data_1lhf_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 1lhf _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' L' L ' 1' B ALA . . . . . 0.402 ' O ' ' NH2' ' H' ' 206' ' ' ARG . . . . . . . . 0 C--O 1.251 1.152 0 N-CA-C 109.532 -0.544 . . . . 20.02 109.532 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 1' A ASP . . . . . . . . . . . . . 8.3 t70 -111.58 4.3 18.61 Favored 'General case' 0 C--O 1.255 1.348 0 O-C-N 124.982 1.426 . . . . 21.21 113.99 -179.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 1' ' ' CYS . . . . . . . . . . . . . 30.3 p -49.09 159.1 0.3 Allowed 'General case' 0 C--N 1.318 -0.775 0 O-C-N 123.98 0.8 . . . . 17.58 109.572 179.494 63.237 78.74 91.846 105.519 2.015 106.083 -54.971 -58.046 1 1 . 1 . 001 ecloud orig full ' L' L ' 2' ' ' GLY . . . . . . . . . . . . . . . 59.52 12.71 20.1 Favored Glycine 0 C--O 1.257 1.542 0 N-CA-C 118.692 2.237 . . . . 15.36 118.692 176.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 3' ' ' LEU . . . . . . . . . . . . . 73.5 mt -119.64 96.77 5.33 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 107.734 -1.21 . . . . 14.91 107.734 179.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 4' ' ' ARG . . . . . 0.698 ' NH1' ' OD2' ' L' ' 14' ' ' ASP . 80.1 mtm180 -61.87 125.29 84.67 Favored Pre-proline 0 C--N 1.305 -1.359 0 O-C-N 126.943 2.652 . . . . 14.85 111.175 179.464 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 5' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -49.89 -55.47 4.08 Favored 'Trans proline' 0 C--N 1.312 -1.368 0 O-C-N 125.037 2.072 . . . . 14.9 111.255 178.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 6' ' ' LEU . . . . . . . . . . . . . 58.4 mt -78.14 2.2 18.82 Favored 'General case' 0 C--O 1.25 1.086 0 N-CA-C 116.241 1.941 . . . . 15.64 116.241 -178.01 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 7' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -128.41 -90.57 0.5 Allowed 'General case' 0 N--CA 1.482 1.154 0 O-C-N 124.953 1.408 . . . . 16.26 113.629 179.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 8' ' ' GLU . . . . . . . . . . . . . 21.7 mp0 -49.37 -43.59 44.21 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 115.849 -0.614 . . . . 16.98 111.579 -178.11 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 9' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -60.49 -39.82 89.07 Favored 'General case' 0 C--O 1.247 0.943 0 C-N-CA 125.482 1.513 . . . . 20.76 112.665 178.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 10' ' ' LYS . . . . . 0.709 ' NZ ' ' O ' ' L' ' 556' ' ' HOH . 68.4 mttt -89.82 -2.93 58.33 Favored 'General case' 0 C--O 1.257 1.449 0 C-N-CA 125.836 1.654 . . . . 21.32 112.93 -178.91 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 11' ' ' SER . . . . . . . . . . . . . 34.2 t 64.4 20.89 12.33 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-O 123.088 1.423 . . . . 17.23 110.337 -179.186 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 12' ' ' LEU . . . . . . . . . . . . . 90.2 mt -89.51 134.76 33.96 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 106.271 -1.752 . . . . 17.65 106.271 173.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 13' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -97.41 153.27 18.21 Favored 'General case' 0 C--N 1.31 -1.122 0 N-CA-C 106.909 -1.515 . . . . 22.75 106.909 175.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' ' ' ASP . . . . . 0.698 ' OD2' ' NH1' ' L' ' 4' ' ' ARG 0.35 2.9 p30 -92.73 164.85 13.22 Favored 'General case' 0 C--N 1.317 -0.823 0 O-C-N 126.403 2.314 . . . . 18.64 106.576 177.998 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' L' L ' 14' A LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.41 -24.35 67.35 Favored 'General case' 0 C--O 1.26 1.627 0 N-CA-C 117.405 2.372 . . . . 23.54 117.405 -174.0 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 14' B THR . . . . . . . . . . . . . 27.2 p -125.11 -9.02 7.09 Favored 'General case' 0 C--O 1.266 1.955 0 CA-C-N 120.909 1.686 . . . . 19.41 114.838 -179.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' C GLU . . . . . . . . . . . . . 4.9 pt-20 -48.93 -43.26 39.37 Favored 'General case' 0 C--O 1.263 1.814 0 CA-C-N 118.579 0.627 . . . . 19.55 112.317 -178.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' D ARG . . . . . 0.515 ' O ' ' CG ' ' L' ' 14' H GLU . 5.2 ttp180 -51.83 -23.5 4.85 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.37 -0.832 . . . . 22.2 110.175 -178.043 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 14' E GLU . . . . . . . . . . . . . 6.0 tt0 -67.85 -33.87 75.61 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 122.882 1.325 . . . . 20.05 110.605 -178.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' F LEU . . . . . 0.459 ' O ' ' N ' ' L' ' 14' I SER . 1.0 OUTLIER -68.25 -71.06 0.23 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 113.862 -1.517 . . . . 20.11 108.472 178.747 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' L' L ' 14' G LEU . . . . . 0.497 ' CD2' ' N ' ' L' ' 14' G LEU . 1.6 mm? -43.58 -24.79 0.13 Allowed 'General case' 0 C--O 1.25 1.125 0 C-N-CA 126.842 2.057 . . . . 20.01 113.261 -176.811 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 14' H GLU . . . . . 0.515 ' CG ' ' O ' ' L' ' 14' D ARG . 44.3 mt-10 -85.02 -30.76 23.89 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-N 114.504 -1.225 . . . . 22.23 110.322 -177.697 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 14' I SER . . . . . 0.459 ' N ' ' O ' ' L' ' 14' F LEU . 75.2 p -75.42 -23.25 56.97 Favored 'General case' 0 C--O 1.247 0.926 0 O-C-N 126.225 2.203 . . . . 20.35 110.694 -179.289 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 14' J TYR . . . . . . . . . . . . . 16.0 m-85 . . . . . 0 N--CA 1.473 0.718 0 O-C-N 125.838 1.961 . . . . 20.6 110.442 -179.891 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 16' ' ' ILE . . . . . 0.906 ' N ' ' O ' ' H' ' 586' ' ' HOH . 24.6 mm . . . . . 0 C--O 1.241 0.625 0 N-CA-C 107.976 -1.12 . . . . 21.0 107.976 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 17' ' ' VAL . . . . . . . . . . . . . 69.4 t -115.77 132.68 64.5 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.309 0 C-N-CA 126.511 1.924 . . . . 21.96 108.591 179.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 18' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 60.55 26.31 15.97 Favored 'General case' 0 C--N 1.32 -0.71 0 O-C-N 126.146 2.154 . . . . 23.67 109.015 -178.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 19' ' ' GLY . . . . . . . . . . . . . . . -87.26 -152.95 23.79 Favored Glycine 0 C--O 1.249 1.084 0 CA-C-N 112.834 -1.985 . . . . 21.83 110.216 177.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 20' ' ' SER . . . . . . . . . . . . . 5.1 m -165.35 141.38 5.38 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 114.002 -1.099 . . . . 23.32 110.635 -178.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 21' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -41.54 143.76 0.44 Allowed 'General case' 0 N--CA 1.476 0.849 0 O-C-N 126.114 2.133 . . . . 23.18 106.064 177.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 22' ' ' ALA . . . . . . . . . . . . . . . -91.79 136.88 32.81 Favored 'General case' 0 C--O 1.251 1.138 0 O-C-N 125.978 2.049 . . . . 21.04 110.634 178.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 23' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -62.23 154.15 28.38 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 124.987 1.429 . . . . 20.66 107.581 175.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 24' ' ' ILE . . . . . . . . . . . . . 21.1 mm -60.63 145.95 11.72 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 N-CA-C 107.515 -1.291 . . . . 18.86 107.515 179.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 25' ' ' GLY . . . . . . . . . . . . . . . 48.32 41.33 23.9 Favored Glycine 0 C--O 1.257 1.535 0 C-N-CA 125.609 1.576 . . . . 17.78 114.021 -179.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 26' ' ' MET . . . . . . . . . . . . . 5.8 ttt -88.29 -25.77 22.64 Favored 'General case' 0 C--O 1.253 1.254 0 C-N-CA 124.153 0.981 . . . . 16.16 112.263 -178.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 27' ' ' SER . . . . . . . . . . . . . 3.6 m -145.57 71.49 14.08 Favored Pre-proline 0 C--N 1.312 -1.04 0 O-C-N 124.734 1.271 . . . . 15.98 108.434 -179.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 28' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -66.67 4.69 0.97 Allowed 'Trans proline' 0 C--N 1.316 -1.134 0 O-C-N 126.369 2.773 . . . . 15.1 113.615 -176.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 29' ' ' TRP . . . . . . . . . . . . . 6.2 p90 -106.72 -24.03 12.23 Favored 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 125.888 1.675 . . . . 16.05 112.75 -177.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 30' ' ' GLN . . . . . 0.524 ' OE1' ' OG1' ' H' ' 139' ' ' THR . 56.7 tp60 -53.71 135.92 40.39 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 105.732 -1.951 . . . . 17.67 105.732 174.996 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 31' ' ' VAL . . . . . . . . . . . . . 40.0 t -134.6 148.22 29.58 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.282 0 N-CA-C 107.017 -1.475 . . . . 18.72 107.017 -178.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 32' ' ' MET . . . . . . . . . . . . . 54.8 ttm -106.67 128.82 54.49 Favored 'General case' 0 C--N 1.305 -1.337 0 O-C-N 124.994 1.434 . . . . 21.99 108.938 178.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 33' ' ' LEU . . . . . . . . . . . . . 7.8 mt -90.7 115.39 27.76 Favored 'General case' 0 N--CA 1.488 1.467 0 N-CA-C 104.026 -2.583 . . . . 23.41 104.026 172.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 34' ' ' PHE . . . . . . . . . . . . . 78.6 t80 -127.14 129.62 48.24 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 126.981 2.676 . . . . 26.1 109.773 -176.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 35' ' ' ARG . . . . . . . . . . . . 0.303 10.0 ptt180 -90.83 152.83 20.61 Favored 'General case' 0 C--O 1.243 0.747 0 O-C-N 124.363 1.04 . . . . 31.01 111.723 178.801 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 36' ' ' LYS . . . . . 0.523 ' O ' ' N ' ' H' ' 38' ' ' GLN . 84.0 mttt -72.56 -82.88 0.04 OUTLIER 'General case' 0 C--O 1.247 0.971 0 CA-C-N 113.415 -1.72 . . . . 30.5 109.926 -178.425 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 36' A SER . . . . . . . . . . . . . 2.8 m -105.06 104.51 47.32 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 114.355 -1.293 . . . . 31.99 110.649 -179.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 37' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -91.07 149.7 18.68 Favored 'Cis proline' 0 C--O 1.247 0.959 0 C-N-CA 125.128 -0.78 . . . . 32.15 110.909 0.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 38' ' ' GLN . . . . . 0.523 ' N ' ' O ' ' H' ' 36' ' ' LYS . 5.0 mt-30 -62.7 107.04 0.88 Allowed 'General case' 0 C--O 1.244 0.8 0 CA-C-N 114.749 -1.114 . . . . 34.39 111.248 178.984 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 39' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -164.26 172.26 13.82 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 126.103 2.127 . . . . 31.17 111.406 178.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 40' ' ' LEU . . . . . . . . . . . . . 6.2 tt -88.96 128.86 35.7 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 122.513 1.149 . . . . 27.8 110.059 -176.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 41' ' ' LEU . . . . . . . . . . . . . 41.7 mt -100.81 -48.49 4.46 Favored 'General case' 0 C--O 1.251 1.154 0 CA-C-N 113.13 -1.85 . . . . 24.53 111.964 -178.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 42' ' ' CYS . . . . . . . . . . . . . 1.5 m -166.95 -174.36 2.67 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 124.078 1.894 . . . . 21.14 113.544 -175.264 -92.054 -159.882 -82.976 101.433 2.076 100.421 -88.737 -69.482 1 1 . 1 . 001 ecloud orig full ' H' H ' 43' ' ' GLY . . . . . 0.501 ' N ' ' O ' ' H' ' 195' ' ' SER . . . -105.45 164.56 14.06 Favored Glycine 0 N--CA 1.489 2.182 0 N-CA-C 104.38 -3.488 . . . . 18.99 104.38 174.373 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 44' ' ' ALA . . . . . . . . . . . . . . . -156.57 -176.8 6.17 Favored 'General case' 0 C--O 1.264 1.853 0 N-CA-C 107.286 -1.376 . . . . 17.64 107.286 179.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 45' ' ' SER . . . . . . . . . . . . 0.419 9.7 p -145.71 147.0 31.48 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 123.127 1.441 . . . . 16.74 113.027 179.258 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.36 126.89 39.89 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 104.441 -2.429 . . . . 16.8 104.441 179.403 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 47' ' ' ILE . . . . . 0.779 ' O ' ' O ' ' H' ' 628' ' ' HOH . 3.1 pt -117.9 -29.55 1.95 Allowed 'Isoleucine or valine' 0 C--O 1.25 1.129 0 C-N-CA 124.094 0.958 . . . . 18.36 109.872 -179.91 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -145.43 -173.24 4.06 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 105.854 -1.906 . . . . 19.93 105.854 175.578 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 49' ' ' ASP . . . . . . . . . . . . . 19.2 p-10 -75.77 -14.78 60.32 Favored 'General case' 0 C--O 1.267 2.026 0 O-C-N 126.716 2.51 . . . . 22.67 114.966 -178.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 50' ' ' ARG . . . . . . . . . . . . . 23.6 mtp180 -130.52 -5.32 4.2 Favored 'General case' 0 C--O 1.251 1.134 0 CA-C-O 116.662 -1.637 . . . . 26.15 113.431 -179.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 51' ' ' TRP . . . . . . . . . . . . . 93.8 m95 -113.48 141.39 47.18 Favored 'General case' 0 C--N 1.316 -0.884 0 O-C-N 126.051 2.094 . . . . 22.84 112.639 -176.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 52' ' ' VAL . . . . . . . . . . . . . 69.2 t -132.2 132.3 60.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.103 -0.953 . . . . 18.93 111.723 177.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 53' ' ' LEU . . . . . . . . . . . . . 20.6 tp -93.64 153.14 18.54 Favored 'General case' 0 C--N 1.31 -1.134 0 C-N-CA 125.579 1.552 . . . . 17.32 109.775 176.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 54' ' ' THR . . . . . . . . . . . . . 7.2 t -176.11 173.11 2.26 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 125.101 1.501 . . . . 16.72 110.51 178.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 55' ' ' ALA . . . . . . . . . . . . . . . -73.87 136.38 43.41 Favored 'General case' 0 C--O 1.247 0.968 0 N-CA-C 107.615 -1.254 . . . . 15.53 107.615 175.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 56' ' ' ALA . . . . . 0.447 ' N ' ' OD1' ' H' ' 102' ' ' ASP . . . -67.02 -26.18 66.65 Favored 'General case' 0 N--CA 1.481 1.089 0 O-C-N 124.998 1.436 . . . . 15.61 110.093 -178.936 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 57' ' ' HIS . . . . . . . . . . . . . 11.2 p-80 -71.83 -12.35 61.24 Favored 'General case' 0 C--O 1.251 1.146 0 O-C-N 124.647 1.217 . . . . 17.73 111.76 -178.492 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 58' ' ' CYS . . . . . . . . . . . . . 99.6 m -72.25 -20.33 61.56 Favored 'General case' 0 C--O 1.25 1.095 0 O-C-N 124.388 1.055 . . . . 18.31 108.942 177.804 -69.482 -88.737 -82.976 100.421 2.076 101.433 -159.882 -92.054 1 1 . 1 . 001 ecloud orig full ' H' H ' 59' ' ' LEU . . . . . . . . . . . . . 67.7 mt -116.85 -27.9 6.47 Favored 'General case' 0 C--O 1.25 1.085 0 N-CA-C 115.497 1.665 . . . . 18.9 115.497 -175.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' ' ' LEU . . . . . . . . . . . . . 13.2 tp -140.26 111.94 7.41 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-O 122.908 1.337 . . . . 18.56 112.864 -177.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' A TYR . . . . . . . . . . . . . 4.1 t80 -152.61 81.05 5.49 Favored Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 113.217 -1.81 . . . . 18.29 106.727 175.962 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' B PRO . . . . . 0.575 ' N ' ' CD ' ' H' ' 60' C PRO . 93.9 Cg_exo -49.89 -36.17 42.46 Favored 'Trans proline' 0 C--O 1.256 1.378 0 C-N-CA 122.782 2.321 . . . . 18.42 113.318 -178.585 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 60' C PRO . . . . . 0.575 ' CD ' ' N ' ' H' ' 60' B PRO . 57.7 Cg_exo -58.16 -22.09 54.71 Favored 'Trans proline' 0 C--O 1.255 1.341 0 O-C-N 124.386 1.73 . . . . 18.53 114.218 -178.353 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 60' D TRP . . . . . . . . . . . . . 41.7 m0 -122.45 16.99 10.51 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 107.336 -1.357 . . . . 20.24 107.336 -177.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' E ASP . . . . . . . . . . . . . 2.8 m-20 55.41 38.48 30.35 Favored 'General case' 0 C--O 1.244 0.764 0 O-C-N 125.291 1.62 . . . . 23.27 111.479 176.749 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' F LYS . . . . . . . . . . . . . 37.7 ttmt -95.46 113.87 25.57 Favored 'General case' 0 C--N 1.315 -0.916 0 O-C-N 125.321 1.638 . . . . 22.27 109.558 176.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' G ASN . . . . . . . . . . . . . 0.9 OUTLIER -148.07 73.95 1.28 Allowed 'General case' 0 C--O 1.255 1.37 0 O-C-N 124.459 1.099 . . . . 26.48 111.352 178.398 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 60' H PHE . . . . . . . . . . . . . 59.1 m-85 -78.51 146.98 34.05 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 124.441 1.088 . . . . 24.44 111.499 -178.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' I THR . . . . . 0.575 ' O ' ' N ' ' H' ' 63' ' ' ASP . 26.5 p -136.07 139.45 43.05 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 113.347 -1.752 . . . . 25.55 110.13 177.948 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 61' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -22.54 -40.21 0.0 OUTLIER 'General case' 0 C--O 1.255 1.346 0 C-N-CA 126.799 2.04 . . . . 25.99 114.788 -177.91 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 62' ' ' ASN . . . . . 0.508 ' N ' ' O ' ' H' ' 60' I THR . 0.9 OUTLIER -77.55 5.95 8.07 Favored 'General case' 0 C--O 1.248 0.977 0 O-C-N 125.889 1.993 . . . . 27.79 111.781 -179.017 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 63' ' ' ASP . . . . . 0.575 ' N ' ' O ' ' H' ' 60' I THR . 45.5 m-20 -117.57 -8.16 10.99 Favored 'General case' 0 C--N 1.308 -1.228 0 C-N-CA 124.379 1.071 . . . . 26.19 109.236 178.824 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 64' ' ' LEU . . . . . . . . . . . . . 26.8 mt -120.67 156.73 31.11 Favored 'General case' 0 C--N 1.321 -0.645 0 O-C-N 126.341 2.276 . . . . 26.3 115.279 -175.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 65' ' ' LEU . . . . . . . . . . . . 0.282 1.6 tp -141.77 145.74 35.14 Favored 'General case' 0 C--O 1.256 1.425 0 CA-C-N 111.575 -2.557 . . . . 24.99 105.414 179.577 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 66' ' ' VAL . . . . . 0.457 ' N ' ' O ' ' H' ' 83' ' ' SER 0.279 25.6 m -114.26 136.71 49.95 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 125.422 1.701 . . . . 23.74 108.869 177.049 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 67' ' ' ARG . . . . . . . . . . . . . 47.8 mtp180 -118.49 107.84 14.28 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.448 -1.251 . . . . 25.75 110.596 -179.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 68' ' ' ILE . . . . . . . . . . . . . 1.8 mt -114.32 137.86 46.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 CA-C-N 114.053 -1.43 . . . . 23.06 110.866 -176.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 69' ' ' GLY . . . . . . . . . . . . . . . 104.29 8.9 37.51 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 125.15 1.357 . . . . 21.62 112.688 177.053 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 70' ' ' LYS . . . . . 0.482 ' NZ ' ' O ' ' H' ' 75' ' ' ARG . 26.5 mtpp -79.86 138.61 37.23 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 117.322 2.342 . . . . 23.35 117.322 -175.565 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 71' ' ' HIS . . . . . . . . . . . . . 77.3 t60 -116.06 -57.19 2.24 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 111.71 -2.495 . . . . 22.61 105.406 177.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 72' ' ' SER . . . . . 0.567 ' N ' ' OE2' ' H' ' 77' ' ' GLU . 48.4 t -75.21 134.03 41.27 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 113.233 -1.803 . . . . 24.99 109.111 178.557 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 73' ' ' ARG . . . . . 0.571 ' NH2' ' OD2' ' I' ' 55' ' ' ASP . 7.9 ttt-85 -68.68 -61.19 1.92 Allowed 'General case' 0 C--O 1.253 1.255 0 CA-C-N 113.544 -1.662 . . . . 29.31 112.823 -178.302 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 74' ' ' THR . . . . . 0.475 ' OG1' ' O ' ' H' ' 601' ' ' HOH . 18.9 p -80.46 -31.77 37.31 Favored 'General case' 0 C--O 1.268 2.077 0 N-CA-C 119.621 3.193 . . . . 27.6 119.621 -174.868 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 75' ' ' ARG . . . . . 0.567 ' NH1' ' O ' ' H' ' 576' ' ' HOH . 3.2 mpt_? -89.57 162.16 15.81 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 117.639 2.459 . . . . 29.45 117.639 -175.344 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 76' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -88.89 84.81 6.65 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-N 113.351 -1.75 . . . . 27.4 111.304 178.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 77' ' ' GLU . . . . . 0.567 ' OE2' ' N ' ' H' ' 72' ' ' SER . 23.1 mt-10 -61.67 83.37 0.01 OUTLIER 'General case' 0 C--N 1.307 -1.247 0 CA-C-O 126.5 3.048 . . . . 24.89 111.154 -177.705 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 77' A ARG . . . . . . . . . . . . 0.45 5.0 ttm180 -33.02 -46.9 0.16 Allowed 'General case' 0 N--CA 1.396 -3.167 2 N-CA-C 124.491 4.997 . . . . 25.71 124.491 -173.403 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' H' H ' 78' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -123.12 10.77 9.42 Favored 'General case' 0 N--CA 1.481 1.098 0 CA-C-O 117.669 -1.158 . . . . 26.34 109.826 179.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 79' ' ' ILE . . . . . . . . . . . . . 1.2 tt -109.6 -64.45 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 O-C-N 124.879 1.362 . . . . 24.63 112.893 -176.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 80' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -64.28 152.41 41.11 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 125.33 1.452 . . . . 24.89 112.732 -179.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 81' ' ' LYS . . . . . . . . . . . . . 1.6 mmmt -125.44 120.4 30.9 Favored 'General case' 0 C--N 1.315 -0.904 0 C-N-CA 126.396 1.878 . . . . 25.09 111.754 -179.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 82' ' ' ILE . . . . . . . . . . . . . 16.7 mt -98.84 137.89 24.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 N-CA-C 106.925 -1.509 . . . . 25.37 106.925 176.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 83' ' ' SER . . . . . 0.457 ' O ' ' N ' ' H' ' 66' ' ' VAL . 2.2 m -143.66 148.43 35.77 Favored 'General case' 0 C--N 1.312 -1.064 0 O-C-N 125.723 1.89 . . . . 26.22 111.955 -179.287 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 84' ' ' MET . . . . . . . . . . . . . 68.6 mtm -99.85 149.84 22.98 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 111.865 -2.425 . . . . 28.16 108.161 178.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 85' ' ' LEU . . . . . . . . . . . . . 7.9 mt -91.22 143.33 26.78 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 112.974 -1.921 . . . . 26.14 111.16 -178.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 86' ' ' GLU . . . . . 0.438 ' N ' ' O ' ' H' ' 107' ' ' LYS . 13.5 tt0 -93.36 -40.84 10.17 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 112.461 -2.154 . . . . 28.15 107.652 176.108 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 87' ' ' LYS . . . . . 0.489 ' NZ ' ' CB ' ' H' ' 87' ' ' LYS . 0.1 OUTLIER -168.52 147.59 4.35 Favored 'General case' 0 N--CA 1.444 -0.771 0 O-C-N 126.044 2.09 . . . . 26.15 116.135 178.901 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 88' ' ' ILE . . . . . 0.402 ' N ' ' CG ' ' H' ' 87' ' ' LYS . 69.2 mt -105.63 135.96 41.68 Favored 'Isoleucine or valine' 0 C--O 1.252 1.223 0 CA-C-N 113.569 -1.651 . . . . 22.97 109.956 177.971 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 89' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -126.38 123.47 38.02 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 107.342 -1.355 . . . . 25.17 107.342 177.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 90' ' ' ILE . . . . . 0.477 ' O ' ' C ' ' H' ' 91' ' ' HIS . 7.2 mt -112.68 131.24 64.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 O-C-N 125.712 1.882 . . . . 20.49 109.697 -179.415 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 91' ' ' HIS . . . . . 0.477 ' C ' ' O ' ' H' ' 90' ' ' ILE . 28.0 t-80 -42.44 120.94 2.59 Favored Pre-proline 0 CA--C 1.552 1.03 0 N-CA-C 103.562 -2.755 . . . . 18.49 103.562 175.654 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 92' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -55.7 -15.69 13.26 Favored 'Trans proline' 0 C--N 1.322 -0.82 0 O-C-N 126.415 2.797 . . . . 17.54 111.318 177.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 93' ' ' ARG . . . . . . . . . . . . . 77.5 mtp180 -113.63 11.85 18.32 Favored 'General case' 0 C--O 1.252 1.19 0 N-CA-C 115.709 1.744 . . . . 17.82 115.709 -177.146 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 94' ' ' TYR . . . . . . . . . . . . . 4.7 t80 -49.16 121.22 4.63 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 107.182 -1.414 . . . . 15.86 107.182 175.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 95' ' ' ASN . . . . . . . . . . . . . 62.3 t-20 -98.66 73.35 2.04 Favored 'General case' 0 C--N 1.31 -1.137 0 O-C-N 124.65 1.219 . . . . 15.9 112.029 -178.174 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 96' ' ' TRP . . . . . 0.687 ' O ' ' O ' ' H' ' 615' ' ' HOH . 59.0 p-90 -65.9 -24.01 66.75 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 107.973 -1.121 . . . . 17.27 107.973 178.578 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 97' ' ' ARG . . . . . . . . . . . . 0.263 67.8 mtt-85 -59.45 -52.68 64.55 Favored 'General case' 0 C--O 1.264 1.864 0 N-CA-C 117.28 2.326 . . . . 19.18 117.28 -175.612 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 97' A GLU . . . . . 0.446 ' OE1' ' NH1' ' H' ' 175' ' ' ARG . 64.0 tt0 -110.26 -63.95 1.32 Allowed 'General case' 0 C--O 1.264 1.858 0 N-CA-C 117.075 2.25 . . . . 19.79 117.075 -177.465 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 98' ' ' ASN . . . . . 0.444 ' ND2' ' O ' ' H' ' 175' ' ' ARG . 46.8 p-10 -138.02 29.92 2.51 Favored 'General case' 0 C--O 1.256 1.411 0 N-CA-C 117.113 2.264 . . . . 15.8 117.113 -170.532 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 99' ' ' LEU . . . . . . . . . . . . . 60.3 mt 48.49 40.32 14.82 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 125.836 1.654 . . . . 14.57 111.799 -179.024 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 100' ' ' ASP . . . . . 0.485 ' OD2' ' O ' ' H' ' 552' ' ' HOH . 28.3 t70 -71.74 139.15 48.96 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 104.372 -2.455 . . . . 16.06 104.372 173.939 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 101' ' ' ARG . . . . . . . . . . . . . 63.0 mtt85 65.04 31.74 10.91 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 125.676 1.86 . . . . 15.94 114.041 -179.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 102' ' ' ASP . . . . . 0.447 ' OD1' ' N ' ' H' ' 56' ' ' ALA . 59.7 t0 -70.92 81.42 0.65 Allowed 'General case' 0 N--CA 1.484 1.272 0 CA-C-N 113.835 -1.53 . . . . 14.92 107.552 178.722 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 103' ' ' ILE . . . . . . . . . . . . . 18.3 tt -151.39 143.78 16.42 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.072 0 O-C-N 126.228 2.205 . . . . 16.53 107.244 178.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 104' ' ' ALA . . . . . . . . . . . . . . . -148.99 152.59 36.58 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 125.754 1.909 . . . . 17.63 106.834 178.269 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 105' ' ' LEU . . . . . . . . . . . . . 54.6 mt -123.72 142.32 51.19 Favored 'General case' 0 C--N 1.313 -1.01 0 O-C-N 126.087 2.117 . . . . 19.67 106.108 177.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 106' ' ' MET . . . . . . . . . . . . . 60.6 mtp -126.15 142.87 51.35 Favored 'General case' 0 C--N 1.311 -1.071 0 O-C-N 126.027 2.079 . . . . 23.43 107.475 179.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 107' ' ' LYS . . . . . 0.438 ' O ' ' N ' ' H' ' 86' ' ' GLU . 9.9 tptt -112.53 126.44 55.34 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 126.783 2.552 . . . . 27.4 108.651 -178.162 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 108' ' ' LEU . . . . . . . . . . . . . 23.5 mt -81.01 136.05 35.93 Favored 'General case' 0 C--O 1.247 0.971 0 O-C-N 126.728 2.517 . . . . 24.74 108.797 178.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 109' ' ' LYS . . . . . . . . . . . . . 23.5 ttpt -61.42 -25.69 67.38 Favored 'General case' 0 C--N 1.305 -1.346 0 CA-C-N 113.741 -1.572 . . . . 27.46 109.242 -178.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 110' ' ' LYS . . . . . . . . . . . . . 18.6 mmtm -148.01 145.67 21.53 Favored Pre-proline 0 C--N 1.319 -0.75 0 N-CA-C 106.775 -1.565 . . . . 27.39 106.775 179.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 111' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -72.83 170.05 20.58 Favored 'Trans proline' 0 C--N 1.304 -1.774 0 O-C-N 126.328 2.752 . . . . 24.69 108.61 -177.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 112' ' ' VAL . . . . . . . . . . . . . 2.5 m -115.09 141.94 29.9 Favored 'Isoleucine or valine' 0 C--O 1.247 0.932 0 O-C-N 124.309 1.006 . . . . 23.98 110.082 -179.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 113' ' ' ALA . . . . . . . . . . . . . . . -82.17 131.84 35.24 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 104.207 -2.516 . . . . 22.29 104.207 174.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 114' ' ' PHE . . . . . . . . . . . . . 11.4 m-85 -80.53 164.12 23.2 Favored 'General case' 0 C--N 1.31 -1.125 0 O-C-N 125.408 1.693 . . . . 20.9 108.107 179.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 115' ' ' SER . . . . . . . . . . . . . 78.4 p -159.65 -156.13 0.49 Allowed 'General case' 0 C--N 1.317 -0.818 0 O-C-N 125.551 1.782 . . . . 20.24 107.762 -178.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 116' ' ' ASP . . . . . . . . . . . . . 62.6 m-20 -78.03 -26.67 48.53 Favored 'General case' 0 C--N 1.299 -1.593 0 C-N-CA 128.135 2.574 . . . . 21.5 112.518 -178.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 117' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -106.7 -15.76 14.67 Favored 'General case' 0 C--N 1.314 -0.961 0 O-C-N 125.638 1.836 . . . . 19.36 114.117 -178.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 118' ' ' ILE . . . . . . . . . . . . . 20.8 mt -122.15 116.28 48.72 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.038 0 C-N-CA 124.601 1.16 . . . . 17.97 109.455 -177.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 119' ' ' HIS . . . . . . . . . . . . . 28.5 t60 -162.33 144.73 8.52 Favored Pre-proline 0 C--O 1.246 0.894 0 O-C-N 125.937 2.023 . . . . 17.08 111.358 -177.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 120' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -76.15 143.88 26.0 Favored 'Trans proline' 0 N--CA 1.454 -0.808 0 CA-C-O 125.169 2.071 . . . . 16.85 114.272 -178.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 121' ' ' VAL . . . . . . . . . . . . . 7.7 p -95.14 152.5 3.66 Favored 'Isoleucine or valine' 0 C--O 1.249 1.074 0 CA-C-N 111.82 -2.445 . . . . 16.29 104.639 175.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 122' ' ' CYS . . . . . . . . . . . . . 67.7 m -87.41 144.98 26.49 Favored 'General case' 0 CA--C 1.542 0.673 0 O-C-N 126.543 2.402 . . . . 15.38 110.114 -179.896 -58.046 -54.971 91.846 106.083 2.015 105.519 78.74 63.237 1 1 . 1 . 001 ecloud orig full ' H' H ' 123' ' ' LEU . . . . . . . . . . . . . 34.0 mt -93.53 133.63 27.9 Favored Pre-proline 0 N--CA 1.47 0.562 0 O-C-N 127.026 2.704 . . . . 16.57 104.02 173.514 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 124' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -52.93 168.42 0.5 Allowed 'Trans proline' 0 N--CA 1.451 -0.989 0 O-C-N 127.512 3.375 . . . . 18.69 113.624 179.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 125' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -132.85 152.76 51.78 Favored 'General case' 0 C--O 1.25 1.11 0 CA-C-N 110.884 -2.871 . . . . 23.01 105.759 177.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 126' ' ' ARG . . . . . . . . . . . . . 39.6 ttt85 -43.72 -31.4 0.79 Allowed 'General case' 0 C--O 1.258 1.513 0 N-CA-C 117.196 2.295 . . . . 28.49 117.196 -175.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 127' ' ' GLU . . . . . . . . . . . . . 25.4 tp10 -90.83 -34.22 15.36 Favored 'General case' 0 C--O 1.252 1.236 0 N-CA-C 112.427 0.528 . . . . 26.33 112.427 -176.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 128' ' ' THR . . . . . . . . . . . . . 21.2 m -65.09 -39.6 93.4 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 124.58 1.175 . . . . 22.96 107.902 -177.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 129' ' ' ALA . . . . . . . . . . . . . . . -68.45 -31.99 71.68 Favored 'General case' 0 C--O 1.247 0.935 0 CA-C-N 113.315 -1.766 . . . . 22.57 111.564 -178.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 129' A ALA . . . . . . . . . . . . . . . -76.41 -35.0 58.81 Favored 'General case' 0 C--O 1.245 0.862 0 CA-C-O 122.424 1.107 . . . . 22.44 109.985 -177.173 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 129' B SER . . . . . 0.64 ' O ' ' O ' ' H' ' 625' ' ' HOH . 49.4 m -76.41 -43.66 39.44 Favored 'General case' 0 C--O 1.244 0.783 0 CA-C-N 113.757 -1.565 . . . . 23.8 111.453 -179.667 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 129' C LEU . . . . . 0.452 ' O ' ' N ' ' H' ' 131' ' ' GLN . 29.3 mt -92.64 -42.39 9.66 Favored 'General case' 0 C--O 1.259 1.596 0 N-CA-C 117.56 2.43 . . . . 21.85 117.56 -174.178 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 130' ' ' LEU . . . . . . . . . . . . . 3.5 mt -68.42 54.87 0.08 Allowed 'General case' 0 C--O 1.25 1.126 0 O-C-N 123.812 0.695 . . . . 21.59 109.622 179.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 131' ' ' GLN . . . . . 0.488 ' NE2' ' O ' ' H' ' 625' ' ' HOH . 63.7 mt-30 -110.89 142.51 42.85 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 125.572 1.795 . . . . 23.23 108.638 -179.206 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 132' ' ' ALA . . . . . . . . . . . . . . . -70.83 124.2 23.76 Favored 'General case' 0 C--O 1.248 1.019 0 O-C-N 125.194 1.559 . . . . 20.89 110.661 -177.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 133' ' ' GLY . . . . . . . . . . . . . . . 112.13 -17.23 24.6 Favored Glycine 0 C--O 1.251 1.17 0 O-C-N 125.377 1.673 . . . . 20.38 110.888 -179.093 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 134' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -77.95 154.25 31.76 Favored 'General case' 0 C--O 1.265 1.916 0 N-CA-C 108.401 -0.963 . . . . 20.53 108.401 179.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 135' ' ' LYS . . . . . . . . . . . . . 64.0 mttt -111.92 152.05 28.47 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-O 124.706 2.193 . . . . 19.0 114.508 -179.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 136' ' ' GLY . . . . . . . . . . . . . . . -131.24 169.74 21.64 Favored Glycine 0 CA--C 1.542 1.746 0 N-CA-C 106.795 -2.522 . . . . 16.97 106.795 177.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 137' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -117.82 139.35 51.21 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-N 113.576 -1.312 . . . . 17.11 110.135 -179.481 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 138' ' ' VAL . . . . . . . . . . . . . 20.1 t -124.96 140.75 47.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 O-C-N 125.567 1.792 . . . . 17.71 108.518 177.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 139' ' ' THR . . . . . 0.524 ' OG1' ' OE1' ' H' ' 30' ' ' GLN . 75.1 p -130.82 160.76 33.46 Favored 'General case' 0 C--N 1.318 -0.763 0 O-C-N 124.608 1.192 . . . . 18.11 109.264 179.001 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 140' ' ' GLY . . . . . . . . . . . . . . . 157.08 159.5 9.52 Favored Glycine 0 N--CA 1.449 -0.496 0 O-C-N 125.366 1.666 . . . . 18.64 115.296 177.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 141' ' ' TRP . . . . . . . . . . . . . 11.5 m-90 -97.32 20.25 11.86 Favored 'General case' 0 C--O 1.246 0.916 0 C-N-CA 127.442 2.297 . . . . 19.53 112.984 -179.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 142' ' ' GLY . . . . . . . . . . . . . . . -76.0 172.98 54.05 Favored Glycine 0 C--O 1.246 0.859 0 CA-C-O 123.455 1.586 . . . . 20.82 114.587 -178.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 143' ' ' ASN . . . . . . . . . . . . . 53.6 m-20 -46.52 141.42 3.69 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 112.95 -1.625 . . . . 21.86 108.928 -178.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 144' ' ' LEU . . . . . 0.651 ' N ' ' O ' ' H' ' 150' ' ' GLY . 9.6 mt -87.34 -12.32 46.78 Favored 'General case' 0 C--O 1.25 1.097 0 O-C-N 125.168 1.542 . . . . 24.1 114.179 -176.711 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 145' ' ' LYS . . . . . . . . . . . . . 65.8 mmtt -158.03 152.79 25.06 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 106.626 -1.62 . . . . 24.47 106.626 179.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 146' ' ' GLU . . . . . 0.462 ' OE2' ' NH2' ' H' ' 221' A ARG . 80.8 tt0 . . . . . 0 C--O 1.261 1.683 0 O-C-N 125.955 2.035 . . . . 25.08 111.872 179.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 150' ' ' GLY . . . . . 0.651 ' O ' ' N ' ' H' ' 144' ' ' LEU . . . . . . . . 0 CA--C 1.531 1.089 0 N-CA-C 109.425 -1.47 . . . . 29.25 109.425 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 151' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -90.65 128.61 47.85 Favored Pre-proline 0 C--N 1.313 -1.005 0 CA-C-N 114.283 -0.959 . . . . 32.59 108.796 178.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 152' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -77.65 158.44 31.99 Favored 'Trans proline' 0 C--O 1.247 0.93 0 O-C-N 126.545 2.866 . . . . 28.07 109.215 176.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 153' ' ' SER . . . . . . . . . . . . . 2.2 p -86.58 -34.04 20.03 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 125.608 1.817 . . . . 25.78 108.39 178.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 154' ' ' VAL . . . . . . . . . . . . . 1.5 t -120.99 161.96 20.3 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 CA-C-N 113.325 -1.761 . . . . 22.93 110.868 -178.503 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 155' ' ' LEU . . . . . . . . . . . . . 28.0 tp -58.36 134.16 56.36 Favored 'General case' 0 C--O 1.246 0.869 0 C-N-CA 123.973 0.909 . . . . 21.14 110.169 175.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 156' ' ' GLN . . . . . . . . . . . . . 28.8 mm100 -100.4 166.0 11.17 Favored 'General case' 0 C--O 1.251 1.169 0 C-N-CA 124.019 0.927 . . . . 21.26 109.443 179.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 157' ' ' VAL . . . . . . . . . . . . . 94.4 t -154.35 155.06 6.41 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 O-C-N 124.949 1.406 . . . . 19.33 110.887 -176.221 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 158' ' ' VAL . . . . . . . . . . . . . 7.4 p -168.52 154.91 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 O-C-N 124.909 1.381 . . . . 18.18 111.003 -179.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 159' ' ' ASN . . . . . . . . . . . . . 11.1 m-20 -119.17 113.89 21.59 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 126.246 1.818 . . . . 18.16 112.032 -177.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 160' ' ' LEU . . . . . . . . . . . . 0.282 18.7 mt -121.45 137.99 27.67 Favored Pre-proline 0 C--N 1.31 -1.133 0 CA-C-N 113.101 -1.863 . . . . 17.73 109.545 -176.971 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 161' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -78.39 166.1 24.64 Favored 'Trans proline' 0 C--O 1.257 1.432 0 O-C-N 125.715 2.429 . . . . 18.91 110.15 178.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 162' ' ' ILE . . . . . . . . . . . . . 45.7 mm -90.14 128.36 42.13 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 N-CA-C 106.122 -1.807 . . . . 19.94 106.122 178.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 163' ' ' VAL . . . . . . . . . . . . . 8.3 t -95.19 138.37 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 O-C-N 126.751 2.532 . . . . 19.28 108.362 -179.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 164' ' ' GLU . . . . . . . . . . . . . 39.6 mp0 -54.09 151.78 6.64 Favored 'General case' 0 C--N 1.316 -0.864 0 O-C-N 126.242 2.214 . . . . 23.82 109.593 179.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 165' ' ' ARG . . . . . 0.858 ' NH2' ' O ' ' H' ' 177' ' ' THR 0.331 10.1 ttt85 -53.72 -51.7 74.05 Favored Pre-proline 0 C--O 1.256 1.443 0 N-CA-C 114.812 1.412 . . . . 19.4 114.812 -176.116 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 166' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -50.13 -61.85 0.5 Allowed 'Trans proline' 0 C--N 1.313 -1.3 0 C-N-CA 124.289 3.326 . . . . 18.49 111.193 -178.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 167' ' ' VAL . . . . . . . . . . . . . 97.0 t -45.96 -49.42 4.85 Favored 'Isoleucine or valine' 0 C--O 1.247 0.969 0 CA-C-N 112.917 -1.947 . . . . 18.13 109.909 178.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 168' ' ' CYS . . . . . . . . . . . . . 68.6 m -57.43 -47.28 82.18 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 125.216 1.573 . . . . 17.82 108.357 -179.382 -71.929 -62.661 -92.148 105.003 2.0 105.448 -74.54 94.08 1 1 . 1 . 001 ecloud orig full ' H' H ' 169' ' ' LYS . . . . . . . . . . . . . 12.8 ttmm -60.53 -42.39 96.38 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-N 112.566 -2.106 . . . . 20.59 111.78 -179.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 170' ' ' ASP . . . . . . . . . . . . 0.356 17.0 m-20 -80.12 12.23 2.96 Favored 'General case' 0 C--O 1.26 1.653 0 N-CA-C 116.469 2.025 . . . . 18.13 116.469 -177.661 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 171' ' ' SER . . . . . . . . . . . . . 2.9 p -110.13 -9.19 14.71 Favored 'General case' 0 C--O 1.262 1.732 0 N-CA-C 114.396 1.258 . . . . 19.28 114.396 -177.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 172' ' ' THR . . . . . . . . . . . . . 10.1 t -144.78 165.05 29.18 Favored 'General case' 0 C--O 1.249 1.029 0 N-CA-C 114.515 1.302 . . . . 20.37 114.515 -175.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 173' ' ' ARG . . . . . . . . . . . . . 28.6 mtm-85 -94.13 -17.58 22.64 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.271 1.428 . . . . 26.8 108.914 -179.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 174' ' ' ILE . . . . . . . . . . . . . 14.2 mt -68.89 161.07 4.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 O-C-N 126.111 2.132 . . . . 19.99 108.95 177.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 175' ' ' ARG . . . . . 0.446 ' NH1' ' OE1' ' H' ' 97' A GLU . 2.9 ttt180 -100.98 111.05 23.16 Favored 'General case' 0 C--N 1.311 -1.066 0 O-C-N 124.99 1.431 . . . . 18.39 109.315 179.324 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 176' ' ' ILE . . . . . . . . . . . . . 17.4 mm -79.15 142.99 13.26 Favored 'Isoleucine or valine' 0 C--O 1.246 0.88 0 CA-C-N 112.387 -2.188 . . . . 18.66 111.402 179.318 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 177' ' ' THR . . . . . 0.858 ' O ' ' NH2' ' H' ' 165' ' ' ARG . 11.0 p -122.06 179.71 4.43 Favored 'General case' 0 C--O 1.248 0.976 0 CA-C-O 122.953 1.359 . . . . 17.38 110.345 177.135 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 178' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -71.95 -24.75 61.66 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 113.124 -1.853 . . . . 17.24 112.536 -178.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 179' ' ' ASN . . . . . . . . . . . . . 16.3 m-20 -87.03 24.14 1.6 Allowed 'General case' 0 N--CA 1.482 1.16 0 O-C-N 124.565 1.166 . . . . 16.46 107.857 177.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 180' ' ' MET . . . . . . . . . . . . . 48.6 mtt -137.94 144.8 41.4 Favored 'General case' 0 C--N 1.322 -0.625 0 O-C-N 125.669 1.856 . . . . 16.68 112.598 -176.611 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 181' ' ' PHE . . . . . . . . . . . . . 12.8 p90 -141.63 158.72 43.47 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 126.433 2.333 . . . . 16.08 106.222 174.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 182' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -125.74 156.11 39.91 Favored 'General case' 0 C--N 1.319 -0.728 0 O-C-N 125.695 1.872 . . . . 17.16 109.448 177.904 94.08 -74.54 -92.148 105.448 2.0 105.003 -62.661 -71.929 2 2 . 1 . 001 ecloud orig full ' H' H ' 183' ' ' ALA . . . . . . . . . . . . . . . -151.1 147.31 26.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 113.016 -1.902 . . . . 18.55 110.431 -177.655 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 184' ' ' GLY . . . . . . . . . . . . . . . 155.13 165.02 13.6 Favored Glycine 0 C--O 1.25 1.119 0 N-CA-C 108.759 -1.737 . . . . 20.71 108.759 179.542 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 184' A TYR . . . . . . . . . . . . . 57.8 m-85 -85.07 143.45 28.87 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 106.719 -1.585 . . . . 23.31 106.719 176.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 185' ' ' LYS . . . . . . . . . . . . . 84.0 mttt -74.71 125.12 89.89 Favored Pre-proline 0 N--CA 1.485 1.288 0 O-C-N 125.957 2.035 . . . . 26.19 106.472 176.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 186' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -31.5 -33.28 0.04 OUTLIER 'Trans proline' 0 C--O 1.269 2.034 0 C-N-CA 124.254 3.302 . . . . 27.73 117.975 -176.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 186' A ASP . . . . . 0.597 ' OD1' ' O ' ' H' ' 549' ' ' HOH . 58.7 m-20 -89.09 22.75 2.66 Favored 'General case' 0 C--O 1.257 1.488 0 N-CA-C 112.917 0.71 . . . . 29.52 112.917 -178.224 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 186' B GLU . . . . . . . . . . . . . 49.1 mt-10 -116.58 19.15 14.76 Favored 'General case' 0 C--O 1.258 1.504 0 N-CA-C 114.875 1.435 . . . . 30.28 114.875 -177.496 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 186' C GLY . . . . . . . . . . . . . . . 70.86 -75.22 0.59 Allowed Glycine 0 C--O 1.253 1.299 0 CA-C-O 119.119 -0.823 . . . . 28.96 111.127 179.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 186' D LYS . . . . . . . . . . . . . 22.1 mttt -56.95 157.74 5.46 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 122.508 1.147 . . . . 30.39 113.652 -178.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 187' ' ' ARG . . . . . . . . . . . . . 5.3 ptp180 -150.97 -163.59 1.81 Allowed 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 113.379 -1.737 . . . . 26.29 111.744 -179.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 188' ' ' GLY . . . . . 0.778 ' O ' ' O ' ' H' ' 653' ' ' HOH . . . 127.14 155.51 8.86 Favored Glycine 0 C--O 1.253 1.309 0 O-C-N 124.644 1.215 . . . . 24.41 111.214 179.055 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 189' ' ' ASP . . . . . 0.528 ' OD1' ' N ' ' H' ' 190' ' ' ALA . 48.8 t0 -157.77 -177.99 6.98 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 125.919 2.771 . . . . 22.53 112.394 179.706 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 190' ' ' ALA . . . . . 0.612 ' CB ' ' O ' ' H' ' 574' ' ' HOH . . . -100.87 156.05 17.6 Favored 'General case' 0 C--O 1.253 1.237 0 N-CA-C 102.082 -3.303 . . . . 21.77 102.082 173.967 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 191' ' ' CYS . . . . . . . . . . . . . 5.3 t -145.75 176.94 9.27 Favored 'General case' 0 C--N 1.297 -1.684 0 O-C-N 126.211 2.194 . . . . 22.97 108.205 -178.257 -158.238 49.415 87.44 103.737 2.024 104.947 -169.812 -49.794 1 1 . 1 . 001 ecloud orig full ' H' H ' 192' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -59.63 127.78 33.69 Favored 'General case' 0 C--N 1.316 -0.853 0 O-C-N 125.174 1.546 . . . . 24.08 110.608 -179.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 193' ' ' GLY . . . . . . . . . . . . . . . 110.95 -16.55 27.9 Favored Glycine 0 C--O 1.248 1.008 0 O-C-N 125.368 1.667 . . . . 20.53 110.675 179.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 194' ' ' ASP . . . . . 0.41 ' CB ' ' O ' ' H' ' 574' ' ' HOH . 98.8 m-20 -87.77 -6.09 58.33 Favored 'General case' 0 C--O 1.255 1.383 0 N-CA-C 113.933 1.086 . . . . 19.2 113.933 -177.542 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 195' ' ' SER . . . . . 0.501 ' O ' ' N ' ' H' ' 43' ' ' GLY . 56.0 m -64.44 148.86 49.62 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 124.054 0.847 . . . . 18.65 111.647 -175.258 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 196' ' ' GLY . . . . . . . . . . . . . . . 86.78 -5.89 84.0 Favored Glycine 0 CA--C 1.545 1.95 0 O-C-N 128.058 3.349 . . . . 15.35 105.453 179.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 197' ' ' GLY . . . . . 0.433 ' O ' ' N ' ' H' ' 213' ' ' VAL . . . -74.94 140.54 26.87 Favored Glycine 0 N--CA 1.433 -1.525 0 O-C-N 127.521 2.542 . . . . 14.87 111.806 179.573 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 198' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -80.07 149.31 19.85 Favored 'Trans proline' 0 CA--C 1.501 -1.14 0 N-CA-C 118.922 2.624 . . . . 14.51 118.922 -174.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 199' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -120.54 93.53 4.07 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 105.94 -1.874 . . . . 13.89 105.94 175.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 200' ' ' VAL . . . . . . . . . . . . . 10.2 m -97.34 169.1 1.51 Allowed 'Isoleucine or valine' 0 C--O 1.241 0.624 0 CA-C-O 124.149 1.928 . . . . 14.55 114.42 -178.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 201' ' ' MET . . . . . . . . . . . . . 47.1 mtp -150.98 156.64 41.58 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 112.681 -2.054 . . . . 14.2 106.675 177.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 202' ' ' LYS . . . . . . . . . . . . . 30.2 tttt -109.05 125.44 52.1 Favored 'General case' 0 C--N 1.313 -1.009 0 O-C-N 126.026 2.079 . . . . 15.84 107.871 -179.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 203' ' ' SER . . . . . 0.566 ' CB ' ' ND2' ' H' ' 204' B ASN . 47.8 t -72.01 126.29 91.32 Favored Pre-proline 0 C--O 1.259 1.575 0 O-C-N 127.856 3.223 . . . . 15.85 107.608 178.598 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 204' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_exo -78.03 1.45 8.9 Favored 'Trans proline' 0 C--N 1.317 -1.128 0 C-N-CA 121.958 1.772 . . . . 15.75 108.821 179.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 204' A PHE . . . . . . . . . . . . . 3.8 m-85 -100.41 -47.6 4.85 Favored 'General case' 0 C--N 1.309 -1.183 0 O-C-N 125.403 1.69 . . . . 15.8 112.986 -175.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 204' B ASN . . . . . 0.566 ' ND2' ' CB ' ' H' ' 203' ' ' SER . 0.0 OUTLIER -123.59 6.16 8.89 Favored 'General case' 0 C--N 1.307 -1.273 0 C-N-CA 124.622 1.169 . . . . 15.11 112.889 -178.84 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 205' ' ' ASN . . . . . . . . . . . . . 17.7 m120 53.95 27.07 6.9 Favored 'General case' 0 C--O 1.255 1.371 0 C-N-CA 125.033 1.333 . . . . 18.91 113.951 179.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 206' ' ' ARG . . . . . 0.402 ' NH2' ' O ' ' L' ' 1' B ALA . 73.8 mtt-85 -98.08 157.74 15.95 Favored 'General case' 0 N--CA 1.499 2.014 0 N-CA-C 105.862 -1.903 . . . . 18.21 105.862 -179.497 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 207' ' ' TRP . . . . . . . . . . . . . 88.2 m95 -101.61 136.2 41.86 Favored 'General case' 0 C--N 1.31 -1.146 0 O-C-N 127.762 3.164 . . . . 14.97 105.897 178.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 208' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -126.01 135.36 51.71 Favored 'General case' 0 C--N 1.312 -1.032 0 O-C-N 126.967 2.667 . . . . 15.79 109.422 -178.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 209' ' ' GLN . . . . . 0.462 ' NE2' ' O ' ' H' ' 211' ' ' GLY . 43.9 tt0 -84.63 116.86 23.41 Favored 'General case' 0 C--N 1.305 -1.351 0 O-C-N 125.976 2.048 . . . . 12.65 106.602 172.608 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 210' ' ' MET . . . . . . . . . . . . . 61.8 mmm -97.1 -30.22 13.16 Favored 'General case' 0 N--CA 1.433 -1.325 0 C-N-CA 127.314 2.245 . . . . 14.4 114.003 -179.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 211' ' ' GLY . . . . . 0.462 ' O ' ' NE2' ' H' ' 209' ' ' GLN . . . -140.9 172.34 23.71 Favored Glycine 0 C--N 1.315 -0.603 0 C-N-CA 123.878 0.751 . . . . 11.9 113.447 -177.027 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 212' ' ' ILE . . . . . . . . . . . . . 78.7 mt -133.6 129.03 55.25 Favored 'Isoleucine or valine' 0 C--O 1.246 0.908 0 N-CA-C 104.938 -2.245 . . . . 11.4 104.938 176.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 213' ' ' VAL . . . . . 0.433 ' N ' ' O ' ' H' ' 197' ' ' GLY . 69.3 t -55.64 114.56 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 O-C-N 128.228 3.455 . . . . 11.61 106.236 178.916 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 214' ' ' SER . . . . . . . . . . . . 0.281 22.9 t -107.71 -66.72 1.01 Allowed 'General case' 0 C--O 1.249 1.073 0 CA-C-N 114.228 -1.351 . . . . 12.85 114.588 -177.444 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 215' ' ' TRP . . . . . . . . . . . . . 68.4 p-90 -159.39 173.53 16.11 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 126.536 2.397 . . . . 14.47 113.352 -176.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 216' ' ' GLY . . . . . . . . . . . . . . . 173.64 149.67 7.09 Favored Glycine 0 N--CA 1.491 2.351 0 CA-C-N 110.798 -2.91 . . . . 18.92 106.687 179.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 217' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -98.59 92.48 5.64 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 127.236 2.374 . . . . 22.34 107.55 -178.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 219' ' ' GLY . . . . . . . . . . . . . . . 76.63 153.86 5.32 Favored Glycine 0 N--CA 1.478 1.476 0 CA-C-O 123.777 1.765 . . . . 23.05 110.988 -176.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 220' ' ' CYS . . . . . 0.624 ' O ' ' O ' ' H' ' 221' ' ' ASP . 29.8 m -96.12 134.59 39.0 Favored 'General case' 0 C--O 1.242 0.681 0 C-N-CA 126.368 1.867 . . . . 23.26 113.493 -177.701 -49.794 -169.812 87.44 104.947 2.024 103.737 49.415 -158.238 2 2 . 1 . 001 ecloud orig full ' H' H ' 221' ' ' ASP . . . . . 0.624 ' O ' ' O ' ' H' ' 220' ' ' CYS . 24.3 t0 35.82 97.54 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 106.052 -1.832 . . . . 23.69 106.052 -179.211 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 221' A ARG . . . . . 0.462 ' NH2' ' OE2' ' H' ' 146' ' ' GLU . 12.2 mtt85 -146.49 138.11 24.61 Favored 'General case' 0 C--O 1.242 0.67 0 CA-C-N 112.451 -2.158 . . . . 24.25 106.382 -179.745 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 222' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.43 140.77 54.12 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 125.276 1.61 . . . . 24.65 107.966 -178.715 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 223' ' ' GLY . . . . . . . . . . . . . . . 70.39 12.11 69.01 Favored Glycine 0 C--O 1.261 1.785 0 C-N-CA 124.827 1.203 . . . . 22.86 112.712 179.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 224' ' ' LYS . . . . . . . . . . . . . 2.8 mmtp -122.73 165.23 16.89 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 117.878 -1.058 . . . . 21.58 108.392 178.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 225' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -146.75 175.6 10.5 Favored 'General case' 0 C--O 1.243 0.717 0 O-C-N 125.076 1.485 . . . . 18.21 112.044 -178.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 226' ' ' GLY . . . . . . . . . . . . . . . -102.88 147.39 16.94 Favored Glycine 0 N--CA 1.477 1.379 0 N-CA-C 106.781 -2.527 . . . . 16.04 106.781 179.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 227' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -118.12 138.23 52.41 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 126.576 1.986 . . . . 13.47 109.71 -179.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 228' ' ' TYR . . . . . . . . . . . . . 38.7 m-85 -132.33 140.44 48.55 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 125.304 1.627 . . . . 15.61 110.797 -177.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 229' ' ' THR . . . . . . . . . . . . . 20.4 m -60.66 129.64 42.53 Favored 'General case' 0 C--O 1.255 1.367 0 N-CA-C 107.678 -1.23 . . . . 13.6 107.678 175.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 230' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -86.1 99.85 11.77 Favored 'General case' 0 N--CA 1.504 2.246 0 CA-C-O 123.476 1.608 . . . . 15.04 107.065 179.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 231' ' ' VAL . . . . . . . . . . . . 0.283 3.9 t -65.11 -33.51 64.24 Favored 'Isoleucine or valine' 0 C--O 1.264 1.823 0 N-CA-C 118.891 2.923 . . . . 15.48 118.891 -173.628 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 232' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -65.38 -43.34 91.0 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 106.688 -1.597 . . . . 17.67 106.688 178.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 233' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 -61.13 -29.76 69.97 Favored 'General case' 0 C--O 1.247 0.972 0 CA-C-N 114.43 -1.259 . . . . 19.68 114.343 -179.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 234' ' ' LEU . . . . . . . . . . . . . 13.4 mt -103.47 11.47 36.36 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 107.645 -1.243 . . . . 19.72 107.645 179.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 235' ' ' LYS . . . . . . . . . . . . . 33.9 tttt -56.58 -53.35 58.63 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 112.768 -2.014 . . . . 22.21 108.67 -174.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 236' ' ' LYS . . . . . 0.543 ' CD ' ' OE1' ' H' ' 239' ' ' GLN 0.42 0.0 OUTLIER -55.89 -20.35 15.44 Favored 'General case' 0 CA--C 1.483 -1.609 0 N-CA-C 117.054 2.242 . . . . 23.09 117.054 -176.374 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' H' H ' 237' ' ' TRP . . . . . . . . . . . . . 39.3 t90 -80.25 -41.12 25.65 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 106.459 -1.682 . . . . 24.95 106.459 176.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 238' ' ' ILE . . . . . . . . . . . . . 45.0 mt -51.67 -61.83 0.66 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.517 0 O-C-N 126.864 2.602 . . . . 26.08 110.767 -179.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 239' ' ' GLN . . . . . 0.543 ' OE1' ' CD ' ' H' ' 236' ' ' LYS . 70.5 mt-30 -50.42 -49.04 55.88 Favored 'General case' 0 N--CA 1.481 1.088 0 O-C-N 124.555 1.16 . . . . 28.88 110.674 179.479 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 240' ' ' LYS . . . . . . . . . . . . . 10.2 tmtt? -43.8 -68.32 0.21 Allowed 'General case' 0 C--O 1.254 1.333 0 CA-C-N 115.637 -0.711 . . . . 31.62 111.365 -179.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 241' ' ' VAL . . . . . 0.471 ' O ' ' CD2' ' H' ' 245' ' ' PHE . 0.2 OUTLIER -59.87 -16.96 12.47 Favored 'Isoleucine or valine' 0 C--O 1.256 1.427 0 C-N-CA 123.911 0.884 . . . . 29.32 112.857 -178.883 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 242' ' ' ILE . . . . . . . . . . . . . 4.2 mt -88.29 -28.85 5.37 Favored 'Isoleucine or valine' 0 C--O 1.247 0.961 0 CA-C-N 115.282 -0.872 . . . . 30.23 110.414 -179.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 243' ' ' ASP . . . . . . . . . . . . . 50.1 m-20 -86.71 -21.59 26.53 Favored 'General case' 0 C--O 1.248 1.026 0 CA-C-N 115.558 -0.746 . . . . 31.71 110.925 -179.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 244' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -84.15 -38.7 20.34 Favored 'General case' 0 C--O 1.244 0.775 0 CA-C-O 122.502 1.144 . . . . 32.54 110.428 -178.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 245' ' ' PHE . . . . . 0.471 ' CD2' ' O ' ' H' ' 241' ' ' VAL . 1.9 m-85 . . . . . 0 N--CA 1.49 1.539 0 CA-C-N 114.321 -1.308 . . . . 31.82 109.934 -176.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.025 0 N-CA-C 106.359 -2.696 . . . . 35.42 106.359 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 55' ' ' ASP . . . . . 0.571 ' OD2' ' NH2' ' H' ' 73' ' ' ARG . 21.1 t0 -86.73 -8.2 57.6 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 103.079 -2.934 . . . . 35.09 103.079 174.902 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' I' I ' 56' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -95.71 151.14 19.63 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 109.859 -3.337 . . . . 34.33 110.71 -176.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 57' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -90.39 127.46 36.2 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 112.782 -2.008 . . . . 33.8 109.656 -179.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 58' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -45.08 143.46 1.56 Allowed 'General case' 0 C--O 1.249 1.027 0 O-C-N 125.78 1.925 . . . . 36.18 109.847 179.978 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' I' I ' 59' ' ' ILE . . . . . 0.509 ' O ' ' C ' ' I' ' 60' ' ' PRO . 36.7 pt -108.2 141.34 22.98 Favored Pre-proline 0 C--O 1.246 0.918 0 O-C-N 125.361 1.663 . . . . 35.77 107.34 178.069 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' I' I ' 60' ' ' PRO . . . . . 0.509 ' C ' ' O ' ' I' ' 59' ' ' ILE . 97.3 Cg_exo . . . . . 0 C--O 1.252 1.201 0 O-C-N 126.27 2.721 . . . . 35.74 109.23 -179.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 400' ' ' DI4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 541' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 556' ' ' HOH . . . . . 0.709 ' O ' ' NZ ' ' L' ' 10' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 591' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 593' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 595' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 596' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 602' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 636' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 649' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 650' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 651' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 501' ' ' HOH . . . . . 0.565 ' O ' ' NH1' ' H' ' 165' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 529' ' ' HOH . . . . . 0.56 ' O ' ' NE ' ' H' ' 165' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 537' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 538' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 544' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 548' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 549' ' ' HOH . . . . . 0.597 ' O ' ' OD1' ' H' ' 186' A ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 551' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 552' ' ' HOH . . . . . 0.485 ' O ' ' OD2' ' H' ' 100' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 553' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 554' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 555' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 557' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 559' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 561' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 562' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 568' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 569' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 570' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 571' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 572' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 574' ' ' HOH . . . . . 0.612 ' O ' ' CB ' ' H' ' 190' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 575' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 576' ' ' HOH . . . . . 0.567 ' O ' ' NH1' ' H' ' 75' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 577' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 578' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 579' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 580' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 581' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 582' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 583' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 584' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 586' ' ' HOH . . . . . 0.906 ' O ' ' N ' ' H' ' 16' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 587' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 588' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 589' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 590' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 594' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 599' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 600' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 601' ' ' HOH . . . . . 0.475 ' O ' ' OG1' ' H' ' 74' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 603' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 605' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 609' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 611' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 614' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 615' ' ' HOH . . . . . 0.687 ' O ' ' O ' ' H' ' 96' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 616' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 617' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 620' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 621' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 623' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 624' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 625' ' ' HOH . . . . . 0.64 ' O ' ' O ' ' H' ' 129' B SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 626' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 628' ' ' HOH . . . . . 0.779 ' O ' ' O ' ' H' ' 47' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 630' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 631' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 632' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 635' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 638' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 640' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 641' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 643' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 644' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 647' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 648' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 652' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 653' ' ' HOH . . . . . 0.778 ' O ' ' O ' ' H' ' 188' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 654' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 1' B ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.152 0 N-CA-C 109.532 -0.544 . . . . 20.02 109.532 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 1' A ASP . . . . . . . . . . . . . 8.3 t70 -111.58 4.3 18.61 Favored 'General case' 0 C--O 1.255 1.348 0 O-C-N 124.982 1.426 . . . . 21.210000000000001 113.99 -179.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 1' ' ' CYS . . . . . . . . . . . . . 30.3 p -49.09 159.1 0.3 Allowed 'General case' 0 C--N 1.318 -0.775 0 O-C-N 123.98 0.8 . . . . 17.579999999999998 109.572 179.494 63.237 78.74 91.846 105.519 2.015 106.083 -54.971 -58.046 1 1 . 1 . 001 ecloud build full ' L' L ' 2' ' ' GLY . . . . . . . . . . . . . . . 59.52 12.71 20.1 Favored Glycine 0 C--O 1.257 1.542 0 N-CA-C 118.692 2.237 . . . . 15.359999999999999 118.692 176.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 3' ' ' LEU . . . . . . . . . . . . . 73.5 mt -119.64 96.77 5.33 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 107.734 -1.21 . . . . 14.91 107.734 179.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 4' ' ' ARG . . . . . 0.698 ' NH1' ' OD2' ' L' ' 14' ' ' ASP . 80.1 mtm180 -61.87 125.29 84.67 Favored Pre-proline 0 C--N 1.305 -1.359 0 O-C-N 126.943 2.652 . . . . 14.85 111.175 179.464 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 5' ' ' PRO . . . . . 0.664 ' HA ' ' HG3' ' L' ' 9' ' ' LYS . 77.3 Cg_exo -49.89 -55.47 4.08 Favored 'Trans proline' 0 C--N 1.312 -1.368 0 O-C-N 125.037 2.072 . . . . 14.9 111.255 178.849 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 6' ' ' LEU . . . . . . . . . . . . . 58.4 mt -78.14 2.2 18.82 Favored 'General case' 0 C--O 1.25 1.086 0 N-CA-C 116.241 1.941 . . . . 15.640000000000001 116.241 -178.01 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 7' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -128.41 -90.57 0.5 Allowed 'General case' 0 N--CA 1.482 1.154 0 O-C-N 124.953 1.408 . . . . 16.260000000000002 113.629 179.843 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 8' ' ' GLU . . . . . . . . . . . . . 21.7 mp0 -49.37 -43.59 44.21 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 115.849 -0.614 . . . . 16.98 111.579 -178.11 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 9' ' ' LYS . . . . . 0.664 ' HG3' ' HA ' ' L' ' 5' ' ' PRO . 34.1 mmtp -60.49 -39.82 89.07 Favored 'General case' 0 C--O 1.247 0.943 0 C-N-CA 125.482 1.513 . . . . 20.760000000000002 112.665 178.726 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 10' ' ' LYS . . . . . . . . . . . . . 68.4 mttt -89.82 -2.93 58.33 Favored 'General case' 0 C--O 1.257 1.449 0 C-N-CA 125.836 1.654 . . . . 21.32 112.93 -178.91 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 11' ' ' SER . . . . . . . . . . . . . 34.2 t 64.4 20.89 12.33 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-O 123.088 1.423 . . . . 17.23 110.337 -179.186 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 12' ' ' LEU . . . . . . . . . . . . . 90.2 mt -89.51 134.76 33.96 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 106.271 -1.752 . . . . 17.649999999999999 106.271 173.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 13' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -97.41 153.27 18.21 Favored 'General case' 0 C--N 1.31 -1.122 0 N-CA-C 106.909 -1.515 . . . . 22.75 106.909 175.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 14' ' ' ASP . . . . . 0.698 ' OD2' ' NH1' ' L' ' 4' ' ' ARG 0.35 2.9 p30 -92.73 164.85 13.22 Favored 'General case' 0 C--N 1.317 -0.823 0 O-C-N 126.403 2.314 . . . . 18.640000000000001 106.576 177.998 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' L' L ' 14' A LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.41 -24.35 67.35 Favored 'General case' 0 C--O 1.26 1.627 0 N-CA-C 117.405 2.372 . . . . 23.539999999999999 117.405 -174.0 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' B THR . . . . . . . . . . . . . 27.2 p -125.11 -9.02 7.09 Favored 'General case' 0 C--O 1.266 1.955 0 CA-C-N 120.909 1.686 . . . . 19.41 114.838 -179.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 14' C GLU . . . . . . . . . . . . . 4.9 pt-20 -48.93 -43.26 39.37 Favored 'General case' 0 C--O 1.263 1.814 0 CA-C-N 118.579 0.627 . . . . 19.550000000000001 112.317 -178.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 14' D ARG . . . . . 0.981 ' O ' ' HG3' ' L' ' 14' H GLU . 5.2 ttp180 -51.83 -23.5 4.85 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.37 -0.832 . . . . 22.199999999999999 110.175 -178.043 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' E GLU . . . . . . . . . . . . . 6.0 tt0 -67.85 -33.87 75.61 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 122.882 1.325 . . . . 20.050000000000001 110.605 -178.564 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 14' F LEU . . . . . 0.403 ' O ' ' N ' ' L' ' 14' I SER . 1.0 OUTLIER -68.25 -71.06 0.23 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 113.862 -1.517 . . . . 20.109999999999999 108.472 178.747 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' L' L ' 14' G LEU . . . . . 0.54 ' HA ' ' CD2' ' L' ' 14' J TYR . 1.6 mm? -43.58 -24.79 0.13 Allowed 'General case' 0 C--O 1.25 1.125 0 C-N-CA 126.842 2.057 . . . . 20.010000000000002 113.261 -176.811 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' H GLU . . . . . 0.981 ' HG3' ' O ' ' L' ' 14' D ARG . 44.3 mt-10 -85.02 -30.76 23.89 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-N 114.504 -1.225 . . . . 22.23 110.322 -177.697 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' I SER . . . . . 0.403 ' N ' ' O ' ' L' ' 14' F LEU . 75.2 p -75.42 -23.25 56.97 Favored 'General case' 0 C--O 1.247 0.926 0 O-C-N 126.225 2.203 . . . . 20.350000000000001 110.694 -179.289 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' J TYR . . . . . 0.54 ' CD2' ' HA ' ' L' ' 14' G LEU . 16.0 m-85 . . . . . 0 N--CA 1.473 0.718 0 O-C-N 125.838 1.961 . . . . 20.600000000000001 110.442 -179.891 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 16' ' ' ILE . . . . . 0.906 ' N ' ' O ' ' H' ' 586' ' ' HOH . 24.6 mm . . . . . 0 C--O 1.241 0.625 0 N-CA-C 107.976 -1.12 . . . . 21.0 107.976 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 17' ' ' VAL . . . . . . . . . . . . . 69.4 t -115.77 132.68 64.5 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.309 0 C-N-CA 126.511 1.924 . . . . 21.960000000000001 108.591 179.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 18' ' ' GLU . . . . . 0.572 ' HG3' ' HG3' ' H' ' 187' ' ' ARG . 17.9 mm-40 60.55 26.31 15.97 Favored 'General case' 0 C--N 1.32 -0.71 0 O-C-N 126.146 2.154 . . . . 23.670000000000002 109.015 -178.88 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 19' ' ' GLY . . . . . . . . . . . . . . . -87.26 -152.95 23.79 Favored Glycine 0 C--O 1.249 1.084 0 CA-C-N 112.834 -1.985 . . . . 21.829999999999998 110.216 177.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 20' ' ' SER . . . . . . . . . . . . . 5.1 m -165.35 141.38 5.38 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 114.002 -1.099 . . . . 23.32 110.635 -178.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 21' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -41.54 143.76 0.44 Allowed 'General case' 0 N--CA 1.476 0.849 0 O-C-N 126.114 2.133 . . . . 23.18 106.064 177.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 22' ' ' ALA . . . . . 0.576 ' O ' ' HE1' ' H' ' 71' ' ' HIS . . . -91.79 136.88 32.81 Favored 'General case' 0 C--O 1.251 1.138 0 O-C-N 125.978 2.049 . . . . 21.039999999999999 110.634 178.241 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 23' ' ' GLU . . . . . 0.453 ' OE2' ' HB2' ' L' ' 14' ' ' ASP . 47.5 mt-10 -62.23 154.15 28.38 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 124.987 1.429 . . . . 20.66 107.581 175.704 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 24' ' ' ILE . . . . . 0.511 HG12 ' O ' ' H' ' 522' ' ' HOH . 21.1 mm -60.63 145.95 11.72 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 N-CA-C 107.515 -1.291 . . . . 18.859999999999999 107.515 179.347 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 25' ' ' GLY . . . . . . . . . . . . . . . 48.32 41.33 23.9 Favored Glycine 0 C--O 1.257 1.535 0 C-N-CA 125.609 1.576 . . . . 17.780000000000001 114.021 -179.052 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 26' ' ' MET . . . . . 0.402 ' HB2' ' O ' ' H' ' 23' ' ' GLU . 5.8 ttt -88.29 -25.77 22.64 Favored 'General case' 0 C--O 1.253 1.254 0 C-N-CA 124.153 0.981 . . . . 16.16 112.263 -178.712 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 27' ' ' SER . . . . . . . . . . . . . 3.6 m -145.57 71.49 14.08 Favored Pre-proline 0 C--N 1.312 -1.04 0 O-C-N 124.734 1.271 . . . . 15.98 108.434 -179.444 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 28' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -66.67 4.69 0.97 Allowed 'Trans proline' 0 C--N 1.316 -1.134 0 O-C-N 126.369 2.773 . . . . 15.1 113.615 -176.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 29' ' ' TRP . . . . . 0.494 ' O ' HG23 ' H' ' 31' ' ' VAL . 6.2 p90 -106.72 -24.03 12.23 Favored 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 125.888 1.675 . . . . 16.050000000000001 112.75 -177.869 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 30' ' ' GLN . . . . . . . . . . . . . 56.7 tp60 -53.71 135.92 40.39 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 105.732 -1.951 . . . . 17.670000000000002 105.732 174.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 31' ' ' VAL . . . . . 0.631 HG22 HG23 ' H' ' 68' ' ' ILE . 40.0 t -134.6 148.22 29.58 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.282 0 N-CA-C 107.017 -1.475 . . . . 18.719999999999999 107.017 -178.337 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 32' ' ' MET . . . . . . . . . . . . . 54.8 ttm -106.67 128.82 54.49 Favored 'General case' 0 C--N 1.305 -1.337 0 O-C-N 124.994 1.434 . . . . 21.989999999999998 108.938 178.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 33' ' ' LEU . . . . . . . . . . . . . 7.8 mt -90.7 115.39 27.76 Favored 'General case' 0 N--CA 1.488 1.467 0 N-CA-C 104.026 -2.583 . . . . 23.41 104.026 172.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 34' ' ' PHE . . . . . . . . . . . . . 78.6 t80 -127.14 129.62 48.24 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 126.981 2.676 . . . . 26.100000000000001 109.773 -176.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 35' ' ' ARG . . . . . 0.672 ' HB3' HD11 ' H' ' 41' ' ' LEU 0.303 10.0 ptt180 -90.83 152.83 20.61 Favored 'General case' 0 C--O 1.243 0.747 0 O-C-N 124.363 1.04 . . . . 31.010000000000002 111.723 178.801 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 36' ' ' LYS . . . . . 0.523 ' O ' ' N ' ' H' ' 38' ' ' GLN . 84.0 mttt -72.56 -82.88 0.04 OUTLIER 'General case' 0 C--O 1.247 0.971 0 CA-C-N 113.415 -1.72 . . . . 30.5 109.926 -178.425 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 36' A SER . . . . . 0.445 ' HA ' ' HA ' ' H' ' 37' ' ' PRO . 2.8 m -105.06 104.51 47.32 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 114.355 -1.293 . . . . 31.989999999999998 110.649 -179.581 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 37' ' ' PRO . . . . . 0.626 ' O ' ' HG3' ' H' ' 35' ' ' ARG . 91.9 Cg_endo -91.07 149.7 18.68 Favored 'Cis proline' 0 C--O 1.247 0.959 0 C-N-CA 125.128 -0.78 . . . . 32.149999999999999 110.909 0.95 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 38' ' ' GLN . . . . . 0.523 ' N ' ' O ' ' H' ' 36' ' ' LYS . 5.0 mt-30 -62.7 107.04 0.88 Allowed 'General case' 0 C--O 1.244 0.8 0 CA-C-N 114.749 -1.114 . . . . 34.390000000000001 111.248 178.984 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 39' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -164.26 172.26 13.82 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 126.103 2.127 . . . . 31.170000000000002 111.406 178.379 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 40' ' ' LEU . . . . . . . . . . . . . 6.2 tt -88.96 128.86 35.7 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 122.513 1.149 . . . . 27.800000000000001 110.059 -176.657 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 41' ' ' LEU . . . . . 0.672 HD11 ' HB3' ' H' ' 35' ' ' ARG . 41.7 mt -100.81 -48.49 4.46 Favored 'General case' 0 C--O 1.251 1.154 0 CA-C-N 113.13 -1.85 . . . . 24.530000000000001 111.964 -178.604 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 42' ' ' CYS . . . . . . . . . . . . . 1.5 m -166.95 -174.36 2.67 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 124.078 1.894 . . . . 21.140000000000001 113.544 -175.264 -92.054 -159.882 -82.976 101.433 2.076 100.421 -88.737 -69.482 1 1 . 1 . 001 ecloud build full ' H' H ' 43' ' ' GLY . . . . . . . . . . . . . . . -105.45 164.56 14.06 Favored Glycine 0 N--CA 1.489 2.182 0 N-CA-C 104.38 -3.488 . . . . 18.989999999999998 104.38 174.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 44' ' ' ALA . . . . . . . . . . . . . . . -156.57 -176.8 6.17 Favored 'General case' 0 C--O 1.264 1.853 0 N-CA-C 107.286 -1.376 . . . . 17.640000000000001 107.286 179.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 45' ' ' SER . . . . . . . . . . . . 0.419 9.7 p -145.71 147.0 31.48 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 123.127 1.441 . . . . 16.739999999999998 113.027 179.258 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 46' ' ' LEU . . . . . 0.674 ' O ' HG12 ' H' ' 121' ' ' VAL . 0.2 OUTLIER -94.36 126.89 39.89 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 104.441 -2.429 . . . . 16.800000000000001 104.441 179.403 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 47' ' ' ILE . . . . . 0.779 ' O ' ' O ' ' H' ' 628' ' ' HOH . 3.1 pt -117.9 -29.55 1.95 Allowed 'Isoleucine or valine' 0 C--O 1.25 1.129 0 C-N-CA 124.094 0.958 . . . . 18.359999999999999 109.872 -179.91 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 48' ' ' SER . . . . . 0.537 ' O ' HD22 ' H' ' 46' ' ' LEU . 0.3 OUTLIER -145.43 -173.24 4.06 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 105.854 -1.906 . . . . 19.93 105.854 175.578 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 49' ' ' ASP . . . . . . . . . . . . . 19.2 p-10 -75.77 -14.78 60.32 Favored 'General case' 0 C--O 1.267 2.026 0 O-C-N 126.716 2.51 . . . . 22.670000000000002 114.966 -178.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 50' ' ' ARG . . . . . 0.588 ' HA ' HD12 ' H' ' 108' ' ' LEU . 23.6 mtp180 -130.52 -5.32 4.2 Favored 'General case' 0 C--O 1.251 1.134 0 CA-C-O 116.662 -1.637 . . . . 26.149999999999999 113.431 -179.064 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 51' ' ' TRP . . . . . . . . . . . . . 93.8 m95 -113.48 141.39 47.18 Favored 'General case' 0 C--N 1.316 -0.884 0 O-C-N 126.051 2.094 . . . . 22.84 112.639 -176.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 52' ' ' VAL . . . . . . . . . . . . . 69.2 t -132.2 132.3 60.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.103 -0.953 . . . . 18.93 111.723 177.344 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 53' ' ' LEU . . . . . 0.681 HD11 HD11 ' H' ' 103' ' ' ILE . 20.6 tp -93.64 153.14 18.54 Favored 'General case' 0 C--N 1.31 -1.134 0 C-N-CA 125.579 1.552 . . . . 17.32 109.775 176.981 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 54' ' ' THR . . . . . . . . . . . . . 7.2 t -176.11 173.11 2.26 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 125.101 1.501 . . . . 16.719999999999999 110.51 178.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 55' ' ' ALA . . . . . 0.47 ' H ' ' HA2' ' H' ' 196' ' ' GLY . . . -73.87 136.38 43.41 Favored 'General case' 0 C--O 1.247 0.968 0 N-CA-C 107.615 -1.254 . . . . 15.529999999999999 107.615 175.98 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 56' ' ' ALA . . . . . 0.447 ' N ' ' OD1' ' H' ' 102' ' ' ASP . . . -67.02 -26.18 66.65 Favored 'General case' 0 N--CA 1.481 1.089 0 O-C-N 124.998 1.436 . . . . 15.609999999999999 110.093 -178.936 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 57' ' ' HIS . . . . . . . . . . . . . 11.2 p-80 -71.83 -12.35 61.24 Favored 'General case' 0 C--O 1.251 1.146 0 O-C-N 124.647 1.217 . . . . 17.73 111.76 -178.492 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 58' ' ' CYS . . . . . . . . . . . . . 99.6 m -72.25 -20.33 61.56 Favored 'General case' 0 C--O 1.25 1.095 0 O-C-N 124.388 1.055 . . . . 18.309999999999999 108.942 177.804 -69.482 -88.737 -82.976 100.421 2.076 101.433 -159.882 -92.054 1 1 . 1 . 001 ecloud build full ' H' H ' 59' ' ' LEU . . . . . . . . . . . . . 67.7 mt -116.85 -27.9 6.47 Favored 'General case' 0 C--O 1.25 1.085 0 N-CA-C 115.497 1.665 . . . . 18.899999999999999 115.497 -175.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' ' ' LEU . . . . . . . . . . . . . 13.2 tp -140.26 111.94 7.41 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-O 122.908 1.337 . . . . 18.559999999999999 112.864 -177.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' A TYR . . . . . . . . . . . . . 4.1 t80 -152.61 81.05 5.49 Favored Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 113.217 -1.81 . . . . 18.289999999999999 106.727 175.962 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' B PRO . . . . . 0.575 ' N ' ' CD ' ' H' ' 60' C PRO . 93.9 Cg_exo -49.89 -36.17 42.46 Favored 'Trans proline' 0 C--O 1.256 1.378 0 C-N-CA 122.782 2.321 . . . . 18.420000000000002 113.318 -178.585 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 60' C PRO . . . . . 0.575 ' CD ' ' N ' ' H' ' 60' B PRO . 57.7 Cg_exo -58.16 -22.09 54.71 Favored 'Trans proline' 0 C--O 1.255 1.341 0 O-C-N 124.386 1.73 . . . . 18.530000000000001 114.218 -178.353 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 60' D TRP . . . . . . . . . . . . . 41.7 m0 -122.45 16.99 10.51 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 107.336 -1.357 . . . . 20.239999999999998 107.336 -177.216 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' E ASP . . . . . . . . . . . . . 2.8 m-20 55.41 38.48 30.35 Favored 'General case' 0 C--O 1.244 0.764 0 O-C-N 125.291 1.62 . . . . 23.27 111.479 176.749 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' F LYS . . . . . . . . . . . . . 37.7 ttmt -95.46 113.87 25.57 Favored 'General case' 0 C--N 1.315 -0.916 0 O-C-N 125.321 1.638 . . . . 22.27 109.558 176.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' G ASN . . . . . . . . . . . . . 44.6 t30 -148.07 73.95 1.28 Allowed 'General case' 0 C--O 1.255 1.37 0 O-C-N 124.459 1.099 . . . . 26.48 111.352 178.398 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' H PHE . . . . . . . . . . . . . 59.1 m-85 -78.51 146.98 34.05 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 124.441 1.088 . . . . 24.440000000000001 111.499 -178.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' I THR . . . . . 0.575 ' O ' ' N ' ' H' ' 63' ' ' ASP . 26.5 p -136.07 139.45 43.05 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 113.347 -1.752 . . . . 25.550000000000001 110.13 177.948 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 61' ' ' GLU . . . . . 0.636 ' OE1' ' HA ' ' H' ' 87' ' ' LYS . 1.9 pm0 -22.54 -40.21 0.0 OUTLIER 'General case' 0 C--O 1.255 1.346 0 C-N-CA 126.799 2.04 . . . . 25.989999999999998 114.788 -177.91 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 62' ' ' ASN . . . . . 0.508 ' N ' ' O ' ' H' ' 60' I THR . 7.3 m-20 -77.55 5.95 8.07 Favored 'General case' 0 C--O 1.248 0.977 0 O-C-N 125.889 1.993 . . . . 27.789999999999999 111.781 -179.017 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 63' ' ' ASP . . . . . 0.575 ' N ' ' O ' ' H' ' 60' I THR . 45.5 m-20 -117.57 -8.16 10.99 Favored 'General case' 0 C--N 1.308 -1.228 0 C-N-CA 124.379 1.071 . . . . 26.190000000000001 109.236 178.824 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 64' ' ' LEU . . . . . 0.62 ' HB2' ' CD1' ' H' ' 85' ' ' LEU . 26.8 mt -120.67 156.73 31.11 Favored 'General case' 0 C--N 1.321 -0.645 0 O-C-N 126.341 2.276 . . . . 26.300000000000001 115.279 -175.231 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 65' ' ' LEU . . . . . . . . . . . . 0.282 1.6 tp -141.77 145.74 35.14 Favored 'General case' 0 C--O 1.256 1.425 0 CA-C-N 111.575 -2.557 . . . . 24.989999999999998 105.414 179.577 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 66' ' ' VAL . . . . . 0.631 HG13 HD21 ' H' ' 85' ' ' LEU 0.279 25.6 m -114.26 136.71 49.95 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 125.422 1.701 . . . . 23.739999999999998 108.869 177.049 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 67' ' ' ARG . . . . . . . . . . . . . 47.8 mtp180 -118.49 107.84 14.28 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.448 -1.251 . . . . 25.75 110.596 -179.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 68' ' ' ILE . . . . . 0.631 HG23 HG22 ' H' ' 31' ' ' VAL . 1.8 mt -114.32 137.86 46.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 CA-C-N 114.053 -1.43 . . . . 23.059999999999999 110.866 -176.916 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 69' ' ' GLY . . . . . . . . . . . . . . . 104.29 8.9 37.51 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 125.15 1.357 . . . . 21.620000000000001 112.688 177.053 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 70' ' ' LYS . . . . . 0.482 ' NZ ' ' O ' ' H' ' 75' ' ' ARG . 26.5 mtpp -79.86 138.61 37.23 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 117.322 2.342 . . . . 23.350000000000001 117.322 -175.565 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 71' ' ' HIS . . . . . 0.576 ' HE1' ' O ' ' H' ' 22' ' ' ALA . 77.3 t60 -116.06 -57.19 2.24 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 111.71 -2.495 . . . . 22.609999999999999 105.406 177.573 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 72' ' ' SER . . . . . 0.408 ' O ' ' HE3' ' H' ' 70' ' ' LYS . 48.4 t -75.21 134.03 41.27 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 113.233 -1.803 . . . . 24.989999999999998 109.111 178.557 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 73' ' ' ARG . . . . . 0.553 ' NH2' ' OD2' ' I' ' 55' ' ' ASP . 7.9 ttt-85 -68.68 -61.19 1.92 Allowed 'General case' 0 C--O 1.253 1.255 0 CA-C-N 113.544 -1.662 . . . . 29.309999999999999 112.823 -178.302 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 74' ' ' THR . . . . . 0.499 ' HB ' ' O ' ' I' ' 55' ' ' ASP . 18.9 p -80.46 -31.77 37.31 Favored 'General case' 0 C--O 1.268 2.077 0 N-CA-C 119.621 3.193 . . . . 27.600000000000001 119.621 -174.868 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 75' ' ' ARG . . . . . 0.567 ' NH1' ' O ' ' H' ' 576' ' ' HOH . 3.2 mpt_? -89.57 162.16 15.81 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 117.639 2.459 . . . . 29.449999999999999 117.639 -175.344 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 76' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -88.89 84.81 6.65 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-N 113.351 -1.75 . . . . 27.399999999999999 111.304 178.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 77' ' ' GLU . . . . . 0.722 ' HB3' HG23 ' H' ' 79' ' ' ILE . 23.1 mt-10 -61.67 83.37 0.01 OUTLIER 'General case' 0 C--N 1.307 -1.247 0 CA-C-O 126.5 3.048 . . . . 24.890000000000001 111.154 -177.705 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 77' A ARG . . . . . . . . . . . . 0.45 5.0 ttm180 -33.02 -46.9 0.16 Allowed 'General case' 0 N--CA 1.396 -3.167 2 N-CA-C 124.491 4.997 . . . . 25.710000000000001 124.491 -173.403 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' H' H ' 78' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -123.12 10.77 9.42 Favored 'General case' 0 N--CA 1.481 1.098 0 CA-C-O 117.669 -1.158 . . . . 26.34 109.826 179.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 79' ' ' ILE . . . . . 0.722 HG23 ' HB3' ' H' ' 77' ' ' GLU . 1.2 tt -109.6 -64.45 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 O-C-N 124.879 1.362 . . . . 24.629999999999999 112.893 -176.767 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 80' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -64.28 152.41 41.11 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 125.33 1.452 . . . . 24.890000000000001 112.732 -179.499 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 81' ' ' LYS . . . . . 0.48 ' HE2' HG12 ' H' ' 112' ' ' VAL . 1.6 mmmt -125.44 120.4 30.9 Favored 'General case' 0 C--N 1.315 -0.904 0 C-N-CA 126.396 1.878 . . . . 25.09 111.754 -179.672 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 82' ' ' ILE . . . . . . . . . . . . . 16.7 mt -98.84 137.89 24.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 N-CA-C 106.925 -1.509 . . . . 25.370000000000001 106.925 176.461 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 83' ' ' SER . . . . . . . . . . . . . 2.2 m -143.66 148.43 35.77 Favored 'General case' 0 C--N 1.312 -1.064 0 O-C-N 125.723 1.89 . . . . 26.219999999999999 111.955 -179.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 84' ' ' MET . . . . . . . . . . . . . 68.6 mtm -99.85 149.84 22.98 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 111.865 -2.425 . . . . 28.16 108.161 178.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 85' ' ' LEU . . . . . 0.631 HD21 HG13 ' H' ' 66' ' ' VAL . 7.9 mt -91.22 143.33 26.78 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 112.974 -1.921 . . . . 26.140000000000001 111.16 -178.264 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 86' ' ' GLU . . . . . . . . . . . . . 13.5 tt0 -93.36 -40.84 10.17 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 112.461 -2.154 . . . . 28.149999999999999 107.652 176.108 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 87' ' ' LYS . . . . . 0.7 ' HB2' ' NZ ' ' H' ' 87' ' ' LYS . 0.1 OUTLIER -168.52 147.59 4.35 Favored 'General case' 0 N--CA 1.444 -0.771 0 O-C-N 126.044 2.09 . . . . 26.149999999999999 116.135 178.901 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 88' ' ' ILE . . . . . 0.489 ' N ' ' HG3' ' H' ' 87' ' ' LYS . 69.2 mt -105.63 135.96 41.68 Favored 'Isoleucine or valine' 0 C--O 1.252 1.223 0 CA-C-N 113.569 -1.651 . . . . 22.969999999999999 109.956 177.971 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 89' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -126.38 123.47 38.02 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 107.342 -1.355 . . . . 25.170000000000002 107.342 177.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 90' ' ' ILE . . . . . 0.477 ' O ' ' C ' ' H' ' 91' ' ' HIS . 7.2 mt -112.68 131.24 64.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 O-C-N 125.712 1.882 . . . . 20.489999999999998 109.697 -179.415 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 91' ' ' HIS . . . . . 0.477 ' C ' ' O ' ' H' ' 90' ' ' ILE . 28.0 t-80 -42.44 120.94 2.59 Favored Pre-proline 0 CA--C 1.552 1.03 0 N-CA-C 103.562 -2.755 . . . . 18.489999999999998 103.562 175.654 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 92' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -55.7 -15.69 13.26 Favored 'Trans proline' 0 C--N 1.322 -0.82 0 O-C-N 126.415 2.797 . . . . 17.539999999999999 111.318 177.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 93' ' ' ARG . . . . . . . . . . . . . 77.5 mtp180 -113.63 11.85 18.32 Favored 'General case' 0 C--O 1.252 1.19 0 N-CA-C 115.709 1.744 . . . . 17.82 115.709 -177.146 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 94' ' ' TYR . . . . . . . . . . . . . 4.7 t80 -49.16 121.22 4.63 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 107.182 -1.414 . . . . 15.859999999999999 107.182 175.052 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 95' ' ' ASN . . . . . . . . . . . . . 62.3 t-20 -98.66 73.35 2.04 Favored 'General case' 0 C--N 1.31 -1.137 0 O-C-N 124.65 1.219 . . . . 15.9 112.029 -178.174 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 96' ' ' TRP . . . . . 0.687 ' O ' ' O ' ' H' ' 615' ' ' HOH . 59.0 p-90 -65.9 -24.01 66.75 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 107.973 -1.121 . . . . 17.27 107.973 178.578 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 97' ' ' ARG . . . . . . . . . . . . 0.263 67.8 mtt-85 -59.45 -52.68 64.55 Favored 'General case' 0 C--O 1.264 1.864 0 N-CA-C 117.28 2.326 . . . . 19.18 117.28 -175.612 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 97' A GLU . . . . . 0.446 ' OE1' ' NH1' ' H' ' 175' ' ' ARG . 64.0 tt0 -110.26 -63.95 1.32 Allowed 'General case' 0 C--O 1.264 1.858 0 N-CA-C 117.075 2.25 . . . . 19.789999999999999 117.075 -177.465 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 98' ' ' ASN . . . . . . . . . . . . . 46.8 p-10 -138.02 29.92 2.51 Favored 'General case' 0 C--O 1.256 1.411 0 N-CA-C 117.113 2.264 . . . . 15.800000000000001 117.113 -170.532 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 99' ' ' LEU . . . . . 0.794 HD11 ' H91' ' H' ' 400' ' ' DI4 . 60.3 mt 48.49 40.32 14.82 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 125.836 1.654 . . . . 14.57 111.799 -179.024 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 100' ' ' ASP . . . . . 0.485 ' OD2' ' O ' ' H' ' 552' ' ' HOH . 28.3 t70 -71.74 139.15 48.96 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 104.372 -2.455 . . . . 16.059999999999999 104.372 173.939 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 101' ' ' ARG . . . . . . . . . . . . . 63.0 mtt85 65.04 31.74 10.91 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 125.676 1.86 . . . . 15.94 114.041 -179.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 102' ' ' ASP . . . . . 0.447 ' OD1' ' N ' ' H' ' 56' ' ' ALA . 59.7 t0 -70.92 81.42 0.65 Allowed 'General case' 0 N--CA 1.484 1.272 0 CA-C-N 113.835 -1.53 . . . . 14.92 107.552 178.722 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 103' ' ' ILE . . . . . 0.681 HD11 HD11 ' H' ' 53' ' ' LEU . 18.3 tt -151.39 143.78 16.42 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.072 0 O-C-N 126.228 2.205 . . . . 16.530000000000001 107.244 178.443 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 104' ' ' ALA . . . . . . . . . . . . . . . -148.99 152.59 36.58 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 125.754 1.909 . . . . 17.629999999999999 106.834 178.269 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 105' ' ' LEU . . . . . . . . . . . . . 54.6 mt -123.72 142.32 51.19 Favored 'General case' 0 C--N 1.313 -1.01 0 O-C-N 126.087 2.117 . . . . 19.670000000000002 106.108 177.145 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 106' ' ' MET . . . . . 0.521 ' HE2' HD13 ' H' ' 85' ' ' LEU . 60.6 mtp -126.15 142.87 51.35 Favored 'General case' 0 C--N 1.311 -1.071 0 O-C-N 126.027 2.079 . . . . 23.43 107.475 179.319 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 107' ' ' LYS . . . . . . . . . . . . . 9.9 tptt -112.53 126.44 55.34 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 126.783 2.552 . . . . 27.399999999999999 108.651 -178.162 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 108' ' ' LEU . . . . . 0.588 HD12 ' HA ' ' H' ' 50' ' ' ARG . 23.5 mt -81.01 136.05 35.93 Favored 'General case' 0 C--O 1.247 0.971 0 O-C-N 126.728 2.517 . . . . 24.739999999999998 108.797 178.357 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 109' ' ' LYS . . . . . . . . . . . . . 23.5 ttpt -61.42 -25.69 67.38 Favored 'General case' 0 C--N 1.305 -1.346 0 CA-C-N 113.741 -1.572 . . . . 27.460000000000001 109.242 -178.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 110' ' ' LYS . . . . . 0.472 ' HA ' ' HD3' ' H' ' 110' ' ' LYS . 18.6 mmtm -148.01 145.67 21.53 Favored Pre-proline 0 C--N 1.319 -0.75 0 N-CA-C 106.775 -1.565 . . . . 27.390000000000001 106.775 179.283 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 111' ' ' PRO . . . . . 0.424 ' HB3' ' HG2' ' H' ' 50' ' ' ARG . 3.1 Cg_exo -72.83 170.05 20.58 Favored 'Trans proline' 0 C--N 1.304 -1.774 0 O-C-N 126.328 2.752 . . . . 24.690000000000001 108.61 -177.689 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 112' ' ' VAL . . . . . 0.48 HG12 ' HE2' ' H' ' 81' ' ' LYS . 2.5 m -115.09 141.94 29.9 Favored 'Isoleucine or valine' 0 C--O 1.247 0.932 0 O-C-N 124.309 1.006 . . . . 23.98 110.082 -179.565 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 113' ' ' ALA . . . . . . . . . . . . . . . -82.17 131.84 35.24 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 104.207 -2.516 . . . . 22.289999999999999 104.207 174.424 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 114' ' ' PHE . . . . . . . . . . . . . 11.4 m-85 -80.53 164.12 23.2 Favored 'General case' 0 C--N 1.31 -1.125 0 O-C-N 125.408 1.693 . . . . 20.899999999999999 108.107 179.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 115' ' ' SER . . . . . . . . . . . . . 78.4 p -159.65 -156.13 0.49 Allowed 'General case' 0 C--N 1.317 -0.818 0 O-C-N 125.551 1.782 . . . . 20.239999999999998 107.762 -178.537 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 116' ' ' ASP . . . . . . . . . . . . . 62.6 m-20 -78.03 -26.67 48.53 Favored 'General case' 0 C--N 1.299 -1.593 0 C-N-CA 128.135 2.574 . . . . 21.5 112.518 -178.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 117' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -106.7 -15.76 14.67 Favored 'General case' 0 C--N 1.314 -0.961 0 O-C-N 125.638 1.836 . . . . 19.359999999999999 114.117 -178.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 118' ' ' ILE . . . . . 0.415 HG23 HG22 ' H' ' 68' ' ' ILE . 20.8 mt -122.15 116.28 48.72 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.038 0 C-N-CA 124.601 1.16 . . . . 17.969999999999999 109.455 -177.545 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 119' ' ' HIS . . . . . 0.405 ' O ' ' HB3' ' H' ' 29' ' ' TRP . 28.5 t60 -162.33 144.73 8.52 Favored Pre-proline 0 C--O 1.246 0.894 0 O-C-N 125.937 2.023 . . . . 17.079999999999998 111.358 -177.261 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 120' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -76.15 143.88 26.0 Favored 'Trans proline' 0 N--CA 1.454 -0.808 0 CA-C-O 125.169 2.071 . . . . 16.850000000000001 114.272 -178.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 121' ' ' VAL . . . . . 0.674 HG12 ' O ' ' H' ' 46' ' ' LEU . 7.7 p -95.14 152.5 3.66 Favored 'Isoleucine or valine' 0 C--O 1.249 1.074 0 CA-C-N 111.82 -2.445 . . . . 16.289999999999999 104.639 175.918 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 122' ' ' CYS . . . . . . . . . . . . . 67.7 m -87.41 144.98 26.49 Favored 'General case' 0 CA--C 1.542 0.673 0 O-C-N 126.543 2.402 . . . . 15.380000000000001 110.114 -179.896 -58.046 -54.971 91.846 106.083 2.015 105.519 78.74 63.237 1 1 . 1 . 001 ecloud build full ' H' H ' 123' ' ' LEU . . . . . . . . . . . . . 34.0 mt -93.53 133.63 27.9 Favored Pre-proline 0 N--CA 1.47 0.562 0 O-C-N 127.026 2.704 . . . . 16.57 104.02 173.514 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 124' ' ' PRO . . . . . 0.454 ' HD3' ' O ' ' H' ' 209' ' ' GLN . 37.1 Cg_endo -52.93 168.42 0.5 Allowed 'Trans proline' 0 N--CA 1.451 -0.989 0 O-C-N 127.512 3.375 . . . . 18.690000000000001 113.624 179.205 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 125' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -132.85 152.76 51.78 Favored 'General case' 0 C--O 1.25 1.11 0 CA-C-N 110.884 -2.871 . . . . 23.010000000000002 105.759 177.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 126' ' ' ARG . . . . . . . . . . . . . 39.6 ttt85 -43.72 -31.4 0.79 Allowed 'General case' 0 C--O 1.258 1.513 0 N-CA-C 117.196 2.295 . . . . 28.489999999999998 117.196 -175.738 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 127' ' ' GLU . . . . . . . . . . . . . 25.4 tp10 -90.83 -34.22 15.36 Favored 'General case' 0 C--O 1.252 1.236 0 N-CA-C 112.427 0.528 . . . . 26.329999999999998 112.427 -176.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 128' ' ' THR . . . . . 0.665 HG22 HD12 ' H' ' 129' C LEU . 21.2 m -65.09 -39.6 93.4 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 124.58 1.175 . . . . 22.960000000000001 107.902 -177.949 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 129' ' ' ALA . . . . . 0.598 ' O ' ' HB2' ' H' ' 130' ' ' LEU . . . -68.45 -31.99 71.68 Favored 'General case' 0 C--O 1.247 0.935 0 CA-C-N 113.315 -1.766 . . . . 22.57 111.564 -178.686 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 129' A ALA . . . . . . . . . . . . . . . -76.41 -35.0 58.81 Favored 'General case' 0 C--O 1.245 0.862 0 CA-C-O 122.424 1.107 . . . . 22.440000000000001 109.985 -177.173 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 129' B SER . . . . . 0.64 ' O ' ' O ' ' H' ' 625' ' ' HOH . 49.4 m -76.41 -43.66 39.44 Favored 'General case' 0 C--O 1.244 0.783 0 CA-C-N 113.757 -1.565 . . . . 23.800000000000001 111.453 -179.667 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 129' C LEU . . . . . 0.665 HD12 HG22 ' H' ' 128' ' ' THR . 29.3 mt -92.64 -42.39 9.66 Favored 'General case' 0 C--O 1.259 1.596 0 N-CA-C 117.56 2.43 . . . . 21.850000000000001 117.56 -174.178 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 130' ' ' LEU . . . . . 0.598 ' HB2' ' O ' ' H' ' 129' ' ' ALA . 3.5 mt -68.42 54.87 0.08 Allowed 'General case' 0 C--O 1.25 1.126 0 O-C-N 123.812 0.695 . . . . 21.59 109.622 179.383 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 131' ' ' GLN . . . . . . . . . . . . . 22.5 mt-30 -110.89 142.51 42.85 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 125.572 1.795 . . . . 23.23 108.638 -179.206 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 132' ' ' ALA . . . . . . . . . . . . . . . -70.83 124.2 23.76 Favored 'General case' 0 C--O 1.248 1.019 0 O-C-N 125.194 1.559 . . . . 20.890000000000001 110.661 -177.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 133' ' ' GLY . . . . . . . . . . . . . . . 112.13 -17.23 24.6 Favored Glycine 0 C--O 1.251 1.17 0 O-C-N 125.377 1.673 . . . . 20.379999999999999 110.888 -179.093 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 134' ' ' TYR . . . . . 0.409 ' O ' ' HA ' ' H' ' 161' ' ' PRO . 2.7 m-85 -77.95 154.25 31.76 Favored 'General case' 0 C--O 1.265 1.916 0 N-CA-C 108.401 -0.963 . . . . 20.530000000000001 108.401 179.844 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 135' ' ' LYS . . . . . . . . . . . . . 64.0 mttt -111.92 152.05 28.47 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-O 124.706 2.193 . . . . 19.0 114.508 -179.178 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 136' ' ' GLY . . . . . 0.433 ' O ' ' HA ' ' H' ' 159' ' ' ASN . . . -131.24 169.74 21.64 Favored Glycine 0 CA--C 1.542 1.746 0 N-CA-C 106.795 -2.522 . . . . 16.969999999999999 106.795 177.932 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 137' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -117.82 139.35 51.21 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-N 113.576 -1.312 . . . . 17.109999999999999 110.135 -179.481 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 138' ' ' VAL . . . . . . . . . . . . . 20.1 t -124.96 140.75 47.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 O-C-N 125.567 1.792 . . . . 17.710000000000001 108.518 177.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 139' ' ' THR . . . . . 0.927 HG22 HG22 ' H' ' 157' ' ' VAL . 75.1 p -130.82 160.76 33.46 Favored 'General case' 0 C--N 1.318 -0.763 0 O-C-N 124.608 1.192 . . . . 18.109999999999999 109.264 179.001 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 140' ' ' GLY . . . . . . . . . . . . . . . 157.08 159.5 9.52 Favored Glycine 0 N--CA 1.449 -0.496 0 O-C-N 125.366 1.666 . . . . 18.640000000000001 115.296 177.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 141' ' ' TRP . . . . . 0.502 ' CD1' ' HB2' ' H' ' 73' ' ' ARG . 11.5 m-90 -97.32 20.25 11.86 Favored 'General case' 0 C--O 1.246 0.916 0 C-N-CA 127.442 2.297 . . . . 19.530000000000001 112.984 -179.227 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 142' ' ' GLY . . . . . . . . . . . . . . . -76.0 172.98 54.05 Favored Glycine 0 C--O 1.246 0.859 0 CA-C-O 123.455 1.586 . . . . 20.82 114.587 -178.634 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 143' ' ' ASN . . . . . . . . . . . . . 53.6 m-20 -46.52 141.42 3.69 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 112.95 -1.625 . . . . 21.859999999999999 108.928 -178.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 144' ' ' LEU . . . . . 0.729 ' HG ' ' HD3' ' H' ' 152' ' ' PRO . 9.6 mt -87.34 -12.32 46.78 Favored 'General case' 0 C--O 1.25 1.097 0 O-C-N 125.168 1.542 . . . . 24.100000000000001 114.179 -176.711 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 145' ' ' LYS . . . . . . . . . . . . . 65.8 mmtt -158.03 152.79 25.06 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 106.626 -1.62 . . . . 24.469999999999999 106.626 179.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 146' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 . . . . . 0 C--O 1.261 1.683 0 O-C-N 125.955 2.035 . . . . 25.079999999999998 111.872 179.563 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 150' ' ' GLY . . . . . 0.643 ' O ' ' N ' ' H' ' 144' ' ' LEU . . . . . . . . 0 CA--C 1.531 1.089 0 N-CA-C 109.425 -1.47 . . . . 29.25 109.425 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 151' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -90.65 128.61 47.85 Favored Pre-proline 0 C--N 1.313 -1.005 0 CA-C-N 114.283 -0.959 . . . . 32.590000000000003 108.796 178.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 152' ' ' PRO . . . . . 0.729 ' HD3' ' HG ' ' H' ' 144' ' ' LEU . 43.7 Cg_endo -77.65 158.44 31.99 Favored 'Trans proline' 0 C--O 1.247 0.93 0 O-C-N 126.545 2.866 . . . . 28.07 109.215 176.661 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 153' ' ' SER . . . . . 0.526 ' HB2' ' O ' ' H' ' 576' ' ' HOH . 2.2 p -86.58 -34.04 20.03 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 125.608 1.817 . . . . 25.780000000000001 108.39 178.712 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 154' ' ' VAL . . . . . 0.491 HG22 ' CD2' ' H' ' 71' ' ' HIS . 1.5 t -120.99 161.96 20.3 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 CA-C-N 113.325 -1.761 . . . . 22.93 110.868 -178.503 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 155' ' ' LEU . . . . . . . . . . . . . 28.0 tp -58.36 134.16 56.36 Favored 'General case' 0 C--O 1.246 0.869 0 C-N-CA 123.973 0.909 . . . . 21.140000000000001 110.169 175.936 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 156' ' ' GLN . . . . . 0.515 ' C ' HG23 ' H' ' 157' ' ' VAL . 87.6 mm-40 -100.4 166.0 11.17 Favored 'General case' 0 C--O 1.251 1.169 0 C-N-CA 124.019 0.927 . . . . 21.260000000000002 109.443 179.426 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 157' ' ' VAL . . . . . 0.927 HG22 HG22 ' H' ' 139' ' ' THR . 94.4 t -154.35 155.06 6.41 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 O-C-N 124.949 1.406 . . . . 19.329999999999998 110.887 -176.221 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 158' ' ' VAL . . . . . . . . . . . . . 7.4 p -168.52 154.91 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 O-C-N 124.909 1.381 . . . . 18.18 111.003 -179.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 159' ' ' ASN . . . . . 0.433 ' HA ' ' O ' ' H' ' 136' ' ' GLY . 11.1 m-20 -119.17 113.89 21.59 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 126.246 1.818 . . . . 18.16 112.032 -177.178 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 160' ' ' LEU . . . . . . . . . . . . 0.282 18.7 mt -121.45 137.99 27.67 Favored Pre-proline 0 C--N 1.31 -1.133 0 CA-C-N 113.101 -1.863 . . . . 17.73 109.545 -176.971 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 161' ' ' PRO . . . . . 0.559 ' HG2' ' O ' ' H' ' 512' ' ' HOH . 17.9 Cg_endo -78.39 166.1 24.64 Favored 'Trans proline' 0 C--O 1.257 1.432 0 O-C-N 125.715 2.429 . . . . 18.91 110.15 178.756 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 162' ' ' ILE . . . . . 0.434 HD11 ' CZ ' ' H' ' 199' ' ' PHE . 45.7 mm -90.14 128.36 42.13 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 N-CA-C 106.122 -1.807 . . . . 19.940000000000001 106.122 178.525 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 163' ' ' VAL . . . . . 0.495 HG21 ' CD2' ' H' ' 225' ' ' TYR . 8.3 t -95.19 138.37 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 O-C-N 126.751 2.532 . . . . 19.280000000000001 108.362 -179.981 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 164' ' ' GLU . . . . . . . . . . . . . 39.6 mp0 -54.09 151.78 6.64 Favored 'General case' 0 C--N 1.316 -0.864 0 O-C-N 126.242 2.214 . . . . 23.82 109.593 179.364 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 165' ' ' ARG . . . . . 0.858 ' NH2' ' O ' ' H' ' 177' ' ' THR 0.331 10.1 ttt85 -53.72 -51.7 74.05 Favored Pre-proline 0 C--O 1.256 1.443 0 N-CA-C 114.812 1.412 . . . . 19.399999999999999 114.812 -176.116 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 166' ' ' PRO . . . . . 0.519 ' HD2' ' N ' ' H' ' 165' ' ' ARG . 3.3 Cg_exo -50.13 -61.85 0.5 Allowed 'Trans proline' 0 C--N 1.313 -1.3 0 C-N-CA 124.289 3.326 . . . . 18.489999999999998 111.193 -178.897 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 167' ' ' VAL . . . . . . . . . . . . . 97.0 t -45.96 -49.42 4.85 Favored 'Isoleucine or valine' 0 C--O 1.247 0.969 0 CA-C-N 112.917 -1.947 . . . . 18.129999999999999 109.909 178.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 168' ' ' CYS . . . . . . . . . . . . . 68.6 m -57.43 -47.28 82.18 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 125.216 1.573 . . . . 17.82 108.357 -179.382 -71.929 -62.661 -92.148 105.003 2.0 105.448 -74.54 94.08 1 1 . 1 . 001 ecloud build full ' H' H ' 169' ' ' LYS . . . . . . . . . . . . . 12.8 ttmm -60.53 -42.39 96.38 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-N 112.566 -2.106 . . . . 20.59 111.78 -179.108 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 170' ' ' ASP . . . . . . . . . . . . 0.356 17.0 m-20 -80.12 12.23 2.96 Favored 'General case' 0 C--O 1.26 1.653 0 N-CA-C 116.469 2.025 . . . . 18.129999999999999 116.469 -177.661 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 171' ' ' SER . . . . . . . . . . . . . 2.9 p -110.13 -9.19 14.71 Favored 'General case' 0 C--O 1.262 1.732 0 N-CA-C 114.396 1.258 . . . . 19.280000000000001 114.396 -177.51 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 172' ' ' THR . . . . . . . . . . . . . 10.1 t -144.78 165.05 29.18 Favored 'General case' 0 C--O 1.249 1.029 0 N-CA-C 114.515 1.302 . . . . 20.370000000000001 114.515 -175.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 173' ' ' ARG . . . . . 0.719 ' HB2' ' O ' ' H' ' 537' ' ' HOH . 28.6 mtm-85 -94.13 -17.58 22.64 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.271 1.428 . . . . 26.800000000000001 108.914 -179.073 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 174' ' ' ILE . . . . . 0.606 HD13 ' C20' ' H' ' 400' ' ' DI4 . 14.2 mt -68.89 161.07 4.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 O-C-N 126.111 2.132 . . . . 19.989999999999998 108.95 177.566 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 175' ' ' ARG . . . . . 0.446 ' NH1' ' OE1' ' H' ' 97' A GLU . 2.9 ttt180 -100.98 111.05 23.16 Favored 'General case' 0 C--N 1.311 -1.066 0 O-C-N 124.99 1.431 . . . . 18.390000000000001 109.315 179.324 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 176' ' ' ILE . . . . . . . . . . . . . 17.4 mm -79.15 142.99 13.26 Favored 'Isoleucine or valine' 0 C--O 1.246 0.88 0 CA-C-N 112.387 -2.188 . . . . 18.66 111.402 179.318 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 177' ' ' THR . . . . . 0.858 ' O ' ' NH2' ' H' ' 165' ' ' ARG . 11.0 p -122.06 179.71 4.43 Favored 'General case' 0 C--O 1.248 0.976 0 CA-C-O 122.953 1.359 . . . . 17.379999999999999 110.345 177.135 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 178' ' ' ASP . . . . . 0.571 ' O ' ' HD2' ' H' ' 233' ' ' ARG . 14.9 m-20 -71.95 -24.75 61.66 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 113.124 -1.853 . . . . 17.239999999999998 112.536 -178.771 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 179' ' ' ASN . . . . . . . . . . . . . 16.3 m-20 -87.03 24.14 1.6 Allowed 'General case' 0 N--CA 1.482 1.16 0 O-C-N 124.565 1.166 . . . . 16.460000000000001 107.857 177.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 180' ' ' MET . . . . . . . . . . . . . 48.6 mtt -137.94 144.8 41.4 Favored 'General case' 0 C--N 1.322 -0.625 0 O-C-N 125.669 1.856 . . . . 16.68 112.598 -176.611 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 181' ' ' PHE . . . . . . . . . . . . . 12.8 p90 -141.63 158.72 43.47 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 126.433 2.333 . . . . 16.079999999999998 106.222 174.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 182' ' ' CYS . . . . . 0.536 ' HA ' ' O ' ' H' ' 226' ' ' GLY . 0.5 OUTLIER -125.74 156.11 39.91 Favored 'General case' 0 C--N 1.319 -0.728 0 O-C-N 125.695 1.872 . . . . 17.16 109.448 177.904 94.08 -74.54 -92.148 105.448 2.0 105.003 -62.661 -71.929 3 3 . 1 . 001 ecloud build full ' H' H ' 183' ' ' ALA . . . . . 0.407 ' HA ' HG23 ' H' ' 163' ' ' VAL . . . -151.1 147.31 26.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 113.016 -1.902 . . . . 18.550000000000001 110.431 -177.655 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 184' ' ' GLY . . . . . . . . . . . . . . . 155.13 165.02 13.6 Favored Glycine 0 C--O 1.25 1.119 0 N-CA-C 108.759 -1.737 . . . . 20.710000000000001 108.759 179.542 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 184' A TYR . . . . . . . . . . . . . 57.8 m-85 -85.07 143.45 28.87 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 106.719 -1.585 . . . . 23.309999999999999 106.719 176.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 185' ' ' LYS . . . . . . . . . . . . . 84.0 mttt -74.71 125.12 89.89 Favored Pre-proline 0 N--CA 1.485 1.288 0 O-C-N 125.957 2.035 . . . . 26.190000000000001 106.472 176.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 186' ' ' PRO . . . . . 0.442 ' HD3' ' O ' ' H' ' 507' ' ' HOH . 88.1 Cg_endo -31.5 -33.28 0.04 OUTLIER 'Trans proline' 0 C--O 1.269 2.034 0 C-N-CA 124.254 3.302 . . . . 27.73 117.975 -176.15 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 186' A ASP . . . . . 0.597 ' OD1' ' O ' ' H' ' 549' ' ' HOH . 58.7 m-20 -89.09 22.75 2.66 Favored 'General case' 0 C--O 1.257 1.488 0 N-CA-C 112.917 0.71 . . . . 29.52 112.917 -178.224 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 186' B GLU . . . . . . . . . . . . . 49.1 mt-10 -116.58 19.15 14.76 Favored 'General case' 0 C--O 1.258 1.504 0 N-CA-C 114.875 1.435 . . . . 30.280000000000001 114.875 -177.496 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 186' C GLY . . . . . . . . . . . . . . . 70.86 -75.22 0.59 Allowed Glycine 0 C--O 1.253 1.299 0 CA-C-O 119.119 -0.823 . . . . 28.960000000000001 111.127 179.489 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 186' D LYS . . . . . . . . . . . . . 22.1 mttt -56.95 157.74 5.46 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 122.508 1.147 . . . . 30.390000000000001 113.652 -178.107 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 187' ' ' ARG . . . . . 0.572 ' HG3' ' HG3' ' H' ' 18' ' ' GLU . 5.3 ptp180 -150.97 -163.59 1.81 Allowed 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 113.379 -1.737 . . . . 26.289999999999999 111.744 -179.44 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 188' ' ' GLY . . . . . 0.778 ' O ' ' O ' ' H' ' 653' ' ' HOH . . . 127.14 155.51 8.86 Favored Glycine 0 C--O 1.253 1.309 0 O-C-N 124.644 1.215 . . . . 24.41 111.214 179.055 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 189' ' ' ASP . . . . . 0.505 ' CG ' ' H ' ' H' ' 190' ' ' ALA . 48.8 t0 -157.77 -177.99 6.98 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 125.919 2.771 . . . . 22.530000000000001 112.394 179.706 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 190' ' ' ALA . . . . . 0.948 ' HB1' ' O ' ' H' ' 574' ' ' HOH . . . -100.87 156.05 17.6 Favored 'General case' 0 C--O 1.253 1.237 0 N-CA-C 102.082 -3.303 . . . . 21.77 102.082 173.967 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 191' ' ' CYS . . . . . . . . . . . . . 5.3 t -145.75 176.94 9.27 Favored 'General case' 0 C--N 1.297 -1.684 0 O-C-N 126.211 2.194 . . . . 22.969999999999999 108.205 -178.257 -158.238 49.415 87.44 103.737 2.024 104.947 -169.812 -49.794 1 1 . 1 . 001 ecloud build full ' H' H ' 192' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -59.63 127.78 33.69 Favored 'General case' 0 C--N 1.316 -0.853 0 O-C-N 125.174 1.546 . . . . 24.079999999999998 110.608 -179.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 193' ' ' GLY . . . . . . . . . . . . . . . 110.95 -16.55 27.9 Favored Glycine 0 C--O 1.248 1.008 0 O-C-N 125.368 1.667 . . . . 20.530000000000001 110.675 179.472 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 194' ' ' ASP . . . . . 0.41 ' CB ' ' O ' ' H' ' 574' ' ' HOH . 98.8 m-20 -87.77 -6.09 58.33 Favored 'General case' 0 C--O 1.255 1.383 0 N-CA-C 113.933 1.086 . . . . 19.199999999999999 113.933 -177.542 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 195' ' ' SER . . . . . . . . . . . . . 56.0 m -64.44 148.86 49.62 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 124.054 0.847 . . . . 18.649999999999999 111.647 -175.258 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 196' ' ' GLY . . . . . 0.47 ' HA2' ' H ' ' H' ' 55' ' ' ALA . . . 86.78 -5.89 84.0 Favored Glycine 0 CA--C 1.545 1.95 0 O-C-N 128.058 3.349 . . . . 15.35 105.453 179.74 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 197' ' ' GLY . . . . . 0.403 ' HA2' ' HD2' ' H' ' 198' ' ' PRO . . . -74.94 140.54 26.87 Favored Glycine 0 N--CA 1.433 -1.525 0 O-C-N 127.521 2.542 . . . . 14.869999999999999 111.806 179.573 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 198' ' ' PRO . . . . . 0.403 ' HD2' ' HA2' ' H' ' 197' ' ' GLY . 57.8 Cg_endo -80.07 149.31 19.85 Favored 'Trans proline' 0 CA--C 1.501 -1.14 0 N-CA-C 118.922 2.624 . . . . 14.51 118.922 -174.981 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 199' ' ' PHE . . . . . 0.434 ' CZ ' HD11 ' H' ' 162' ' ' ILE . 6.6 t80 -120.54 93.53 4.07 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 105.94 -1.874 . . . . 13.890000000000001 105.94 175.615 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 200' ' ' VAL . . . . . 0.461 ' HA ' ' O ' ' H' ' 208' ' ' TYR . 10.2 m -97.34 169.1 1.51 Allowed 'Isoleucine or valine' 0 C--O 1.241 0.624 0 CA-C-O 124.149 1.928 . . . . 14.550000000000001 114.42 -178.705 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 201' ' ' MET . . . . . . . . . . . . . 47.1 mtp -150.98 156.64 41.58 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 112.681 -2.054 . . . . 14.199999999999999 106.675 177.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 202' ' ' LYS . . . . . 0.488 ' HB3' HD21 ' L' ' 14' G LEU . 30.2 tttt -109.05 125.44 52.1 Favored 'General case' 0 C--N 1.313 -1.009 0 O-C-N 126.026 2.079 . . . . 15.84 107.871 -179.797 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 203' ' ' SER . . . . . 0.707 ' HB3' ' OD1' ' H' ' 204' B ASN . 47.8 t -72.01 126.29 91.32 Favored Pre-proline 0 C--O 1.259 1.575 0 O-C-N 127.856 3.223 . . . . 15.85 107.608 178.598 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 204' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_exo -78.03 1.45 8.9 Favored 'Trans proline' 0 C--N 1.317 -1.128 0 C-N-CA 121.958 1.772 . . . . 15.75 108.821 179.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 204' A PHE . . . . . 0.436 ' HD2' ' OG ' ' H' ' 203' ' ' SER . 3.8 m-85 -100.41 -47.6 4.85 Favored 'General case' 0 C--N 1.309 -1.183 0 O-C-N 125.403 1.69 . . . . 15.800000000000001 112.986 -175.42 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 204' B ASN . . . . . 0.707 ' OD1' ' HB3' ' H' ' 203' ' ' SER . 51.3 p-10 -123.59 6.16 8.89 Favored 'General case' 0 C--N 1.307 -1.273 0 C-N-CA 124.622 1.169 . . . . 15.109999999999999 112.889 -178.84 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 205' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 53.95 27.07 6.9 Favored 'General case' 0 C--O 1.255 1.371 0 C-N-CA 125.033 1.333 . . . . 18.91 113.951 179.686 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 206' ' ' ARG . . . . . 0.568 ' HD2' ' ND2' ' H' ' 204' B ASN . 73.8 mtt-85 -98.08 157.74 15.95 Favored 'General case' 0 N--CA 1.499 2.014 0 N-CA-C 105.862 -1.903 . . . . 18.210000000000001 105.862 -179.497 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 207' ' ' TRP . . . . . 0.417 ' CE3' HG23 ' H' ' 200' ' ' VAL . 88.2 m95 -101.61 136.2 41.86 Favored 'General case' 0 C--N 1.31 -1.146 0 O-C-N 127.762 3.164 . . . . 14.970000000000001 105.897 178.944 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 208' ' ' TYR . . . . . 0.461 ' O ' ' HA ' ' H' ' 200' ' ' VAL . 56.6 m-85 -126.01 135.36 51.71 Favored 'General case' 0 C--N 1.312 -1.032 0 O-C-N 126.967 2.667 . . . . 15.789999999999999 109.422 -178.538 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 209' ' ' GLN . . . . . 0.454 ' O ' ' HD3' ' H' ' 124' ' ' PRO . 43.9 tt0 -84.63 116.86 23.41 Favored 'General case' 0 C--N 1.305 -1.351 0 O-C-N 125.976 2.048 . . . . 12.65 106.602 172.608 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 210' ' ' MET . . . . . . . . . . . . . 61.8 mmm -97.1 -30.22 13.16 Favored 'General case' 0 N--CA 1.433 -1.325 0 C-N-CA 127.314 2.245 . . . . 14.4 114.003 -179.588 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 211' ' ' GLY . . . . . 0.451 ' HA2' ' O ' ' H' ' 229' ' ' THR . . . -140.9 172.34 23.71 Favored Glycine 0 C--N 1.315 -0.603 0 C-N-CA 123.878 0.751 . . . . 11.9 113.447 -177.027 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 212' ' ' ILE . . . . . . . . . . . . . 78.7 mt -133.6 129.03 55.25 Favored 'Isoleucine or valine' 0 C--O 1.246 0.908 0 N-CA-C 104.938 -2.245 . . . . 11.4 104.938 176.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 213' ' ' VAL . . . . . . . . . . . . . 69.3 t -55.64 114.56 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 O-C-N 128.228 3.455 . . . . 11.609999999999999 106.236 178.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 214' ' ' SER . . . . . . . . . . . . 0.281 22.9 t -107.71 -66.72 1.01 Allowed 'General case' 0 C--O 1.249 1.073 0 CA-C-N 114.228 -1.351 . . . . 12.85 114.588 -177.444 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 215' ' ' TRP . . . . . 0.674 ' CE3' ' H20' ' H' ' 400' ' ' DI4 . 68.4 p-90 -159.39 173.53 16.11 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 126.536 2.397 . . . . 14.470000000000001 113.352 -176.127 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 216' ' ' GLY . . . . . 0.475 ' HA3' ' H61' ' H' ' 400' ' ' DI4 . . . 173.64 149.67 7.09 Favored Glycine 0 N--CA 1.491 2.351 0 CA-C-N 110.798 -2.91 . . . . 18.920000000000002 106.687 179.564 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 217' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -98.59 92.48 5.64 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 127.236 2.374 . . . . 22.34 107.55 -178.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 219' ' ' GLY . . . . . . . . . . . . . . . 76.63 153.86 5.32 Favored Glycine 0 N--CA 1.478 1.476 0 CA-C-O 123.777 1.765 . . . . 23.050000000000001 110.988 -176.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 220' ' ' CYS . . . . . 0.624 ' O ' ' O ' ' H' ' 221' ' ' ASP . 29.8 m -96.12 134.59 39.0 Favored 'General case' 0 C--O 1.242 0.681 0 C-N-CA 126.368 1.867 . . . . 23.260000000000002 113.493 -177.701 -49.794 -169.812 87.44 104.947 2.024 103.737 49.415 -158.238 2 2 . 1 . 001 ecloud build full ' H' H ' 221' ' ' ASP . . . . . 0.624 ' O ' ' O ' ' H' ' 220' ' ' CYS . 24.3 t0 35.82 97.54 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 106.052 -1.832 . . . . 23.690000000000001 106.052 -179.211 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 221' A ARG . . . . . . . . . . . . . 12.2 mtt85 -146.49 138.11 24.61 Favored 'General case' 0 C--O 1.242 0.67 0 CA-C-N 112.451 -2.158 . . . . 24.25 106.382 -179.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 222' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.43 140.77 54.12 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 125.276 1.61 . . . . 24.649999999999999 107.966 -178.715 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 223' ' ' GLY . . . . . . . . . . . . . . . 70.39 12.11 69.01 Favored Glycine 0 C--O 1.261 1.785 0 C-N-CA 124.827 1.203 . . . . 22.859999999999999 112.712 179.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 224' ' ' LYS . . . . . . . . . . . . . 2.8 mmtp -122.73 165.23 16.89 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 117.878 -1.058 . . . . 21.579999999999998 108.392 178.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 225' ' ' TYR . . . . . 0.495 ' CD2' HG21 ' H' ' 163' ' ' VAL . 53.9 m-85 -146.75 175.6 10.5 Favored 'General case' 0 C--O 1.243 0.717 0 O-C-N 125.076 1.485 . . . . 18.210000000000001 112.044 -178.287 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 226' ' ' GLY . . . . . 0.536 ' O ' ' HA ' ' H' ' 182' ' ' CYS . . . -102.88 147.39 16.94 Favored Glycine 0 N--CA 1.477 1.379 0 N-CA-C 106.781 -2.527 . . . . 16.039999999999999 106.781 179.731 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 227' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -118.12 138.23 52.41 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 126.576 1.986 . . . . 13.470000000000001 109.71 -179.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 228' ' ' TYR . . . . . . . . . . . . . 38.7 m-85 -132.33 140.44 48.55 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 125.304 1.627 . . . . 15.609999999999999 110.797 -177.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 229' ' ' THR . . . . . 0.451 ' O ' ' HA2' ' H' ' 211' ' ' GLY . 20.4 m -60.66 129.64 42.53 Favored 'General case' 0 C--O 1.255 1.367 0 N-CA-C 107.678 -1.23 . . . . 13.6 107.678 175.294 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 230' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -86.1 99.85 11.77 Favored 'General case' 0 N--CA 1.504 2.246 0 CA-C-O 123.476 1.608 . . . . 15.039999999999999 107.065 179.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 231' ' ' VAL . . . . . . . . . . . . 0.283 3.9 t -65.11 -33.51 64.24 Favored 'Isoleucine or valine' 0 C--O 1.264 1.823 0 N-CA-C 118.891 2.923 . . . . 15.48 118.891 -173.628 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 232' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -65.38 -43.34 91.0 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 106.688 -1.597 . . . . 17.670000000000002 106.688 178.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 233' ' ' ARG . . . . . 0.571 ' HD2' ' O ' ' H' ' 178' ' ' ASP . 2.5 mtt180 -61.13 -29.76 69.97 Favored 'General case' 0 C--O 1.247 0.972 0 CA-C-N 114.43 -1.259 . . . . 19.68 114.343 -179.15 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 234' ' ' LEU . . . . . . . . . . . . . 13.4 mt -103.47 11.47 36.36 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 107.645 -1.243 . . . . 19.719999999999999 107.645 179.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 235' ' ' LYS . . . . . 0.703 ' HB3' ' NZ ' ' H' ' 236' ' ' LYS . 33.9 tttt -56.58 -53.35 58.63 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 112.768 -2.014 . . . . 22.210000000000001 108.67 -174.057 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 236' ' ' LYS . . . . . 0.849 ' HD2' ' OE1' ' H' ' 239' ' ' GLN 0.42 0.0 OUTLIER -55.89 -20.35 15.44 Favored 'General case' 0 CA--C 1.483 -1.609 0 N-CA-C 117.054 2.242 . . . . 23.09 117.054 -176.374 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' H' H ' 237' ' ' TRP . . . . . 0.44 ' O ' HG12 ' H' ' 241' ' ' VAL . 39.3 t90 -80.25 -41.12 25.65 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 106.459 -1.682 . . . . 24.949999999999999 106.459 176.246 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 238' ' ' ILE . . . . . 0.584 HD11 HD11 ' H' ' 103' ' ' ILE . 45.0 mt -51.67 -61.83 0.66 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.517 0 O-C-N 126.864 2.602 . . . . 26.079999999999998 110.767 -179.628 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 239' ' ' GLN . . . . . 0.849 ' OE1' ' HD2' ' H' ' 236' ' ' LYS . 70.5 mt-30 -50.42 -49.04 55.88 Favored 'General case' 0 N--CA 1.481 1.088 0 O-C-N 124.555 1.16 . . . . 28.879999999999999 110.674 179.479 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 240' ' ' LYS . . . . . 0.461 ' HE2' ' OE1' ' H' ' 244' ' ' GLN . 10.2 tmtt? -43.8 -68.32 0.21 Allowed 'General case' 0 C--O 1.254 1.333 0 CA-C-N 115.637 -0.711 . . . . 31.620000000000001 111.365 -179.764 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 241' ' ' VAL . . . . . 0.681 ' O ' ' HD2' ' H' ' 245' ' ' PHE . 0.2 OUTLIER -59.87 -16.96 12.47 Favored 'Isoleucine or valine' 0 C--O 1.256 1.427 0 C-N-CA 123.911 0.884 . . . . 29.32 112.857 -178.883 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 242' ' ' ILE . . . . . . . . . . . . . 4.2 mt -88.29 -28.85 5.37 Favored 'Isoleucine or valine' 0 C--O 1.247 0.961 0 CA-C-N 115.282 -0.872 . . . . 30.23 110.414 -179.251 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 243' ' ' ASP . . . . . . . . . . . . . 50.1 m-20 -86.71 -21.59 26.53 Favored 'General case' 0 C--O 1.248 1.026 0 CA-C-N 115.558 -0.746 . . . . 31.710000000000001 110.925 -179.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 244' ' ' GLN . . . . . 0.567 ' HB3' ' CE2' ' H' ' 245' ' ' PHE . 37.4 tt0 -84.15 -38.7 20.34 Favored 'General case' 0 C--O 1.244 0.775 0 CA-C-O 122.502 1.144 . . . . 32.539999999999999 110.428 -178.681 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 245' ' ' PHE . . . . . 0.681 ' HD2' ' O ' ' H' ' 241' ' ' VAL . 1.9 m-85 . . . . . 0 N--CA 1.49 1.539 0 CA-C-N 114.321 -1.308 . . . . 31.82 109.934 -176.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.025 0 N-CA-C 106.359 -2.696 . . . . 35.420000000000002 106.359 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 55' ' ' ASP . . . . . 0.553 ' OD2' ' NH2' ' H' ' 73' ' ' ARG . 21.1 t0 -86.73 -8.2 57.6 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 103.079 -2.934 . . . . 35.090000000000003 103.079 174.902 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 56' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -95.71 151.14 19.63 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 109.859 -3.337 . . . . 34.329999999999998 110.71 -176.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 57' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -90.39 127.46 36.2 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 112.782 -2.008 . . . . 33.799999999999997 109.656 -179.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 58' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -45.08 143.46 1.56 Allowed 'General case' 0 C--O 1.249 1.027 0 O-C-N 125.78 1.925 . . . . 36.18 109.847 179.978 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 59' ' ' ILE . . . . . 0.517 HG12 ' OE1' ' H' ' 38' ' ' GLN . 36.7 pt -108.2 141.34 22.98 Favored Pre-proline 0 C--O 1.246 0.918 0 O-C-N 125.361 1.663 . . . . 35.770000000000003 107.34 178.069 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 60' ' ' PRO . . . . . 0.509 ' C ' ' O ' ' I' ' 59' ' ' ILE . 97.3 Cg_exo . . . . . 0 C--O 1.252 1.201 0 O-C-N 126.27 2.721 . . . . 35.740000000000002 109.23 -179.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 400' ' ' DI4 . . . . . 0.794 ' H91' HD11 ' H' ' 99' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 541' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 556' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 591' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 593' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 595' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 596' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 602' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 636' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 649' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 650' ' ' HOH . . . . . 0.534 ' O ' ' HB2' ' L' ' 14' D ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 651' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 501' ' ' HOH . . . . . 0.565 ' O ' ' NH1' ' H' ' 165' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 505' ' ' HOH . . . . . 0.43 ' O ' ' HD2' ' H' ' 81' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 507' ' ' HOH . . . . . 0.442 ' O ' ' HD3' ' H' ' 186' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 512' ' ' HOH . . . . . 0.559 ' O ' ' HG2' ' H' ' 161' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 522' ' ' HOH . . . . . 0.511 ' O ' HG12 ' H' ' 24' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 537' ' ' HOH . . . . . 0.719 ' O ' ' HB2' ' H' ' 173' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 538' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 544' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 548' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 549' ' ' HOH . . . . . 0.597 ' O ' ' OD1' ' H' ' 186' A ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 551' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 552' ' ' HOH . . . . . 0.485 ' O ' ' OD2' ' H' ' 100' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 553' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 554' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 555' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 557' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 559' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 561' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 562' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 568' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 569' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 570' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 571' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 572' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 574' ' ' HOH . . . . . 0.948 ' O ' ' HB1' ' H' ' 190' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 575' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 576' ' ' HOH . . . . . 0.567 ' O ' ' NH1' ' H' ' 75' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 577' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 578' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 579' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 580' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 581' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 582' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 583' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 584' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 586' ' ' HOH . . . . . 0.906 ' O ' ' N ' ' H' ' 16' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 587' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 588' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 589' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 590' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 594' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 599' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 600' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 601' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 603' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 605' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 609' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 611' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 614' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 615' ' ' HOH . . . . . 0.687 ' O ' ' O ' ' H' ' 96' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 616' ' ' HOH . . . . . 0.429 ' O ' HD11 ' H' ' 79' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 617' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 620' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 621' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 623' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 624' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 625' ' ' HOH . . . . . 0.64 ' O ' ' O ' ' H' ' 129' B SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 626' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 628' ' ' HOH . . . . . 0.779 ' O ' ' O ' ' H' ' 47' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 630' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 631' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 632' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 635' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 638' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 640' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 641' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 643' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 644' ' ' HOH . . . . . 0.603 ' O ' ' HB2' ' H' ' 236' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 647' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 648' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 652' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 653' ' ' HOH . . . . . 0.778 ' O ' ' O ' ' H' ' 188' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 654' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 1' B ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.152 0 N-CA-C 109.532 -0.544 . . . . 20.02 109.532 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 1' A ASP . . . . . . . . . . . . . 8.3 t70 -111.58 4.3 18.61 Favored 'General case' 0 C--O 1.255 1.348 0 O-C-N 124.982 1.426 . . . . 21.210000000000001 113.99 -179.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 1' ' ' CYS . . . . . . . . . . . . . 30.3 p -49.09 159.1 0.3 Allowed 'General case' 0 C--N 1.318 -0.775 0 O-C-N 123.98 0.8 . . . . 17.579999999999998 109.572 179.494 63.237 78.74 91.846 105.519 2.015 106.083 -54.971 -58.046 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 2' ' ' GLY . . . . . . . . . . . . . . . 59.52 12.71 20.1 Favored Glycine 0 C--O 1.257 1.542 0 N-CA-C 118.692 2.237 . . . . 15.359999999999999 118.692 176.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 3' ' ' LEU . . . . . . . . . . . . . 73.5 mt -119.64 96.77 5.33 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 107.734 -1.21 . . . . 14.91 107.734 179.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 4' ' ' ARG . . . . . 0.698 ' NH1' ' OD2' ' L' ' 14' ' ' ASP . 80.1 mtm180 -61.87 125.29 84.67 Favored Pre-proline 0 C--N 1.305 -1.359 0 O-C-N 126.943 2.652 . . . . 14.85 111.175 179.464 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 5' ' ' PRO . . . . . 0.664 ' HA ' ' HG3' ' L' ' 9' ' ' LYS . 77.3 Cg_exo -49.89 -55.47 4.08 Favored 'Trans proline' 0 C--N 1.312 -1.368 0 O-C-N 125.037 2.072 . . . . 14.9 111.255 178.849 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 6' ' ' LEU . . . . . . . . . . . . . 58.4 mt -78.14 2.2 18.82 Favored 'General case' 0 C--O 1.25 1.086 0 N-CA-C 116.241 1.941 . . . . 15.640000000000001 116.241 -178.01 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 7' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -128.41 -90.57 0.5 Allowed 'General case' 0 N--CA 1.482 1.154 0 O-C-N 124.953 1.408 . . . . 16.260000000000002 113.629 179.843 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 8' ' ' GLU . . . . . . . . . . . . . 21.7 mp0 -49.37 -43.59 44.21 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 115.849 -0.614 . . . . 16.98 111.579 -178.11 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 9' ' ' LYS . . . . . 0.664 ' HG3' ' HA ' ' L' ' 5' ' ' PRO . 34.1 mmtp -60.49 -39.82 89.07 Favored 'General case' 0 C--O 1.247 0.943 0 C-N-CA 125.482 1.513 . . . . 20.760000000000002 112.665 178.726 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 10' ' ' LYS . . . . . . . . . . . . . 68.4 mttt -89.82 -2.93 58.33 Favored 'General case' 0 C--O 1.257 1.449 0 C-N-CA 125.836 1.654 . . . . 21.32 112.93 -178.91 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 11' ' ' SER . . . . . . . . . . . . . 34.2 t 64.4 20.89 12.33 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-O 123.088 1.423 . . . . 17.23 110.337 -179.186 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 12' ' ' LEU . . . . . . . . . . . . . 90.2 mt -89.51 134.76 33.96 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 106.271 -1.752 . . . . 17.649999999999999 106.271 173.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 13' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -97.41 153.27 18.21 Favored 'General case' 0 C--N 1.31 -1.122 0 N-CA-C 106.909 -1.515 . . . . 22.75 106.909 175.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 14' ' ' ASP . . . . . 0.698 ' OD2' ' NH1' ' L' ' 4' ' ' ARG 0.35 2.9 p30 -92.73 164.85 13.22 Favored 'General case' 0 C--N 1.317 -0.823 0 O-C-N 126.403 2.314 . . . . 18.640000000000001 106.576 177.998 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' L' L ' 14' A LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.41 -24.35 67.35 Favored 'General case' 0 C--O 1.26 1.627 0 N-CA-C 117.405 2.372 . . . . 23.539999999999999 117.405 -174.0 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' B THR . . . . . . . . . . . . . 27.2 p -125.11 -9.02 7.09 Favored 'General case' 0 C--O 1.266 1.955 0 CA-C-N 120.909 1.686 . . . . 19.41 114.838 -179.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 14' C GLU . . . . . . . . . . . . . 4.9 pt-20 -48.93 -43.26 39.37 Favored 'General case' 0 C--O 1.263 1.814 0 CA-C-N 118.579 0.627 . . . . 19.550000000000001 112.317 -178.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 14' D ARG . . . . . 0.981 ' O ' ' HG3' ' L' ' 14' H GLU . 5.2 ttp180 -51.83 -23.5 4.85 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.37 -0.832 . . . . 22.199999999999999 110.175 -178.043 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' E GLU . . . . . . . . . . . . . 6.0 tt0 -67.85 -33.87 75.61 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 122.882 1.325 . . . . 20.050000000000001 110.605 -178.564 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 14' F LEU . . . . . 0.403 ' O ' ' N ' ' L' ' 14' I SER . 1.0 OUTLIER -68.25 -71.06 0.23 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 113.862 -1.517 . . . . 20.109999999999999 108.472 178.747 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' L' L ' 14' G LEU . . . . . 0.54 ' HA ' ' CD2' ' L' ' 14' J TYR . 1.6 mm? -43.58 -24.79 0.13 Allowed 'General case' 0 C--O 1.25 1.125 0 C-N-CA 126.842 2.057 . . . . 20.010000000000002 113.261 -176.811 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' H GLU . . . . . 0.981 ' HG3' ' O ' ' L' ' 14' D ARG . 44.3 mt-10 -85.02 -30.76 23.89 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-N 114.504 -1.225 . . . . 22.23 110.322 -177.697 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' I SER . . . . . 0.403 ' N ' ' O ' ' L' ' 14' F LEU . 75.2 p -75.42 -23.25 56.97 Favored 'General case' 0 C--O 1.247 0.926 0 O-C-N 126.225 2.203 . . . . 20.350000000000001 110.694 -179.289 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' J TYR . . . . . 0.54 ' CD2' ' HA ' ' L' ' 14' G LEU . 16.0 m-85 . . . . . 0 N--CA 1.473 0.718 0 O-C-N 125.838 1.961 . . . . 20.600000000000001 110.442 -179.891 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 16' ' ' ILE . . . . . 0.906 ' N ' ' O ' ' H' ' 586' ' ' HOH . 24.6 mm . . . . . 0 C--O 1.241 0.625 0 N-CA-C 107.976 -1.12 . . . . 21.0 107.976 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 17' ' ' VAL . . . . . . . . . . . . . 69.4 t -115.77 132.68 64.5 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.309 0 C-N-CA 126.511 1.924 . . . . 21.960000000000001 108.591 179.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 18' ' ' GLU . . . . . 0.572 ' HG3' ' HG3' ' H' ' 187' ' ' ARG . 17.9 mm-40 60.55 26.31 15.97 Favored 'General case' 0 C--N 1.32 -0.71 0 O-C-N 126.146 2.154 . . . . 23.670000000000002 109.015 -178.88 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 19' ' ' GLY . . . . . . . . . . . . . . . -87.26 -152.95 23.79 Favored Glycine 0 C--O 1.249 1.084 0 CA-C-N 112.834 -1.985 . . . . 21.829999999999998 110.216 177.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 20' ' ' SER . . . . . . . . . . . . . 5.1 m -165.35 141.38 5.38 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 114.002 -1.099 . . . . 23.32 110.635 -178.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 21' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -41.54 143.76 0.44 Allowed 'General case' 0 N--CA 1.476 0.849 0 O-C-N 126.114 2.133 . . . . 23.18 106.064 177.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 22' ' ' ALA . . . . . 0.576 ' O ' ' HE1' ' H' ' 71' ' ' HIS . . . -91.79 136.88 32.81 Favored 'General case' 0 C--O 1.251 1.138 0 O-C-N 125.978 2.049 . . . . 21.039999999999999 110.634 178.241 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 23' ' ' GLU . . . . . 0.453 ' OE2' ' HB2' ' L' ' 14' ' ' ASP . 47.5 mt-10 -62.23 154.15 28.38 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 124.987 1.429 . . . . 20.66 107.581 175.704 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 24' ' ' ILE . . . . . 0.511 HG12 ' O ' ' H' ' 522' ' ' HOH . 21.1 mm -60.63 145.95 11.72 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 N-CA-C 107.515 -1.291 . . . . 18.859999999999999 107.515 179.347 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 25' ' ' GLY . . . . . . . . . . . . . . . 48.32 41.33 23.9 Favored Glycine 0 C--O 1.257 1.535 0 C-N-CA 125.609 1.576 . . . . 17.780000000000001 114.021 -179.052 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 26' ' ' MET . . . . . 0.402 ' HB2' ' O ' ' H' ' 23' ' ' GLU . 5.8 ttt -88.29 -25.77 22.64 Favored 'General case' 0 C--O 1.253 1.254 0 C-N-CA 124.153 0.981 . . . . 16.16 112.263 -178.712 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 27' ' ' SER . . . . . . . . . . . . . 3.6 m -145.57 71.49 14.08 Favored Pre-proline 0 C--N 1.312 -1.04 0 O-C-N 124.734 1.271 . . . . 15.98 108.434 -179.444 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 28' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -66.67 4.69 0.97 Allowed 'Trans proline' 0 C--N 1.316 -1.134 0 O-C-N 126.369 2.773 . . . . 15.1 113.615 -176.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 29' ' ' TRP . . . . . 0.494 ' O ' HG23 ' H' ' 31' ' ' VAL . 6.2 p90 -106.72 -24.03 12.23 Favored 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 125.888 1.675 . . . . 16.050000000000001 112.75 -177.869 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 30' ' ' GLN . . . . . . . . . . . . . 56.7 tp60 -53.71 135.92 40.39 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 105.732 -1.951 . . . . 17.670000000000002 105.732 174.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 31' ' ' VAL . . . . . 0.631 HG22 HG23 ' H' ' 68' ' ' ILE . 40.0 t -134.6 148.22 29.58 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.282 0 N-CA-C 107.017 -1.475 . . . . 18.719999999999999 107.017 -178.337 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 32' ' ' MET . . . . . . . . . . . . . 54.8 ttm -106.67 128.82 54.49 Favored 'General case' 0 C--N 1.305 -1.337 0 O-C-N 124.994 1.434 . . . . 21.989999999999998 108.938 178.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 33' ' ' LEU . . . . . . . . . . . . . 7.8 mt -90.7 115.39 27.76 Favored 'General case' 0 N--CA 1.488 1.467 0 N-CA-C 104.026 -2.583 . . . . 23.41 104.026 172.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 34' ' ' PHE . . . . . . . . . . . . . 78.6 t80 -127.14 129.62 48.24 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 126.981 2.676 . . . . 26.100000000000001 109.773 -176.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 35' ' ' ARG . . . . . 0.672 ' HB3' HD11 ' H' ' 41' ' ' LEU 0.303 10.0 ptt180 -90.83 152.83 20.61 Favored 'General case' 0 C--O 1.243 0.747 0 O-C-N 124.363 1.04 . . . . 31.010000000000002 111.723 178.801 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 36' ' ' LYS . . . . . 0.523 ' O ' ' N ' ' H' ' 38' ' ' GLN . 84.0 mttt -72.56 -82.88 0.04 OUTLIER 'General case' 0 C--O 1.247 0.971 0 CA-C-N 113.415 -1.72 . . . . 30.5 109.926 -178.425 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 36' A SER . . . . . 0.445 ' HA ' ' HA ' ' H' ' 37' ' ' PRO . 2.8 m -105.06 104.51 47.32 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 114.355 -1.293 . . . . 31.989999999999998 110.649 -179.581 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 37' ' ' PRO . . . . . 0.626 ' O ' ' HG3' ' H' ' 35' ' ' ARG . 91.9 Cg_endo -91.07 149.7 18.68 Favored 'Cis proline' 0 C--O 1.247 0.959 0 C-N-CA 125.128 -0.78 . . . . 32.149999999999999 110.909 0.95 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 38' ' ' GLN . . . . . 0.523 ' N ' ' O ' ' H' ' 36' ' ' LYS . 5.0 mt-30 -62.7 107.04 0.88 Allowed 'General case' 0 C--O 1.244 0.8 0 CA-C-N 114.749 -1.114 . . . . 34.390000000000001 111.248 178.984 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 39' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -164.26 172.26 13.82 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 126.103 2.127 . . . . 31.170000000000002 111.406 178.379 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 40' ' ' LEU . . . . . . . . . . . . . 6.2 tt -88.96 128.86 35.7 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 122.513 1.149 . . . . 27.800000000000001 110.059 -176.657 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 41' ' ' LEU . . . . . 0.672 HD11 ' HB3' ' H' ' 35' ' ' ARG . 41.7 mt -100.81 -48.49 4.46 Favored 'General case' 0 C--O 1.251 1.154 0 CA-C-N 113.13 -1.85 . . . . 24.530000000000001 111.964 -178.604 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 42' ' ' CYS . . . . . . . . . . . . . 1.5 m -166.95 -174.36 2.67 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 124.078 1.894 . . . . 21.140000000000001 113.544 -175.264 -92.054 -159.882 -82.976 101.433 2.076 100.421 -88.737 -69.482 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 43' ' ' GLY . . . . . . . . . . . . . . . -105.45 164.56 14.06 Favored Glycine 0 N--CA 1.489 2.182 0 N-CA-C 104.38 -3.488 . . . . 18.989999999999998 104.38 174.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 44' ' ' ALA . . . . . . . . . . . . . . . -156.57 -176.8 6.17 Favored 'General case' 0 C--O 1.264 1.853 0 N-CA-C 107.286 -1.376 . . . . 17.640000000000001 107.286 179.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 45' ' ' SER . . . . . . . . . . . . 0.419 9.7 p -145.71 147.0 31.48 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 123.127 1.441 . . . . 16.739999999999998 113.027 179.258 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 46' ' ' LEU . . . . . 0.674 ' O ' HG12 ' H' ' 121' ' ' VAL . 0.2 OUTLIER -94.36 126.89 39.89 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 104.441 -2.429 . . . . 16.800000000000001 104.441 179.403 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 47' ' ' ILE . . . . . 0.779 ' O ' ' O ' ' H' ' 628' ' ' HOH . 3.1 pt -117.9 -29.55 1.95 Allowed 'Isoleucine or valine' 0 C--O 1.25 1.129 0 C-N-CA 124.094 0.958 . . . . 18.359999999999999 109.872 -179.91 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 48' ' ' SER . . . . . 0.537 ' O ' HD22 ' H' ' 46' ' ' LEU . 0.3 OUTLIER -145.43 -173.24 4.06 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 105.854 -1.906 . . . . 19.93 105.854 175.578 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 49' ' ' ASP . . . . . . . . . . . . . 19.2 p-10 -75.77 -14.78 60.32 Favored 'General case' 0 C--O 1.267 2.026 0 O-C-N 126.716 2.51 . . . . 22.670000000000002 114.966 -178.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 50' ' ' ARG . . . . . 0.588 ' HA ' HD12 ' H' ' 108' ' ' LEU . 23.6 mtp180 -130.52 -5.32 4.2 Favored 'General case' 0 C--O 1.251 1.134 0 CA-C-O 116.662 -1.637 . . . . 26.149999999999999 113.431 -179.064 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 51' ' ' TRP . . . . . . . . . . . . . 93.8 m95 -113.48 141.39 47.18 Favored 'General case' 0 C--N 1.316 -0.884 0 O-C-N 126.051 2.094 . . . . 22.84 112.639 -176.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 52' ' ' VAL . . . . . . . . . . . . . 69.2 t -132.2 132.3 60.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.103 -0.953 . . . . 18.93 111.723 177.344 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 53' ' ' LEU . . . . . 0.681 HD11 HD11 ' H' ' 103' ' ' ILE . 20.6 tp -93.64 153.14 18.54 Favored 'General case' 0 C--N 1.31 -1.134 0 C-N-CA 125.579 1.552 . . . . 17.32 109.775 176.981 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 54' ' ' THR . . . . . . . . . . . . . 7.2 t -176.11 173.11 2.26 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 125.101 1.501 . . . . 16.719999999999999 110.51 178.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 55' ' ' ALA . . . . . 0.47 ' H ' ' HA2' ' H' ' 196' ' ' GLY . . . -73.87 136.38 43.41 Favored 'General case' 0 C--O 1.247 0.968 0 N-CA-C 107.615 -1.254 . . . . 15.529999999999999 107.615 175.98 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 56' ' ' ALA . . . . . 0.447 ' N ' ' OD1' ' H' ' 102' ' ' ASP . . . -67.02 -26.18 66.65 Favored 'General case' 0 N--CA 1.481 1.089 0 O-C-N 124.998 1.436 . . . . 15.609999999999999 110.093 -178.936 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 57' ' ' HIS . . . . . . . . . . . . . 11.2 p-80 -71.83 -12.35 61.24 Favored 'General case' 0 C--O 1.251 1.146 0 O-C-N 124.647 1.217 . . . . 17.73 111.76 -178.492 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 58' ' ' CYS . . . . . . . . . . . . . 99.6 m -72.25 -20.33 61.56 Favored 'General case' 0 C--O 1.25 1.095 0 O-C-N 124.388 1.055 . . . . 18.309999999999999 108.942 177.804 -69.482 -88.737 -82.976 100.421 2.076 101.433 -159.882 -92.054 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 59' ' ' LEU . . . . . . . . . . . . . 67.7 mt -116.85 -27.9 6.47 Favored 'General case' 0 C--O 1.25 1.085 0 N-CA-C 115.497 1.665 . . . . 18.899999999999999 115.497 -175.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' ' ' LEU . . . . . . . . . . . . . 13.2 tp -140.26 111.94 7.41 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-O 122.908 1.337 . . . . 18.559999999999999 112.864 -177.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' A TYR . . . . . . . . . . . . . 4.1 t80 -152.61 81.05 5.49 Favored Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 113.217 -1.81 . . . . 18.289999999999999 106.727 175.962 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' B PRO . . . . . 0.575 ' N ' ' CD ' ' H' ' 60' C PRO . 93.9 Cg_exo -49.89 -36.17 42.46 Favored 'Trans proline' 0 C--O 1.256 1.378 0 C-N-CA 122.782 2.321 . . . . 18.420000000000002 113.318 -178.585 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 60' C PRO . . . . . 0.575 ' CD ' ' N ' ' H' ' 60' B PRO . 57.7 Cg_exo -58.16 -22.09 54.71 Favored 'Trans proline' 0 C--O 1.255 1.341 0 O-C-N 124.386 1.73 . . . . 18.530000000000001 114.218 -178.353 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 60' D TRP . . . . . . . . . . . . . 41.7 m0 -122.45 16.99 10.51 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 107.336 -1.357 . . . . 20.239999999999998 107.336 -177.216 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' E ASP . . . . . . . . . . . . . 2.8 m-20 55.41 38.48 30.35 Favored 'General case' 0 C--O 1.244 0.764 0 O-C-N 125.291 1.62 . . . . 23.27 111.479 176.749 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' F LYS . . . . . . . . . . . . . 37.7 ttmt -95.46 113.87 25.57 Favored 'General case' 0 C--N 1.315 -0.916 0 O-C-N 125.321 1.638 . . . . 22.27 109.558 176.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' G ASN . . . . . . . . . . . . . 0.9 OUTLIER -148.07 73.95 1.28 Allowed 'General case' 0 C--O 1.255 1.37 0 O-C-N 124.459 1.099 . . . . 26.48 111.352 178.398 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 60' H PHE . . . . . . . . . . . . . 59.1 m-85 -78.51 146.98 34.05 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 124.441 1.088 . . . . 24.440000000000001 111.499 -178.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' I THR . . . . . 0.575 ' O ' ' N ' ' H' ' 63' ' ' ASP . 26.5 p -136.07 139.45 43.05 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 113.347 -1.752 . . . . 25.550000000000001 110.13 177.948 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 61' ' ' GLU . . . . . 0.636 ' OE1' ' HA ' ' H' ' 87' ' ' LYS . 1.9 pm0 -22.54 -40.21 0.0 OUTLIER 'General case' 0 C--O 1.255 1.346 0 C-N-CA 126.799 2.04 . . . . 25.989999999999998 114.788 -177.91 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 62' ' ' ASN . . . . . 0.508 ' N ' ' O ' ' H' ' 60' I THR . 0.9 OUTLIER -77.55 5.95 8.07 Favored 'General case' 0 C--O 1.248 0.977 0 O-C-N 125.889 1.993 . . . . 27.789999999999999 111.781 -179.017 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 63' ' ' ASP . . . . . 0.575 ' N ' ' O ' ' H' ' 60' I THR . 45.5 m-20 -117.57 -8.16 10.99 Favored 'General case' 0 C--N 1.308 -1.228 0 C-N-CA 124.379 1.071 . . . . 26.190000000000001 109.236 178.824 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 64' ' ' LEU . . . . . 0.62 ' HB2' ' CD1' ' H' ' 85' ' ' LEU . 26.8 mt -120.67 156.73 31.11 Favored 'General case' 0 C--N 1.321 -0.645 0 O-C-N 126.341 2.276 . . . . 26.300000000000001 115.279 -175.231 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 65' ' ' LEU . . . . . . . . . . . . 0.282 1.6 tp -141.77 145.74 35.14 Favored 'General case' 0 C--O 1.256 1.425 0 CA-C-N 111.575 -2.557 . . . . 24.989999999999998 105.414 179.577 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 66' ' ' VAL . . . . . 0.631 HG13 HD21 ' H' ' 85' ' ' LEU 0.279 25.6 m -114.26 136.71 49.95 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 125.422 1.701 . . . . 23.739999999999998 108.869 177.049 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 67' ' ' ARG . . . . . . . . . . . . . 47.8 mtp180 -118.49 107.84 14.28 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.448 -1.251 . . . . 25.75 110.596 -179.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 68' ' ' ILE . . . . . 0.631 HG23 HG22 ' H' ' 31' ' ' VAL . 1.8 mt -114.32 137.86 46.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 CA-C-N 114.053 -1.43 . . . . 23.059999999999999 110.866 -176.916 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 69' ' ' GLY . . . . . . . . . . . . . . . 104.29 8.9 37.51 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 125.15 1.357 . . . . 21.620000000000001 112.688 177.053 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 70' ' ' LYS . . . . . 0.482 ' NZ ' ' O ' ' H' ' 75' ' ' ARG . 26.5 mtpp -79.86 138.61 37.23 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 117.322 2.342 . . . . 23.350000000000001 117.322 -175.565 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 71' ' ' HIS . . . . . 0.576 ' HE1' ' O ' ' H' ' 22' ' ' ALA . 77.3 t60 -116.06 -57.19 2.24 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 111.71 -2.495 . . . . 22.609999999999999 105.406 177.573 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 72' ' ' SER . . . . . 0.408 ' O ' ' HE3' ' H' ' 70' ' ' LYS . 48.4 t -75.21 134.03 41.27 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 113.233 -1.803 . . . . 24.989999999999998 109.111 178.557 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 73' ' ' ARG . . . . . 0.553 ' NH2' ' OD2' ' I' ' 55' ' ' ASP . 7.9 ttt-85 -68.68 -61.19 1.92 Allowed 'General case' 0 C--O 1.253 1.255 0 CA-C-N 113.544 -1.662 . . . . 29.309999999999999 112.823 -178.302 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 74' ' ' THR . . . . . 0.499 ' HB ' ' O ' ' I' ' 55' ' ' ASP . 18.9 p -80.46 -31.77 37.31 Favored 'General case' 0 C--O 1.268 2.077 0 N-CA-C 119.621 3.193 . . . . 27.600000000000001 119.621 -174.868 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 75' ' ' ARG . . . . . 0.567 ' NH1' ' O ' ' H' ' 576' ' ' HOH . 3.2 mpt_? -89.57 162.16 15.81 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 117.639 2.459 . . . . 29.449999999999999 117.639 -175.344 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 76' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -88.89 84.81 6.65 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-N 113.351 -1.75 . . . . 27.399999999999999 111.304 178.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 77' ' ' GLU . . . . . 0.722 ' HB3' HG23 ' H' ' 79' ' ' ILE . 23.1 mt-10 -61.67 83.37 0.01 OUTLIER 'General case' 0 C--N 1.307 -1.247 0 CA-C-O 126.5 3.048 . . . . 24.890000000000001 111.154 -177.705 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 77' A ARG . . . . . . . . . . . . 0.45 5.0 ttm180 -33.02 -46.9 0.16 Allowed 'General case' 0 N--CA 1.396 -3.167 2 N-CA-C 124.491 4.997 . . . . 25.710000000000001 124.491 -173.403 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' H' H ' 78' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -123.12 10.77 9.42 Favored 'General case' 0 N--CA 1.481 1.098 0 CA-C-O 117.669 -1.158 . . . . 26.34 109.826 179.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 79' ' ' ILE . . . . . 0.722 HG23 ' HB3' ' H' ' 77' ' ' GLU . 1.2 tt -109.6 -64.45 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 O-C-N 124.879 1.362 . . . . 24.629999999999999 112.893 -176.767 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 80' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -64.28 152.41 41.11 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 125.33 1.452 . . . . 24.890000000000001 112.732 -179.499 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 81' ' ' LYS . . . . . 0.48 ' HE2' HG12 ' H' ' 112' ' ' VAL . 1.6 mmmt -125.44 120.4 30.9 Favored 'General case' 0 C--N 1.315 -0.904 0 C-N-CA 126.396 1.878 . . . . 25.09 111.754 -179.672 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 82' ' ' ILE . . . . . . . . . . . . . 16.7 mt -98.84 137.89 24.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 N-CA-C 106.925 -1.509 . . . . 25.370000000000001 106.925 176.461 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 83' ' ' SER . . . . . . . . . . . . . 2.2 m -143.66 148.43 35.77 Favored 'General case' 0 C--N 1.312 -1.064 0 O-C-N 125.723 1.89 . . . . 26.219999999999999 111.955 -179.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 84' ' ' MET . . . . . . . . . . . . . 68.6 mtm -99.85 149.84 22.98 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 111.865 -2.425 . . . . 28.16 108.161 178.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 85' ' ' LEU . . . . . 0.631 HD21 HG13 ' H' ' 66' ' ' VAL . 7.9 mt -91.22 143.33 26.78 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 112.974 -1.921 . . . . 26.140000000000001 111.16 -178.264 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 86' ' ' GLU . . . . . . . . . . . . . 13.5 tt0 -93.36 -40.84 10.17 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 112.461 -2.154 . . . . 28.149999999999999 107.652 176.108 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 87' ' ' LYS . . . . . 0.7 ' HB2' ' NZ ' ' H' ' 87' ' ' LYS . 0.1 OUTLIER -168.52 147.59 4.35 Favored 'General case' 0 N--CA 1.444 -0.771 0 O-C-N 126.044 2.09 . . . . 26.149999999999999 116.135 178.901 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 88' ' ' ILE . . . . . 0.489 ' N ' ' HG3' ' H' ' 87' ' ' LYS . 69.2 mt -105.63 135.96 41.68 Favored 'Isoleucine or valine' 0 C--O 1.252 1.223 0 CA-C-N 113.569 -1.651 . . . . 22.969999999999999 109.956 177.971 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 89' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -126.38 123.47 38.02 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 107.342 -1.355 . . . . 25.170000000000002 107.342 177.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 90' ' ' ILE . . . . . 0.477 ' O ' ' C ' ' H' ' 91' ' ' HIS . 7.2 mt -112.68 131.24 64.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 O-C-N 125.712 1.882 . . . . 20.489999999999998 109.697 -179.415 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 91' ' ' HIS . . . . . 0.477 ' C ' ' O ' ' H' ' 90' ' ' ILE . 28.0 t-80 -42.44 120.94 2.59 Favored Pre-proline 0 CA--C 1.552 1.03 0 N-CA-C 103.562 -2.755 . . . . 18.489999999999998 103.562 175.654 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 92' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -55.7 -15.69 13.26 Favored 'Trans proline' 0 C--N 1.322 -0.82 0 O-C-N 126.415 2.797 . . . . 17.539999999999999 111.318 177.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 93' ' ' ARG . . . . . . . . . . . . . 77.5 mtp180 -113.63 11.85 18.32 Favored 'General case' 0 C--O 1.252 1.19 0 N-CA-C 115.709 1.744 . . . . 17.82 115.709 -177.146 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 94' ' ' TYR . . . . . . . . . . . . . 4.7 t80 -49.16 121.22 4.63 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 107.182 -1.414 . . . . 15.859999999999999 107.182 175.052 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 95' ' ' ASN . . . . . . . . . . . . . 62.3 t-20 -98.66 73.35 2.04 Favored 'General case' 0 C--N 1.31 -1.137 0 O-C-N 124.65 1.219 . . . . 15.9 112.029 -178.174 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 96' ' ' TRP . . . . . 0.687 ' O ' ' O ' ' H' ' 615' ' ' HOH . 59.0 p-90 -65.9 -24.01 66.75 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 107.973 -1.121 . . . . 17.27 107.973 178.578 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 97' ' ' ARG . . . . . . . . . . . . 0.263 67.8 mtt-85 -59.45 -52.68 64.55 Favored 'General case' 0 C--O 1.264 1.864 0 N-CA-C 117.28 2.326 . . . . 19.18 117.28 -175.612 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 97' A GLU . . . . . 0.446 ' OE1' ' NH1' ' H' ' 175' ' ' ARG . 64.0 tt0 -110.26 -63.95 1.32 Allowed 'General case' 0 C--O 1.264 1.858 0 N-CA-C 117.075 2.25 . . . . 19.789999999999999 117.075 -177.465 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 98' ' ' ASN . . . . . . . . . . . . . 46.8 p-10 -138.02 29.92 2.51 Favored 'General case' 0 C--O 1.256 1.411 0 N-CA-C 117.113 2.264 . . . . 15.800000000000001 117.113 -170.532 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 99' ' ' LEU . . . . . 0.794 HD11 ' H91' ' H' ' 400' ' ' DI4 . 60.3 mt 48.49 40.32 14.82 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 125.836 1.654 . . . . 14.57 111.799 -179.024 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 100' ' ' ASP . . . . . 0.485 ' OD2' ' O ' ' H' ' 552' ' ' HOH . 28.3 t70 -71.74 139.15 48.96 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 104.372 -2.455 . . . . 16.059999999999999 104.372 173.939 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 101' ' ' ARG . . . . . . . . . . . . . 63.0 mtt85 65.04 31.74 10.91 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 125.676 1.86 . . . . 15.94 114.041 -179.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 102' ' ' ASP . . . . . 0.447 ' OD1' ' N ' ' H' ' 56' ' ' ALA . 59.7 t0 -70.92 81.42 0.65 Allowed 'General case' 0 N--CA 1.484 1.272 0 CA-C-N 113.835 -1.53 . . . . 14.92 107.552 178.722 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 103' ' ' ILE . . . . . 0.681 HD11 HD11 ' H' ' 53' ' ' LEU . 18.3 tt -151.39 143.78 16.42 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.072 0 O-C-N 126.228 2.205 . . . . 16.530000000000001 107.244 178.443 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 104' ' ' ALA . . . . . . . . . . . . . . . -148.99 152.59 36.58 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 125.754 1.909 . . . . 17.629999999999999 106.834 178.269 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 105' ' ' LEU . . . . . . . . . . . . . 54.6 mt -123.72 142.32 51.19 Favored 'General case' 0 C--N 1.313 -1.01 0 O-C-N 126.087 2.117 . . . . 19.670000000000002 106.108 177.145 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 106' ' ' MET . . . . . 0.521 ' HE2' HD13 ' H' ' 85' ' ' LEU . 60.6 mtp -126.15 142.87 51.35 Favored 'General case' 0 C--N 1.311 -1.071 0 O-C-N 126.027 2.079 . . . . 23.43 107.475 179.319 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 107' ' ' LYS . . . . . . . . . . . . . 9.9 tptt -112.53 126.44 55.34 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 126.783 2.552 . . . . 27.399999999999999 108.651 -178.162 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 108' ' ' LEU . . . . . 0.588 HD12 ' HA ' ' H' ' 50' ' ' ARG . 23.5 mt -81.01 136.05 35.93 Favored 'General case' 0 C--O 1.247 0.971 0 O-C-N 126.728 2.517 . . . . 24.739999999999998 108.797 178.357 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 109' ' ' LYS . . . . . . . . . . . . . 23.5 ttpt -61.42 -25.69 67.38 Favored 'General case' 0 C--N 1.305 -1.346 0 CA-C-N 113.741 -1.572 . . . . 27.460000000000001 109.242 -178.151 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 110' ' ' LYS . . . . . 0.472 ' HA ' ' HD3' ' H' ' 110' ' ' LYS . 18.6 mmtm -148.01 145.67 21.53 Favored Pre-proline 0 C--N 1.319 -0.75 0 N-CA-C 106.775 -1.565 . . . . 27.390000000000001 106.775 179.283 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 111' ' ' PRO . . . . . 0.424 ' HB3' ' HG2' ' H' ' 50' ' ' ARG . 3.1 Cg_exo -72.83 170.05 20.58 Favored 'Trans proline' 0 C--N 1.304 -1.774 0 O-C-N 126.328 2.752 . . . . 24.690000000000001 108.61 -177.689 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 112' ' ' VAL . . . . . 0.48 HG12 ' HE2' ' H' ' 81' ' ' LYS . 2.5 m -115.09 141.94 29.9 Favored 'Isoleucine or valine' 0 C--O 1.247 0.932 0 O-C-N 124.309 1.006 . . . . 23.98 110.082 -179.565 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 113' ' ' ALA . . . . . . . . . . . . . . . -82.17 131.84 35.24 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 104.207 -2.516 . . . . 22.289999999999999 104.207 174.424 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 114' ' ' PHE . . . . . . . . . . . . . 11.4 m-85 -80.53 164.12 23.2 Favored 'General case' 0 C--N 1.31 -1.125 0 O-C-N 125.408 1.693 . . . . 20.899999999999999 108.107 179.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 115' ' ' SER . . . . . . . . . . . . . 78.4 p -159.65 -156.13 0.49 Allowed 'General case' 0 C--N 1.317 -0.818 0 O-C-N 125.551 1.782 . . . . 20.239999999999998 107.762 -178.537 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 116' ' ' ASP . . . . . . . . . . . . . 62.6 m-20 -78.03 -26.67 48.53 Favored 'General case' 0 C--N 1.299 -1.593 0 C-N-CA 128.135 2.574 . . . . 21.5 112.518 -178.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 117' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -106.7 -15.76 14.67 Favored 'General case' 0 C--N 1.314 -0.961 0 O-C-N 125.638 1.836 . . . . 19.359999999999999 114.117 -178.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 118' ' ' ILE . . . . . 0.415 HG23 HG22 ' H' ' 68' ' ' ILE . 20.8 mt -122.15 116.28 48.72 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.038 0 C-N-CA 124.601 1.16 . . . . 17.969999999999999 109.455 -177.545 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 119' ' ' HIS . . . . . 0.405 ' O ' ' HB3' ' H' ' 29' ' ' TRP . 28.5 t60 -162.33 144.73 8.52 Favored Pre-proline 0 C--O 1.246 0.894 0 O-C-N 125.937 2.023 . . . . 17.079999999999998 111.358 -177.261 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 120' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -76.15 143.88 26.0 Favored 'Trans proline' 0 N--CA 1.454 -0.808 0 CA-C-O 125.169 2.071 . . . . 16.850000000000001 114.272 -178.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 121' ' ' VAL . . . . . 0.674 HG12 ' O ' ' H' ' 46' ' ' LEU . 7.7 p -95.14 152.5 3.66 Favored 'Isoleucine or valine' 0 C--O 1.249 1.074 0 CA-C-N 111.82 -2.445 . . . . 16.289999999999999 104.639 175.918 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 122' ' ' CYS . . . . . . . . . . . . . 67.7 m -87.41 144.98 26.49 Favored 'General case' 0 CA--C 1.542 0.673 0 O-C-N 126.543 2.402 . . . . 15.380000000000001 110.114 -179.896 -58.046 -54.971 91.846 106.083 2.015 105.519 78.74 63.237 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 123' ' ' LEU . . . . . . . . . . . . . 34.0 mt -93.53 133.63 27.9 Favored Pre-proline 0 N--CA 1.47 0.562 0 O-C-N 127.026 2.704 . . . . 16.57 104.02 173.514 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 124' ' ' PRO . . . . . 0.454 ' HD3' ' O ' ' H' ' 209' ' ' GLN . 37.1 Cg_endo -52.93 168.42 0.5 Allowed 'Trans proline' 0 N--CA 1.451 -0.989 0 O-C-N 127.512 3.375 . . . . 18.690000000000001 113.624 179.205 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 125' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -132.85 152.76 51.78 Favored 'General case' 0 C--O 1.25 1.11 0 CA-C-N 110.884 -2.871 . . . . 23.010000000000002 105.759 177.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 126' ' ' ARG . . . . . . . . . . . . . 39.6 ttt85 -43.72 -31.4 0.79 Allowed 'General case' 0 C--O 1.258 1.513 0 N-CA-C 117.196 2.295 . . . . 28.489999999999998 117.196 -175.738 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 127' ' ' GLU . . . . . . . . . . . . . 25.4 tp10 -90.83 -34.22 15.36 Favored 'General case' 0 C--O 1.252 1.236 0 N-CA-C 112.427 0.528 . . . . 26.329999999999998 112.427 -176.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 128' ' ' THR . . . . . 0.665 HG22 HD12 ' H' ' 129' C LEU . 21.2 m -65.09 -39.6 93.4 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 124.58 1.175 . . . . 22.960000000000001 107.902 -177.949 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 129' ' ' ALA . . . . . 0.598 ' O ' ' HB2' ' H' ' 130' ' ' LEU . . . -68.45 -31.99 71.68 Favored 'General case' 0 C--O 1.247 0.935 0 CA-C-N 113.315 -1.766 . . . . 22.57 111.564 -178.686 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 129' A ALA . . . . . . . . . . . . . . . -76.41 -35.0 58.81 Favored 'General case' 0 C--O 1.245 0.862 0 CA-C-O 122.424 1.107 . . . . 22.440000000000001 109.985 -177.173 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 129' B SER . . . . . 0.64 ' O ' ' O ' ' H' ' 625' ' ' HOH . 49.4 m -76.41 -43.66 39.44 Favored 'General case' 0 C--O 1.244 0.783 0 CA-C-N 113.757 -1.565 . . . . 23.800000000000001 111.453 -179.667 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 129' C LEU . . . . . 0.665 HD12 HG22 ' H' ' 128' ' ' THR . 29.3 mt -92.64 -42.39 9.66 Favored 'General case' 0 C--O 1.259 1.596 0 N-CA-C 117.56 2.43 . . . . 21.850000000000001 117.56 -174.178 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 130' ' ' LEU . . . . . 0.598 ' HB2' ' O ' ' H' ' 129' ' ' ALA . 3.5 mt -68.42 54.87 0.08 Allowed 'General case' 0 C--O 1.25 1.126 0 O-C-N 123.812 0.695 . . . . 21.59 109.622 179.383 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 131' ' ' GLN . . . . . 0.488 ' NE2' ' O ' ' H' ' 625' ' ' HOH . 63.7 mt-30 -110.89 142.51 42.85 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 125.572 1.795 . . . . 23.23 108.638 -179.206 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 132' ' ' ALA . . . . . . . . . . . . . . . -70.83 124.2 23.76 Favored 'General case' 0 C--O 1.248 1.019 0 O-C-N 125.194 1.559 . . . . 20.890000000000001 110.661 -177.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 133' ' ' GLY . . . . . . . . . . . . . . . 112.13 -17.23 24.6 Favored Glycine 0 C--O 1.251 1.17 0 O-C-N 125.377 1.673 . . . . 20.379999999999999 110.888 -179.093 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 134' ' ' TYR . . . . . 0.409 ' O ' ' HA ' ' H' ' 161' ' ' PRO . 2.7 m-85 -77.95 154.25 31.76 Favored 'General case' 0 C--O 1.265 1.916 0 N-CA-C 108.401 -0.963 . . . . 20.530000000000001 108.401 179.844 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 135' ' ' LYS . . . . . . . . . . . . . 64.0 mttt -111.92 152.05 28.47 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-O 124.706 2.193 . . . . 19.0 114.508 -179.178 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 136' ' ' GLY . . . . . 0.433 ' O ' ' HA ' ' H' ' 159' ' ' ASN . . . -131.24 169.74 21.64 Favored Glycine 0 CA--C 1.542 1.746 0 N-CA-C 106.795 -2.522 . . . . 16.969999999999999 106.795 177.932 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 137' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -117.82 139.35 51.21 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-N 113.576 -1.312 . . . . 17.109999999999999 110.135 -179.481 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 138' ' ' VAL . . . . . . . . . . . . . 20.1 t -124.96 140.75 47.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 O-C-N 125.567 1.792 . . . . 17.710000000000001 108.518 177.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 139' ' ' THR . . . . . 0.927 HG22 HG22 ' H' ' 157' ' ' VAL . 75.1 p -130.82 160.76 33.46 Favored 'General case' 0 C--N 1.318 -0.763 0 O-C-N 124.608 1.192 . . . . 18.109999999999999 109.264 179.001 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 140' ' ' GLY . . . . . . . . . . . . . . . 157.08 159.5 9.52 Favored Glycine 0 N--CA 1.449 -0.496 0 O-C-N 125.366 1.666 . . . . 18.640000000000001 115.296 177.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 141' ' ' TRP . . . . . 0.502 ' CD1' ' HB2' ' H' ' 73' ' ' ARG . 11.5 m-90 -97.32 20.25 11.86 Favored 'General case' 0 C--O 1.246 0.916 0 C-N-CA 127.442 2.297 . . . . 19.530000000000001 112.984 -179.227 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 142' ' ' GLY . . . . . . . . . . . . . . . -76.0 172.98 54.05 Favored Glycine 0 C--O 1.246 0.859 0 CA-C-O 123.455 1.586 . . . . 20.82 114.587 -178.634 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 143' ' ' ASN . . . . . . . . . . . . . 53.6 m-20 -46.52 141.42 3.69 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 112.95 -1.625 . . . . 21.859999999999999 108.928 -178.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 144' ' ' LEU . . . . . 0.729 ' HG ' ' HD3' ' H' ' 152' ' ' PRO . 9.6 mt -87.34 -12.32 46.78 Favored 'General case' 0 C--O 1.25 1.097 0 O-C-N 125.168 1.542 . . . . 24.100000000000001 114.179 -176.711 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 145' ' ' LYS . . . . . . . . . . . . . 65.8 mmtt -158.03 152.79 25.06 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 106.626 -1.62 . . . . 24.469999999999999 106.626 179.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 146' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 . . . . . 0 C--O 1.261 1.683 0 O-C-N 125.955 2.035 . . . . 25.079999999999998 111.872 179.563 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 150' ' ' GLY . . . . . 0.643 ' O ' ' N ' ' H' ' 144' ' ' LEU . . . . . . . . 0 CA--C 1.531 1.089 0 N-CA-C 109.425 -1.47 . . . . 29.25 109.425 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 151' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -90.65 128.61 47.85 Favored Pre-proline 0 C--N 1.313 -1.005 0 CA-C-N 114.283 -0.959 . . . . 32.590000000000003 108.796 178.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 152' ' ' PRO . . . . . 0.729 ' HD3' ' HG ' ' H' ' 144' ' ' LEU . 43.7 Cg_endo -77.65 158.44 31.99 Favored 'Trans proline' 0 C--O 1.247 0.93 0 O-C-N 126.545 2.866 . . . . 28.07 109.215 176.661 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 153' ' ' SER . . . . . 0.526 ' HB2' ' O ' ' H' ' 576' ' ' HOH . 2.2 p -86.58 -34.04 20.03 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 125.608 1.817 . . . . 25.780000000000001 108.39 178.712 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 154' ' ' VAL . . . . . 0.491 HG22 ' CD2' ' H' ' 71' ' ' HIS . 1.5 t -120.99 161.96 20.3 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 CA-C-N 113.325 -1.761 . . . . 22.93 110.868 -178.503 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 155' ' ' LEU . . . . . . . . . . . . . 28.0 tp -58.36 134.16 56.36 Favored 'General case' 0 C--O 1.246 0.869 0 C-N-CA 123.973 0.909 . . . . 21.140000000000001 110.169 175.936 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 156' ' ' GLN . . . . . 0.515 ' C ' HG23 ' H' ' 157' ' ' VAL . 28.8 mm100 -100.4 166.0 11.17 Favored 'General case' 0 C--O 1.251 1.169 0 C-N-CA 124.019 0.927 . . . . 21.260000000000002 109.443 179.426 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 157' ' ' VAL . . . . . 0.927 HG22 HG22 ' H' ' 139' ' ' THR . 94.4 t -154.35 155.06 6.41 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 O-C-N 124.949 1.406 . . . . 19.329999999999998 110.887 -176.221 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 158' ' ' VAL . . . . . . . . . . . . . 7.4 p -168.52 154.91 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 O-C-N 124.909 1.381 . . . . 18.18 111.003 -179.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 159' ' ' ASN . . . . . 0.433 ' HA ' ' O ' ' H' ' 136' ' ' GLY . 11.1 m-20 -119.17 113.89 21.59 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 126.246 1.818 . . . . 18.16 112.032 -177.178 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 160' ' ' LEU . . . . . . . . . . . . 0.282 18.7 mt -121.45 137.99 27.67 Favored Pre-proline 0 C--N 1.31 -1.133 0 CA-C-N 113.101 -1.863 . . . . 17.73 109.545 -176.971 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 161' ' ' PRO . . . . . 0.559 ' HG2' ' O ' ' H' ' 512' ' ' HOH . 17.9 Cg_endo -78.39 166.1 24.64 Favored 'Trans proline' 0 C--O 1.257 1.432 0 O-C-N 125.715 2.429 . . . . 18.91 110.15 178.756 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 162' ' ' ILE . . . . . 0.434 HD11 ' CZ ' ' H' ' 199' ' ' PHE . 45.7 mm -90.14 128.36 42.13 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 N-CA-C 106.122 -1.807 . . . . 19.940000000000001 106.122 178.525 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 163' ' ' VAL . . . . . 0.495 HG21 ' CD2' ' H' ' 225' ' ' TYR . 8.3 t -95.19 138.37 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 O-C-N 126.751 2.532 . . . . 19.280000000000001 108.362 -179.981 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 164' ' ' GLU . . . . . . . . . . . . . 39.6 mp0 -54.09 151.78 6.64 Favored 'General case' 0 C--N 1.316 -0.864 0 O-C-N 126.242 2.214 . . . . 23.82 109.593 179.364 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 165' ' ' ARG . . . . . 0.858 ' NH2' ' O ' ' H' ' 177' ' ' THR 0.331 10.1 ttt85 -53.72 -51.7 74.05 Favored Pre-proline 0 C--O 1.256 1.443 0 N-CA-C 114.812 1.412 . . . . 19.399999999999999 114.812 -176.116 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 166' ' ' PRO . . . . . 0.519 ' HD2' ' N ' ' H' ' 165' ' ' ARG . 3.3 Cg_exo -50.13 -61.85 0.5 Allowed 'Trans proline' 0 C--N 1.313 -1.3 0 C-N-CA 124.289 3.326 . . . . 18.489999999999998 111.193 -178.897 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 167' ' ' VAL . . . . . . . . . . . . . 97.0 t -45.96 -49.42 4.85 Favored 'Isoleucine or valine' 0 C--O 1.247 0.969 0 CA-C-N 112.917 -1.947 . . . . 18.129999999999999 109.909 178.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 168' ' ' CYS . . . . . . . . . . . . . 68.6 m -57.43 -47.28 82.18 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 125.216 1.573 . . . . 17.82 108.357 -179.382 -71.929 -62.661 -92.148 105.003 2.0 105.448 -74.54 94.08 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 169' ' ' LYS . . . . . . . . . . . . . 12.8 ttmm -60.53 -42.39 96.38 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-N 112.566 -2.106 . . . . 20.59 111.78 -179.108 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 170' ' ' ASP . . . . . . . . . . . . 0.356 17.0 m-20 -80.12 12.23 2.96 Favored 'General case' 0 C--O 1.26 1.653 0 N-CA-C 116.469 2.025 . . . . 18.129999999999999 116.469 -177.661 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 171' ' ' SER . . . . . . . . . . . . . 2.9 p -110.13 -9.19 14.71 Favored 'General case' 0 C--O 1.262 1.732 0 N-CA-C 114.396 1.258 . . . . 19.280000000000001 114.396 -177.51 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 172' ' ' THR . . . . . . . . . . . . . 10.1 t -144.78 165.05 29.18 Favored 'General case' 0 C--O 1.249 1.029 0 N-CA-C 114.515 1.302 . . . . 20.370000000000001 114.515 -175.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 173' ' ' ARG . . . . . 0.719 ' HB2' ' O ' ' H' ' 537' ' ' HOH . 28.6 mtm-85 -94.13 -17.58 22.64 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.271 1.428 . . . . 26.800000000000001 108.914 -179.073 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 174' ' ' ILE . . . . . 0.606 HD13 ' C20' ' H' ' 400' ' ' DI4 . 14.2 mt -68.89 161.07 4.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 O-C-N 126.111 2.132 . . . . 19.989999999999998 108.95 177.566 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 175' ' ' ARG . . . . . 0.446 ' NH1' ' OE1' ' H' ' 97' A GLU . 2.9 ttt180 -100.98 111.05 23.16 Favored 'General case' 0 C--N 1.311 -1.066 0 O-C-N 124.99 1.431 . . . . 18.390000000000001 109.315 179.324 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 176' ' ' ILE . . . . . . . . . . . . . 17.4 mm -79.15 142.99 13.26 Favored 'Isoleucine or valine' 0 C--O 1.246 0.88 0 CA-C-N 112.387 -2.188 . . . . 18.66 111.402 179.318 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 177' ' ' THR . . . . . 0.858 ' O ' ' NH2' ' H' ' 165' ' ' ARG . 11.0 p -122.06 179.71 4.43 Favored 'General case' 0 C--O 1.248 0.976 0 CA-C-O 122.953 1.359 . . . . 17.379999999999999 110.345 177.135 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 178' ' ' ASP . . . . . 0.571 ' O ' ' HD2' ' H' ' 233' ' ' ARG . 14.9 m-20 -71.95 -24.75 61.66 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 113.124 -1.853 . . . . 17.239999999999998 112.536 -178.771 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 179' ' ' ASN . . . . . . . . . . . . . 16.3 m-20 -87.03 24.14 1.6 Allowed 'General case' 0 N--CA 1.482 1.16 0 O-C-N 124.565 1.166 . . . . 16.460000000000001 107.857 177.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 180' ' ' MET . . . . . . . . . . . . . 48.6 mtt -137.94 144.8 41.4 Favored 'General case' 0 C--N 1.322 -0.625 0 O-C-N 125.669 1.856 . . . . 16.68 112.598 -176.611 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 181' ' ' PHE . . . . . . . . . . . . . 12.8 p90 -141.63 158.72 43.47 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 126.433 2.333 . . . . 16.079999999999998 106.222 174.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 182' ' ' CYS . . . . . 0.536 ' HA ' ' O ' ' H' ' 226' ' ' GLY . 0.5 OUTLIER -125.74 156.11 39.91 Favored 'General case' 0 C--N 1.319 -0.728 0 O-C-N 125.695 1.872 . . . . 17.16 109.448 177.904 94.08 -74.54 -92.148 105.448 2.0 105.003 -62.661 -71.929 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 183' ' ' ALA . . . . . 0.407 ' HA ' HG23 ' H' ' 163' ' ' VAL . . . -151.1 147.31 26.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 113.016 -1.902 . . . . 18.550000000000001 110.431 -177.655 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 184' ' ' GLY . . . . . . . . . . . . . . . 155.13 165.02 13.6 Favored Glycine 0 C--O 1.25 1.119 0 N-CA-C 108.759 -1.737 . . . . 20.710000000000001 108.759 179.542 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 184' A TYR . . . . . . . . . . . . . 57.8 m-85 -85.07 143.45 28.87 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 106.719 -1.585 . . . . 23.309999999999999 106.719 176.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 185' ' ' LYS . . . . . . . . . . . . . 84.0 mttt -74.71 125.12 89.89 Favored Pre-proline 0 N--CA 1.485 1.288 0 O-C-N 125.957 2.035 . . . . 26.190000000000001 106.472 176.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 186' ' ' PRO . . . . . 0.442 ' HD3' ' O ' ' H' ' 507' ' ' HOH . 88.1 Cg_endo -31.5 -33.28 0.04 OUTLIER 'Trans proline' 0 C--O 1.269 2.034 0 C-N-CA 124.254 3.302 . . . . 27.73 117.975 -176.15 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 186' A ASP . . . . . 0.597 ' OD1' ' O ' ' H' ' 549' ' ' HOH . 58.7 m-20 -89.09 22.75 2.66 Favored 'General case' 0 C--O 1.257 1.488 0 N-CA-C 112.917 0.71 . . . . 29.52 112.917 -178.224 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 186' B GLU . . . . . . . . . . . . . 49.1 mt-10 -116.58 19.15 14.76 Favored 'General case' 0 C--O 1.258 1.504 0 N-CA-C 114.875 1.435 . . . . 30.280000000000001 114.875 -177.496 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 186' C GLY . . . . . . . . . . . . . . . 70.86 -75.22 0.59 Allowed Glycine 0 C--O 1.253 1.299 0 CA-C-O 119.119 -0.823 . . . . 28.960000000000001 111.127 179.489 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 186' D LYS . . . . . . . . . . . . . 22.1 mttt -56.95 157.74 5.46 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 122.508 1.147 . . . . 30.390000000000001 113.652 -178.107 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 187' ' ' ARG . . . . . 0.572 ' HG3' ' HG3' ' H' ' 18' ' ' GLU . 5.3 ptp180 -150.97 -163.59 1.81 Allowed 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 113.379 -1.737 . . . . 26.289999999999999 111.744 -179.44 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 188' ' ' GLY . . . . . 0.778 ' O ' ' O ' ' H' ' 653' ' ' HOH . . . 127.14 155.51 8.86 Favored Glycine 0 C--O 1.253 1.309 0 O-C-N 124.644 1.215 . . . . 24.41 111.214 179.055 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 189' ' ' ASP . . . . . 0.505 ' CG ' ' H ' ' H' ' 190' ' ' ALA . 48.8 t0 -157.77 -177.99 6.98 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 125.919 2.771 . . . . 22.530000000000001 112.394 179.706 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 190' ' ' ALA . . . . . 0.948 ' HB1' ' O ' ' H' ' 574' ' ' HOH . . . -100.87 156.05 17.6 Favored 'General case' 0 C--O 1.253 1.237 0 N-CA-C 102.082 -3.303 . . . . 21.77 102.082 173.967 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 191' ' ' CYS . . . . . . . . . . . . . 5.3 t -145.75 176.94 9.27 Favored 'General case' 0 C--N 1.297 -1.684 0 O-C-N 126.211 2.194 . . . . 22.969999999999999 108.205 -178.257 -158.238 49.415 87.44 103.737 2.024 104.947 -169.812 -49.794 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 192' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -59.63 127.78 33.69 Favored 'General case' 0 C--N 1.316 -0.853 0 O-C-N 125.174 1.546 . . . . 24.079999999999998 110.608 -179.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 193' ' ' GLY . . . . . . . . . . . . . . . 110.95 -16.55 27.9 Favored Glycine 0 C--O 1.248 1.008 0 O-C-N 125.368 1.667 . . . . 20.530000000000001 110.675 179.472 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 194' ' ' ASP . . . . . 0.41 ' CB ' ' O ' ' H' ' 574' ' ' HOH . 98.8 m-20 -87.77 -6.09 58.33 Favored 'General case' 0 C--O 1.255 1.383 0 N-CA-C 113.933 1.086 . . . . 19.199999999999999 113.933 -177.542 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 195' ' ' SER . . . . . . . . . . . . . 56.0 m -64.44 148.86 49.62 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 124.054 0.847 . . . . 18.649999999999999 111.647 -175.258 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 196' ' ' GLY . . . . . 0.47 ' HA2' ' H ' ' H' ' 55' ' ' ALA . . . 86.78 -5.89 84.0 Favored Glycine 0 CA--C 1.545 1.95 0 O-C-N 128.058 3.349 . . . . 15.35 105.453 179.74 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 197' ' ' GLY . . . . . 0.403 ' HA2' ' HD2' ' H' ' 198' ' ' PRO . . . -74.94 140.54 26.87 Favored Glycine 0 N--CA 1.433 -1.525 0 O-C-N 127.521 2.542 . . . . 14.869999999999999 111.806 179.573 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 198' ' ' PRO . . . . . 0.403 ' HD2' ' HA2' ' H' ' 197' ' ' GLY . 57.8 Cg_endo -80.07 149.31 19.85 Favored 'Trans proline' 0 CA--C 1.501 -1.14 0 N-CA-C 118.922 2.624 . . . . 14.51 118.922 -174.981 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 199' ' ' PHE . . . . . 0.434 ' CZ ' HD11 ' H' ' 162' ' ' ILE . 6.6 t80 -120.54 93.53 4.07 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 105.94 -1.874 . . . . 13.890000000000001 105.94 175.615 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 200' ' ' VAL . . . . . 0.461 ' HA ' ' O ' ' H' ' 208' ' ' TYR . 10.2 m -97.34 169.1 1.51 Allowed 'Isoleucine or valine' 0 C--O 1.241 0.624 0 CA-C-O 124.149 1.928 . . . . 14.550000000000001 114.42 -178.705 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 201' ' ' MET . . . . . . . . . . . . . 47.1 mtp -150.98 156.64 41.58 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 112.681 -2.054 . . . . 14.199999999999999 106.675 177.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 202' ' ' LYS . . . . . 0.488 ' HB3' HD21 ' L' ' 14' G LEU . 30.2 tttt -109.05 125.44 52.1 Favored 'General case' 0 C--N 1.313 -1.009 0 O-C-N 126.026 2.079 . . . . 15.84 107.871 -179.797 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 203' ' ' SER . . . . . 0.894 ' HB3' HD21 ' H' ' 204' B ASN . 47.8 t -72.01 126.29 91.32 Favored Pre-proline 0 C--O 1.259 1.575 0 O-C-N 127.856 3.223 . . . . 15.85 107.608 178.598 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 204' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_exo -78.03 1.45 8.9 Favored 'Trans proline' 0 C--N 1.317 -1.128 0 C-N-CA 121.958 1.772 . . . . 15.75 108.821 179.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 204' A PHE . . . . . 0.436 ' HD2' ' OG ' ' H' ' 203' ' ' SER . 3.8 m-85 -100.41 -47.6 4.85 Favored 'General case' 0 C--N 1.309 -1.183 0 O-C-N 125.403 1.69 . . . . 15.800000000000001 112.986 -175.42 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 204' B ASN . . . . . 0.894 HD21 ' HB3' ' H' ' 203' ' ' SER . 0.0 OUTLIER -123.59 6.16 8.89 Favored 'General case' 0 C--N 1.307 -1.273 0 C-N-CA 124.622 1.169 . . . . 15.109999999999999 112.889 -178.84 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 205' ' ' ASN . . . . . . . . . . . . . 17.7 m120 53.95 27.07 6.9 Favored 'General case' 0 C--O 1.255 1.371 0 C-N-CA 125.033 1.333 . . . . 18.91 113.951 179.686 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 206' ' ' ARG . . . . . 0.418 ' HD2' ' OD1' ' H' ' 204' B ASN . 73.8 mtt-85 -98.08 157.74 15.95 Favored 'General case' 0 N--CA 1.499 2.014 0 N-CA-C 105.862 -1.903 . . . . 18.210000000000001 105.862 -179.497 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 207' ' ' TRP . . . . . 0.417 ' CE3' HG23 ' H' ' 200' ' ' VAL . 88.2 m95 -101.61 136.2 41.86 Favored 'General case' 0 C--N 1.31 -1.146 0 O-C-N 127.762 3.164 . . . . 14.970000000000001 105.897 178.944 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 208' ' ' TYR . . . . . 0.461 ' O ' ' HA ' ' H' ' 200' ' ' VAL . 56.6 m-85 -126.01 135.36 51.71 Favored 'General case' 0 C--N 1.312 -1.032 0 O-C-N 126.967 2.667 . . . . 15.789999999999999 109.422 -178.538 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 209' ' ' GLN . . . . . 0.454 ' O ' ' HD3' ' H' ' 124' ' ' PRO . 43.9 tt0 -84.63 116.86 23.41 Favored 'General case' 0 C--N 1.305 -1.351 0 O-C-N 125.976 2.048 . . . . 12.65 106.602 172.608 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 210' ' ' MET . . . . . . . . . . . . . 61.8 mmm -97.1 -30.22 13.16 Favored 'General case' 0 N--CA 1.433 -1.325 0 C-N-CA 127.314 2.245 . . . . 14.4 114.003 -179.588 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 211' ' ' GLY . . . . . 0.451 ' HA2' ' O ' ' H' ' 229' ' ' THR . . . -140.9 172.34 23.71 Favored Glycine 0 C--N 1.315 -0.603 0 C-N-CA 123.878 0.751 . . . . 11.9 113.447 -177.027 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 212' ' ' ILE . . . . . . . . . . . . . 78.7 mt -133.6 129.03 55.25 Favored 'Isoleucine or valine' 0 C--O 1.246 0.908 0 N-CA-C 104.938 -2.245 . . . . 11.4 104.938 176.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 213' ' ' VAL . . . . . . . . . . . . . 69.3 t -55.64 114.56 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 O-C-N 128.228 3.455 . . . . 11.609999999999999 106.236 178.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 214' ' ' SER . . . . . . . . . . . . 0.281 22.9 t -107.71 -66.72 1.01 Allowed 'General case' 0 C--O 1.249 1.073 0 CA-C-N 114.228 -1.351 . . . . 12.85 114.588 -177.444 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 215' ' ' TRP . . . . . 0.674 ' CE3' ' H20' ' H' ' 400' ' ' DI4 . 68.4 p-90 -159.39 173.53 16.11 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 126.536 2.397 . . . . 14.470000000000001 113.352 -176.127 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 216' ' ' GLY . . . . . 0.475 ' HA3' ' H61' ' H' ' 400' ' ' DI4 . . . 173.64 149.67 7.09 Favored Glycine 0 N--CA 1.491 2.351 0 CA-C-N 110.798 -2.91 . . . . 18.920000000000002 106.687 179.564 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 217' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -98.59 92.48 5.64 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 127.236 2.374 . . . . 22.34 107.55 -178.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 219' ' ' GLY . . . . . . . . . . . . . . . 76.63 153.86 5.32 Favored Glycine 0 N--CA 1.478 1.476 0 CA-C-O 123.777 1.765 . . . . 23.050000000000001 110.988 -176.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 220' ' ' CYS . . . . . 0.624 ' O ' ' O ' ' H' ' 221' ' ' ASP . 29.8 m -96.12 134.59 39.0 Favored 'General case' 0 C--O 1.242 0.681 0 C-N-CA 126.368 1.867 . . . . 23.260000000000002 113.493 -177.701 -49.794 -169.812 87.44 104.947 2.024 103.737 49.415 -158.238 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 221' ' ' ASP . . . . . 0.624 ' O ' ' O ' ' H' ' 220' ' ' CYS . 24.3 t0 35.82 97.54 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 106.052 -1.832 . . . . 23.690000000000001 106.052 -179.211 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 221' A ARG . . . . . . . . . . . . . 12.2 mtt85 -146.49 138.11 24.61 Favored 'General case' 0 C--O 1.242 0.67 0 CA-C-N 112.451 -2.158 . . . . 24.25 106.382 -179.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 222' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.43 140.77 54.12 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 125.276 1.61 . . . . 24.649999999999999 107.966 -178.715 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 223' ' ' GLY . . . . . . . . . . . . . . . 70.39 12.11 69.01 Favored Glycine 0 C--O 1.261 1.785 0 C-N-CA 124.827 1.203 . . . . 22.859999999999999 112.712 179.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 224' ' ' LYS . . . . . . . . . . . . . 2.8 mmtp -122.73 165.23 16.89 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 117.878 -1.058 . . . . 21.579999999999998 108.392 178.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 225' ' ' TYR . . . . . 0.495 ' CD2' HG21 ' H' ' 163' ' ' VAL . 53.9 m-85 -146.75 175.6 10.5 Favored 'General case' 0 C--O 1.243 0.717 0 O-C-N 125.076 1.485 . . . . 18.210000000000001 112.044 -178.287 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 226' ' ' GLY . . . . . 0.536 ' O ' ' HA ' ' H' ' 182' ' ' CYS . . . -102.88 147.39 16.94 Favored Glycine 0 N--CA 1.477 1.379 0 N-CA-C 106.781 -2.527 . . . . 16.039999999999999 106.781 179.731 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 227' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -118.12 138.23 52.41 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 126.576 1.986 . . . . 13.470000000000001 109.71 -179.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 228' ' ' TYR . . . . . . . . . . . . . 38.7 m-85 -132.33 140.44 48.55 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 125.304 1.627 . . . . 15.609999999999999 110.797 -177.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 229' ' ' THR . . . . . 0.451 ' O ' ' HA2' ' H' ' 211' ' ' GLY . 20.4 m -60.66 129.64 42.53 Favored 'General case' 0 C--O 1.255 1.367 0 N-CA-C 107.678 -1.23 . . . . 13.6 107.678 175.294 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 230' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -86.1 99.85 11.77 Favored 'General case' 0 N--CA 1.504 2.246 0 CA-C-O 123.476 1.608 . . . . 15.039999999999999 107.065 179.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 231' ' ' VAL . . . . . . . . . . . . 0.283 3.9 t -65.11 -33.51 64.24 Favored 'Isoleucine or valine' 0 C--O 1.264 1.823 0 N-CA-C 118.891 2.923 . . . . 15.48 118.891 -173.628 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 232' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -65.38 -43.34 91.0 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 106.688 -1.597 . . . . 17.670000000000002 106.688 178.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 233' ' ' ARG . . . . . 0.571 ' HD2' ' O ' ' H' ' 178' ' ' ASP . 2.5 mtt180 -61.13 -29.76 69.97 Favored 'General case' 0 C--O 1.247 0.972 0 CA-C-N 114.43 -1.259 . . . . 19.68 114.343 -179.15 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 234' ' ' LEU . . . . . . . . . . . . . 13.4 mt -103.47 11.47 36.36 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 107.645 -1.243 . . . . 19.719999999999999 107.645 179.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 235' ' ' LYS . . . . . 0.703 ' HB3' ' NZ ' ' H' ' 236' ' ' LYS . 33.9 tttt -56.58 -53.35 58.63 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 112.768 -2.014 . . . . 22.210000000000001 108.67 -174.057 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 236' ' ' LYS . . . . . 0.849 ' HD2' ' OE1' ' H' ' 239' ' ' GLN 0.42 0.0 OUTLIER -55.89 -20.35 15.44 Favored 'General case' 0 CA--C 1.483 -1.609 0 N-CA-C 117.054 2.242 . . . . 23.09 117.054 -176.374 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' H' H ' 237' ' ' TRP . . . . . 0.44 ' O ' HG12 ' H' ' 241' ' ' VAL . 39.3 t90 -80.25 -41.12 25.65 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 106.459 -1.682 . . . . 24.949999999999999 106.459 176.246 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 238' ' ' ILE . . . . . 0.584 HD11 HD11 ' H' ' 103' ' ' ILE . 45.0 mt -51.67 -61.83 0.66 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.517 0 O-C-N 126.864 2.602 . . . . 26.079999999999998 110.767 -179.628 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 239' ' ' GLN . . . . . 0.849 ' OE1' ' HD2' ' H' ' 236' ' ' LYS . 70.5 mt-30 -50.42 -49.04 55.88 Favored 'General case' 0 N--CA 1.481 1.088 0 O-C-N 124.555 1.16 . . . . 28.879999999999999 110.674 179.479 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 240' ' ' LYS . . . . . 0.611 ' HE2' ' NE2' ' H' ' 244' ' ' GLN . 10.2 tmtt? -43.8 -68.32 0.21 Allowed 'General case' 0 C--O 1.254 1.333 0 CA-C-N 115.637 -0.711 . . . . 31.620000000000001 111.365 -179.764 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 241' ' ' VAL . . . . . 0.681 ' O ' ' HD2' ' H' ' 245' ' ' PHE . 0.2 OUTLIER -59.87 -16.96 12.47 Favored 'Isoleucine or valine' 0 C--O 1.256 1.427 0 C-N-CA 123.911 0.884 . . . . 29.32 112.857 -178.883 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 242' ' ' ILE . . . . . . . . . . . . . 4.2 mt -88.29 -28.85 5.37 Favored 'Isoleucine or valine' 0 C--O 1.247 0.961 0 CA-C-N 115.282 -0.872 . . . . 30.23 110.414 -179.251 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 243' ' ' ASP . . . . . . . . . . . . . 50.1 m-20 -86.71 -21.59 26.53 Favored 'General case' 0 C--O 1.248 1.026 0 CA-C-N 115.558 -0.746 . . . . 31.710000000000001 110.925 -179.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 244' ' ' GLN . . . . . 0.611 ' NE2' ' HE2' ' H' ' 240' ' ' LYS . 10.5 tt0 -84.15 -38.7 20.34 Favored 'General case' 0 C--O 1.244 0.775 0 CA-C-O 122.502 1.144 . . . . 32.539999999999999 110.428 -178.681 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 245' ' ' PHE . . . . . 0.681 ' HD2' ' O ' ' H' ' 241' ' ' VAL . 1.9 m-85 . . . . . 0 N--CA 1.49 1.539 0 CA-C-N 114.321 -1.308 . . . . 31.82 109.934 -176.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.025 0 N-CA-C 106.359 -2.696 . . . . 35.420000000000002 106.359 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 55' ' ' ASP . . . . . 0.553 ' OD2' ' NH2' ' H' ' 73' ' ' ARG . 21.1 t0 -86.73 -8.2 57.6 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 103.079 -2.934 . . . . 35.090000000000003 103.079 174.902 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 56' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -95.71 151.14 19.63 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 109.859 -3.337 . . . . 34.329999999999998 110.71 -176.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 57' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -90.39 127.46 36.2 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 112.782 -2.008 . . . . 33.799999999999997 109.656 -179.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 58' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -45.08 143.46 1.56 Allowed 'General case' 0 C--O 1.249 1.027 0 O-C-N 125.78 1.925 . . . . 36.18 109.847 179.978 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 59' ' ' ILE . . . . . 0.517 HG12 ' OE1' ' H' ' 38' ' ' GLN . 36.7 pt -108.2 141.34 22.98 Favored Pre-proline 0 C--O 1.246 0.918 0 O-C-N 125.361 1.663 . . . . 35.770000000000003 107.34 178.069 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 60' ' ' PRO . . . . . 0.509 ' C ' ' O ' ' I' ' 59' ' ' ILE . 97.3 Cg_exo . . . . . 0 C--O 1.252 1.201 0 O-C-N 126.27 2.721 . . . . 35.740000000000002 109.23 -179.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 400' ' ' DI4 . . . . . 0.794 ' H91' HD11 ' H' ' 99' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 541' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 556' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 591' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 593' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 595' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 596' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 602' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 636' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 649' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 650' ' ' HOH . . . . . 0.534 ' O ' ' HB2' ' L' ' 14' D ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 651' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 501' ' ' HOH . . . . . 0.565 ' O ' ' NH1' ' H' ' 165' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 505' ' ' HOH . . . . . 0.43 ' O ' ' HD2' ' H' ' 81' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 507' ' ' HOH . . . . . 0.442 ' O ' ' HD3' ' H' ' 186' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 512' ' ' HOH . . . . . 0.559 ' O ' ' HG2' ' H' ' 161' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 522' ' ' HOH . . . . . 0.511 ' O ' HG12 ' H' ' 24' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 537' ' ' HOH . . . . . 0.719 ' O ' ' HB2' ' H' ' 173' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 538' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 544' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 548' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 549' ' ' HOH . . . . . 0.597 ' O ' ' OD1' ' H' ' 186' A ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 551' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 552' ' ' HOH . . . . . 0.485 ' O ' ' OD2' ' H' ' 100' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 553' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 554' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 555' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 557' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 559' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 561' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 562' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 568' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 569' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 570' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 571' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 572' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 574' ' ' HOH . . . . . 0.948 ' O ' ' HB1' ' H' ' 190' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 575' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 576' ' ' HOH . . . . . 0.567 ' O ' ' NH1' ' H' ' 75' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 577' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 578' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 579' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 580' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 581' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 582' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 583' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 584' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 586' ' ' HOH . . . . . 0.906 ' O ' ' N ' ' H' ' 16' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 587' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 588' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 589' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 590' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 594' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 599' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 600' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 601' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 603' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 605' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 609' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 611' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 614' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 615' ' ' HOH . . . . . 0.687 ' O ' ' O ' ' H' ' 96' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 616' ' ' HOH . . . . . 0.429 ' O ' HD11 ' H' ' 79' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 617' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 620' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 621' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 623' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 624' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 625' ' ' HOH . . . . . 0.64 ' O ' ' O ' ' H' ' 129' B SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 626' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 628' ' ' HOH . . . . . 0.779 ' O ' ' O ' ' H' ' 47' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 630' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 631' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 632' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 635' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 638' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 640' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 641' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 643' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 644' ' ' HOH . . . . . 0.603 ' O ' ' HB2' ' H' ' 236' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 647' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 648' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 652' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 653' ' ' HOH . . . . . 0.778 ' O ' ' O ' ' H' ' 188' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 654' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_