O ' ' HG2' ' B' ' 92' ' ' MET . . . 92.13 -2.83 75.9 Favored Glycine 0 N--CA 1.478 1.458 0 CA-C-O 114.412 -3.438 . . . . 12.17 108.602 -177.976 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -86.89 90.36 8.3 Favored 'General case' 0 N--CA 1.51 2.537 0 CA-C-O 126.012 2.815 . . . . 48.17 112.242 177.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -63.04 130.69 45.78 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 126.172 1.789 . . . . 18.71 114.048 -176.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' ILE . . . . . . . . . . . . . 58.2 mt -124.53 124.78 69.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-N 112.987 -1.915 . . . . 24.16 105.835 179.474 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' SER . . . . . 0.416 ' HA ' ' HD3' ' B' ' 10' ' ' PRO . 39.0 t -71.48 132.19 85.86 Favored Pre-proline 0 N--CA 1.478 0.949 0 O-C-N 128.72 3.763 . . . . 13.52 112.662 176.214 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 10' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' B' ' 9' ' ' SER . 8.1 Cg_exo -79.65 -11.61 14.05 Favored 'Trans proline' 0 N--CA 1.434 -2.013 0 C-N-CA 124.296 3.33 . . . . 11.18 109.973 177.367 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -100.72 132.65 46.01 Favored 'General case' 0 C--O 1.222 -0.382 0 O-C-N 127.104 2.752 . . . . 23.61 115.587 -173.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' ALA . . . . . 0.548 ' HB1' HG21 ' B' ' 21' ' ' VAL . . . -81.06 73.37 8.1 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 110.851 -2.886 . . . . 80.48 112.864 -178.123 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 50.5 mm-40 -148.44 140.81 24.24 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 126.94 3.257 . . . . 99.99 112.396 -179.011 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' HIS . . . . . 0.69 ' O ' ' N ' ' B' ' 16' ' ' LYS . 0.0 OUTLIER -166.25 -18.03 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 101.583 -3.488 . . . . 99.99 101.583 179.886 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 15' ' ' GLY . . . . . 0.419 ' C ' ' O ' ' B' ' 14' ' ' HIS . . . -9.85 64.25 0.0 OUTLIER Glycine 0 CA--C 1.528 0.894 0 CA-C-N 111.276 -2.693 . . . . 99.99 112.374 178.998 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 16' ' ' LYS . . . . . 0.69 ' N ' ' O ' ' B' ' 14' ' ' HIS . 35.3 mttt -133.05 -75.39 0.49 Allowed 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 112.23 -1.985 . . . . 99.99 106.829 179.628 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 29.0 ttmt -109.1 -64.39 1.25 Allowed 'General case' 0 C--O 1.247 0.935 0 CA-C-O 123.694 1.711 . . . . 99.99 113.857 179.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -97.42 165.52 11.97 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 117.828 2.529 . . . . 99.99 117.828 -177.308 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 19' ' ' GLU . . . . . 0.403 ' C ' ' H ' ' B' ' 21' ' ' VAL . 12.9 mt-10 -118.81 73.61 0.93 Allowed 'General case' 0 C--O 1.239 0.524 0 CA-C-N 111.122 -2.763 . . . . 99.99 111.259 179.508 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.12 29.31 0.03 OUTLIER 'General case' 0 C--O 1.245 0.822 0 C-N-CA 129.372 3.069 . . . . 99.99 113.311 179.83 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 21' ' ' VAL . . . . . 0.548 HG21 ' HB1' ' B' ' 12' ' ' ALA . 39.4 t -130.5 142.38 43.84 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 CA-C-N 113.353 -1.749 . . . . 52.94 113.203 -177.191 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 24.0 mmtt -110.09 165.86 11.41 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 112.152 -2.295 . . . . 68.01 105.934 177.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 13.2 mttp -121.59 140.25 52.48 Favored 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 103.532 -2.766 . . . . 49.59 103.532 -179.209 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 49.6 pt -139.17 157.67 28.44 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.778 0 N-CA-C 102.619 -3.104 . . . . 17.25 102.619 178.106 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 62.7 m -115.71 133.62 55.85 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 112.98 -1.918 . . . . 17.23 106.91 179.191 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' VAL . . . . . 0.442 HG11 HD12 ' A' ' 57' ' ' LEU . 27.5 m -130.31 148.76 33.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 O-C-N 128.342 3.526 . . . . 14.67 111.351 178.844 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 6.2 m -98.81 117.11 32.54 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 111.238 -2.71 . . . . 31.51 107.708 176.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 39.4 mt -116.49 119.91 35.39 Favored Pre-proline 0 C--O 1.25 1.102 0 CA-C-O 123.012 1.387 . . . . 29.2 109.596 179.514 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_exo -59.74 143.58 99.6 Favored 'Trans proline' 0 C--O 1.257 1.426 0 C-N-CA 123.676 2.918 . . . . 16.17 106.51 175.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -49.55 -39.48 34.82 Favored 'General case' 0 C--O 1.257 1.473 0 N-CA-C 120.225 3.417 . . . . 47.4 120.225 -177.617 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.84 -36.45 83.28 Favored 'General case' 0 C--N 1.281 -2.387 0 C-N-CA 131.534 3.933 . . . . 79.5 111.203 -179.638 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 82.9 t -80.44 -38.42 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 CA-C-O 123.483 1.611 . . . . 17.19 106.665 -179.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 50.4 tp -59.88 -41.17 90.97 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 112.905 -1.952 . . . . 17.81 109.044 179.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' LYS . . . . . . . . . . . . . 49.0 tptt -54.38 -50.28 67.88 Favored 'General case' 0 C--N 1.319 -0.717 0 O-C-N 121.046 -1.034 . . . . 70.08 110.722 179.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' ILE . . . . . . . . . . . . . 57.8 mt -57.95 -43.27 84.41 Favored 'Isoleucine or valine' 0 C--O 1.259 1.556 0 O-C-N 120.238 -1.538 . . . . 27.89 109.656 178.067 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 21.2 tp -62.57 -46.77 86.8 Favored 'General case' 0 C--O 1.249 1.037 0 O-C-N 124.553 1.158 . . . . 15.69 113.256 -179.219 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' THR . . . . . . . . . . . . . 99.3 m -65.47 -38.36 89.57 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 119.636 -1.915 . . . . 24.32 110.12 178.273 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -59.57 -47.92 83.68 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 124.488 1.115 . . . . 28.49 108.96 177.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 52.3 tp10 -68.23 -37.72 81.11 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 124.547 2.118 . . . . 27.92 110.831 179.442 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' ARG . . . . . 0.466 HH11 ' HD3' ' B' ' 40' ' ' ARG . 37.5 ttp-105 -64.4 -45.47 87.49 Favored 'General case' 0 N--CA 1.47 0.542 1 O-C-N 116.071 -4.143 . . . . 40.05 109.968 -178.792 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 86.2 m -63.66 -41.05 98.24 Favored 'General case' 0 C--O 1.257 1.474 0 O-C-N 126.794 2.559 . . . . 20.33 111.192 -179.331 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 49.3 ttp85 -58.9 -41.34 86.99 Favored 'General case' 0 C--O 1.264 1.865 0 C-N-CA 127.467 2.307 . . . . 31.05 111.249 178.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 78.2 mtt180 -67.6 -50.91 55.96 Favored 'General case' 0 C--O 1.226 -0.133 0 C-N-CA 126.116 1.766 . . . . 22.49 108.211 177.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -56.8 -50.95 70.79 Favored 'General case' 0 C--O 1.25 1.105 0 CA-C-N 114.419 -1.264 . . . . 66.74 110.638 179.657 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . 0.298 4.3 m -67.57 -30.58 49.24 Favored 'Isoleucine or valine' 0 C--O 1.247 0.94 0 CA-C-O 112.172 -3.775 . . . . 30.15 112.009 -179.418 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 67.9 m-80 -89.88 9.96 25.61 Favored 'General case' 0 N--CA 1.489 1.481 1 O-C-N 129.191 4.057 . . . . 36.11 110.442 -179.949 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 2.8 m120 56.61 41.3 28.68 Favored 'General case' 0 C--O 1.257 1.45 0 CA-C-O 115.922 -1.989 . . . . 69.13 109.465 179.24 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 83.9 mt -95.18 158.54 15.42 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 127.279 2.862 . . . . 18.28 107.565 176.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 48.9 mtt-85 -77.93 166.16 23.2 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 107.798 -1.186 . . . . 62.41 107.798 178.18 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' HIS . . . . . . . . . . . . . 63.5 m-70 55.77 45.68 23.89 Favored 'General case' 0 C--O 1.255 1.369 0 CA-C-O 126.107 2.861 . . . . 20.83 117.398 177.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -93.57 56.69 2.44 Favored 'General case' 0 C--O 1.241 0.634 0 C-N-CA 127.149 2.18 . . . . 20.95 110.612 179.647 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 37.0 p -136.36 157.25 47.25 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-O 115.863 -2.018 . . . . 19.72 106.372 177.358 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -55.92 -44.1 77.98 Favored 'General case' 0 C--N 1.316 -0.872 0 O-C-N 126.628 2.455 . . . . 27.55 111.372 -179.489 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' SER . . . . . . . . . . . . . 66.1 m -61.26 -46.27 91.05 Favored 'General case' 0 C--N 1.299 -1.621 0 CA-C-O 113.743 -3.027 . . . . 11.74 114.543 -178.372 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -69.58 -38.1 77.23 Favored 'General case' 0 N--CA 1.486 1.356 0 O-C-N 127.534 3.021 . . . . 19.4 108.274 -176.567 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 79.9 mt -63.99 -43.94 94.19 Favored 'General case' 0 C--N 1.32 -0.706 1 O-C-N 129.417 4.198 . . . . 11.29 112.367 177.618 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 54.4 mt -64.38 -38.9 92.65 Favored 'General case' 0 C--O 1.253 1.276 0 CA-C-O 117.679 -1.153 . . . . 15.35 109.965 178.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' CYS . . . . . . . . . . . . . 72.1 m -72.02 -38.92 69.5 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 116.533 -1.699 . . . . 12.61 110.395 -179.57 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -62.04 -44.19 97.22 Favored 'General case' 0 C--N 1.354 0.776 0 O-C-N 126.384 2.302 . . . . 10.84 108.763 177.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -66.01 -40.32 90.99 Favored 'General case' 0 C--O 1.248 0.985 0 O-C-N 128.599 3.687 . . . . 11.14 112.565 -177.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' PHE . . . . . . . . . . . . . 92.8 t80 -63.34 -45.37 91.55 Favored 'General case' 0 N--CA 1.496 1.848 0 CA-C-O 124.448 2.07 . . . . 14.25 111.998 -177.411 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 33.4 mt -67.52 -33.76 75.73 Favored 'General case' 0 C--N 1.307 -1.277 0 O-C-N 120.357 -1.464 . . . . 19.88 109.558 -177.791 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' HIS . . . . . . . . . . . . . 61.1 t60 -71.78 -50.22 31.86 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 125.52 1.762 . . . . 20.49 106.727 -178.147 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -65.4 -46.82 78.52 Favored 'General case' 0 C--O 1.257 1.471 0 N-CA-C 114.903 1.445 . . . . 13.27 114.903 -178.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' PHE . . . . . . . . . . . . 0.436 96.7 m-85 -89.07 -12.87 40.0 Favored 'General case' 0 C--O 1.249 1.072 0 CA-C-O 113.153 -3.308 . . . . 34.88 115.534 -176.767 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 8.6 p -128.86 -8.25 4.97 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 123.38 2.809 . . . . 19.68 115.341 178.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' GLY . . . . . . . . . . . . . . . 87.77 -2.41 85.88 Favored Glycine 0 C--N 1.314 -0.644 0 O-C-N 125.356 1.66 . . . . 15.6 112.562 -177.124 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -59.9 125.54 80.88 Favored Pre-proline 0 C--O 1.255 1.355 0 CA-C-O 126.253 2.93 . . . . 17.5 113.205 -178.637 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -57.64 146.32 85.36 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 CA-C-O 125.405 2.169 . . . . 18.83 110.64 177.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' LEU . . . . . 0.433 HD11 ' HB1' ' A' ' 64' ' ' ALA . 38.5 mt -88.22 152.06 49.78 Favored Pre-proline 0 C--O 1.253 1.278 0 CA-C-N 111.775 -2.466 . . . . 18.35 107.055 176.259 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 71' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -71.25 141.84 40.18 Favored 'Trans proline' 0 C--N 1.311 -1.429 0 C-N-CA 122.107 1.871 . . . . 15.05 111.912 176.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -82.9 156.95 23.27 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 102.239 -3.245 . . . . 46.04 102.239 175.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -57.24 -29.4 63.76 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-N 120.032 1.287 . . . . 20.12 111.261 178.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.34 -39.15 92.03 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-O 116.961 -1.495 . . . . 15.47 108.868 176.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -64.88 -30.58 71.59 Favored 'General case' 0 C--O 1.255 1.348 0 CA-C-N 119.939 1.245 . . . . 13.0 112.552 178.899 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 95.7 mt -79.75 -0.18 33.22 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 112.841 -1.981 . . . . 30.01 114.912 -177.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' ARG . . . . . 0.421 HH11 ' HD3' ' B' ' 77' ' ' ARG . 15.1 mtm180 -97.74 -46.01 6.14 Favored 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 104.32 -2.474 . . . . 69.82 104.32 177.81 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 78' ' ' LYS . . . . . . . . . . . . . 32.0 mtmt -14.34 -126.44 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.181 1 C-N-CA 134.291 5.036 . . . . 74.3 121.257 -179.578 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 79' ' ' GLU . . . . . 0.613 ' O ' ' O ' ' B' ' 82' ' ' ASP . 3.7 mm-40 -152.18 140.01 19.97 Favored 'General case' 0 C--O 1.245 0.819 0 C-N-CA 130.48 3.512 . . . . 99.99 111.814 -178.859 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.78 -17.5 64.04 Favored 'General case' 0 C--O 1.247 0.924 0 CA-C-O 124.111 1.91 . . . . 99.99 110.056 178.73 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 81' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.57 -19.33 38.72 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-N 112.514 -2.13 . . . . 81.05 108.622 178.3 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 82' ' ' ASP . . . . . 0.613 ' O ' ' O ' ' B' ' 79' ' ' GLU . 28.0 t0 -141.79 78.45 1.63 Allowed 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 111.484 -2.598 . . . . 67.37 105.423 -179.537 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -107.33 -13.06 15.2 Favored 'General case' 0 C--O 1.254 1.326 0 CA-C-O 115.708 -2.091 . . . . 39.24 110.623 -178.177 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 59.6 mt -65.95 128.2 93.66 Favored Pre-proline 0 C--O 1.257 1.464 0 C-N-CA 113.886 -3.126 . . . . 24.59 109.515 -179.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_exo -51.16 144.32 29.67 Favored 'Trans proline' 0 C--N 1.312 -1.346 0 O-C-N 126.158 2.662 . . . . 18.56 106.169 178.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 -65.53 -37.4 86.63 Favored 'General case' 0 C--O 1.248 0.975 0 O-C-N 121.875 -0.516 . . . . 26.61 111.285 178.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.15 -37.63 85.9 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-O 117.257 -1.354 . . . . 14.5 108.027 176.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.38 -45.23 88.57 Favored 'General case' 0 C--N 1.309 -1.18 0 C-N-CA 128.885 2.874 . . . . 16.68 110.348 176.534 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -63.43 -37.16 86.23 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 107.653 -1.24 . . . . 24.31 107.653 178.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' GLU . . . . . . . . . . . . . 29.2 tp10 -66.65 -42.05 87.29 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 116.49 -2.084 . . . . 41.81 110.712 -179.655 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' ILE . . . . . . . . . . . . . 67.2 mt -64.77 -39.92 87.3 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 120.85 1.659 . . . . 15.0 110.591 178.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' MET . . . . . 0.412 ' HG2' ' O ' ' B' ' 5' ' ' GLY . 94.5 mtp -59.78 -50.33 74.22 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 107.123 -1.436 . . . . 15.02 107.123 177.396 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 93' ' ' ARG . . . . . . . . . . . . . 42.8 mtt180 -56.85 -43.03 80.73 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 119.013 -1.075 . . . . 24.46 113.232 177.019 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 81.1 mt-10 -62.8 -23.66 67.36 Favored 'General case' 0 N--CA 1.443 -0.79 0 N-CA-C 115.26 1.578 . . . . 36.1 115.26 177.499 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' MET . . . . . . . . . . . . . 3.2 mmt -96.84 2.05 51.34 Favored 'General case' 0 C--O 1.249 1.039 0 C-N-CA 126.872 2.069 . . . . 28.86 110.518 -179.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 81.52 21.03 62.84 Favored Glycine 0 C--N 1.294 -1.805 0 C-N-CA 125.886 1.708 . . . . 24.24 114.775 178.798 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 13.4 mt -108.19 126.98 64.79 Favored 'Isoleucine or valine' 0 C--O 1.253 1.244 0 C-N-CA 125.219 1.408 . . . . 30.3 108.632 178.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' ASN . . . . . 0.619 ' OD1' ' HB2' ' B' ' 100' ' ' GLU . 64.8 t-20 -90.87 117.21 67.76 Favored Pre-proline 0 CA--C 1.536 0.437 0 O-C-N 126.047 2.092 . . . . 44.63 109.843 -179.443 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -57.83 -33.93 97.6 Favored 'Trans proline' 0 C--O 1.257 1.463 0 O-C-N 127.693 3.47 . . . . 28.44 115.38 179.846 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' GLU . . . . . 0.619 ' HB2' ' OD1' ' B' ' 98' ' ' ASN . 24.8 mm-40 -63.92 -29.63 70.79 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 129.835 3.254 . . . . 55.89 116.185 -179.848 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 57.8 p -116.29 2.54 13.27 Favored 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 126.332 1.853 . . . . 31.31 112.085 179.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' TRP . . . . . . . . . . . . . 76.6 t-105 -79.15 129.36 34.38 Favored 'General case' 0 C--O 1.255 1.37 0 CA-C-O 123.417 1.579 . . . . 31.12 107.797 -179.46 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -104.29 121.73 43.95 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 110.942 -2.844 . . . . 90.23 109.164 179.364 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 104' ' ' TYR . . . . . . . . . . . . . 27.5 p90 . . . . . 0 C--O 1.262 1.752 0 O-C-N 126.524 2.39 . . . . 56.75 110.121 178.485 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 105' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 125' ' ' HOH . . . . . 0.515 ' O ' ' NH1' ' A' ' 93' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 146' ' ' HOH . . . . . 0.478 ' O ' ' HA2' ' A' ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 122' ' ' HOH . . . . . 0.454 ' O ' ' HA ' ' B' ' 82' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 143' ' ' HOH . . . . . 0.464 ' O ' ' NH2' ' B' ' 40' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 145' ' ' HOH . . . . . 0.412 ' O ' ' NH1' ' B' ' 77' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.884 0 CA-C-O 121.762 0.792 . . . . 99.99 111.553 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -71.0 -35.85 72.23 Favored 'General case' 0 C--O 1.247 0.948 0 N-CA-C 117.673 2.471 . . . . 97.77 117.673 -179.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 21.0 t90 -81.87 122.69 28.05 Favored 'General case' 0 C--N 1.315 -0.933 0 C-N-CA 125.706 1.602 . . . . 50.81 110.92 179.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 75.0 p -68.99 -22.59 64.08 Favored 'General case' 0 C--N 1.298 -1.66 0 C-N-CA 128.097 2.559 . . . . 38.73 115.59 178.577 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 96.3 0.65 61.26 Favored Glycine 0 N--CA 1.48 1.613 0 N-CA-C 109.716 -1.353 . . . . 23.58 109.716 -179.192 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -86.05 88.22 7.55 Favored 'General case' 0 C--N 1.307 -1.24 0 O-C-N 116.579 -3.895 . . . . 76.16 108.949 179.228 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -57.48 131.92 51.59 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 117.585 -1.198 . . . . 23.75 114.127 -177.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 77.0 mt -120.96 129.2 75.95 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.064 1 O-C-N 130.53 4.894 . . . . 28.27 105.686 176.319 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.4 t -71.23 128.25 90.51 Favored Pre-proline 0 N--CA 1.49 1.556 0 O-C-N 126.592 2.432 . . . . 16.65 110.594 178.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -78.79 -8.39 15.71 Favored 'Trans proline' 0 C--N 1.32 -0.938 0 O-C-N 119.584 -0.798 . . . . 19.59 110.913 176.552 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -101.21 154.42 18.77 Favored 'General case' 0 C--O 1.257 1.497 1 C-N-CA 131.881 4.072 . . . . 22.44 115.399 -176.89 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.71 -31.83 52.53 Favored 'General case' 0 N--CA 1.484 1.254 0 O-C-N 118.317 -2.739 . . . . 32.56 115.79 -177.164 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -133.77 152.28 51.83 Favored 'General case' 0 CA--C 1.505 -0.77 0 CA-C-O 122.544 1.164 . . . . 85.95 113.492 -177.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 42.6 p-80 -169.99 131.7 1.05 Allowed 'General case' 0 C--O 1.25 1.105 0 CA-C-N 112.848 -1.978 . . . . 37.59 105.76 178.267 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 61.43 -124.36 34.59 Favored Glycine 0 N--CA 1.471 0.989 0 N-CA-C 109.356 -1.498 . . . . 33.86 109.356 -179.396 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -101.11 -0.75 35.62 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-O 124.192 1.949 . . . . 66.0 113.768 179.75 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 38.3 mttm -91.09 136.34 33.15 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-O 125.864 2.745 . . . . 57.6 108.011 -179.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.4 t -141.16 111.43 6.78 Favored 'General case' 0 N--CA 1.478 0.962 0 CA-C-N 110.891 -2.868 . . . . 60.13 107.159 -178.332 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -81.5 146.51 30.16 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 127.067 2.729 . . . . 85.32 109.572 -179.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -74.02 138.15 43.9 Favored 'General case' 0 C--O 1.257 1.49 0 N-CA-C 102.636 -3.098 . . . . 56.38 102.636 176.021 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 6.1 m -121.79 155.64 26.16 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 CA-C-O 125.674 2.654 . . . . 40.2 110.099 179.402 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 18.2 mttp -123.27 131.66 53.74 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 109.679 -3.419 . . . . 51.91 106.026 177.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 72.9 mttt -98.74 127.24 44.6 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 103.897 -2.631 . . . . 73.78 103.897 178.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 19.7 pt -127.77 153.62 37.29 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.562 0 N-CA-C 105.295 -2.113 . . . . 21.34 105.295 179.201 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 97.9 m -102.39 130.56 49.18 Favored 'General case' 0 C--N 1.305 -1.364 0 O-C-N 128.144 3.403 . . . . 34.74 107.925 175.514 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 44.9 t -110.99 129.46 66.2 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.358 0 C-N-CA 129.275 3.03 . . . . 30.37 114.055 -179.891 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' SER . . . . . 0.401 ' HB3' HG11 ' B' ' 21' ' ' VAL . 72.9 m -85.91 125.79 33.6 Favored 'General case' 0 C--O 1.251 1.157 0 N-CA-C 102.011 -3.329 . . . . 36.28 102.011 174.934 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . 0.25 6.9 tt -130.41 122.72 20.07 Favored Pre-proline 0 C--N 1.314 -0.943 0 C-N-CA 124.796 1.238 . . . . 20.76 113.702 -177.058 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -55.61 148.61 53.14 Favored 'Trans proline' 0 C--O 1.263 1.771 0 N-CA-C 104.561 -2.9 . . . . 19.69 104.561 177.116 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 32.4 tp -55.94 -46.68 78.46 Favored 'General case' 0 C--O 1.262 1.741 0 N-CA-C 114.295 1.22 . . . . 53.28 114.295 178.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.434 ' HE2' ' HB3' ' A' ' 31' ' ' LYS . 25.2 mtpt -58.64 -37.78 76.67 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.742 1.015 . . . . 82.21 113.742 179.731 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 61.4 t -69.53 -41.9 80.6 Favored 'Isoleucine or valine' 0 C--O 1.257 1.454 0 CA-C-O 123.735 1.731 . . . . 14.68 110.958 178.028 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 51.4 tp -62.91 -35.72 80.99 Favored 'General case' 0 N--CA 1.488 1.434 0 CA-C-O 115.806 -2.045 . . . . 23.81 110.432 -178.106 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.4 tptt -63.27 -41.55 99.03 Favored 'General case' 0 C--N 1.299 -1.601 0 O-C-N 127.494 2.996 . . . . 53.2 108.451 177.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 79.7 mt -69.11 -37.86 77.29 Favored 'Isoleucine or valine' 0 C--O 1.272 2.277 0 CA-C-O 125.792 2.71 . . . . 20.03 112.38 178.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 45.0 tp -64.47 -50.08 68.89 Favored 'General case' 0 C--N 1.323 -0.567 1 O-C-N 116.012 -4.18 . . . . 16.79 108.982 179.545 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 54.7 m -59.03 -43.48 91.63 Favored 'General case' 0 C--O 1.248 0.996 0 C-N-CA 126.861 2.065 . . . . 18.69 111.001 -179.573 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 88.1 m-20 -59.75 -45.04 93.46 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-O 116.344 -1.789 . . . . 45.54 108.772 176.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 53.7 tp10 -71.59 -36.03 70.73 Favored 'General case' 0 C--O 1.251 1.151 0 C-N-CA 113.053 -3.459 . . . . 28.5 110.017 -179.856 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 8.4 ttm180 -62.1 -48.74 78.81 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-N 119.393 0.997 . . . . 30.99 108.977 -179.004 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 22.6 p -66.7 -35.23 79.65 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 125.575 1.797 . . . . 15.51 114.192 178.45 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 19.8 ttp85 -62.45 -42.6 99.58 Favored 'General case' 0 C--O 1.261 1.667 0 O-C-N 118.516 -2.615 . . . . 25.17 107.397 177.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 83.3 mtt180 -63.31 -53.16 57.14 Favored 'General case' 0 C--O 1.241 0.618 1 O-C-N 116.176 -4.077 . . . . 16.19 110.791 177.415 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.518 ' HG3' ' HB1' ' A' ' 51' ' ' ALA . 58.6 mt-30 -53.71 -48.56 69.46 Favored 'General case' 0 C--O 1.253 1.257 0 CA-C-O 113.831 -2.985 . . . . 50.81 111.332 -178.944 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . 0.356 2.9 m -71.02 -18.58 20.74 Favored 'Isoleucine or valine' 0 C--O 1.244 0.772 0 CA-C-O 112.54 -3.6 . . . . 27.53 111.538 -178.704 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 -100.56 3.5 42.76 Favored 'General case' 0 C--N 1.307 -1.246 0 O-C-N 125.772 1.92 . . . . 46.32 113.405 178.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 66.58 30.2 8.55 Favored 'General case' 0 C--O 1.242 0.694 0 N-CA-C 115.781 1.771 . . . . 59.65 115.781 177.365 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 96.6 mt -88.3 147.86 24.58 Favored 'General case' 0 C--O 1.252 1.197 1 O-C-N 130.428 4.83 . . . . 26.51 107.435 -179.854 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 73.8 mtt-85 -75.43 162.54 28.27 Favored 'General case' 0 C--O 1.251 1.159 0 CA-C-O 123.822 1.772 . . . . 52.89 107.191 177.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 60.86 47.25 7.9 Favored 'General case' 0 C--O 1.259 1.562 0 CA-C-N 112.395 -2.184 . . . . 20.62 113.702 175.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.518 ' HB1' ' HG3' ' A' ' 44' ' ' GLN . . . -93.33 67.76 4.12 Favored 'General case' 0 C--O 1.256 1.446 0 CA-C-N 109.877 -3.329 . . . . 23.35 111.019 -179.851 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 65.1 p -145.01 151.5 38.67 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-O 115.464 -2.208 . . . . 18.57 108.264 -179.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -57.49 -42.43 82.67 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 128.679 3.737 . . . . 15.41 108.107 179.825 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 75.1 m -57.2 -52.77 63.96 Favored 'General case' 0 C--N 1.299 -1.611 0 C-N-CA 124.097 0.959 . . . . 23.69 112.253 -179.115 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -62.15 -45.6 92.71 Favored 'General case' 0 C--N 1.315 -0.893 0 O-C-N 127.272 2.857 . . . . 19.12 111.096 -179.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 56.9 mt -61.54 -42.63 99.12 Favored 'General case' 0 C--O 1.256 1.42 0 CA-C-O 116.538 -1.696 . . . . 11.19 110.669 177.661 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.442 HD12 HG11 ' B' ' 26' ' ' VAL . 22.6 mt -67.12 -34.85 78.49 Favored 'General case' 0 C--N 1.286 -2.157 0 C-N-CA 125.213 1.405 . . . . 16.4 112.279 -179.547 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 63.6 m -74.01 -46.29 44.5 Favored 'General case' 0 C--N 1.294 -1.808 0 N-CA-C 106.158 -1.793 . . . . 22.79 106.158 -179.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 65.9 mt-10 -56.77 -49.53 75.0 Favored 'General case' 0 C--O 1.269 2.091 0 O-C-N 126.748 2.53 . . . . 14.9 109.279 177.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.78 -51.39 69.96 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 125.099 1.36 . . . . 11.91 109.937 -178.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -55.7 -51.07 68.55 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-O 115.154 -2.355 . . . . 14.18 110.613 179.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 50.5 mt -59.51 -40.31 86.66 Favored 'General case' 0 C--N 1.295 -1.778 0 CA-C-N 122.419 2.372 . . . . 12.95 109.929 177.91 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 49.1 t-80 -59.52 -55.85 29.43 Favored 'General case' 0 C--O 1.259 1.584 0 O-C-N 124.33 1.019 . . . . 19.34 113.514 179.766 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.433 ' HB1' HD11 ' B' ' 70' ' ' LEU . . . -67.06 -43.13 83.46 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-O 115.661 -2.114 . . . . 17.76 113.375 -177.402 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . 0.362 90.0 m-85 -95.18 -15.4 23.32 Favored 'General case' 0 C--O 1.253 1.28 0 CA-C-O 113.09 -3.338 . . . . 31.77 115.834 -177.043 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.6 p -121.83 -16.08 7.72 Favored 'General case' 0 C--O 1.247 0.961 0 O-C-N 125.925 2.016 . . . . 21.95 109.921 178.356 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.478 ' HA2' ' O ' ' A' ' 146' ' ' HOH . . . 79.81 12.77 83.14 Favored Glycine 0 C--O 1.243 0.666 0 C-N-CA 125.024 1.297 . . . . 14.46 111.174 179.54 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 38.0 tt0 -67.54 128.37 93.56 Favored Pre-proline 0 N--CA 1.5 2.071 0 CA-C-O 116.507 -1.711 . . . . 22.47 109.438 -179.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_exo -54.55 140.83 75.08 Favored 'Trans proline' 0 C--N 1.312 -1.385 0 O-C-N 125.449 2.289 . . . . 14.67 117.297 -179.591 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 28.3 mt -80.16 156.03 74.4 Favored Pre-proline 0 CA--C 1.542 0.664 0 O-C-N 124.853 1.346 . . . . 27.87 108.478 175.173 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -72.8 149.32 47.83 Favored 'Trans proline' 0 C--O 1.247 0.958 0 C-N-CA 120.463 0.775 . . . . 26.36 112.064 175.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.31 0.4 OUTLIER -101.66 169.96 8.49 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 102.815 -3.032 . . . . 69.77 102.815 176.448 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -47.73 -50.64 24.75 Favored 'General case' 0 C--O 1.252 1.225 0 N-CA-C 114.852 1.427 . . . . 33.39 114.852 -179.312 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -50.03 -36.88 30.59 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 122.898 1.332 . . . . 31.54 113.241 -179.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 74.7 m-20 -68.33 -29.52 68.29 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 127.17 2.188 . . . . 25.22 110.071 -179.468 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 84.9 mt -97.64 4.64 50.08 Favored 'General case' 0 C--O 1.257 1.464 0 N-CA-C 117.256 2.317 . . . . 32.7 117.256 -178.564 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 28.1 mmt180 -67.52 141.52 56.86 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 108.466 -0.939 . . . . 83.37 108.466 178.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 67.2 mttt -71.02 -12.93 61.8 Favored 'General case' 0 C--O 1.248 1.006 0 CA-C-O 116.197 -1.859 . . . . 76.29 111.22 -179.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -86.11 -1.97 57.9 Favored 'General case' 0 C--O 1.254 1.311 0 CA-C-N 120.906 1.684 . . . . 99.99 112.39 179.251 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.602 ' HG2' ' O ' ' A' ' 81' ' ' SER . 39.1 ttt-85 -108.59 149.36 29.0 Favored 'General case' 0 C--O 1.249 1.069 0 N-CA-C 104.766 -2.309 . . . . 67.1 104.766 178.979 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' SER . . . . . 0.602 ' O ' ' HG2' ' A' ' 80' ' ' ARG . 15.9 m -73.07 153.19 40.94 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 103.578 -2.749 . . . . 67.27 103.578 178.84 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -80.09 86.38 5.55 Favored 'General case' 0 C--N 1.317 -0.821 0 O-C-N 125.711 1.882 . . . . 42.99 109.434 179.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -121.89 -172.71 2.49 Favored 'General case' 0 C--N 1.32 -0.697 0 O-C-N 126.37 2.294 . . . . 71.93 111.728 179.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 58.6 mt -59.42 137.77 89.05 Favored Pre-proline 0 C--N 1.313 -1.009 0 C-N-CA 126.751 2.021 . . . . 27.26 110.576 176.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_exo -50.07 140.7 31.84 Favored 'Trans proline' 0 C--N 1.325 -0.678 0 C-N-CA 122.933 2.422 . . . . 20.36 107.278 178.794 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -57.97 -43.16 86.33 Favored 'General case' 0 C--O 1.252 1.212 0 O-C-N 124.944 1.402 . . . . 43.08 110.292 -179.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.31 -30.78 70.71 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 120.723 -1.236 . . . . 41.23 111.591 -179.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.08 -44.75 65.08 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 106.669 -1.604 . . . . 23.86 106.669 179.382 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -57.32 -43.12 83.03 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 125.483 1.739 . . . . 34.04 108.23 179.273 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -52.7 -53.95 40.39 Favored 'General case' 0 C--O 1.249 1.058 0 O-C-N 128.636 3.71 . . . . 71.51 113.056 -178.117 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 26.7 mt -63.4 -38.3 81.8 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.566 0 CA-C-O 113.623 -3.084 . . . . 33.7 113.192 179.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 36.4 mtp -62.15 -46.66 88.01 Favored 'General case' 0 CA--C 1.543 0.674 1 O-C-N 129.737 4.398 . . . . 19.2 107.47 179.949 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.515 ' NH1' ' O ' ' A' ' 125' ' ' HOH . 31.9 mtm-85 -63.48 -38.33 90.71 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-O 116.79 -1.576 . . . . 47.98 112.804 -179.189 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 88.3 mt-10 -64.58 -24.76 67.7 Favored 'General case' 0 C--N 1.311 -1.097 0 O-C-N 126.616 2.448 . . . . 48.97 111.848 178.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 79.3 mtp -100.91 10.88 40.59 Favored 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 124.618 1.167 . . . . 52.94 110.494 178.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 70.68 27.67 72.09 Favored Glycine 0 C--O 1.248 0.988 0 C-N-CA 126.221 1.867 . . . . 32.84 116.917 -179.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 30.8 mt -106.17 129.39 59.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 N-CA-C 103.018 -2.956 . . . . 30.53 103.018 179.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.719 HD22 ' HD2' ' A' ' 99' ' ' PRO . 0.7 OUTLIER -84.26 113.91 51.38 Favored Pre-proline 0 N--CA 1.481 1.081 0 O-C-N 128.203 3.439 . . . . 46.21 107.595 177.708 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.719 ' HD2' HD22 ' A' ' 98' ' ' ASN . 36.6 Cg_endo -65.24 -26.12 56.93 Favored 'Trans proline' 0 C--N 1.313 -1.298 0 O-C-N 125.828 2.488 . . . . 30.26 115.239 -179.897 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -71.74 -24.82 61.85 Favored 'General case' 0 C--N 1.313 -1.001 0 C-N-CA 127.347 2.259 . . . . 78.97 113.337 -178.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 35.8 p -112.64 5.75 17.93 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 116.39 -1.766 . . . . 31.89 107.764 -178.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' TRP . . . . . . . . . . . . . 73.1 t-105 -73.42 135.25 44.17 Favored 'General case' 0 N--CA 1.484 1.241 0 O-C-N 127.695 3.122 . . . . 29.53 109.5 179.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -112.88 133.86 54.67 Favored 'General case' 0 C--N 1.319 -0.74 0 O-C-N 126.162 2.163 . . . . 99.99 108.366 -178.333 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 36.2 p90 . . . . . 0 N--CA 1.493 1.725 1 O-C-N 129.411 4.195 . . . . 37.55 111.769 -178.438 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.927 0 N-CA-C 109.805 -0.443 . . . . 96.31 109.805 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' GLU . . . . . 0.503 ' CD ' ' H ' ' B' ' 3' ' ' TRP . 0.0 OUTLIER -119.03 -177.67 3.39 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-O 126.015 2.817 . . . . 79.92 113.177 179.961 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' TRP . . . . . 0.503 ' H ' ' CD ' ' B' ' 2' ' ' GLU . 23.1 t90 -72.55 148.82 44.59 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 100.752 -3.795 . . . . 54.85 100.752 177.737 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 81.1 p -79.77 -8.75 59.45 Favored 'General case' 0 C--N 1.297 -1.675 0 O-C-N 124.092 0.87 . . . . 38.51 112.608 -179.098 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' GLY . . . . . 0.412 ' O ' ' HG2' ' B' ' 92' ' ' MET . . . 92.13 -2.83 75.9 Favored Glycine 0 N--CA 1.478 1.458 0 CA-C-O 114.412 -3.438 . . . . 12.17 108.602 -177.976 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -86.89 90.36 8.3 Favored 'General case' 0 N--CA 1.51 2.537 0 CA-C-O 126.012 2.815 . . . . 48.17 112.242 177.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -63.04 130.69 45.78 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 126.172 1.789 . . . . 18.71 114.048 -176.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' ILE . . . . . . . . . . . . . 58.2 mt -124.53 124.78 69.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-N 112.987 -1.915 . . . . 24.16 105.835 179.474 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' SER . . . . . 0.416 ' HA ' ' HD3' ' B' ' 10' ' ' PRO . 39.0 t -71.48 132.19 85.86 Favored Pre-proline 0 N--CA 1.478 0.949 0 O-C-N 128.72 3.763 . . . . 13.52 112.662 176.214 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' B' ' 9' ' ' SER . 8.1 Cg_exo -79.65 -11.61 14.05 Favored 'Trans proline' 0 N--CA 1.434 -2.013 0 C-N-CA 124.296 3.33 . . . . 11.18 109.973 177.367 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -100.72 132.65 46.01 Favored 'General case' 0 C--O 1.222 -0.382 0 O-C-N 127.104 2.752 . . . . 23.61 115.587 -173.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' ALA . . . . . 0.548 ' HB1' HG21 ' B' ' 21' ' ' VAL . . . -81.06 73.37 8.1 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 110.851 -2.886 . . . . 80.48 112.864 -178.123 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 50.5 mm-40 -148.44 140.81 24.24 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 126.94 3.257 . . . . 99.99 112.396 -179.011 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' HIS . . . . . 0.69 ' O ' ' N ' ' B' ' 16' ' ' LYS . 0.0 OUTLIER -166.25 -18.03 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 101.583 -3.488 . . . . 99.99 101.583 179.886 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' GLY . . . . . 0.419 ' C ' ' O ' ' B' ' 14' ' ' HIS . . . -9.85 64.25 0.0 OUTLIER Glycine 0 CA--C 1.528 0.894 0 CA-C-N 111.276 -2.693 . . . . 99.99 112.374 178.998 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' LYS . . . . . 0.69 ' N ' ' O ' ' B' ' 14' ' ' HIS . 35.3 mttt -133.05 -75.39 0.49 Allowed 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 112.23 -1.985 . . . . 99.99 106.829 179.628 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 29.0 ttmt -109.1 -64.39 1.25 Allowed 'General case' 0 C--O 1.247 0.935 0 CA-C-O 123.694 1.711 . . . . 99.99 113.857 179.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -97.42 165.52 11.97 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 117.828 2.529 . . . . 99.99 117.828 -177.308 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' GLU . . . . . 0.403 ' C ' ' H ' ' B' ' 21' ' ' VAL . 12.9 mt-10 -118.81 73.61 0.93 Allowed 'General case' 0 C--O 1.239 0.524 0 CA-C-N 111.122 -2.763 . . . . 99.99 111.259 179.508 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -68.12 29.31 0.03 OUTLIER 'General case' 0 C--O 1.245 0.822 0 C-N-CA 129.372 3.069 . . . . 99.99 113.311 179.83 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' VAL . . . . . 0.548 HG21 ' HB1' ' B' ' 12' ' ' ALA . 39.4 t -130.5 142.38 43.84 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 CA-C-N 113.353 -1.749 . . . . 52.94 113.203 -177.191 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 24.0 mmtt -110.09 165.86 11.41 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 112.152 -2.295 . . . . 68.01 105.934 177.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 13.2 mttp -121.59 140.25 52.48 Favored 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 103.532 -2.766 . . . . 49.59 103.532 -179.209 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 49.6 pt -139.17 157.67 28.44 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.778 0 N-CA-C 102.619 -3.104 . . . . 17.25 102.619 178.106 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 62.7 m -115.71 133.62 55.85 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 112.98 -1.918 . . . . 17.23 106.91 179.191 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' VAL . . . . . 0.442 HG11 HD12 ' A' ' 57' ' ' LEU . 27.5 m -130.31 148.76 33.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 O-C-N 128.342 3.526 . . . . 14.67 111.351 178.844 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 6.2 m -98.81 117.11 32.54 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 111.238 -2.71 . . . . 31.51 107.708 176.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 39.4 mt -116.49 119.91 35.39 Favored Pre-proline 0 C--O 1.25 1.102 0 CA-C-O 123.012 1.387 . . . . 29.2 109.596 179.514 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_exo -59.74 143.58 99.6 Favored 'Trans proline' 0 C--O 1.257 1.426 0 C-N-CA 123.676 2.918 . . . . 16.17 106.51 175.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -49.55 -39.48 34.82 Favored 'General case' 0 C--O 1.257 1.473 0 N-CA-C 120.225 3.417 . . . . 47.4 120.225 -177.617 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.84 -36.45 83.28 Favored 'General case' 0 C--N 1.281 -2.387 0 C-N-CA 131.534 3.933 . . . . 79.5 111.203 -179.638 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 82.9 t -80.44 -38.42 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 CA-C-O 123.483 1.611 . . . . 17.19 106.665 -179.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 50.4 tp -59.88 -41.17 90.97 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 112.905 -1.952 . . . . 17.81 109.044 179.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' LYS . . . . . . . . . . . . . 49.0 tptt -54.38 -50.28 67.88 Favored 'General case' 0 C--N 1.319 -0.717 0 O-C-N 121.046 -1.034 . . . . 70.08 110.722 179.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' ILE . . . . . . . . . . . . . 57.8 mt -57.95 -43.27 84.41 Favored 'Isoleucine or valine' 0 C--O 1.259 1.556 0 O-C-N 120.238 -1.538 . . . . 27.89 109.656 178.067 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 21.2 tp -62.57 -46.77 86.8 Favored 'General case' 0 C--O 1.249 1.037 0 O-C-N 124.553 1.158 . . . . 15.69 113.256 -179.219 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' THR . . . . . . . . . . . . . 99.3 m -65.47 -38.36 89.57 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 119.636 -1.915 . . . . 24.32 110.12 178.273 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -59.57 -47.92 83.68 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 124.488 1.115 . . . . 28.49 108.96 177.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 52.3 tp10 -68.23 -37.72 81.11 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 124.547 2.118 . . . . 27.92 110.831 179.442 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.466 HH11 ' HD3' ' B' ' 40' ' ' ARG . 37.5 ttp-105 -64.4 -45.47 87.49 Favored 'General case' 0 N--CA 1.47 0.542 1 O-C-N 116.071 -4.143 . . . . 40.05 109.968 -178.792 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 86.2 m -63.66 -41.05 98.24 Favored 'General case' 0 C--O 1.257 1.474 0 O-C-N 126.794 2.559 . . . . 20.33 111.192 -179.331 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 49.3 ttp85 -58.9 -41.34 86.99 Favored 'General case' 0 C--O 1.264 1.865 0 C-N-CA 127.467 2.307 . . . . 31.05 111.249 178.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 78.2 mtt180 -67.6 -50.91 55.96 Favored 'General case' 0 C--O 1.226 -0.133 0 C-N-CA 126.116 1.766 . . . . 22.49 108.211 177.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -56.8 -50.95 70.79 Favored 'General case' 0 C--O 1.25 1.105 0 CA-C-N 114.419 -1.264 . . . . 66.74 110.638 179.657 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . 0.298 4.3 m -67.57 -30.58 49.24 Favored 'Isoleucine or valine' 0 C--O 1.247 0.94 0 CA-C-O 112.172 -3.775 . . . . 30.15 112.009 -179.418 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 67.9 m-80 -89.88 9.96 25.61 Favored 'General case' 0 N--CA 1.489 1.481 1 O-C-N 129.191 4.057 . . . . 36.11 110.442 -179.949 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 2.8 m120 56.61 41.3 28.68 Favored 'General case' 0 C--O 1.257 1.45 0 CA-C-O 115.922 -1.989 . . . . 69.13 109.465 179.24 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 83.9 mt -95.18 158.54 15.42 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 127.279 2.862 . . . . 18.28 107.565 176.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 48.9 mtt-85 -77.93 166.16 23.2 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 107.798 -1.186 . . . . 62.41 107.798 178.18 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' HIS . . . . . . . . . . . . . 63.5 m-70 55.77 45.68 23.89 Favored 'General case' 0 C--O 1.255 1.369 0 CA-C-O 126.107 2.861 . . . . 20.83 117.398 177.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -93.57 56.69 2.44 Favored 'General case' 0 C--O 1.241 0.634 0 C-N-CA 127.149 2.18 . . . . 20.95 110.612 179.647 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 37.0 p -136.36 157.25 47.25 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-O 115.863 -2.018 . . . . 19.72 106.372 177.358 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -55.92 -44.1 77.98 Favored 'General case' 0 C--N 1.316 -0.872 0 O-C-N 126.628 2.455 . . . . 27.55 111.372 -179.489 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' SER . . . . . . . . . . . . . 66.1 m -61.26 -46.27 91.05 Favored 'General case' 0 C--N 1.299 -1.621 0 CA-C-O 113.743 -3.027 . . . . 11.74 114.543 -178.372 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -69.58 -38.1 77.23 Favored 'General case' 0 N--CA 1.486 1.356 0 O-C-N 127.534 3.021 . . . . 19.4 108.274 -176.567 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 79.9 mt -63.99 -43.94 94.19 Favored 'General case' 0 C--N 1.32 -0.706 1 O-C-N 129.417 4.198 . . . . 11.29 112.367 177.618 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 54.4 mt -64.38 -38.9 92.65 Favored 'General case' 0 C--O 1.253 1.276 0 CA-C-O 117.679 -1.153 . . . . 15.35 109.965 178.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' CYS . . . . . . . . . . . . . 72.1 m -72.02 -38.92 69.5 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 116.533 -1.699 . . . . 12.61 110.395 -179.57 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -62.04 -44.19 97.22 Favored 'General case' 0 C--N 1.354 0.776 0 O-C-N 126.384 2.302 . . . . 10.84 108.763 177.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -66.01 -40.32 90.99 Favored 'General case' 0 C--O 1.248 0.985 0 O-C-N 128.599 3.687 . . . . 11.14 112.565 -177.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' PHE . . . . . . . . . . . . . 92.8 t80 -63.34 -45.37 91.55 Favored 'General case' 0 N--CA 1.496 1.848 0 CA-C-O 124.448 2.07 . . . . 14.25 111.998 -177.411 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 33.4 mt -67.52 -33.76 75.73 Favored 'General case' 0 C--N 1.307 -1.277 0 O-C-N 120.357 -1.464 . . . . 19.88 109.558 -177.791 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' HIS . . . . . . . . . . . . . 61.1 t60 -71.78 -50.22 31.86 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 125.52 1.762 . . . . 20.49 106.727 -178.147 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -65.4 -46.82 78.52 Favored 'General case' 0 C--O 1.257 1.471 0 N-CA-C 114.903 1.445 . . . . 13.27 114.903 -178.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' PHE . . . . . . . . . . . . 0.436 96.7 m-85 -89.07 -12.87 40.0 Favored 'General case' 0 C--O 1.249 1.072 0 CA-C-O 113.153 -3.308 . . . . 34.88 115.534 -176.767 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 8.6 p -128.86 -8.25 4.97 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 123.38 2.809 . . . . 19.68 115.341 178.469 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' GLY . . . . . . . . . . . . . . . 87.77 -2.41 85.88 Favored Glycine 0 C--N 1.314 -0.644 0 O-C-N 125.356 1.66 . . . . 15.6 112.562 -177.124 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -59.9 125.54 80.88 Favored Pre-proline 0 C--O 1.255 1.355 0 CA-C-O 126.253 2.93 . . . . 17.5 113.205 -178.637 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -57.64 146.32 85.36 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 CA-C-O 125.405 2.169 . . . . 18.83 110.64 177.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' LEU . . . . . 0.433 HD11 ' HB1' ' A' ' 64' ' ' ALA . 38.5 mt -88.22 152.06 49.78 Favored Pre-proline 0 C--O 1.253 1.278 0 CA-C-N 111.775 -2.466 . . . . 18.35 107.055 176.259 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -71.25 141.84 40.18 Favored 'Trans proline' 0 C--N 1.311 -1.429 0 C-N-CA 122.107 1.871 . . . . 15.05 111.912 176.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -82.9 156.95 23.27 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 102.239 -3.245 . . . . 46.04 102.239 175.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -57.24 -29.4 63.76 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-N 120.032 1.287 . . . . 20.12 111.261 178.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.34 -39.15 92.03 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-O 116.961 -1.495 . . . . 15.47 108.868 176.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -64.88 -30.58 71.59 Favored 'General case' 0 C--O 1.255 1.348 0 CA-C-N 119.939 1.245 . . . . 13.0 112.552 178.899 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 95.7 mt -79.75 -0.18 33.22 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 112.841 -1.981 . . . . 30.01 114.912 -177.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' ARG . . . . . 0.421 HH11 ' HD3' ' B' ' 77' ' ' ARG . 15.1 mtm180 -97.74 -46.01 6.14 Favored 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 104.32 -2.474 . . . . 69.82 104.32 177.81 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' LYS . . . . . . . . . . . . . 32.0 mtmt -14.34 -126.44 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.181 1 C-N-CA 134.291 5.036 . . . . 74.3 121.257 -179.578 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' GLU . . . . . 0.613 ' O ' ' O ' ' B' ' 82' ' ' ASP . 3.7 mm-40 -152.18 140.01 19.97 Favored 'General case' 0 C--O 1.245 0.819 0 C-N-CA 130.48 3.512 . . . . 99.99 111.814 -178.859 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.78 -17.5 64.04 Favored 'General case' 0 C--O 1.247 0.924 0 CA-C-O 124.111 1.91 . . . . 99.99 110.056 178.73 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.57 -19.33 38.72 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-N 112.514 -2.13 . . . . 81.05 108.622 178.3 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' ASP . . . . . 0.613 ' O ' ' O ' ' B' ' 79' ' ' GLU . 28.0 t0 -141.79 78.45 1.63 Allowed 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 111.484 -2.598 . . . . 67.37 105.423 -179.537 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -107.33 -13.06 15.2 Favored 'General case' 0 C--O 1.254 1.326 0 CA-C-O 115.708 -2.091 . . . . 39.24 110.623 -178.177 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 59.6 mt -65.95 128.2 93.66 Favored Pre-proline 0 C--O 1.257 1.464 0 C-N-CA 113.886 -3.126 . . . . 24.59 109.515 -179.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_exo -51.16 144.32 29.67 Favored 'Trans proline' 0 C--N 1.312 -1.346 0 O-C-N 126.158 2.662 . . . . 18.56 106.169 178.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 -65.53 -37.4 86.63 Favored 'General case' 0 C--O 1.248 0.975 0 O-C-N 121.875 -0.516 . . . . 26.61 111.285 178.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.15 -37.63 85.9 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-O 117.257 -1.354 . . . . 14.5 108.027 176.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.38 -45.23 88.57 Favored 'General case' 0 C--N 1.309 -1.18 0 C-N-CA 128.885 2.874 . . . . 16.68 110.348 176.534 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -63.43 -37.16 86.23 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 107.653 -1.24 . . . . 24.31 107.653 178.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' GLU . . . . . . . . . . . . . 29.2 tp10 -66.65 -42.05 87.29 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 116.49 -2.084 . . . . 41.81 110.712 -179.655 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' ILE . . . . . . . . . . . . . 67.2 mt -64.77 -39.92 87.3 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 120.85 1.659 . . . . 15.0 110.591 178.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' MET . . . . . 0.412 ' HG2' ' O ' ' B' ' 5' ' ' GLY . 94.5 mtp -59.78 -50.33 74.22 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 107.123 -1.436 . . . . 15.02 107.123 177.396 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' ARG . . . . . . . . . . . . . 42.8 mtt180 -56.85 -43.03 80.73 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 119.013 -1.075 . . . . 24.46 113.232 177.019 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 81.1 mt-10 -62.8 -23.66 67.36 Favored 'General case' 0 N--CA 1.443 -0.79 0 N-CA-C 115.26 1.578 . . . . 36.1 115.26 177.499 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' MET . . . . . . . . . . . . . 3.2 mmt -96.84 2.05 51.34 Favored 'General case' 0 C--O 1.249 1.039 0 C-N-CA 126.872 2.069 . . . . 28.86 110.518 -179.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 81.52 21.03 62.84 Favored Glycine 0 C--N 1.294 -1.805 0 C-N-CA 125.886 1.708 . . . . 24.24 114.775 178.798 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 13.4 mt -108.19 126.98 64.79 Favored 'Isoleucine or valine' 0 C--O 1.253 1.244 0 C-N-CA 125.219 1.408 . . . . 30.3 108.632 178.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' ASN . . . . . 0.83 HD21 ' HB2' ' B' ' 100' ' ' GLU . 0.3 OUTLIER -90.87 117.21 67.76 Favored Pre-proline 0 CA--C 1.536 0.437 0 O-C-N 126.047 2.092 . . . . 44.63 109.843 -179.443 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -57.83 -33.93 97.6 Favored 'Trans proline' 0 C--O 1.257 1.463 0 O-C-N 127.693 3.47 . . . . 28.44 115.38 179.846 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' GLU . . . . . 0.83 ' HB2' HD21 ' B' ' 98' ' ' ASN . 24.8 mm-40 -63.92 -29.63 70.79 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 129.835 3.254 . . . . 55.89 116.185 -179.848 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 57.8 p -116.29 2.54 13.27 Favored 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 126.332 1.853 . . . . 31.31 112.085 179.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' TRP . . . . . . . . . . . . . 76.6 t-105 -79.15 129.36 34.38 Favored 'General case' 0 C--O 1.255 1.37 0 CA-C-O 123.417 1.579 . . . . 31.12 107.797 -179.46 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -104.29 121.73 43.95 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 110.942 -2.844 . . . . 90.23 109.164 179.364 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' TYR . . . . . . . . . . . . . 27.5 p90 . . . . . 0 C--O 1.262 1.752 0 O-C-N 126.524 2.39 . . . . 56.75 110.121 178.485 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' HOH . . . . . 0.515 ' O ' ' NH1' ' A' ' 93' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' HOH . . . . . 0.478 ' O ' ' HA2' ' A' ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' HOH . . . . . 0.454 ' O ' ' HA ' ' B' ' 82' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 143' ' ' HOH . . . . . 0.464 ' O ' ' NH2' ' B' ' 40' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 145' ' ' HOH . . . . . 0.412 ' O ' ' NH1' ' B' ' 77' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_