data_7brn_residue ############################ # Computer software used # ############################ 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 7brn _Structure_validation_residue.Date_analyzed 2020-07-03 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' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.464 0 N-CA-C 114.109 0.403 . . . . 57.21 114.109 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_exo -60.02 145.6 98.01 Favored 'Trans proline' 0 C--N 1.329 -0.498 0 O-C-N 122.654 0.818 . . . . 53.41 111.728 -179.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 36.8 mm-40 -93.09 157.27 16.38 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 114.955 -1.02 . . . . 65.37 110.409 167.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -50.12 136.62 21.56 Favored Pre-proline 0 C--O 1.241 0.613 0 CA-C-N 115.11 -0.95 . . . . 37.73 110.166 175.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -91.84 11.9 55.52 Favored 'Cis proline' 0 CA--C 1.541 0.859 0 C-N-CA 129.986 1.244 . . . . 37.03 114.712 1.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 72.5 m-80 -84.62 1.21 47.17 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 117.371 -1.732 . . . . 34.39 113.52 -169.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ASP . . . . . 0.423 ' N ' ' OD1' ' A' ' 7' ' ' ASP . 15.1 p-10 -75.18 -7.45 53.86 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 123.781 0.675 . . . . 34.12 112.205 162.364 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 -92.75 145.51 24.36 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 118.747 0.703 . . . . 35.47 111.692 173.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -87.67 117.29 26.39 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.182 -0.917 . . . . 36.59 109.584 168.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -86.95 -4.23 59.16 Favored 'General case' 0 C--O 1.238 0.499 0 N-CA-C 112.385 0.513 . . . . 41.59 112.385 179.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 7.4 mtt 57.02 42.71 25.64 Favored 'General case' 0 CA--C 1.522 -0.118 0 CA-C-O 121.028 0.442 . . . . 50.12 111.113 175.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 20.3 mp0 -54.62 -25.34 25.93 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 120.073 -0.651 . . . . 68.93 112.659 -178.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 21.2 p-10 -67.31 -5.09 12.71 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 113.393 0.886 . . . . 58.43 113.393 179.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 8.6 pt -138.37 10.46 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 120.033 1.288 . . . . 68.88 110.434 172.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . . . -61.72 130.54 46.28 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 109.172 -0.677 . . . . 70.64 109.172 176.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -115.55 169.74 8.95 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.714 0.768 . . . . 85.72 110.457 -173.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -65.8 -23.57 66.73 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.307 -0.86 . . . . 93.3 111.543 169.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 61.8 p -72.37 -7.51 50.03 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 112.898 0.703 . . . . 79.62 112.898 175.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 18.1 mtt -119.39 1.99 11.26 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 113.044 0.757 . . . . 93.16 113.044 -176.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.4 tttt -72.47 141.64 48.58 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 118.913 0.779 . . . . 68.14 110.931 -177.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.9 t -158.3 126.25 5.24 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.304 -0.999 . . . . 50.15 108.304 -164.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 33.7 p -136.64 178.31 7.17 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 121.808 0.813 . . . . 45.49 109.034 -179.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -60.55 -49.71 76.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.961 -1.018 . . . . 39.83 110.176 -173.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 48.9 mttt -59.11 -37.7 77.8 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 120.589 -0.444 . . . . 54.08 112.137 -178.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 77.0 p -88.38 -3.71 58.79 Favored 'General case' 0 C--N 1.347 0.491 0 N-CA-C 112.609 0.596 . . . . 36.73 112.609 -176.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -102.16 -19.8 14.96 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 113.676 0.991 . . . . 39.13 113.676 179.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -132.43 134.2 24.57 Favored Pre-proline 0 C--O 1.249 1.073 0 CA-C-N 118.697 0.68 . . . . 36.45 111.026 -175.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -58.72 143.91 98.45 Favored 'Trans proline' 0 N--CA 1.475 0.435 0 CA-C-N 119.11 0.718 . . . . 38.66 111.051 -172.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -45.28 -47.84 12.97 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.016 -0.538 . . . . 44.55 111.543 172.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 -63.23 -37.64 88.05 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 118.002 -1.479 . . . . 66.95 110.535 -173.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -67.27 -36.16 80.99 Favored 'General case' 0 CA--C 1.513 -0.478 0 C-N-CA 118.642 -1.223 . . . . 65.02 110.322 177.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 30.0 mtm105 -68.26 -45.77 72.25 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 120.625 0.25 . . . . 39.94 111.205 -179.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.2 tptp -60.94 -44.32 97.43 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 120.189 -0.604 . . . . 55.39 111.336 178.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.52 -35.36 75.79 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.481 -0.488 . . . . 35.22 111.537 179.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLU . . . . . 0.518 ' OE1' ' H11' ' A' ' 203' ' ' EDO . 23.2 tt0 -69.84 -45.73 67.16 Favored 'General case' 0 C--O 1.236 0.389 0 O-C-N 122.099 -0.376 . . . . 29.93 111.117 -179.196 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 52.7 p -66.22 -34.12 77.29 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 118.791 -1.164 . . . . 32.76 111.364 176.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -63.89 -40.16 95.86 Favored 'General case' 0 C--O 1.239 0.535 0 C-N-CA 119.0 -1.08 . . . . 50.15 110.548 174.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 30.3 tpt180 -61.65 -38.77 88.93 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.286 -0.566 . . . . 38.04 110.641 177.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 75.7 mt -67.33 -42.09 87.17 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 O-C-N 122.003 -0.436 . . . . 32.95 111.825 178.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -55.95 -32.29 63.71 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 120.067 -0.653 . . . . 38.19 111.059 174.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -81.63 -40.2 23.29 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 119.824 -0.751 . . . . 38.26 111.838 -179.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 42.0 tpt85 -100.38 -25.76 14.11 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.078 0.551 . . . . 36.5 112.277 -164.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -128.79 62.46 61.35 Favored Pre-proline 0 C--N 1.328 -0.362 0 C-N-CA 123.241 0.617 . . . . 32.82 109.522 171.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -54.65 -32.4 75.15 Favored 'Trans proline' 0 CA--C 1.505 -0.956 0 N-CA-C 115.774 1.413 . . . . 42.98 115.774 -168.161 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -96.76 17.26 16.99 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 113.047 0.758 . . . . 64.41 113.047 -175.314 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.7 mmt180 -108.67 145.45 34.99 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 118.387 0.54 . . . . 66.78 111.119 175.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 36.9 mt -97.63 121.75 57.21 Favored Pre-proline 0 C--N 1.328 -0.349 0 N-CA-C 107.7 -1.222 . . . . 59.97 107.7 174.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -85.32 121.65 2.33 Favored 'Trans proline' 0 C--O 1.235 0.335 0 CA-C-N 119.263 0.773 . . . . 36.85 110.733 -178.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 79.2 t -123.63 124.14 68.79 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 N-CA-C 107.484 -1.302 . . . . 32.9 107.484 -170.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 23.3 mm -93.17 116.13 33.59 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 N-CA-C 107.009 -1.478 . . . . 37.8 107.009 167.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 46.9 t -117.74 116.59 27.32 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 108.391 -0.966 . . . . 37.59 108.391 -179.226 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -129.66 162.56 28.04 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 121.661 0.743 . . . . 38.46 110.845 -178.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -82.41 129.46 34.89 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.319 -0.855 . . . . 63.88 111.395 -175.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -51.74 149.55 4.61 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.43 0.633 . . . . 45.03 110.862 177.013 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 69.4 tt0 -66.07 124.7 23.3 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.858 -0.61 . . . . 91.87 110.329 -174.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . . . 66.34 17.03 10.62 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 113.364 0.875 . . . . 74.05 113.364 175.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 12.9 t -74.36 148.06 41.6 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.638 0.732 . . . . 57.64 110.41 176.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -91.33 79.19 5.66 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 108.089 -1.078 . . . . 73.8 108.089 -177.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 10.0 tt -159.37 148.15 14.07 Favored Pre-proline 0 C--O 1.24 0.56 0 CA-C-N 114.826 -1.079 . . . . 45.41 108.167 -176.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -58.24 155.46 34.84 Favored 'Trans proline' 0 C--N 1.328 -0.507 0 C-N-CA 120.469 0.78 . . . . 49.99 112.058 -178.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -81.34 168.13 18.74 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.973 -1.012 . . . . 38.4 109.573 172.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 7.2 tt -123.86 141.19 44.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.33 -0.85 . . . . 40.34 109.666 -176.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 65.6 t0 -72.18 -72.18 0.25 Allowed 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.677 -0.692 . . . . 36.28 109.441 177.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -82.4 110.8 17.86 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 121.341 -0.849 . . . . 37.92 109.724 177.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 12.2 ptt180 -91.47 5.88 47.7 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 113.826 1.047 . . . . 35.71 113.826 171.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 44.7 mtmt -117.23 122.97 45.47 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.155 0.889 . . . . 37.24 109.927 -177.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 70.6 m-85 -120.34 137.99 53.97 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.871 0.367 . . . . 45.6 111.38 -175.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 7.1 mt -99.25 87.48 3.66 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 107.818 -1.178 . . . . 54.54 107.818 168.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 90.1 t -83.15 128.94 62.98 Favored Pre-proline 0 C--O 1.24 0.563 0 N-CA-C 109.187 -0.671 . . . . 45.52 109.187 -172.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_exo -55.0 149.0 44.94 Favored 'Trans proline' 0 C--N 1.33 -0.4 0 CA-C-N 118.859 0.628 . . . . 52.97 110.611 168.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -70.54 -31.34 68.36 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.379 -0.828 . . . . 66.03 112.248 -168.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -94.57 12.91 25.84 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 113.693 0.998 . . . . 71.33 113.693 179.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 21.6 tp -77.34 130.87 37.71 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 118.67 0.668 . . . . 45.54 110.882 179.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.1 p -78.14 165.84 23.48 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 119.066 -1.053 . . . . 53.04 110.84 -178.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 29.3 t -61.13 -45.83 97.82 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 CA-C-N 114.785 -1.098 . . . . 52.13 110.355 172.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -52.16 -45.64 57.16 Favored Glycine 0 C--N 1.332 0.35 0 C-N-CA 120.07 -1.062 . . . . 48.37 111.77 174.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -67.5 -40.32 85.2 Favored 'General case' 0 C--O 1.239 0.517 0 C-N-CA 118.501 -1.279 . . . . 51.44 111.332 -178.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -60.12 -42.35 94.58 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 119.175 -1.01 . . . . 43.75 111.49 177.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 43.5 t -58.65 -43.36 87.33 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 O-C-N 121.64 -0.663 . . . . 46.68 110.708 178.008 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -58.51 -40.35 82.62 Favored 'General case' 0 C--O 1.237 0.406 0 O-C-N 121.595 -0.691 . . . . 66.25 111.555 178.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 13.9 t -63.93 -45.61 96.42 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 C-N-CA 120.292 -0.563 . . . . 43.46 110.851 179.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 44.1 mm -61.55 -46.06 97.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 C-N-CA 119.232 -0.987 . . . . 44.01 110.215 179.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 49.7 ttm-85 -49.79 -47.11 51.41 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.261 0.553 . . . . 58.5 110.534 174.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 23.1 tttt -60.71 -39.7 89.55 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-N 116.286 -0.415 . . . . 66.39 110.781 -179.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 84.6 mmt-85 -73.62 -42.71 61.11 Favored 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 120.745 -0.382 . . . . 59.43 111.414 -171.043 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 26.1 pt -80.73 4.73 1.7 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.265 0 O-C-N 122.183 -0.323 . . . . 57.32 111.464 174.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 89.4 mtp 50.27 41.02 23.72 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-O 122.253 1.025 . . . . 93.3 111.623 -179.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 19.5 tp -66.16 130.1 94.28 Favored Pre-proline 0 C--N 1.316 -0.881 0 C-N-CA 119.917 -0.713 . . . . 55.35 109.575 177.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -58.12 139.77 91.68 Favored 'Trans proline' 0 C--O 1.24 0.618 0 N-CA-C 110.041 -0.792 . . . . 64.56 110.041 177.173 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -53.73 -29.61 52.65 Favored 'Trans proline' 0 C--O 1.241 0.628 0 N-CA-C 113.637 0.591 . . . . 71.96 113.637 -177.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' GLU . . . . . 0.457 ' N ' ' OE1' ' A' ' 91' ' ' GLU . 19.3 pm0 -76.09 -10.14 59.18 Favored 'General case' 0 C--N 1.345 0.399 0 N-CA-C 113.661 0.986 . . . . 77.54 113.661 -177.244 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -101.26 147.59 26.1 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 119.109 0.868 . . . . 79.89 111.473 178.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -87.23 158.39 19.12 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.829 0.823 . . . . 59.88 112.794 -170.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.8 tt -153.78 131.39 2.39 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-N 115.496 -0.774 . . . . 49.67 110.661 174.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -124.9 148.71 48.17 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 108.937 -0.764 . . . . 62.32 108.937 179.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 18.8 pt -118.29 139.17 46.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 108.853 -0.795 . . . . 59.54 108.853 171.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -114.17 142.34 46.37 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.645 -0.707 . . . . 58.84 110.051 179.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 95.6 t -126.36 123.51 63.6 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 N-CA-C 106.669 -1.604 . . . . 60.53 106.669 169.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 56.5 t30 55.09 40.32 31.84 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.791 0.805 . . . . 92.82 109.555 -175.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 59.23 32.12 21.75 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.733 -0.667 . . . . 86.31 112.02 -178.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 82.0 m -135.14 145.85 48.22 Favored 'General case' 0 C--O 1.235 0.307 0 O-C-N 121.584 -0.698 . . . . 72.26 110.77 -179.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 61.9 mt -76.82 109.36 8.63 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 115.21 -0.904 . . . . 59.03 109.765 171.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -67.55 152.46 78.33 Favored 'Trans proline' 0 CA--C 1.51 -0.693 0 N-CA-C 110.202 -0.73 . . . . 62.27 110.202 176.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_endo -66.5 131.89 27.57 Favored 'Trans proline' 0 C--O 1.233 0.243 0 N-CA-C 110.02 -0.8 . . . . 62.14 110.02 175.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 7.4 p -65.77 -19.79 66.02 Favored 'General case' 0 C--O 1.238 0.478 0 N-CA-C 112.722 0.638 . . . . 69.79 112.722 -166.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -88.88 -0.71 57.61 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.705 0.631 . . . . 55.32 112.705 177.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -74.73 138.69 42.91 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 118.426 0.557 . . . . 55.08 110.924 -177.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 32.5 mt -67.37 136.81 55.36 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 121.28 0.562 . . . . 54.68 110.407 174.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 96.7 mmm -58.86 -28.28 65.96 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 119.891 -0.724 . . . . 51.37 111.254 173.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 91.3 p -64.66 -40.07 94.79 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 119.002 -1.079 . . . . 56.31 110.858 177.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -64.82 -45.52 85.86 Favored 'General case' 0 C--O 1.236 0.348 0 O-C-N 122.012 -0.43 . . . . 51.75 111.418 177.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 11.0 mt -60.59 -36.5 70.67 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 C-N-CA 120.391 -0.524 . . . . 59.04 110.86 177.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -62.51 -45.62 92.19 Favored 'General case' 0 C--O 1.239 0.51 0 O-C-N 121.71 -0.619 . . . . 60.24 111.472 175.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -65.66 -30.98 71.75 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.042 -0.663 . . . . 86.89 111.533 -176.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -84.86 -31.3 23.84 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 114.003 1.112 . . . . 90.35 114.003 178.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -127.04 14.0 7.31 Favored 'General case' 0 C--N 1.342 0.278 0 N-CA-C 115.309 1.596 . . . . 54.71 115.309 -167.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 17.7 pttt -69.42 150.07 47.66 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 117.997 -1.481 . . . . 70.12 110.02 -173.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -76.74 161.27 28.62 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.397 -0.819 . . . . 48.87 110.321 -175.45 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . . . -53.44 -26.72 21.2 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 119.467 -0.893 . . . . 44.98 110.908 170.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 31.9 p30 -86.57 3.4 44.46 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 113.927 1.084 . . . . 37.24 113.927 -179.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 91.74 -11.56 71.79 Favored Glycine 0 C--O 1.244 0.721 0 N-CA-C 115.607 1.003 . . . . 36.23 115.607 177.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -88.27 158.61 18.42 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 118.443 1.122 . . . . 34.78 110.642 178.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 50.2 tp -102.89 122.95 45.6 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 107.162 -1.422 . . . . 39.15 107.162 166.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 48.8 m-85 -97.3 125.65 42.02 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 109.596 -0.52 . . . . 44.71 109.596 -179.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 24.4 t -123.25 150.82 27.41 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 N-CA-C 108.472 -0.936 . . . . 47.79 108.472 176.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 98.4 m -126.72 130.08 49.66 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 124.662 1.185 . . . . 51.85 108.069 178.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' TYR . . . . . . . . . . . . . 31.9 p90 -112.18 154.89 24.85 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.161 0.505 . . . . 48.41 109.688 175.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 5.8 p -156.81 167.31 30.84 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.676 0.751 . . . . 72.44 109.454 178.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . -97.15 -162.71 31.96 Favored Glycine 0 N--CA 1.442 -0.926 0 CA-C-N 114.763 -1.108 . . . . 64.99 111.338 173.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -80.43 -34.18 36.29 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.227 -0.487 . . . . 96.67 111.866 -178.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 67.0 m-20 -112.03 172.3 6.99 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 124.381 1.072 . . . . 100.18 110.357 -177.317 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 51.8 p -156.72 153.63 28.75 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.169 -0.923 . . . . 97.67 109.068 178.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.392 0 CA-C-N 115.738 -0.665 . . . . 86.43 112.633 -174.141 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' ALE . . . . . 0.623 ' O3 ' H92C ' A' ' 201' ' ' ALE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' EDO . . . . . 0.518 ' H11' ' OE1' ' A' ' 35' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' GLY . . . . . 0.416 ' HA3' ' O ' ' A' ' 308' ' ' HOH . . . . . . . . 0 N--CA 1.449 -0.464 0 N-CA-C 114.109 0.403 . . . . 57.21 114.109 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_exo -60.02 145.6 98.01 Favored 'Trans proline' 0 C--N 1.329 -0.498 0 O-C-N 122.654 0.818 . . . . 53.41 111.728 -179.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 36.8 mm-40 -93.09 157.27 16.38 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 114.955 -1.02 . . . . 65.37 110.409 167.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -50.12 136.62 21.56 Favored Pre-proline 0 C--O 1.241 0.613 0 CA-C-N 115.11 -0.95 . . . . 37.73 110.166 175.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -91.84 11.9 55.52 Favored 'Cis proline' 0 CA--C 1.541 0.859 0 C-N-CA 129.986 1.244 . . . . 37.03 114.712 1.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 72.5 m-80 -84.62 1.21 47.17 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 117.371 -1.732 . . . . 34.39 113.52 -169.456 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ASP . . . . . 0.423 ' OD1' ' N ' ' A' ' 7' ' ' ASP . 15.1 p-10 -75.18 -7.45 53.86 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 123.781 0.675 . . . . 34.12 112.205 162.364 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 -92.75 145.51 24.36 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 118.747 0.703 . . . . 35.47 111.692 173.378 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -87.67 117.29 26.39 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.182 -0.917 . . . . 36.59 109.584 168.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -86.95 -4.23 59.16 Favored 'General case' 0 C--O 1.238 0.499 0 N-CA-C 112.385 0.513 . . . . 41.59 112.385 179.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 7.4 mtt 57.02 42.71 25.64 Favored 'General case' 0 CA--C 1.522 -0.118 0 CA-C-O 121.028 0.442 . . . . 50.12 111.113 175.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 20.3 mp0 -54.62 -25.34 25.93 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 120.073 -0.651 . . . . 68.93 112.659 -178.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 21.2 p-10 -67.31 -5.09 12.71 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 113.393 0.886 . . . . 58.43 113.393 179.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 8.6 pt -138.37 10.46 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 120.033 1.288 . . . . 68.88 110.434 172.41 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . . . -61.72 130.54 46.28 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 109.172 -0.677 . . . . 70.64 109.172 176.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -115.55 169.74 8.95 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.714 0.768 . . . . 85.72 110.457 -173.016 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -65.8 -23.57 66.73 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.307 -0.86 . . . . 93.3 111.543 169.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 61.8 p -72.37 -7.51 50.03 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 112.898 0.703 . . . . 79.62 112.898 175.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 18.1 mtt -119.39 1.99 11.26 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 113.044 0.757 . . . . 93.16 113.044 -176.044 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LYS . . . . . 0.454 ' HG3' ' N ' ' A' ' 21' ' ' SER . 12.4 tttt -72.47 141.64 48.58 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 118.913 0.779 . . . . 68.14 110.931 -177.163 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' SER . . . . . 0.454 ' N ' ' HG3' ' A' ' 20' ' ' LYS . 2.9 t -158.3 126.25 5.24 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.304 -0.999 . . . . 50.15 108.304 -164.436 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 33.7 p -136.64 178.31 7.17 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 121.808 0.813 . . . . 45.49 109.034 -179.037 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -60.55 -49.71 76.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.961 -1.018 . . . . 39.83 110.176 -173.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 48.9 mttt -59.11 -37.7 77.8 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 120.589 -0.444 . . . . 54.08 112.137 -178.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 77.0 p -88.38 -3.71 58.79 Favored 'General case' 0 C--N 1.347 0.491 0 N-CA-C 112.609 0.596 . . . . 36.73 112.609 -176.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -102.16 -19.8 14.96 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 113.676 0.991 . . . . 39.13 113.676 179.101 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -132.43 134.2 24.57 Favored Pre-proline 0 C--O 1.249 1.073 0 CA-C-N 118.697 0.68 . . . . 36.45 111.026 -175.372 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -58.72 143.91 98.45 Favored 'Trans proline' 0 N--CA 1.475 0.435 0 CA-C-N 119.11 0.718 . . . . 38.66 111.051 -172.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -45.28 -47.84 12.97 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.016 -0.538 . . . . 44.55 111.543 172.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 -63.23 -37.64 88.05 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 118.002 -1.479 . . . . 66.95 110.535 -173.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -67.27 -36.16 80.99 Favored 'General case' 0 CA--C 1.513 -0.478 0 C-N-CA 118.642 -1.223 . . . . 65.02 110.322 177.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 30.0 mtm105 -68.26 -45.77 72.25 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 120.625 0.25 . . . . 39.94 111.205 -179.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.2 tptp -60.94 -44.32 97.43 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 120.189 -0.604 . . . . 55.39 111.336 178.605 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.52 -35.36 75.79 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.481 -0.488 . . . . 35.22 111.537 179.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLU . . . . . 0.508 ' OE1' ' H12' ' A' ' 203' ' ' EDO . 23.2 tt0 -69.84 -45.73 67.16 Favored 'General case' 0 C--O 1.236 0.389 0 O-C-N 122.099 -0.376 . . . . 29.93 111.117 -179.196 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 52.7 p -66.22 -34.12 77.29 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 118.791 -1.164 . . . . 32.76 111.364 176.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -63.89 -40.16 95.86 Favored 'General case' 0 C--O 1.239 0.535 0 C-N-CA 119.0 -1.08 . . . . 50.15 110.548 174.543 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 30.3 tpt180 -61.65 -38.77 88.93 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.286 -0.566 . . . . 38.04 110.641 177.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 75.7 mt -67.33 -42.09 87.17 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 O-C-N 122.003 -0.436 . . . . 32.95 111.825 178.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -55.95 -32.29 63.71 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 120.067 -0.653 . . . . 38.19 111.059 174.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -81.63 -40.2 23.29 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 119.824 -0.751 . . . . 38.26 111.838 -179.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 42.0 tpt85 -100.38 -25.76 14.11 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.078 0.551 . . . . 36.5 112.277 -164.329 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -128.79 62.46 61.35 Favored Pre-proline 0 C--N 1.328 -0.362 0 C-N-CA 123.241 0.617 . . . . 32.82 109.522 171.297 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -54.65 -32.4 75.15 Favored 'Trans proline' 0 CA--C 1.505 -0.956 0 N-CA-C 115.774 1.413 . . . . 42.98 115.774 -168.161 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -96.76 17.26 16.99 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 113.047 0.758 . . . . 64.41 113.047 -175.314 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.7 mmt180 -108.67 145.45 34.99 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 118.387 0.54 . . . . 66.78 111.119 175.955 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ILE . . . . . 0.543 HD13 ' HA ' ' A' ' 110' ' ' SER . 36.9 mt -97.63 121.75 57.21 Favored Pre-proline 0 C--N 1.328 -0.349 0 N-CA-C 107.7 -1.222 . . . . 59.97 107.7 174.792 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -85.32 121.65 2.33 Favored 'Trans proline' 0 C--O 1.235 0.335 0 CA-C-N 119.263 0.773 . . . . 36.85 110.733 -178.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 79.2 t -123.63 124.14 68.79 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 N-CA-C 107.484 -1.302 . . . . 32.9 107.484 -170.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 23.3 mm -93.17 116.13 33.59 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 N-CA-C 107.009 -1.478 . . . . 37.8 107.009 167.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 46.9 t -117.74 116.59 27.32 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 108.391 -0.966 . . . . 37.59 108.391 -179.226 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -129.66 162.56 28.04 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 121.661 0.743 . . . . 38.46 110.845 -178.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -82.41 129.46 34.89 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.319 -0.855 . . . . 63.88 111.395 -175.75 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -51.74 149.55 4.61 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.43 0.633 . . . . 45.03 110.862 177.013 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 69.4 tt0 -66.07 124.7 23.3 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.858 -0.61 . . . . 91.87 110.329 -174.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . . . 66.34 17.03 10.62 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 113.364 0.875 . . . . 74.05 113.364 175.18 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' SER . . . . . 1.022 ' HA ' HG22 ' A' ' 132' ' ' THR . 12.9 t -74.36 148.06 41.6 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.638 0.732 . . . . 57.64 110.41 176.63 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -91.33 79.19 5.66 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 108.089 -1.078 . . . . 73.8 108.089 -177.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ILE . . . . . 0.664 HG13 ' HD2' ' A' ' 60' ' ' PRO . 10.0 tt -159.37 148.15 14.07 Favored Pre-proline 0 C--O 1.24 0.56 0 CA-C-N 114.826 -1.079 . . . . 45.41 108.167 -176.589 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' PRO . . . . . 0.664 ' HD2' HG13 ' A' ' 59' ' ' ILE . 53.2 Cg_exo -58.24 155.46 34.84 Favored 'Trans proline' 0 C--N 1.328 -0.507 0 C-N-CA 120.469 0.78 . . . . 49.99 112.058 -178.293 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -81.34 168.13 18.74 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.973 -1.012 . . . . 38.4 109.573 172.344 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 7.2 tt -123.86 141.19 44.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.33 -0.85 . . . . 40.34 109.666 -176.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 65.6 t0 -72.18 -72.18 0.25 Allowed 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.677 -0.692 . . . . 36.28 109.441 177.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -82.4 110.8 17.86 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 121.341 -0.849 . . . . 37.92 109.724 177.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 12.2 ptt180 -91.47 5.88 47.7 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 113.826 1.047 . . . . 35.71 113.826 171.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 44.7 mtmt -117.23 122.97 45.47 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.155 0.889 . . . . 37.24 109.927 -177.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 70.6 m-85 -120.34 137.99 53.97 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.871 0.367 . . . . 45.6 111.38 -175.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 7.1 mt -99.25 87.48 3.66 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 107.818 -1.178 . . . . 54.54 107.818 168.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' VAL . . . . . 0.407 HG12 ' O ' ' A' ' 70' ' ' PRO . 90.1 t -83.15 128.94 62.98 Favored Pre-proline 0 C--O 1.24 0.563 0 N-CA-C 109.187 -0.671 . . . . 45.52 109.187 -172.005 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' PRO . . . . . 0.407 ' O ' HG12 ' A' ' 69' ' ' VAL . 55.4 Cg_exo -55.0 149.0 44.94 Favored 'Trans proline' 0 C--N 1.33 -0.4 0 CA-C-N 118.859 0.628 . . . . 52.97 110.611 168.399 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -70.54 -31.34 68.36 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.379 -0.828 . . . . 66.03 112.248 -168.654 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -94.57 12.91 25.84 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 113.693 0.998 . . . . 71.33 113.693 179.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' LEU . . . . . 0.45 HD11 ' HB3' ' A' ' 77' ' ' GLN . 21.6 tp -77.34 130.87 37.71 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 118.67 0.668 . . . . 45.54 110.882 179.712 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.1 p -78.14 165.84 23.48 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 119.066 -1.053 . . . . 53.04 110.84 -178.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' VAL . . . . . 0.531 ' O ' HG23 ' A' ' 79' ' ' VAL . 29.3 t -61.13 -45.83 97.82 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 CA-C-N 114.785 -1.098 . . . . 52.13 110.355 172.959 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -52.16 -45.64 57.16 Favored Glycine 0 C--N 1.332 0.35 0 C-N-CA 120.07 -1.062 . . . . 48.37 111.77 174.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' GLN . . . . . 0.45 ' HB3' HD11 ' A' ' 73' ' ' LEU . 85.9 mt-30 -67.5 -40.32 85.2 Favored 'General case' 0 C--O 1.239 0.517 0 C-N-CA 118.501 -1.279 . . . . 51.44 111.332 -178.622 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -60.12 -42.35 94.58 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 119.175 -1.01 . . . . 43.75 111.49 177.763 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' VAL . . . . . 0.531 HG23 ' O ' ' A' ' 75' ' ' VAL . 43.5 t -58.65 -43.36 87.33 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 O-C-N 121.64 -0.663 . . . . 46.68 110.708 178.008 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -58.51 -40.35 82.62 Favored 'General case' 0 C--O 1.237 0.406 0 O-C-N 121.595 -0.691 . . . . 66.25 111.555 178.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 13.9 t -63.93 -45.61 96.42 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 C-N-CA 120.292 -0.563 . . . . 43.46 110.851 179.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 44.1 mm -61.55 -46.06 97.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 C-N-CA 119.232 -0.987 . . . . 44.01 110.215 179.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 49.7 ttm-85 -49.79 -47.11 51.41 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.261 0.553 . . . . 58.5 110.534 174.598 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 23.1 tttt -60.71 -39.7 89.55 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-N 116.286 -0.415 . . . . 66.39 110.781 -179.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 84.6 mmt-85 -73.62 -42.71 61.11 Favored 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 120.745 -0.382 . . . . 59.43 111.414 -171.043 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 26.1 pt -80.73 4.73 1.7 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.265 0 O-C-N 122.183 -0.323 . . . . 57.32 111.464 174.764 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 89.4 mtp 50.27 41.02 23.72 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-O 122.253 1.025 . . . . 93.3 111.623 -179.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 19.5 tp -66.16 130.1 94.28 Favored Pre-proline 0 C--N 1.316 -0.881 0 C-N-CA 119.917 -0.713 . . . . 55.35 109.575 177.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -58.12 139.77 91.68 Favored 'Trans proline' 0 C--O 1.24 0.618 0 N-CA-C 110.041 -0.792 . . . . 64.56 110.041 177.173 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -53.73 -29.61 52.65 Favored 'Trans proline' 0 C--O 1.241 0.628 0 N-CA-C 113.637 0.591 . . . . 71.96 113.637 -177.955 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 19.3 pm0 -76.09 -10.14 59.18 Favored 'General case' 0 C--N 1.345 0.399 0 N-CA-C 113.661 0.986 . . . . 77.54 113.661 -177.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -101.26 147.59 26.1 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 119.109 0.868 . . . . 79.89 111.473 178.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ALA . . . . . 0.424 ' HA ' ' O1 ' ' A' ' 202' ' ' EDO . . . -87.23 158.39 19.12 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.829 0.823 . . . . 59.88 112.794 -170.823 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ILE . . . . . 0.479 HG22 ' H21' ' A' ' 202' ' ' EDO . 8.8 tt -153.78 131.39 2.39 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-N 115.496 -0.774 . . . . 49.67 110.661 174.528 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -124.9 148.71 48.17 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 108.937 -0.764 . . . . 62.32 108.937 179.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ILE . . . . . 0.502 HD11 HG13 ' A' ' 75' ' ' VAL . 18.8 pt -118.29 139.17 46.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 108.853 -0.795 . . . . 59.54 108.853 171.909 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -114.17 142.34 46.37 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.645 -0.707 . . . . 58.84 110.051 179.53 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 95.6 t -126.36 123.51 63.6 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 N-CA-C 106.669 -1.604 . . . . 60.53 106.669 169.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 56.5 t30 55.09 40.32 31.84 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.791 0.805 . . . . 92.82 109.555 -175.794 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 59.23 32.12 21.75 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.733 -0.667 . . . . 86.31 112.02 -178.067 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 82.0 m -135.14 145.85 48.22 Favored 'General case' 0 C--O 1.235 0.307 0 O-C-N 121.584 -0.698 . . . . 72.26 110.77 -179.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 61.9 mt -76.82 109.36 8.63 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 115.21 -0.904 . . . . 59.03 109.765 171.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -67.55 152.46 78.33 Favored 'Trans proline' 0 CA--C 1.51 -0.693 0 N-CA-C 110.202 -0.73 . . . . 62.27 110.202 176.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' PRO . . . . . 0.449 ' HG2' ' HB2' ' A' ' 107' ' ' ALA . 24.1 Cg_endo -66.5 131.89 27.57 Favored 'Trans proline' 0 C--O 1.233 0.243 0 N-CA-C 110.02 -0.8 . . . . 62.14 110.02 175.537 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 7.4 p -65.77 -19.79 66.02 Favored 'General case' 0 C--O 1.238 0.478 0 N-CA-C 112.722 0.638 . . . . 69.79 112.722 -166.147 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -88.88 -0.71 57.61 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.705 0.631 . . . . 55.32 112.705 177.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ALA . . . . . 0.449 ' HB2' ' HG2' ' A' ' 104' ' ' PRO . . . -74.73 138.69 42.91 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 118.426 0.557 . . . . 55.08 110.924 -177.764 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 32.5 mt -67.37 136.81 55.36 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 121.28 0.562 . . . . 54.68 110.407 174.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 96.7 mmm -58.86 -28.28 65.96 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 119.891 -0.724 . . . . 51.37 111.254 173.251 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' SER . . . . . 0.543 ' HA ' HD13 ' A' ' 47' ' ' ILE . 91.3 p -64.66 -40.07 94.79 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 119.002 -1.079 . . . . 56.31 110.858 177.8 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -64.82 -45.52 85.86 Favored 'General case' 0 C--O 1.236 0.348 0 O-C-N 122.012 -0.43 . . . . 51.75 111.418 177.472 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 11.0 mt -60.59 -36.5 70.67 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 C-N-CA 120.391 -0.524 . . . . 59.04 110.86 177.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' TYR . . . . . 0.42 ' CZ ' ' HD3' ' A' ' 117' ' ' LYS . 81.9 t80 -62.51 -45.62 92.19 Favored 'General case' 0 C--O 1.239 0.51 0 O-C-N 121.71 -0.619 . . . . 60.24 111.472 175.484 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -65.66 -30.98 71.75 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.042 -0.663 . . . . 86.89 111.533 -176.179 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -84.86 -31.3 23.84 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 114.003 1.112 . . . . 90.35 114.003 178.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -127.04 14.0 7.31 Favored 'General case' 0 C--N 1.342 0.278 0 N-CA-C 115.309 1.596 . . . . 54.71 115.309 -167.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' LYS . . . . . 0.42 ' HD3' ' CZ ' ' A' ' 113' ' ' TYR . 17.7 pttt -69.42 150.07 47.66 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 117.997 -1.481 . . . . 70.12 110.02 -173.842 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 118' ' ' ASP . . . . . 0.449 ' HB3' ' OD1' ' A' ' 120' ' ' ASP . 10.7 t70 -76.74 161.27 28.62 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.397 -0.819 . . . . 48.87 110.321 -175.45 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . . . -53.44 -26.72 21.2 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 119.467 -0.893 . . . . 44.98 110.908 170.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' ASP . . . . . 0.449 ' OD1' ' HB3' ' A' ' 118' ' ' ASP . 31.9 p30 -86.57 3.4 44.46 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 113.927 1.084 . . . . 37.24 113.927 -179.143 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 91.74 -11.56 71.79 Favored Glycine 0 C--O 1.244 0.721 0 N-CA-C 115.607 1.003 . . . . 36.23 115.607 177.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -88.27 158.61 18.42 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 118.443 1.122 . . . . 34.78 110.642 178.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 50.2 tp -102.89 122.95 45.6 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 107.162 -1.422 . . . . 39.15 107.162 166.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 48.8 m-85 -97.3 125.65 42.02 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 109.596 -0.52 . . . . 44.71 109.596 -179.059 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 24.4 t -123.25 150.82 27.41 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 N-CA-C 108.472 -0.936 . . . . 47.79 108.472 176.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' THR . . . . . 0.421 ' O ' ' HA ' ' A' ' 96' ' ' ILE . 98.4 m -126.72 130.08 49.66 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 124.662 1.185 . . . . 51.85 108.069 178.896 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 127' ' ' TYR . . . . . . . . . . . . . 31.9 p90 -112.18 154.89 24.85 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.161 0.505 . . . . 48.41 109.688 175.077 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 5.8 p -156.81 167.31 30.84 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.676 0.751 . . . . 72.44 109.454 178.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . -97.15 -162.71 31.96 Favored Glycine 0 N--CA 1.442 -0.926 0 CA-C-N 114.763 -1.108 . . . . 64.99 111.338 173.194 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -80.43 -34.18 36.29 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.227 -0.487 . . . . 96.67 111.866 -178.15 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 67.0 m-20 -112.03 172.3 6.99 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 124.381 1.072 . . . . 100.18 110.357 -177.317 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' THR . . . . . 1.022 HG22 ' HA ' ' A' ' 57' ' ' SER . 51.8 p -156.72 153.63 28.75 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.169 -0.923 . . . . 97.67 109.068 178.787 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.392 0 CA-C-N 115.738 -0.665 . . . . 86.43 112.633 -174.141 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' ALE . . . . . 0.839 ' O3 ' H92C ' A' ' 201' ' ' ALE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 202' ' ' EDO . . . . . 0.479 ' H21' HG22 ' A' ' 94' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 203' ' ' EDO . . . . . 0.508 ' H12' ' OE1' ' A' ' 35' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 308' ' ' HOH . . . . . 0.416 ' O ' ' HA3' ' A' ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.416 ' HA3' ' O ' ' A' ' 308' ' ' HOH . . . . . . . . 0 N--CA 1.449 -0.464 0 N-CA-C 114.109 0.403 . . . . 57.21 114.109 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_exo -60.02 145.6 98.01 Favored 'Trans proline' 0 C--N 1.329 -0.498 0 O-C-N 122.654 0.818 . . . . 53.41 111.728 -179.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 36.8 mm-40 -93.09 157.27 16.38 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 114.955 -1.02 . . . . 65.37 110.409 167.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -50.12 136.62 21.56 Favored Pre-proline 0 C--O 1.241 0.613 0 CA-C-N 115.11 -0.95 . . . . 37.73 110.166 175.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -91.84 11.9 55.52 Favored 'Cis proline' 0 CA--C 1.541 0.859 0 C-N-CA 129.986 1.244 . . . . 37.03 114.712 1.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 72.5 m-80 -84.62 1.21 47.17 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 117.371 -1.732 . . . . 34.39 113.52 -169.456 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ASP . . . . . 0.423 ' OD1' ' N ' ' A' ' 7' ' ' ASP . 15.1 p-10 -75.18 -7.45 53.86 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 123.781 0.675 . . . . 34.12 112.205 162.364 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 -92.75 145.51 24.36 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 118.747 0.703 . . . . 35.47 111.692 173.378 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -87.67 117.29 26.39 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.182 -0.917 . . . . 36.59 109.584 168.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -86.95 -4.23 59.16 Favored 'General case' 0 C--O 1.238 0.499 0 N-CA-C 112.385 0.513 . . . . 41.59 112.385 179.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 7.4 mtt 57.02 42.71 25.64 Favored 'General case' 0 CA--C 1.522 -0.118 0 CA-C-O 121.028 0.442 . . . . 50.12 111.113 175.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 20.3 mp0 -54.62 -25.34 25.93 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 120.073 -0.651 . . . . 68.93 112.659 -178.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 21.2 p-10 -67.31 -5.09 12.71 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 113.393 0.886 . . . . 58.43 113.393 179.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 8.6 pt -138.37 10.46 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 120.033 1.288 . . . . 68.88 110.434 172.41 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . . . -61.72 130.54 46.28 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 109.172 -0.677 . . . . 70.64 109.172 176.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -115.55 169.74 8.95 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.714 0.768 . . . . 85.72 110.457 -173.016 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -65.8 -23.57 66.73 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.307 -0.86 . . . . 93.3 111.543 169.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 61.8 p -72.37 -7.51 50.03 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 112.898 0.703 . . . . 79.62 112.898 175.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 18.1 mtt -119.39 1.99 11.26 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 113.044 0.757 . . . . 93.16 113.044 -176.044 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.454 ' HG3' ' N ' ' A' ' 21' ' ' SER . 12.4 tttt -72.47 141.64 48.58 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 118.913 0.779 . . . . 68.14 110.931 -177.163 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' SER . . . . . 0.454 ' N ' ' HG3' ' A' ' 20' ' ' LYS . 2.9 t -158.3 126.25 5.24 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.304 -0.999 . . . . 50.15 108.304 -164.436 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 33.7 p -136.64 178.31 7.17 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 121.808 0.813 . . . . 45.49 109.034 -179.037 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -60.55 -49.71 76.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.961 -1.018 . . . . 39.83 110.176 -173.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 48.9 mttt -59.11 -37.7 77.8 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 120.589 -0.444 . . . . 54.08 112.137 -178.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 77.0 p -88.38 -3.71 58.79 Favored 'General case' 0 C--N 1.347 0.491 0 N-CA-C 112.609 0.596 . . . . 36.73 112.609 -176.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -102.16 -19.8 14.96 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 113.676 0.991 . . . . 39.13 113.676 179.101 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -132.43 134.2 24.57 Favored Pre-proline 0 C--O 1.249 1.073 0 CA-C-N 118.697 0.68 . . . . 36.45 111.026 -175.372 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -58.72 143.91 98.45 Favored 'Trans proline' 0 N--CA 1.475 0.435 0 CA-C-N 119.11 0.718 . . . . 38.66 111.051 -172.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -45.28 -47.84 12.97 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.016 -0.538 . . . . 44.55 111.543 172.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 -63.23 -37.64 88.05 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 118.002 -1.479 . . . . 66.95 110.535 -173.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -67.27 -36.16 80.99 Favored 'General case' 0 CA--C 1.513 -0.478 0 C-N-CA 118.642 -1.223 . . . . 65.02 110.322 177.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 30.0 mtm105 -68.26 -45.77 72.25 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 120.625 0.25 . . . . 39.94 111.205 -179.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.2 tptp -60.94 -44.32 97.43 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 120.189 -0.604 . . . . 55.39 111.336 178.605 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.52 -35.36 75.79 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.481 -0.488 . . . . 35.22 111.537 179.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.508 ' OE1' ' H12' ' A' ' 203' ' ' EDO . 23.2 tt0 -69.84 -45.73 67.16 Favored 'General case' 0 C--O 1.236 0.389 0 O-C-N 122.099 -0.376 . . . . 29.93 111.117 -179.196 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 52.7 p -66.22 -34.12 77.29 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 118.791 -1.164 . . . . 32.76 111.364 176.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -63.89 -40.16 95.86 Favored 'General case' 0 C--O 1.239 0.535 0 C-N-CA 119.0 -1.08 . . . . 50.15 110.548 174.543 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 30.3 tpt180 -61.65 -38.77 88.93 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.286 -0.566 . . . . 38.04 110.641 177.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 75.7 mt -67.33 -42.09 87.17 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 O-C-N 122.003 -0.436 . . . . 32.95 111.825 178.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -55.95 -32.29 63.71 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 120.067 -0.653 . . . . 38.19 111.059 174.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -81.63 -40.2 23.29 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 119.824 -0.751 . . . . 38.26 111.838 -179.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 42.0 tpt85 -100.38 -25.76 14.11 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.078 0.551 . . . . 36.5 112.277 -164.329 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -128.79 62.46 61.35 Favored Pre-proline 0 C--N 1.328 -0.362 0 C-N-CA 123.241 0.617 . . . . 32.82 109.522 171.297 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -54.65 -32.4 75.15 Favored 'Trans proline' 0 CA--C 1.505 -0.956 0 N-CA-C 115.774 1.413 . . . . 42.98 115.774 -168.161 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -96.76 17.26 16.99 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 113.047 0.758 . . . . 64.41 113.047 -175.314 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.7 mmt180 -108.67 145.45 34.99 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 118.387 0.54 . . . . 66.78 111.119 175.955 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.543 HD13 ' HA ' ' A' ' 110' ' ' SER . 36.9 mt -97.63 121.75 57.21 Favored Pre-proline 0 C--N 1.328 -0.349 0 N-CA-C 107.7 -1.222 . . . . 59.97 107.7 174.792 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -85.32 121.65 2.33 Favored 'Trans proline' 0 C--O 1.235 0.335 0 CA-C-N 119.263 0.773 . . . . 36.85 110.733 -178.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 79.2 t -123.63 124.14 68.79 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 N-CA-C 107.484 -1.302 . . . . 32.9 107.484 -170.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 23.3 mm -93.17 116.13 33.59 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 N-CA-C 107.009 -1.478 . . . . 37.8 107.009 167.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 46.9 t -117.74 116.59 27.32 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 108.391 -0.966 . . . . 37.59 108.391 -179.226 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -129.66 162.56 28.04 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 121.661 0.743 . . . . 38.46 110.845 -178.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -82.41 129.46 34.89 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.319 -0.855 . . . . 63.88 111.395 -175.75 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -51.74 149.55 4.61 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.43 0.633 . . . . 45.03 110.862 177.013 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 69.4 tt0 -66.07 124.7 23.3 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.858 -0.61 . . . . 91.87 110.329 -174.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . . . 66.34 17.03 10.62 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 113.364 0.875 . . . . 74.05 113.364 175.18 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' SER . . . . . 1.022 ' HA ' HG22 ' A' ' 132' ' ' THR . 12.9 t -74.36 148.06 41.6 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.638 0.732 . . . . 57.64 110.41 176.63 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -91.33 79.19 5.66 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 108.089 -1.078 . . . . 73.8 108.089 -177.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.664 HG13 ' HD2' ' A' ' 60' ' ' PRO . 10.0 tt -159.37 148.15 14.07 Favored Pre-proline 0 C--O 1.24 0.56 0 CA-C-N 114.826 -1.079 . . . . 45.41 108.167 -176.589 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.664 ' HD2' HG13 ' A' ' 59' ' ' ILE . 53.2 Cg_exo -58.24 155.46 34.84 Favored 'Trans proline' 0 C--N 1.328 -0.507 0 C-N-CA 120.469 0.78 . . . . 49.99 112.058 -178.293 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -81.34 168.13 18.74 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.973 -1.012 . . . . 38.4 109.573 172.344 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 7.2 tt -123.86 141.19 44.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.33 -0.85 . . . . 40.34 109.666 -176.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 65.6 t0 -72.18 -72.18 0.25 Allowed 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.677 -0.692 . . . . 36.28 109.441 177.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -82.4 110.8 17.86 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 121.341 -0.849 . . . . 37.92 109.724 177.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 12.2 ptt180 -91.47 5.88 47.7 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 113.826 1.047 . . . . 35.71 113.826 171.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 44.7 mtmt -117.23 122.97 45.47 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.155 0.889 . . . . 37.24 109.927 -177.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 70.6 m-85 -120.34 137.99 53.97 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.871 0.367 . . . . 45.6 111.38 -175.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 7.1 mt -99.25 87.48 3.66 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 107.818 -1.178 . . . . 54.54 107.818 168.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.407 HG12 ' O ' ' A' ' 70' ' ' PRO . 90.1 t -83.15 128.94 62.98 Favored Pre-proline 0 C--O 1.24 0.563 0 N-CA-C 109.187 -0.671 . . . . 45.52 109.187 -172.005 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.407 ' O ' HG12 ' A' ' 69' ' ' VAL . 55.4 Cg_exo -55.0 149.0 44.94 Favored 'Trans proline' 0 C--N 1.33 -0.4 0 CA-C-N 118.859 0.628 . . . . 52.97 110.611 168.399 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -70.54 -31.34 68.36 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.379 -0.828 . . . . 66.03 112.248 -168.654 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -94.57 12.91 25.84 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 113.693 0.998 . . . . 71.33 113.693 179.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.45 HD11 ' HB3' ' A' ' 77' ' ' GLN . 21.6 tp -77.34 130.87 37.71 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 118.67 0.668 . . . . 45.54 110.882 179.712 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.1 p -78.14 165.84 23.48 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 119.066 -1.053 . . . . 53.04 110.84 -178.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.531 ' O ' HG23 ' A' ' 79' ' ' VAL . 29.3 t -61.13 -45.83 97.82 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 CA-C-N 114.785 -1.098 . . . . 52.13 110.355 172.959 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -52.16 -45.64 57.16 Favored Glycine 0 C--N 1.332 0.35 0 C-N-CA 120.07 -1.062 . . . . 48.37 111.77 174.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.45 ' HB3' HD11 ' A' ' 73' ' ' LEU . 85.9 mt-30 -67.5 -40.32 85.2 Favored 'General case' 0 C--O 1.239 0.517 0 C-N-CA 118.501 -1.279 . . . . 51.44 111.332 -178.622 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -60.12 -42.35 94.58 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 119.175 -1.01 . . . . 43.75 111.49 177.763 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.531 HG23 ' O ' ' A' ' 75' ' ' VAL . 43.5 t -58.65 -43.36 87.33 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 O-C-N 121.64 -0.663 . . . . 46.68 110.708 178.008 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -58.51 -40.35 82.62 Favored 'General case' 0 C--O 1.237 0.406 0 O-C-N 121.595 -0.691 . . . . 66.25 111.555 178.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 13.9 t -63.93 -45.61 96.42 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 C-N-CA 120.292 -0.563 . . . . 43.46 110.851 179.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 44.1 mm -61.55 -46.06 97.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 C-N-CA 119.232 -0.987 . . . . 44.01 110.215 179.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 49.7 ttm-85 -49.79 -47.11 51.41 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.261 0.553 . . . . 58.5 110.534 174.598 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 23.1 tttt -60.71 -39.7 89.55 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-N 116.286 -0.415 . . . . 66.39 110.781 -179.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 84.6 mmt-85 -73.62 -42.71 61.11 Favored 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 120.745 -0.382 . . . . 59.43 111.414 -171.043 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 26.1 pt -80.73 4.73 1.7 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.265 0 O-C-N 122.183 -0.323 . . . . 57.32 111.464 174.764 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 89.4 mtp 50.27 41.02 23.72 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-O 122.253 1.025 . . . . 93.3 111.623 -179.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 19.5 tp -66.16 130.1 94.28 Favored Pre-proline 0 C--N 1.316 -0.881 0 C-N-CA 119.917 -0.713 . . . . 55.35 109.575 177.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -58.12 139.77 91.68 Favored 'Trans proline' 0 C--O 1.24 0.618 0 N-CA-C 110.041 -0.792 . . . . 64.56 110.041 177.173 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -53.73 -29.61 52.65 Favored 'Trans proline' 0 C--O 1.241 0.628 0 N-CA-C 113.637 0.591 . . . . 71.96 113.637 -177.955 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 19.3 pm0 -76.09 -10.14 59.18 Favored 'General case' 0 C--N 1.345 0.399 0 N-CA-C 113.661 0.986 . . . . 77.54 113.661 -177.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -101.26 147.59 26.1 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 119.109 0.868 . . . . 79.89 111.473 178.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.424 ' HA ' ' O1 ' ' A' ' 202' ' ' EDO . . . -87.23 158.39 19.12 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.829 0.823 . . . . 59.88 112.794 -170.823 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.479 HG22 ' H21' ' A' ' 202' ' ' EDO . 8.8 tt -153.78 131.39 2.39 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-N 115.496 -0.774 . . . . 49.67 110.661 174.528 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -124.9 148.71 48.17 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 108.937 -0.764 . . . . 62.32 108.937 179.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.502 HD11 HG13 ' A' ' 75' ' ' VAL . 18.8 pt -118.29 139.17 46.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 108.853 -0.795 . . . . 59.54 108.853 171.909 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -114.17 142.34 46.37 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.645 -0.707 . . . . 58.84 110.051 179.53 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 95.6 t -126.36 123.51 63.6 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 N-CA-C 106.669 -1.604 . . . . 60.53 106.669 169.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 56.5 t30 55.09 40.32 31.84 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.791 0.805 . . . . 92.82 109.555 -175.794 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 59.23 32.12 21.75 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.733 -0.667 . . . . 86.31 112.02 -178.067 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 82.0 m -135.14 145.85 48.22 Favored 'General case' 0 C--O 1.235 0.307 0 O-C-N 121.584 -0.698 . . . . 72.26 110.77 -179.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 61.9 mt -76.82 109.36 8.63 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 115.21 -0.904 . . . . 59.03 109.765 171.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -67.55 152.46 78.33 Favored 'Trans proline' 0 CA--C 1.51 -0.693 0 N-CA-C 110.202 -0.73 . . . . 62.27 110.202 176.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' PRO . . . . . 0.449 ' HG2' ' HB2' ' A' ' 107' ' ' ALA . 24.1 Cg_endo -66.5 131.89 27.57 Favored 'Trans proline' 0 C--O 1.233 0.243 0 N-CA-C 110.02 -0.8 . . . . 62.14 110.02 175.537 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 7.4 p -65.77 -19.79 66.02 Favored 'General case' 0 C--O 1.238 0.478 0 N-CA-C 112.722 0.638 . . . . 69.79 112.722 -166.147 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -88.88 -0.71 57.61 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.705 0.631 . . . . 55.32 112.705 177.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.449 ' HB2' ' HG2' ' A' ' 104' ' ' PRO . . . -74.73 138.69 42.91 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 118.426 0.557 . . . . 55.08 110.924 -177.764 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 32.5 mt -67.37 136.81 55.36 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 121.28 0.562 . . . . 54.68 110.407 174.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 96.7 mmm -58.86 -28.28 65.96 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 119.891 -0.724 . . . . 51.37 111.254 173.251 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' SER . . . . . 0.543 ' HA ' HD13 ' A' ' 47' ' ' ILE . 91.3 p -64.66 -40.07 94.79 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 119.002 -1.079 . . . . 56.31 110.858 177.8 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -64.82 -45.52 85.86 Favored 'General case' 0 C--O 1.236 0.348 0 O-C-N 122.012 -0.43 . . . . 51.75 111.418 177.472 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 11.0 mt -60.59 -36.5 70.67 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 C-N-CA 120.391 -0.524 . . . . 59.04 110.86 177.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' TYR . . . . . 0.42 ' CZ ' ' HD3' ' A' ' 117' ' ' LYS . 81.9 t80 -62.51 -45.62 92.19 Favored 'General case' 0 C--O 1.239 0.51 0 O-C-N 121.71 -0.619 . . . . 60.24 111.472 175.484 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -65.66 -30.98 71.75 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.042 -0.663 . . . . 86.89 111.533 -176.179 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -84.86 -31.3 23.84 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 114.003 1.112 . . . . 90.35 114.003 178.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -127.04 14.0 7.31 Favored 'General case' 0 C--N 1.342 0.278 0 N-CA-C 115.309 1.596 . . . . 54.71 115.309 -167.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' LYS . . . . . 0.42 ' HD3' ' CZ ' ' A' ' 113' ' ' TYR . 17.7 pttt -69.42 150.07 47.66 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 117.997 -1.481 . . . . 70.12 110.02 -173.842 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.449 ' HB3' ' OD1' ' A' ' 120' ' ' ASP . 10.7 t70 -76.74 161.27 28.62 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.397 -0.819 . . . . 48.87 110.321 -175.45 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . . . -53.44 -26.72 21.2 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 119.467 -0.893 . . . . 44.98 110.908 170.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' ASP . . . . . 0.449 ' OD1' ' HB3' ' A' ' 118' ' ' ASP . 31.9 p30 -86.57 3.4 44.46 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 113.927 1.084 . . . . 37.24 113.927 -179.143 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 91.74 -11.56 71.79 Favored Glycine 0 C--O 1.244 0.721 0 N-CA-C 115.607 1.003 . . . . 36.23 115.607 177.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -88.27 158.61 18.42 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 118.443 1.122 . . . . 34.78 110.642 178.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 50.2 tp -102.89 122.95 45.6 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 107.162 -1.422 . . . . 39.15 107.162 166.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 48.8 m-85 -97.3 125.65 42.02 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 109.596 -0.52 . . . . 44.71 109.596 -179.059 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 24.4 t -123.25 150.82 27.41 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 N-CA-C 108.472 -0.936 . . . . 47.79 108.472 176.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' THR . . . . . 0.421 ' O ' ' HA ' ' A' ' 96' ' ' ILE . 98.4 m -126.72 130.08 49.66 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 124.662 1.185 . . . . 51.85 108.069 178.896 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' TYR . . . . . . . . . . . . . 31.9 p90 -112.18 154.89 24.85 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.161 0.505 . . . . 48.41 109.688 175.077 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 5.8 p -156.81 167.31 30.84 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.676 0.751 . . . . 72.44 109.454 178.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . -97.15 -162.71 31.96 Favored Glycine 0 N--CA 1.442 -0.926 0 CA-C-N 114.763 -1.108 . . . . 64.99 111.338 173.194 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -80.43 -34.18 36.29 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.227 -0.487 . . . . 96.67 111.866 -178.15 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 67.0 m-20 -112.03 172.3 6.99 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 124.381 1.072 . . . . 100.18 110.357 -177.317 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' THR . . . . . 1.022 HG22 ' HA ' ' A' ' 57' ' ' SER . 51.8 p -156.72 153.63 28.75 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.169 -0.923 . . . . 97.67 109.068 178.787 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.392 0 CA-C-N 115.738 -0.665 . . . . 86.43 112.633 -174.141 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' ALE . . . . . 0.839 ' O3 ' H92C ' A' ' 201' ' ' ALE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' EDO . . . . . 0.479 ' H21' HG22 ' A' ' 94' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' EDO . . . . . 0.508 ' H12' ' OE1' ' A' ' 35' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 308' ' ' HOH . . . . . 0.416 ' O ' ' HA3' ' A' ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_