data_1b5g_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 1b5g _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' C GLU . . . . . . . . . . . . . 2.3 mm-40 . . . . . 0 C--O 1.246 0.887 0 CA-C-O 120.667 0.27 . . . . 50.0 110.902 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 1' B ALA . . . . . . . . . . . . . . . -152.12 -46.59 0.11 Allowed 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 125.542 1.537 . . . . 41.22 108.654 -179.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 1' A ASP . . . . . . . . . . . . . 2.5 t0 -104.24 5.71 34.97 Favored 'General case' 0 CA--C 1.549 0.935 0 CA-C-N 110.925 -2.852 . . . . 44.79 109.142 177.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 1' ' ' CYS . . . . . . . . . . . . . 14.4 p -52.16 154.9 2.12 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 126.341 2.972 . . . . 28.0 112.82 -178.822 75.182 69.94 103.946 104.647 2.011 101.178 -56.326 -60.626 1 1 . 1 . 001 ecloud orig full ' L' L ' 2' ' ' GLY . . . . . . . . . . . . . . . 55.59 9.61 2.6 Favored Glycine 0 N--CA 1.399 -3.8 0 CA-C-O 114.321 -3.488 . . . . 22.18 117.822 175.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 3' ' ' LEU . . . . . . . . . . . . . 67.7 mt -107.76 113.08 26.09 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 121.806 2.803 . . . . 20.6 105.775 172.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 4' ' ' ARG . . . . . . . . . . . . . 90.8 mtm180 -74.94 122.74 88.14 Favored Pre-proline 0 C--N 1.302 -1.495 0 CA-C-O 123.532 1.634 . . . . 19.76 114.156 -176.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 5' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -52.6 -32.92 56.26 Favored 'Trans proline' 0 C--O 1.259 1.53 0 CA-C-O 114.11 -2.537 . . . . 21.71 110.032 179.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -100.15 8.01 44.17 Favored 'General case' 0 C--N 1.303 -1.44 1 CA-C-N 127.398 4.635 . . . . 19.28 117.015 -175.715 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' L' L ' 7' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -138.29 -84.46 0.29 Allowed 'General case' 0 N--CA 1.502 2.173 0 N-CA-C 105.202 -2.147 . . . . 21.82 105.202 -176.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 8' ' ' GLU . . . . . . . . . . . . . 45.6 mp0 -49.29 -55.39 12.88 Favored 'General case' 0 C--O 1.254 1.341 0 N-CA-C 115.184 1.55 . . . . 21.8 115.184 -178.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 9' ' ' LYS . . . . . . . . . . . . . 17.0 mmtm -58.4 -19.4 35.67 Favored 'General case' 0 C--N 1.311 -1.093 0 C-N-CA 128.928 2.891 . . . . 29.56 112.714 -177.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 10' ' ' LYS . . . . . 0.658 ' CE ' ' O ' ' L' ' 515' ' ' HOH . 10.0 mtpt -115.48 1.51 13.66 Favored 'General case' 0 C--N 1.297 -1.7 0 CA-C-N 121.498 1.954 . . . . 33.95 107.009 -178.892 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 11' ' ' SER . . . . . . . . . . . . . 15.2 t 58.69 40.37 23.39 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 128.079 3.362 . . . . 25.47 113.096 -176.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 12' ' ' LEU . . . . . . . . . . . . . 85.4 mt -109.41 146.98 33.56 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 105.961 -1.866 . . . . 23.67 105.961 176.167 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 13' ' ' GLU . . . . . . . . . . . . . 80.2 mt-10 -106.39 144.43 33.09 Favored 'General case' 0 C--N 1.296 -1.759 0 O-C-N 126.317 2.261 . . . . 39.63 111.969 -178.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' ' ' ASP . . . . . . . . . . . . 0.25 2.0 p30 -74.23 166.66 23.06 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 126.342 2.276 . . . . 23.76 105.722 175.358 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 14' A LYS . . . . . . . . . . . . 0.356 0.0 OUTLIER -68.98 -7.44 35.39 Favored 'General case' 0 N--CA 1.428 -1.547 0 N-CA-C 117.618 2.451 . . . . 39.99 117.618 -175.186 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' L' L ' 14' B THR . . . . . . . . . . . . . 31.0 p -137.25 12.67 3.04 Favored 'General case' 0 C--N 1.291 -1.96 0 CA-C-N 123.573 2.897 . . . . 23.55 108.368 179.59 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' C GLU . . . . . . . . . . . . . 13.3 pt-20 -69.92 -25.26 63.59 Favored 'General case' 0 C--O 1.266 1.962 0 C-N-CA 112.918 -3.513 . . . . 23.72 110.947 179.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' D ARG . . . . . . . . . . . . . 21.6 ptt180 -53.35 -43.1 67.47 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 119.755 1.161 . . . . 49.36 111.1 179.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' E GLU . . . . . . . . . . . . . 19.9 tt0 -51.4 -47.66 62.87 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 128.732 2.813 . . . . 33.42 110.737 177.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' F LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.34 -64.38 0.97 Allowed 'General case' 0 C--N 1.315 -0.934 0 O-C-N 121.446 -0.784 . . . . 24.26 110.456 174.383 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 14' G LEU . . . . . . . . . . . . . 3.6 mm? -51.16 -40.16 57.96 Favored 'General case' 0 C--N 1.311 -1.076 0 C-N-CA 125.431 1.493 . . . . 29.9 113.022 -178.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' H GLU . . . . . . . . . . . . . 89.1 mt-10 -69.51 -7.7 40.54 Favored 'General case' 0 C--O 1.25 1.127 0 O-C-N 119.262 -2.149 . . . . 35.62 114.604 177.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' I SER . . . . . 0.692 ' C ' ' N ' ' L' ' 14' K ILE . 21.0 p -97.6 -21.55 17.0 Favored 'General case' 0 C--O 1.257 1.473 0 O-C-N 124.698 1.249 . . . . 29.22 111.526 -178.39 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 14' J TYR . . . . . 0.752 ' C ' ' CG1' ' L' ' 14' K ILE . 6.4 m-30 -82.91 38.53 0.59 Allowed 'General case' 0 N--CA 1.509 2.515 1 N-CA-C 98.499 -4.63 . . . . 34.12 98.499 -179.322 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' L' L ' 14' K ILE . . . . . 0.752 ' CG1' ' C ' ' L' ' 14' J TYR 0.312 0.2 OUTLIER 48.49 68.5 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.101 1 CA-C-N 105.568 -5.287 . . . . 41.93 108.912 -172.824 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' L' L ' 14' L ASP . . . . . . . . . . . . 0.351 5.7 t0 . . . . . 0 CA--C 1.566 1.593 0 C-N-CA 130.432 3.493 . . . . 47.4 106.779 -175.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 16' ' ' ILE . . . . . . . . . . . . . 46.4 mm . . . . . 0 N--CA 1.449 -0.505 0 N-CA-C 107.56 -1.274 . . . . 21.87 107.56 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 17' ' ' VAL . . . . . . . . . . . . . 16.1 t -101.46 125.42 55.5 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.473 0 CA-C-N 113.453 -1.703 . . . . 26.68 113.311 176.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 18' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 64.02 43.36 5.21 Favored 'General case' 0 C--O 1.248 0.996 0 CA-C-N 114.975 -1.011 . . . . 38.11 112.058 176.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 19' ' ' GLY . . . . . . . . . . . . . . . -109.01 -166.04 20.57 Favored Glycine 0 CA--C 1.536 1.394 0 N-CA-C 106.373 -2.691 . . . . 30.47 106.373 178.401 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 20' ' ' SER . . . . . . . . . . . . . 2.3 p -142.17 162.74 34.72 Favored 'General case' 0 N--CA 1.501 2.123 0 N-CA-C 106.213 -1.773 . . . . 34.61 106.213 177.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 21' ' ' ASP . . . . . 0.475 ' OD1' ' OE1' ' H' ' 156' ' ' GLN . 98.6 m-20 -59.65 142.55 52.73 Favored 'General case' 0 C--N 1.287 -2.145 0 CA-C-N 120.091 1.314 . . . . 33.19 108.809 -179.424 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 22' ' ' ALA . . . . . . . . . . . . . . . -79.39 160.36 26.72 Favored 'General case' 0 C--N 1.285 -2.219 0 N-CA-C 105.159 -2.163 . . . . 25.74 105.159 177.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 23' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -83.99 155.17 22.9 Favored 'General case' 0 C--O 1.276 2.449 0 C-N-CA 125.842 1.657 . . . . 29.84 106.543 174.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 24' ' ' ILE . . . . . . . . . . . . . 37.4 mm -65.67 138.25 23.42 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.294 0 N-CA-C 104.359 -2.46 . . . . 23.39 104.359 -179.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 25' ' ' GLY . . . . . . . . . . . . . . . 70.85 8.91 64.98 Favored Glycine 0 C--N 1.287 -2.165 0 C-N-CA 126.733 2.111 . . . . 21.03 116.175 -179.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 26' ' ' MET . . . . . 0.794 ' CE ' ' O ' ' H' ' 458' ' ' HOH . 1.1 ttt -64.3 -42.71 96.24 Favored 'General case' 0 C--O 1.256 1.439 0 CA-C-O 115.873 -2.013 . . . . 26.22 115.667 178.789 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 27' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -133.06 79.03 63.72 Favored Pre-proline 0 C--O 1.255 1.365 0 CA-C-N 123.034 2.652 . . . . 22.09 107.099 178.175 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 28' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -66.77 -8.53 21.63 Favored 'Trans proline' 0 C--N 1.287 -2.671 0 CA-C-O 128.9 3.625 . . . . 18.19 114.614 -172.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 29' ' ' TRP . . . . . . . . . . . . . 8.0 p90 -93.9 -6.85 44.69 Favored 'General case' 0 C--O 1.275 2.412 0 O-C-N 117.729 -3.107 . . . . 18.5 109.605 -179.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 30' ' ' GLN . . . . . . . . . . . . . 49.6 tp60 -64.34 123.62 19.62 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-O 123.6 1.667 . . . . 21.4 110.265 178.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 31' ' ' VAL . . . . . . . . . . . . . 80.6 t -115.81 144.03 24.38 Favored 'Isoleucine or valine' 0 C--O 1.28 2.706 0 CA-C-N 114.263 -1.335 . . . . 19.56 110.876 179.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 32' ' ' MET . . . . . . . . . . . . . 35.7 ttm -107.71 126.28 52.41 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 106.531 -1.655 . . . . 23.53 106.531 175.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 33' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -86.68 113.3 22.44 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 106.079 -1.823 . . . . 31.72 106.079 175.505 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 34' ' ' PHE . . . . . . . . . . . . . 22.4 t80 -120.99 127.79 52.11 Favored 'General case' 0 CA--C 1.505 -0.752 0 CA-C-O 126.505 3.05 . . . . 33.19 116.99 -171.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 35' ' ' ARG . . . . . . . . . . . . . 3.6 ttt180 -82.51 123.68 29.4 Favored 'General case' 0 C--O 1.246 0.888 0 CA-C-N 111.774 -2.467 . . . . 43.08 111.584 178.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 36' ' ' LYS . . . . . . . . . . . . . 78.9 mttt -67.78 -47.83 68.07 Favored 'General case' 0 C--O 1.253 1.253 0 O-C-N 125.924 2.015 . . . . 42.91 111.135 178.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 36' A SER . . . . . . . . . . . . . 0.6 OUTLIER -140.79 112.24 6.91 Favored Pre-proline 0 N--CA 1.487 1.398 0 N-CA-C 115.85 1.796 . . . . 49.1 115.85 -179.477 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 37' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -70.3 155.86 94.53 Favored 'Cis proline' 0 C--O 1.256 1.415 0 CA-C-N 121.805 1.68 . . . . 44.33 107.805 -2.269 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 38' ' ' GLN . . . . . . . . . . . . . 58.3 mt-30 -75.72 113.41 13.14 Favored 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 107.133 -1.432 . . . . 48.26 107.133 -178.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 39' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -164.44 146.03 8.4 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 125.217 1.573 . . . . 45.27 111.5 -177.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 40' ' ' LEU . . . . . . . . . . . . . 2.1 tp -61.78 129.19 39.81 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-O 114.965 -2.445 . . . . 36.23 106.765 -179.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 41' ' ' LEU . . . . . 0.444 ' CD2' ' CD2' ' H' ' 64' ' ' LEU . 4.0 tp -93.98 -53.07 4.13 Favored 'General case' 0 C--N 1.316 -0.853 1 O-C-N 129.915 4.51 . . . . 34.17 112.201 176.543 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 42' ' ' CYS . . . . . . . . . . . . 0.25 6.8 m -165.79 175.03 9.06 Favored 'General case' 0 C--O 1.25 1.092 0 CA-C-O 122.716 1.246 . . . . 25.44 110.489 -174.96 -85.048 -157.271 -94.33 101.944 1.944 109.731 -81.066 -81.491 2 2 . 1 . 001 ecloud orig full ' H' H ' 43' ' ' GLY . . . . . . . . . . . . . . . -94.38 -178.63 38.44 Favored Glycine 0 C--O 1.281 3.063 0 N-CA-C 104.961 -3.255 . . . . 21.07 104.961 173.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 44' ' ' ALA . . . . . . . . . . . . . . . -174.51 177.44 2.16 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-O 112.533 -3.603 . . . . 15.59 102.485 -179.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 45' ' ' SER . . . . . . . . . . . . . 58.3 p -144.51 152.21 40.25 Favored 'General case' 0 CA--C 1.507 -0.697 1 O-C-N 129.736 4.397 . . . . 18.62 112.503 176.626 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 46' ' ' LEU . . . . . 0.472 ' CD2' ' O ' ' H' ' 48' ' ' SER 0.285 0.0 OUTLIER -87.2 124.58 33.45 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 114.268 -2.777 . . . . 22.73 107.891 -179.921 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' H' H ' 47' ' ' ILE . . . . . . . . . . . . 0.327 46.8 pt -107.58 -19.02 6.96 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.888 0 C-N-CA 128.307 2.643 . . . . 23.72 110.65 179.413 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 48' ' ' SER . . . . . 0.472 ' O ' ' CD2' ' H' ' 46' ' ' LEU . 28.6 p -163.62 -176.76 4.83 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 119.676 -1.89 . . . . 28.28 108.267 173.857 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 49' ' ' ASP . . . . . . . . . . . . . 37.9 p-10 -71.94 -9.91 59.02 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-O 115.479 -2.201 . . . . 38.48 112.559 -176.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 50' ' ' ARG . . . . . 0.506 ' NH1' ' O ' ' H' ' 108' ' ' LEU . 0.0 OUTLIER -129.38 3.58 5.13 Favored 'General case' 0 N--CA 1.497 1.911 0 C-N-CA 116.136 -2.226 . . . . 33.58 114.706 -178.659 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 51' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -128.28 132.31 48.7 Favored 'General case' 0 CA--C 1.501 -0.911 0 O-C-N 126.66 2.475 . . . . 28.99 113.014 -176.341 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 52' ' ' VAL . . . . . . . . . . . . . 25.1 t -118.84 141.65 37.56 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 CA-C-N 112.367 -2.197 . . . . 23.12 107.241 177.61 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 53' ' ' LEU . . . . . . . . . . . . . 47.0 tp -111.08 133.72 53.23 Favored 'General case' 0 C--N 1.299 -1.605 0 O-C-N 118.034 -2.916 . . . . 20.28 110.214 178.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 54' ' ' THR . . . . . . . . . . . . . 5.8 t -148.6 -173.57 4.38 Favored 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 105.434 -2.061 . . . . 18.55 105.434 178.153 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 55' ' ' ALA . . . . . . . . . . . . . . . -85.95 135.12 33.79 Favored 'General case' 0 C--N 1.286 -2.152 0 CA-C-O 114.521 -2.657 . . . . 18.81 108.517 176.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.09 -30.62 69.37 Favored 'General case' 0 C--N 1.284 -2.259 0 CA-C-N 123.871 3.032 . . . . 21.37 111.127 177.361 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 57' ' ' HIS . . . . . 0.406 ' CD2' ' C ' ' H' ' 57' ' ' HIS . 2.8 p-80 -69.34 -10.28 57.17 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-N 119.74 1.155 . . . . 23.83 112.854 -176.803 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 58' ' ' CYS . . . . . . . . . . . . . 17.1 m -79.19 -24.08 43.43 Favored 'General case' 0 C--O 1.248 0.988 0 CA-C-O 114.383 -2.723 . . . . 22.5 108.789 173.992 -81.491 -81.066 -94.33 109.731 1.944 101.944 -157.271 -85.048 1 1 . 1 . 001 ecloud orig full ' H' H ' 59' ' ' LEU . . . . . . . . . . . . . 10.3 mt -102.25 -41.45 6.36 Favored 'General case' 0 C--O 1.255 1.38 0 O-C-N 125.486 1.741 . . . . 25.94 113.915 178.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' ' ' LEU . . . . . . . . . . . . . 15.7 tp -131.57 113.66 13.91 Favored 'General case' 0 C--N 1.298 -1.643 0 C-N-CA 128.69 2.796 . . . . 25.17 114.36 -178.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' A TYR . . . . . . . . . . . . . 9.9 t80 -147.81 79.47 9.34 Favored Pre-proline 0 C--O 1.264 1.83 0 C-N-CA 127.286 2.234 . . . . 27.61 106.969 178.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' B PRO . . . . . 0.412 ' N ' ' CD ' ' H' ' 60' C PRO . 83.4 Cg_exo -50.31 -40.43 52.56 Favored 'Trans proline' 0 C--O 1.258 1.484 0 O-C-N 125.573 2.354 . . . . 26.84 115.822 -175.654 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 60' C PRO . . . . . 0.412 ' CD ' ' N ' ' H' ' 60' B PRO . 26.7 Cg_exo -53.61 -20.99 17.84 Favored 'Trans proline' 0 C--O 1.27 2.114 0 C-N-CA 121.773 1.649 . . . . 29.25 113.558 179.038 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 60' D TRP . . . . . . . . . . . . . 46.4 m0 -121.08 13.58 11.31 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-O 116.876 -1.535 . . . . 37.93 109.14 -174.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' E ASP . . . . . 0.811 ' OD2' ' O ' ' H' ' 511' ' ' HOH . 46.1 m-20 58.05 42.3 22.76 Favored 'General case' 0 C--N 1.287 -2.116 1 O-C-N 130.046 4.591 . . . . 38.57 110.981 -177.996 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 60' F LYS . . . . . . . . . . . . . 12.7 mptt -99.73 126.25 45.76 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 127.238 2.836 . . . . 39.17 109.136 175.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' G ASN . . . . . 0.536 ' OD1' ' O ' ' H' ' 60' G ASN . 49.4 t-20 -160.11 61.7 0.35 Allowed 'General case' 0 C--O 1.247 0.95 0 C-N-CA 116.667 -2.013 . . . . 36.53 114.358 -179.202 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 60' H PHE . . . . . . . . . . . . . 64.7 m-85 -64.38 148.17 50.99 Favored 'General case' 0 C--N 1.299 -1.606 0 CA-C-O 125.49 2.567 . . . . 37.1 115.514 -179.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' I THR . . . . . . . . . . . . . 15.8 p -123.71 163.17 21.65 Favored 'General case' 0 CA--C 1.549 0.941 0 CA-C-N 110.537 -3.029 . . . . 39.07 106.813 177.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 61' ' ' GLU . . . . . 0.626 ' OE1' ' CA ' ' H' ' 87' ' ' LYS . 0.7 OUTLIER -41.14 -52.22 3.32 Favored 'General case' 0 C--O 1.255 1.373 0 CA-C-N 110.203 -3.18 . . . . 50.0 109.361 179.617 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 62' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -63.85 -27.12 68.95 Favored 'General case' 0 C--N 1.299 -1.626 0 CA-C-O 126.943 3.258 . . . . 50.0 115.975 -175.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 63' ' ' ASP . . . . . . . . . . . . . 92.3 m-20 -68.85 -30.82 69.42 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 115.607 -2.139 . . . . 46.0 114.346 -177.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 64' ' ' LEU . . . . . 0.444 ' CD2' ' CD2' ' H' ' 41' ' ' LEU . 13.2 mt -114.61 161.91 17.45 Favored 'General case' 0 C--N 1.314 -0.964 1 O-C-N 129.614 4.321 . . . . 38.56 120.327 -171.874 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 65' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -133.74 143.1 48.26 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 110.226 -3.17 . . . . 33.71 108.884 173.892 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 t -107.36 116.61 51.34 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.327 0 C-N-CA 125.854 1.662 . . . . 30.86 112.45 176.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 67' ' ' ARG . . . . . . . . . . . . . 43.7 mtp180 -110.0 113.43 26.15 Favored 'General case' 0 C--O 1.265 1.894 0 CA-C-O 125.893 2.758 . . . . 26.34 114.119 178.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 68' ' ' ILE . . . . . . . . . . . . . 1.5 mt -109.07 136.62 44.4 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.975 0 C-N-CA 129.237 3.015 . . . . 27.1 118.622 -177.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 69' ' ' GLY . . . . . . . . . . . . . . . 89.56 20.49 44.25 Favored Glycine 0 C--O 1.259 1.662 0 C-N-CA 126.86 2.171 . . . . 24.17 113.325 175.71 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 70' ' ' LYS . . . . . . . . . . . . . 20.4 mtpp -80.76 155.05 26.88 Favored 'General case' 0 CA--C 1.501 -0.925 0 CA-C-N 110.652 -2.774 . . . . 25.01 114.908 -177.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 71' ' ' HIS . . . . . . . . . . . . . 74.4 t60 -132.29 -59.36 0.93 Allowed 'General case' 0 C--O 1.257 1.456 0 CA-C-O 124.55 2.119 . . . . 24.05 106.813 176.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 72' ' ' SER . . . . . 0.501 ' OG ' ' CG ' ' H' ' 75' ' ' ARG . 3.3 t -71.73 139.74 49.24 Favored 'General case' 0 N--CA 1.504 2.269 0 CA-C-N 112.995 -1.911 . . . . 25.09 107.611 177.902 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 73' ' ' ARG . . . . . . . . . . . . . 55.1 ttp85 -67.74 -59.57 3.22 Favored 'General case' 0 C--O 1.266 1.928 0 CA-C-O 125.28 2.467 . . . . 31.55 111.879 177.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 74' ' ' THR . . . . . . . . . . . . . 30.2 p -88.34 -34.27 17.69 Favored 'General case' 0 C--O 1.264 1.845 0 N-CA-C 118.714 2.857 . . . . 32.94 118.714 -178.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 75' ' ' ARG . . . . . 0.639 ' NH1' ' CG ' ' H' ' 75' ' ' ARG . 0.2 OUTLIER -60.11 148.77 34.77 Favored 'General case' 0 N--CA 1.44 -0.926 0 CA-C-N 123.073 2.67 . . . . 31.15 112.82 179.86 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 76' ' ' TYR . . . . . . . . . . . . . 17.8 t80 -95.17 117.49 30.33 Favored 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 101.271 -3.603 . . . . 33.43 101.271 173.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 77' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -92.06 80.28 5.13 Favored 'General case' 0 CA--C 1.494 -1.185 0 CA-C-O 127.085 3.326 . . . . 29.04 112.478 -171.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 77' A ARG . . . . . . . . . . . . . 47.3 ttp85 -55.22 127.78 30.89 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 110.292 -3.14 . . . . 29.5 107.226 -174.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 78' ' ' ASN . . . . . . . . . . . . . 4.4 m120 75.14 -5.55 2.14 Favored 'General case' 0 C--O 1.252 1.236 0 O-C-N 126.341 2.276 . . . . 31.27 114.851 -179.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 79' ' ' ILE . . . . . . . . . . . . . 44.8 mt -107.11 -63.32 1.88 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 CA-C-O 122.6 1.19 . . . . 29.38 110.765 177.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 80' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -76.33 152.04 36.5 Favored 'General case' 0 CA--C 1.498 -1.037 0 CA-C-O 123.807 1.765 . . . . 27.58 112.473 -179.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 81' ' ' LYS . . . . . . . . . . . . . 20.1 mtpt -126.68 135.56 51.32 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 105.434 -2.061 . . . . 45.76 105.434 176.114 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 82' ' ' ILE . . . . . . . . . . . . . 1.2 mt -111.75 132.65 59.78 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.199 0 C-N-CA 127.367 2.267 . . . . 34.14 105.096 -176.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 83' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -132.2 171.99 12.97 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 119.752 1.16 . . . . 37.53 108.157 -178.194 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 84' ' ' MET . . . . . 0.486 ' O ' ' N ' ' H' ' 109' ' ' LYS . 47.9 mtt -113.04 145.08 41.51 Favored 'General case' 0 C--O 1.252 1.207 1 O-C-N 129.431 4.207 . . . . 49.29 110.784 179.412 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 85' ' ' LEU . . . . . 0.459 ' CD1' ' CE ' ' H' ' 106' ' ' MET . 0.5 OUTLIER -87.65 143.56 27.12 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 112.152 -2.295 . . . . 36.28 106.579 179.878 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 86' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -99.15 -35.15 10.1 Favored 'General case' 0 C--N 1.285 -2.204 0 C-N-CA 126.887 2.075 . . . . 45.06 107.521 173.789 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 87' ' ' LYS . . . . . 0.626 ' CA ' ' OE1' ' H' ' 61' ' ' GLU . 0.2 OUTLIER -166.1 142.81 5.15 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 122.616 1.198 . . . . 43.83 112.744 -176.55 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 88' ' ' ILE . . . . . . . . . . . . . 3.1 mt -109.03 137.96 38.55 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.146 0 N-CA-C 107.173 -1.418 . . . . 33.81 107.173 176.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 89' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -129.42 125.3 36.21 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 104.83 -2.285 . . . . 40.66 104.83 177.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 90' ' ' ILE . . . . . . . . . . . . . 15.3 mt -111.95 145.53 17.97 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 O-C-N 128.765 3.79 . . . . 27.34 106.593 -178.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 91' ' ' HIS . . . . . . . . . . . . . 40.3 t-80 -55.57 125.32 60.02 Favored Pre-proline 0 C--O 1.252 1.189 0 CA-C-O 123.328 1.537 . . . . 25.42 111.296 175.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 92' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -50.03 -34.55 38.5 Favored 'Trans proline' 0 N--CA 1.447 -1.225 0 C-N-CA 122.374 2.049 . . . . 27.31 111.245 178.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 93' ' ' ARG . . . . . . . . . . . . . 60.3 mtp180 -109.46 27.33 9.66 Favored 'General case' 0 C--O 1.249 1.064 0 N-CA-C 115.956 1.836 . . . . 34.15 115.956 -178.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 94' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -54.86 127.22 27.6 Favored 'General case' 0 C--O 1.262 1.728 0 CA-C-O 115.245 -2.312 . . . . 24.82 105.623 172.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 95' ' ' ASN . . . . . . . . . . . . . 62.0 t-20 -108.04 85.07 2.05 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-N 120.656 1.571 . . . . 28.91 112.592 -178.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 96' ' ' TRP . . . . . . . . . . . . . 64.2 p-90 -81.38 -19.26 43.04 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 115.547 -2.168 . . . . 26.0 111.189 -175.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 97' ' ' ARG . . . . . 0.572 ' NH2' ' O ' ' H' ' 498' ' ' HOH . 54.5 mtt-85 -71.57 -39.17 70.79 Favored 'General case' 0 C--O 1.276 2.472 1 O-C-N 129.437 4.211 . . . . 34.32 113.578 -179.28 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 97' A GLU . . . . . . . . . . . . . 17.9 tt0 -111.86 -65.93 1.13 Allowed 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 115.581 -2.448 . . . . 36.68 117.017 -177.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 98' ' ' ASN . . . . . 0.511 ' N ' ' OD1' ' H' ' 98' ' ' ASN . 21.9 p30 -134.44 23.83 3.75 Favored 'General case' 0 C--O 1.292 3.342 0 N-CA-C 119.122 3.008 . . . . 27.16 119.122 -176.785 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 99' ' ' LEU . . . . . . . . . . . . . 7.2 mt 62.49 34.54 15.28 Favored 'General case' 0 C--N 1.312 -1.059 0 C-N-CA 129.856 3.262 . . . . 24.41 111.579 -179.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 100' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -69.92 132.03 45.35 Favored 'General case' 0 C--N 1.287 -2.133 0 O-C-N 125.95 2.031 . . . . 21.42 106.605 -177.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 101' ' ' ARG . . . . . 0.564 ' NE ' ' O ' ' H' ' 516' ' ' HOH . 58.0 mtt85 64.83 44.23 3.73 Favored 'General case' 0 CA--C 1.558 1.256 0 O-C-N 128.684 3.74 . . . . 31.03 112.145 -176.2 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 102' ' ' ASP . . . . . . . . . . . . . 42.2 t0 -77.5 83.49 3.91 Favored 'General case' 0 C--N 1.287 -2.113 0 C-N-CA 125.519 1.527 . . . . 17.29 111.802 178.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 103' ' ' ILE . . . . . . . . . . . . . 16.5 tt -155.32 146.49 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 CA-C-N 112.86 -1.973 . . . . 19.13 111.29 -177.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 104' ' ' ALA . . . . . . . . . . . . . . . -153.64 148.28 26.29 Favored 'General case' 0 C--O 1.206 -1.218 0 N-CA-C 106.539 -1.652 . . . . 20.06 106.539 179.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 105' ' ' LEU . . . . . . . . . . . . . 43.4 mt -109.17 147.75 32.01 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 105.227 -2.138 . . . . 25.81 105.227 176.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 106' ' ' MET . . . . . 0.459 ' CE ' ' CD1' ' H' ' 85' ' ' LEU . 62.6 mtp -125.15 125.25 43.41 Favored 'General case' 0 C--N 1.299 -1.587 0 N-CA-C 103.967 -2.605 . . . . 34.07 103.967 177.543 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 107' ' ' LYS . . . . . . . . . . . . . 53.7 tttt -97.27 122.9 40.82 Favored 'General case' 0 C--O 1.265 1.901 0 N-CA-C 107.095 -1.446 . . . . 37.6 107.095 179.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 108' ' ' LEU . . . . . 0.506 ' O ' ' NH1' ' H' ' 50' ' ' ARG . 76.5 mt -76.19 145.19 40.02 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 125.377 1.673 . . . . 30.4 112.272 -177.53 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 109' ' ' LYS . . . . . 0.486 ' N ' ' O ' ' H' ' 84' ' ' MET . 0.6 OUTLIER -56.23 -40.52 74.24 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 125.115 1.509 . . . . 42.42 109.846 178.264 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 110' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -139.6 156.06 71.4 Favored Pre-proline 0 N--CA 1.489 1.521 0 O-C-N 119.355 -2.091 . . . . 46.58 107.257 176.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 111' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_exo -71.65 135.71 26.65 Favored 'Trans proline' 0 C--O 1.272 2.216 0 O-C-N 125.7 2.421 . . . . 36.43 108.76 -179.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 112' ' ' VAL . . . . . . . . . . . . . 7.6 p -87.85 157.95 3.11 Favored 'Isoleucine or valine' 0 C--O 1.259 1.58 0 N-CA-C 106.927 -1.508 . . . . 34.97 106.927 -179.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 113' ' ' ALA . . . . . . . . . . . . . . . -102.42 136.51 42.13 Favored 'General case' 0 N--CA 1.479 0.997 0 O-C-N 126.393 2.308 . . . . 31.76 106.83 -179.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 114' ' ' PHE . . . . . . . . . . . . . 16.3 m-30 -74.8 155.17 37.88 Favored 'General case' 0 CA--C 1.507 -0.702 1 O-C-N 129.461 4.226 . . . . 26.69 107.302 -175.346 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 115' ' ' SER . . . . . . . . . . . . . 3.1 p -160.33 -173.32 3.95 Favored 'General case' 0 C--O 1.269 2.096 0 O-C-N 128.851 3.845 . . . . 22.88 102.881 -176.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 116' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -59.84 -29.29 68.17 Favored 'General case' 0 C--N 1.283 -2.303 0 O-C-N 127.148 2.78 . . . . 24.33 109.997 178.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 117' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -109.49 0.59 19.34 Favored 'General case' 0 C--O 1.266 1.934 0 O-C-N 128.205 3.441 . . . . 25.13 117.513 -176.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 118' ' ' ILE . . . . . . . . . . . . . 12.9 mt -130.76 115.45 30.88 Favored 'Isoleucine or valine' 0 C--N 1.267 -2.984 0 C-N-CA 130.721 3.608 . . . . 21.68 113.209 -177.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 119' ' ' HIS . . . . . . . . . . . . . 25.3 t60 -167.16 134.64 1.99 Allowed Pre-proline 0 N--CA 1.51 2.566 0 C-N-CA 114.362 -2.935 . . . . 22.49 108.625 -176.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 120' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -74.08 155.8 47.35 Favored 'Trans proline' 0 C--O 1.259 1.555 0 C-N-CA 121.949 1.766 . . . . 18.67 114.522 -176.122 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 121' ' ' VAL . . . . . . . . . . . . . 14.8 p -98.47 161.55 2.97 Favored 'Isoleucine or valine' 0 C--O 1.263 1.785 0 N-CA-C 102.859 -3.015 . . . . 18.21 102.859 178.412 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 122' ' ' CYS . . . . . . . . . . . . . 78.9 m -91.18 154.44 19.32 Favored 'General case' 0 C--O 1.254 1.294 0 O-C-N 119.767 -1.833 . . . . 20.91 109.037 178.99 -60.626 -56.326 103.946 101.178 2.011 104.647 69.94 75.182 1 1 . 1 . 001 ecloud orig full ' H' H ' 123' ' ' LEU . . . . . . . . . . . . . 37.1 mt -101.67 138.35 19.82 Favored Pre-proline 0 C--N 1.295 -1.802 0 N-CA-C 103.957 -2.608 . . . . 23.14 103.957 177.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 124' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -71.81 155.8 57.71 Favored 'Trans proline' 0 CA--C 1.497 -1.326 0 O-C-N 126.476 2.83 . . . . 27.63 110.066 -176.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 125' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -106.43 162.39 13.74 Favored 'General case' 0 C--O 1.269 2.117 0 N-CA-C 103.295 -2.854 . . . . 41.41 103.295 174.331 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 126' ' ' ARG . . . . . 0.67 ' N ' ' O ' ' H' ' 431' ' ' HOH . 22.7 ttt180 -46.87 -41.05 15.14 Favored 'General case' 0 CA--C 1.512 -0.484 0 O-C-N 125.675 1.859 . . . . 50.0 113.644 -179.228 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 127' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.4 -46.43 80.06 Favored 'General case' 0 C--N 1.293 -1.878 0 C-N-CA 127.345 2.258 . . . . 41.23 112.37 179.502 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 128' ' ' THR . . . . . . . . . . . . 0.315 88.0 m -67.93 -37.75 82.03 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 117.947 -1.025 . . . . 31.56 108.361 -176.614 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.46 -40.05 89.78 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 124.491 2.091 . . . . 28.89 113.428 178.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 129' A ALA . . . . . . . . . . . . . . . -64.69 -52.85 55.05 Favored 'General case' 0 C--O 1.253 1.272 0 C-N-CA 126.088 1.755 . . . . 29.55 113.797 -176.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 129' B SER . . . . . . . . . . . . . 0.8 OUTLIER -72.34 -26.83 62.08 Favored 'General case' 0 C--N 1.314 -0.976 1 CA-C-O 110.579 -4.534 . . . . 32.01 111.904 179.906 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 129' C LEU . . . . . . . . . . . . . 66.0 mt -100.29 -33.17 10.51 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 128.775 3.797 . . . . 28.1 116.616 -173.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 130' ' ' LEU . . . . . 0.593 ' CD2' ' CD1' ' H' ' 162' ' ' ILE 0.263 2.0 mt -79.77 80.29 6.18 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 128.785 3.803 . . . . 29.18 108.892 -176.396 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 131' ' ' GLN . . . . . . . . . . . . . 63.1 mt-30 -136.74 135.82 38.43 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 112.525 -2.125 . . . . 38.39 116.155 179.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 132' ' ' ALA . . . . . . . . . . . . . . . -48.24 132.47 16.12 Favored 'General case' 0 C--O 1.246 0.899 0 C-N-CA 125.905 1.682 . . . . 25.21 106.574 177.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 133' ' ' GLY . . . . . . . . . . . . . . . 93.34 -34.22 4.7 Favored Glycine 0 N--CA 1.424 -2.134 0 O-C-N 127.827 3.204 . . . . 22.17 117.452 -175.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 134' ' ' TYR . . . . . 0.411 ' N ' ' CD1' ' H' ' 134' ' ' TYR . 3.2 m-30 -62.28 141.56 58.19 Favored 'General case' 0 C--N 1.291 -1.95 0 O-C-N 118.396 -2.826 . . . . 29.17 107.733 177.305 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 135' ' ' LYS . . . . . 0.456 ' CE ' ' OH ' ' H' ' 184' A TYR . 46.9 mttp -99.43 147.25 25.45 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 116.286 -1.816 . . . . 26.28 109.292 -178.889 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 136' ' ' GLY . . . . . . . . . . . . . . . -124.16 -179.79 15.87 Favored Glycine 0 CA--C 1.563 3.031 2 O-C-N 129.708 4.38 . . . . 18.52 102.56 174.899 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 137' ' ' ARG . . . . . . . . . . . . . 21.1 ttm180 -133.92 136.24 44.12 Favored 'General case' 0 C--O 1.206 -1.217 0 N-CA-C 105.211 -2.144 . . . . 16.36 105.211 -176.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 138' ' ' VAL . . . . . . . . . . . . . 8.0 t -120.53 143.98 30.81 Favored 'Isoleucine or valine' 0 C--N 1.37 1.462 0 N-CA-C 103.523 -2.769 . . . . 16.82 103.523 178.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 139' ' ' THR . . . . . . . . . . . . . 18.1 p -133.58 156.95 46.91 Favored 'General case' 0 N--CA 1.485 1.312 0 O-C-N 126.452 2.345 . . . . 16.73 109.34 177.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 140' ' ' GLY . . . . . . . . . . . . . . . 169.54 167.38 30.0 Favored Glycine 0 C--O 1.213 -1.188 0 O-C-N 120.415 -1.428 . . . . 19.99 112.459 178.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 141' ' ' TRP . . . . . . . . . . . . . 5.8 m-90 -101.66 8.59 41.62 Favored 'General case' 0 C--O 1.248 0.998 0 O-C-N 127.784 2.697 . . . . 25.29 111.859 -179.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 142' ' ' GLY . . . . . . . . . . . . . . . -65.29 175.02 15.57 Favored Glycine 0 N--CA 1.436 -1.36 0 C-N-CA 127.782 2.61 . . . . 28.14 115.523 -179.024 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 143' ' ' ASN . . . . . 0.425 ' ND2' ' O ' ' H' ' 512' ' ' HOH . 97.7 m-20 -53.17 142.06 21.61 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 123.847 1.784 . . . . 37.55 111.415 -178.381 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 144' ' ' LEU . . . . . . . . . . . . . 93.2 mt -87.41 -16.27 35.38 Favored 'General case' 0 C--O 1.246 0.873 0 CA-C-N 108.81 -3.814 . . . . 31.12 112.11 -179.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 145' ' ' LYS . . . . . . . . . . . . . 18.7 mtpt -147.87 150.51 34.26 Favored 'General case' 0 C--N 1.288 -2.108 0 O-C-N 126.009 2.068 . . . . 45.41 106.35 -177.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 146' ' ' GLU . . . . . 0.659 ' N ' ' O ' ' H' ' 530' ' ' HOH . 46.1 tt0 . . . . . 0 C--O 1.268 2.057 0 O-C-N 124.922 1.389 . . . . 37.9 113.412 -178.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 150' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.931 0 N-CA-C 115.743 1.057 . . . . 41.26 115.743 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 151' ' ' GLN . . . . . 0.583 ' CG ' ' O ' ' H' ' 447' ' ' HOH . 10.1 mp0 -122.83 140.43 33.23 Favored Pre-proline 0 N--CA 1.495 1.817 0 N-CA-C 102.662 -3.088 . . . . 47.36 102.662 178.235 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 152' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -72.75 165.52 32.52 Favored 'Trans proline' 0 CA--C 1.502 -1.083 0 O-C-N 127.553 3.396 . . . . 36.42 108.557 -173.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 153' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.41 -19.46 21.27 Favored 'General case' 0 C--N 1.295 -1.777 0 N-CA-C 107.153 -1.425 . . . . 34.55 107.153 174.205 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 154' ' ' VAL . . . . . . . . . . . . 0.316 0.5 OUTLIER -138.23 165.77 24.81 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.705 0 N-CA-C 108.551 -0.907 . . . . 28.31 108.551 -178.419 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 155' ' ' LEU . . . . . . . . . . . . . 45.3 tp -55.89 139.46 45.9 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 117.341 -1.314 . . . . 24.15 109.081 -179.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 156' ' ' GLN . . . . . 0.475 ' OE1' ' OD1' ' H' ' 21' ' ' ASP . 24.4 mm100 -105.67 155.24 19.44 Favored 'General case' 0 C--N 1.29 -2.018 0 CA-C-O 115.822 -2.037 . . . . 25.43 109.295 179.567 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 157' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -136.2 152.92 30.76 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 N-CA-C 107.29 -1.374 . . . . 25.86 107.29 177.369 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 158' ' ' VAL . . . . . . . . . . . . . 9.4 p -151.94 142.4 15.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 124.789 1.306 . . . . 20.74 108.377 170.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 159' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -101.75 131.08 48.24 Favored 'General case' 0 C--N 1.307 -1.239 0 C-N-CA 127.982 2.513 . . . . 24.71 107.319 174.273 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 160' ' ' LEU . . . . . . . . . . . . . 82.9 mt -141.19 145.76 40.04 Favored Pre-proline 0 C--N 1.28 -2.433 0 CA-C-N 121.757 2.071 . . . . 23.1 109.815 -175.236 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 161' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -83.79 149.57 12.59 Favored 'Trans proline' 0 CA--C 1.483 -2.067 0 O-C-N 126.148 2.657 . . . . 19.57 112.661 179.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 162' ' ' ILE . . . . . 0.593 ' CD1' ' CD2' ' H' ' 130' ' ' LEU . 84.6 mt -76.84 139.94 17.97 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.436 0 N-CA-C 104.423 -2.436 . . . . 20.68 104.423 175.272 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 163' ' ' VAL . . . . . . . . . . . . . 46.4 t -107.48 146.98 12.99 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.042 0 C-N-CA 128.995 2.918 . . . . 21.17 109.374 -178.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 164' ' ' GLU . . . . . 0.554 ' OE1' ' CG2' ' H' ' 167' ' ' VAL . 7.3 mp0 -62.97 139.12 58.73 Favored 'General case' 0 C--N 1.311 -1.086 0 O-C-N 117.558 -3.214 . . . . 40.33 108.407 177.17 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 165' ' ' ARG . . . . . 0.803 ' NE ' ' NZ ' ' H' ' 169' ' ' LYS . 54.5 ttt180 -45.37 -40.42 12.66 Favored Pre-proline 0 C--N 1.306 -1.316 0 C-N-CA 127.905 2.482 . . . . 44.94 114.527 -179.302 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 166' ' ' PRO . . . . . 0.44 ' CD ' ' N ' ' H' ' 165' ' ' ARG . 36.7 Cg_endo -70.89 -41.82 2.61 Favored 'Trans proline' 0 CA--C 1.494 -1.503 0 C-N-CA 123.016 2.477 . . . . 25.75 111.974 -179.246 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 167' ' ' VAL . . . . . 0.554 ' CG2' ' OE1' ' H' ' 164' ' ' GLU . 43.1 t -61.84 -41.7 91.71 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.305 0 CA-C-N 121.635 2.016 . . . . 23.31 108.799 177.053 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 168' ' ' CYS . . . . . . . . . . . . . 94.6 m -55.88 -59.75 4.45 Favored 'General case' 0 C--O 1.247 0.953 0 CA-C-N 113.4 -1.727 . . . . 22.68 108.309 179.628 -66.175 -59.985 -93.202 105.129 2.014 104.726 -75.726 84.429 1 1 . 1 . 001 ecloud orig full ' H' H ' 169' ' ' LYS . . . . . 0.803 ' NZ ' ' NE ' ' H' ' 165' ' ' ARG . 37.7 mttt -55.15 -42.19 72.79 Favored 'General case' 0 C--O 1.258 1.525 0 C-N-CA 125.529 1.532 . . . . 29.43 114.555 -176.133 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 170' ' ' ASP . . . . . . . . . . . . . 86.0 m-20 -75.74 -8.23 56.33 Favored 'General case' 0 C--N 1.296 -1.72 0 C-N-CA 127.723 2.409 . . . . 24.07 113.86 179.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 171' ' ' SER . . . . . 0.428 ' O ' ' NZ ' ' H' ' 224' ' ' LYS . 88.7 p -91.01 -7.89 50.66 Favored 'General case' 0 C--O 1.275 2.398 0 CA-C-N 120.078 1.308 . . . . 23.35 108.563 178.203 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 172' ' ' THR . . . . . . . . . . . . . 4.4 t -145.27 169.5 18.11 Favored 'General case' 0 C--N 1.299 -1.6 0 CA-C-O 116.01 -1.948 . . . . 21.37 110.258 -175.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 173' ' ' ARG . . . . . . . . . . . . . 45.3 mtp180 -99.16 -9.94 23.12 Favored 'General case' 0 C--O 1.253 1.263 1 O-C-N 130.101 4.625 . . . . 35.26 110.424 176.533 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 174' ' ' ILE . . . . . . . . . . . . . 98.9 mt -80.56 136.72 22.74 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.1 0 O-C-N 124.621 1.2 . . . . 29.02 111.437 178.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 175' ' ' ARG . . . . . . . . . . . . . 52.7 ttp85 -70.38 123.14 21.01 Favored 'General case' 0 C--O 1.26 1.612 0 CA-C-N 119.184 0.902 . . . . 31.75 110.429 -177.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 176' ' ' ILE . . . . . . . . . . . . . 4.1 mm -88.44 139.18 17.77 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.794 0 C-N-CA 129.022 2.929 . . . . 24.13 108.711 177.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 177' ' ' THR . . . . . . . . . . . . . 2.4 p -118.04 166.41 12.58 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-O 115.209 -2.329 . . . . 22.69 109.067 -177.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 178' ' ' ASP . . . . . . . . . . . . . 83.6 m-20 -61.71 -17.17 54.64 Favored 'General case' 0 C--N 1.275 -2.655 0 C-N-CA 130.246 3.418 . . . . 28.03 110.647 177.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 179' ' ' ASN . . . . . . . . . . . . . 27.2 m-80 -87.47 14.46 8.11 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-O 113.771 -3.014 . . . . 19.25 109.394 177.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 180' ' ' MET . . . . . . . . . . . . . 48.0 mtt -130.8 159.49 37.17 Favored 'General case' 0 C--N 1.294 -1.822 0 O-C-N 126.919 2.637 . . . . 22.07 109.692 179.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 181' ' ' PHE . . . . . . . . . . . . . 27.3 p90 -145.85 159.3 43.41 Favored 'General case' 0 C--N 1.287 -2.133 0 O-C-N 127.54 3.025 . . . . 17.21 103.53 170.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 182' ' ' CYS . . . . . . . . . . . . . 1.9 p -123.51 155.51 37.42 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 126.897 2.623 . . . . 22.66 107.571 177.448 84.429 -75.726 -93.202 104.726 2.014 105.129 -59.985 -66.175 1 1 . 1 . 001 ecloud orig full ' H' H ' 183' ' ' ALA . . . . . . . . . . . . . . . -144.55 147.46 33.23 Favored 'General case' 0 C--O 1.196 -1.755 0 O-C-N 125.839 1.962 . . . . 20.73 112.859 -178.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 184' ' ' GLY . . . . . . . . . . . . . . . 149.71 168.86 15.42 Favored Glycine 0 N--CA 1.427 -1.936 0 C-N-CA 125.657 1.599 . . . . 22.32 110.21 -178.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 184' A TYR . . . . . 0.456 ' OH ' ' CE ' ' H' ' 135' ' ' LYS . 66.1 m-85 -88.91 166.29 14.05 Favored 'General case' 0 C--O 1.252 1.197 0 CA-C-O 124.206 1.955 . . . . 26.5 107.423 176.858 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 185' ' ' LYS . . . . . 0.547 ' N ' ' OE1' ' H' ' 186' B GLU . 6.6 mttp -94.06 158.34 36.29 Favored Pre-proline 0 N--CA 1.512 2.661 0 CA-C-N 110.796 -2.911 . . . . 33.74 105.016 179.301 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 186' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -54.93 -19.96 21.32 Favored 'Trans proline' 0 C--O 1.24 0.58 0 C-N-CA 123.757 2.971 . . . . 37.99 112.673 -177.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 186' A ASP . . . . . 0.628 ' O ' ' N ' ' H' ' 186' C GLY 0.318 1.1 m-20 -68.79 -77.78 0.07 Allowed 'General case' 0 C--N 1.278 -2.515 1 C-N-CA 138.265 6.626 . . . . 50.0 111.269 176.206 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' H' H ' 186' B GLU . . . . . 0.547 ' OE1' ' N ' ' H' ' 185' ' ' LYS 0.262 34.8 mt-10 -34.48 -14.8 0.0 OUTLIER 'General case' 0 C--O 1.261 1.671 0 O-C-N 128.639 3.712 . . . . 50.0 112.566 -174.862 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 186' C GLY . . . . . 0.628 ' N ' ' O ' ' H' ' 186' A ASP . . . 39.22 57.4 2.14 Favored Glycine 0 C--O 1.258 1.638 0 CA-C-O 126.628 3.349 . . . . 44.32 116.999 177.381 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 186' D LYS . . . . . . . . . . . . . 9.2 mttm -154.29 141.84 19.81 Favored 'General case' 0 C--N 1.295 -1.79 1 C-N-CA 138.31 6.644 . . . . 45.91 103.063 176.812 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 187' ' ' ARG . . . . . 0.457 ' NH1' ' OD1' ' H' ' 222' ' ' ASP . 0.5 OUTLIER -128.01 -177.78 4.26 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 124.451 1.095 . . . . 35.79 109.007 -178.147 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 188' ' ' GLY . . . . . . . . . . . . . . . 132.42 150.25 6.45 Favored Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 114.208 -1.36 . . . . 27.91 109.974 179.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 189' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -172.75 166.1 5.34 Favored 'General case' 0 C--N 1.289 -2.054 0 C-N-CA 127.787 2.435 . . . . 24.07 105.218 -178.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 190' ' ' ALA . . . . . . . . . . . . . . . -80.82 173.24 12.8 Favored 'General case' 0 C--N 1.286 -2.195 0 N-CA-C 101.501 -3.518 . . . . 24.22 101.501 168.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 191' ' ' CYS . . . . . . . . . . . . . 6.6 t -157.45 176.22 12.95 Favored 'General case' 0 C--N 1.288 -2.082 0 N-CA-C 106.361 -1.718 . . . . 25.44 106.361 179.35 -160.242 52.814 79.6 106.814 2.021 103.696 -174.922 -51.78 1 1 . 1 . 001 ecloud orig full ' H' H ' 192' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -48.57 134.23 15.86 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-O 114.34 -2.743 . . . . 46.49 107.315 178.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 193' ' ' GLY . . . . . . . . . . . . . . . 94.17 -15.81 62.37 Favored Glycine 0 C--N 1.289 -2.058 1 O-C-N 129.412 4.195 . . . . 23.13 115.42 -177.909 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 194' ' ' ASP . . . . . . . . . . . . . 76.0 m-20 -80.38 -21.68 42.1 Favored 'General case' 0 C--N 1.312 -1.045 0 C-N-CA 128.09 2.556 . . . . 23.92 109.232 177.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 195' ' ' SER . . . . . 1.258 ' OG ' ' C ' ' H' ' 372' ' ' 0ZE . 2.8 m -39.79 135.61 1.2 Allowed 'General case' 0 C--O 1.202 -1.42 0 O-C-N 124.718 1.261 . . . . 26.03 110.385 178.323 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 196' ' ' GLY . . . . . . . . . . . . . . . 82.11 -1.37 87.09 Favored Glycine 0 CA--C 1.484 -1.897 0 O-C-N 126.819 2.574 . . . . 17.8 116.77 176.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 197' ' ' GLY . . . . . . . . . . . . . . . -75.24 163.54 54.03 Favored Glycine 0 C--O 1.216 -1.015 0 N-CA-C 108.438 -1.865 . . . . 17.65 108.438 177.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 198' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -87.26 138.53 4.79 Favored 'Trans proline' 0 N--CA 1.435 -1.913 0 O-C-N 125.243 2.181 . . . . 17.45 116.619 -179.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 199' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -102.09 115.7 31.1 Favored 'General case' 0 N--CA 1.511 2.611 1 N-CA-C 99.705 -4.183 . . . . 16.34 99.705 169.838 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 200' ' ' VAL . . . . . . . . . . . . . 35.2 m -121.6 159.34 24.15 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.344 0 O-C-N 119.187 -2.195 . . . . 16.98 109.236 -176.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 201' ' ' MET . . . . . . . . . . . . . 67.5 mtp -133.52 149.05 51.7 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 105.003 -2.221 . . . . 18.79 105.003 178.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 202' ' ' LYS . . . . . . . . . . . . . 69.5 tttt -98.78 119.24 37.21 Favored 'General case' 0 C--O 1.262 1.749 0 CA-C-O 117.155 -1.402 . . . . 18.41 108.693 178.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 203' ' ' SER . . . . . . . . . . . . . 18.3 t -61.56 128.31 89.87 Favored Pre-proline 0 C--N 1.303 -1.454 0 CA-C-N 120.737 1.608 . . . . 18.36 112.998 175.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 204' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -74.98 -16.95 19.97 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 122.699 2.266 . . . . 21.29 111.862 173.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 204' A PHE . . . . . . . . . . . . . 22.4 m-85 -80.69 -50.81 9.43 Favored 'General case' 0 C--N 1.307 -1.272 0 O-C-N 117.377 -3.327 . . . . 26.68 115.98 177.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 204' B ASN . . . . . 0.421 ' O ' ' CB ' ' H' ' 205' ' ' ASN . 0.1 OUTLIER -119.27 0.58 11.19 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 119.432 -0.907 . . . . 24.41 113.046 -179.425 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 205' ' ' ASN . . . . . 0.421 ' CB ' ' O ' ' H' ' 204' B ASN 0.276 1.5 m120 67.2 17.85 10.33 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 116.589 2.07 . . . . 32.88 116.589 176.346 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 206' ' ' ARG . . . . . . . . . . . . . 76.3 mtt-85 -93.65 151.24 19.79 Favored 'General case' 0 C--N 1.267 -3.017 0 O-C-N 128.161 3.413 . . . . 25.87 111.086 179.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 207' ' ' TRP . . . . . . . . . . . . . 93.0 m95 -91.41 130.33 37.27 Favored 'General case' 0 C--N 1.306 -1.283 0 O-C-N 125.842 1.964 . . . . 14.15 108.231 177.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 208' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -120.91 140.58 51.62 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 127.306 2.243 . . . . 17.75 110.531 -177.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 209' ' ' GLN . . . . . . . . . . . . . 41.7 tt0 -97.68 118.44 34.22 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-O 114.856 -2.497 . . . . 15.02 104.648 -176.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 210' ' ' MET . . . . . . . . . . . . . 49.2 mmm -102.68 -22.09 14.01 Favored 'General case' 0 C--O 1.214 -0.797 0 O-C-N 126.405 2.316 . . . . 24.92 114.22 -177.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 211' ' ' GLY . . . . . . . . . . . . . . . -144.21 168.32 26.64 Favored Glycine 0 C--O 1.248 0.979 0 O-C-N 124.225 0.953 . . . . 14.78 111.583 -178.123 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 212' ' ' ILE . . . . . . . . . . . . . 10.6 mt -126.57 132.83 69.82 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.655 0 N-CA-C 105.755 -1.942 . . . . 13.47 105.755 174.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 213' ' ' VAL . . . . . . . . . . . . . 51.6 t -53.27 118.33 1.06 Allowed 'Isoleucine or valine' 0 C--O 1.277 2.528 0 CA-C-O 127.127 3.346 . . . . 14.39 107.538 173.111 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 214' ' ' SER . . . . . . . . . . . . . 12.2 t -110.83 -66.85 1.04 Allowed 'General case' 0 C--O 1.278 2.586 0 O-C-N 117.879 -3.013 . . . . 18.52 116.172 -179.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 215' ' ' TRP . . . . . . . . . . . . . 62.9 p-90 -160.24 162.08 33.61 Favored 'General case' 0 CA--C 1.489 -1.386 0 N-CA-C 116.316 1.969 . . . . 20.99 116.316 -174.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 216' ' ' GLY . . . . . . . . . . . . . . . -160.74 -172.56 28.19 Favored Glycine 0 N--CA 1.487 2.047 0 N-CA-C 105.183 -3.167 . . . . 23.46 105.183 176.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 217' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -129.52 102.93 6.6 Favored 'General case' 0 C--N 1.279 -2.474 0 N-CA-C 104.145 -2.539 . . . . 32.51 104.145 178.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 219' ' ' GLY . . . . . . . . . . . . . . . 74.72 -168.15 54.7 Favored Glycine 1 N--CA 1.523 4.45 1 N-CA-C 101.476 -4.65 . . . . 24.89 101.476 -173.78 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' H' H ' 220' ' ' CYS . . . . . . . . . . . . . 36.8 m -137.2 128.57 28.16 Favored 'General case' 0 C--N 1.291 -1.953 0 N-CA-C 106.827 -1.545 . . . . 27.13 106.827 -179.575 -51.78 -174.922 79.6 103.696 2.021 106.814 52.814 -160.242 1 1 . 1 . 001 ecloud orig full ' H' H ' 221' ' ' ASP . . . . . . . . . . . . . 26.5 t0 58.54 31.91 21.55 Favored 'General case' 0 C--O 1.257 1.485 0 O-C-N 127.092 2.745 . . . . 28.25 112.675 174.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 221' A ARG . . . . . . . . . . . . . 1.0 OUTLIER -81.37 141.93 33.51 Favored 'General case' 0 C--O 1.256 1.42 0 N-CA-C 107.216 -1.402 . . . . 41.38 107.216 173.933 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 222' ' ' ASP . . . . . 0.457 ' OD1' ' NH1' ' H' ' 187' ' ' ARG . 49.6 m-20 -63.31 136.7 57.84 Favored 'General case' 0 C--O 1.243 0.722 0 C-N-CA 119.891 -0.723 . . . . 39.04 110.92 177.642 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 223' ' ' GLY . . . . . . . . . . . . . . . 81.88 4.07 90.41 Favored Glycine 0 C--O 1.255 1.441 0 CA-C-N 119.381 0.991 . . . . 30.47 113.155 177.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 224' ' ' LYS . . . . . 0.428 ' NZ ' ' O ' ' H' ' 171' ' ' SER . 16.2 mmtt -123.47 151.44 42.72 Favored 'General case' 0 CA--C 1.563 1.448 0 C-N-CA 125.365 1.466 . . . . 36.52 107.748 176.777 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 225' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -131.32 155.75 46.66 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-O 125.221 2.438 . . . . 26.22 113.037 -175.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 226' ' ' GLY . . . . . . . . . . . . . . . -85.93 144.23 20.15 Favored Glycine 0 CA--C 1.543 1.819 0 N-CA-C 103.459 -3.857 . . . . 20.28 103.459 175.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 227' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -112.79 135.52 53.45 Favored 'General case' 0 C--O 1.252 1.234 0 C-N-CA 127.711 2.404 . . . . 21.82 108.897 175.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 228' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -120.45 144.38 47.99 Favored 'General case' 0 CA--C 1.494 -1.191 0 O-C-N 128.856 3.847 . . . . 17.69 113.489 -178.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 229' ' ' THR . . . . . . . . . . . . . 16.3 m -66.65 130.87 44.62 Favored 'General case' 0 C--O 1.244 0.777 0 N-CA-C 107.708 -1.219 . . . . 17.57 107.708 169.136 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 230' ' ' HIS . . . . . . . . . . . . . 6.1 t-80 -84.11 97.9 9.59 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 119.132 -2.23 . . . . 23.65 107.967 -179.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 231' ' ' VAL . . . . . . . . . . . . . 74.5 t -58.94 -46.86 91.18 Favored 'Isoleucine or valine' 0 C--O 1.253 1.284 0 CA-C-O 114.541 -2.647 . . . . 18.05 114.43 -176.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 232' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -63.18 -28.13 69.84 Favored 'General case' 0 N--CA 1.511 2.595 0 C-N-CA 114.569 -2.852 . . . . 23.3 112.994 -179.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 233' ' ' ARG . . . . . . . . . . . . . 5.5 mtp-105 -67.42 -23.34 65.53 Favored 'General case' 0 N--CA 1.438 -1.051 1 O-C-N 115.181 -4.7 . . . . 42.08 111.27 178.48 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 234' ' ' LEU . . . . . . . . . . . . . 39.6 mt -104.97 6.05 33.19 Favored 'General case' 0 C--O 1.248 1.008 0 CA-C-N 119.647 1.112 . . . . 26.71 110.241 -179.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 235' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -50.2 -39.83 45.33 Favored 'General case' 0 C--O 1.244 0.807 0 CA-C-O 123.162 1.458 . . . . 37.79 113.604 -179.474 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 236' ' ' LYS . . . . . 0.509 ' CE ' ' O ' ' H' ' 540' ' ' HOH . 0.1 OUTLIER -60.44 -48.5 81.47 Favored 'General case' 0 C--O 1.256 1.415 0 CA-C-N 114.497 -1.229 . . . . 40.79 110.28 -177.541 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 237' ' ' TRP . . . . . . . . . . . . . 56.5 t90 -58.05 -42.23 85.0 Favored 'General case' 0 C--N 1.319 -0.744 0 C-N-CA 125.269 1.427 . . . . 30.79 113.304 178.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 238' ' ' ILE . . . . . . . . . . . . . 67.1 mt -63.01 -43.64 99.2 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.021 0 C-N-CA 124.975 1.31 . . . . 32.99 109.724 -179.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 239' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -55.4 -59.74 4.38 Favored 'General case' 0 C--N 1.301 -1.509 0 CA-C-O 124.678 2.18 . . . . 48.02 109.691 179.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 240' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -41.69 -57.22 2.38 Favored 'General case' 0 C--O 1.257 1.495 0 CA-C-N 109.296 -3.593 . . . . 49.47 107.889 177.323 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 241' ' ' VAL . . . . . . . . . . . . . 39.7 t -57.55 -46.78 86.17 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.372 0 N-CA-C 114.96 1.467 . . . . 39.83 114.96 -179.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 242' ' ' ILE . . . . . . . . . . . . . 76.8 mt -70.92 -40.28 76.25 Favored 'Isoleucine or valine' 0 C--O 1.256 1.432 0 CA-C-N 113.876 -1.511 . . . . 45.54 112.373 -172.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 243' ' ' ASP . . . . . . . . . . . . 0.464 29.6 p30 -91.41 -6.47 52.78 Favored 'General case' 0 C--O 1.262 1.753 0 C-N-CA 114.421 -2.912 . . . . 50.0 113.01 -177.273 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 244' ' ' GLN . . . . . 0.494 ' OE1' ' CE2' ' H' ' 245' ' ' PHE . 0.0 OUTLIER -96.5 -19.29 19.23 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 106.698 -1.593 . . . . 50.0 106.698 176.443 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 245' ' ' PHE . . . . . 0.494 ' CE2' ' OE1' ' H' ' 244' ' ' GLN . 81.7 m-85 -122.15 4.31 9.81 Favored 'General case' 0 C--O 1.261 1.709 0 N-CA-C 117.264 2.32 . . . . 50.0 117.264 -177.288 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 246' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.296 -1.664 0 CA-C-O 116.648 -2.196 . . . . 49.5 114.95 176.793 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 55' ' ' ASP . . . . . . . . . . . . . 1.8 t70 . . . . . 0 N--CA 1.516 2.838 0 CA-C-O 126.573 3.082 . . . . 50.0 105.008 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 56' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -74.04 132.73 42.63 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 110.872 -2.876 . . . . 50.0 110.817 179.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 57' ' ' GLU . . . . . 0.43 ' CG ' ' N ' ' I' ' 58' ' ' GLU . 20.7 tt0 -73.08 146.93 45.43 Favored 'General case' 0 CA--C 1.557 1.213 0 N-CA-C 101.071 -3.677 . . . . 50.0 101.071 177.638 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' I' I ' 58' ' ' GLU . . . . . 0.43 ' N ' ' CG ' ' I' ' 57' ' ' GLU 0.263 2.2 mp0 -62.58 137.22 58.21 Favored 'General case' 0 C--N 1.283 -2.299 0 O-C-N 127.483 2.989 . . . . 50.0 108.803 179.644 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' I' I ' 59' ' ' ILE . . . . . . . . . . . . . 11.1 pt -105.39 161.3 23.19 Favored Pre-proline 0 N--CA 1.478 0.944 0 CA-C-O 117.38 -1.295 . . . . 50.0 107.56 177.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 60' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_exo -68.42 149.36 74.88 Favored 'Trans proline' 0 C--N 1.312 -1.383 0 C-N-CA 124.318 3.346 . . . . 50.0 111.034 -179.174 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 61' ' ' GLU . . . . . 0.549 ' C ' ' N ' ' I' ' 63' ' ' TYS . . . -64.86 -36.98 86.1 Favored 'General case' 0 C--O 1.262 1.749 0 N-CA-C 117.583 2.438 . . . . 50.0 117.583 -176.1 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' I' I ' 62' ' ' GLU . . . . . 0.621 ' N ' ' OE1' ' I' ' 62' ' ' GLU . 2.7 pm0 -50.46 -11.53 0.08 Allowed 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 108.728 -0.842 . . . . 50.0 108.728 -178.022 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' I' I ' 63' ' ' TYS . . . . . 0.549 ' N ' ' C ' ' I' ' 61' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 64' ' ' LEU . . . . . . . . . . . . . 10.9 mt . . . . . 0 C--O 1.282 2.815 0 CA-C-O 112.556 -3.592 . . . . 50.0 115.593 -175.72 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 372' ' ' 0ZE . . . . . 1.258 ' C ' ' OG ' ' H' ' 195' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 391' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 392' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 445' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 456' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 467' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 469' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 480' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 482' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 486' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 515' ' ' HOH . . . . . 0.658 ' O ' ' CE ' ' L' ' 10' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 401' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 422' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 428' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 431' ' ' HOH . . . . . 0.67 ' O ' ' N ' ' H' ' 126' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 432' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 435' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 436' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 438' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 439' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 440' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 441' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 442' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 443' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 444' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 447' ' ' HOH . . . . . 0.583 ' O ' ' CG ' ' H' ' 151' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 449' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 450' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 453' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 454' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 455' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 457' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 458' ' ' HOH . . . . . 0.794 ' O ' ' CE ' ' H' ' 26' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 459' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 460' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 461' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 463' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 465' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 466' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 468' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 470' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 471' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 472' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 473' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 474' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 475' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 476' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 477' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 478' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 479' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 481' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 484' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 485' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 488' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 489' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 490' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 491' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 492' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 493' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 494' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 495' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 497' ' ' HOH . . . . . 0.709 ' O ' ' C41' ' H' ' 372' ' ' 0ZE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 498' ' ' HOH . . . . . 0.572 ' O ' ' NH2' ' H' ' 97' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 499' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 500' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 511' ' ' HOH . . . . . 0.811 ' O ' ' OD2' ' H' ' 60' E ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 512' ' ' HOH . . . . . 0.425 ' O ' ' ND2' ' H' ' 143' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 516' ' ' HOH . . . . . 0.564 ' O ' ' NE ' ' H' ' 101' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 520' ' ' 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 ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 530' ' ' HOH . . . . . 0.659 ' O ' ' N ' ' H' ' 146' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 535' ' ' 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 ' 539' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 540' ' ' HOH . . . . . 0.509 ' O ' ' CE ' ' H' ' 236' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 446' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 462' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 496' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 536' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 1' C GLU . . . . . . . . . . . . . 2.3 mm-40 . . . . . 0 C--O 1.246 0.887 0 CA-C-O 120.667 0.27 . . . . 50.0 110.902 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 1' B ALA . . . . . . . . . . . . . . . -152.12 -46.59 0.11 Allowed 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 125.542 1.537 . . . . 41.22 108.654 -179.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 1' A ASP . . . . . . . . . . . . . 2.5 t0 -104.24 5.71 34.97 Favored 'General case' 0 CA--C 1.549 0.935 0 CA-C-N 110.925 -2.852 . . . . 44.79 109.142 177.798 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 1' ' ' CYS . . . . . . . . . . . . . 14.4 p -52.16 154.9 2.12 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 126.341 2.972 . . . . 28.0 112.82 -178.822 75.182 69.94 103.946 104.647 2.011 101.178 -56.326 -60.626 1 1 . 1 . 001 ecloud build full ' L' L ' 2' ' ' GLY . . . . . . . . . . . . . . . 55.59 9.61 2.6 Favored Glycine 0 N--CA 1.399 -3.8 0 CA-C-O 114.321 -3.488 . . . . 22.18 117.822 175.843 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 3' ' ' LEU . . . . . . . . . . . . . 67.7 mt -107.76 113.08 26.09 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 121.806 2.803 . . . . 20.6 105.775 172.168 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 4' ' ' ARG . . . . . . . . . . . . . 90.8 mtm180 -74.94 122.74 88.14 Favored Pre-proline 0 C--N 1.302 -1.495 0 CA-C-O 123.532 1.634 . . . . 19.76 114.156 -176.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 5' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -52.6 -32.92 56.26 Favored 'Trans proline' 0 C--O 1.259 1.53 0 CA-C-O 114.11 -2.537 . . . . 21.71 110.032 179.105 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -100.15 8.01 44.17 Favored 'General case' 0 C--N 1.303 -1.44 1 CA-C-N 127.398 4.635 . . . . 19.28 117.015 -175.715 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' L' L ' 7' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -138.29 -84.46 0.29 Allowed 'General case' 0 N--CA 1.502 2.173 0 N-CA-C 105.202 -2.147 . . . . 21.82 105.202 -176.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 8' ' ' GLU . . . . . . . . . . . . . 45.6 mp0 -49.29 -55.39 12.88 Favored 'General case' 0 C--O 1.254 1.341 0 N-CA-C 115.184 1.55 . . . . 21.8 115.184 -178.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 9' ' ' LYS . . . . . . . . . . . . . 17.0 mmtm -58.4 -19.4 35.67 Favored 'General case' 0 C--N 1.311 -1.093 0 C-N-CA 128.928 2.891 . . . . 29.56 112.714 -177.199 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 10' ' ' LYS . . . . . 0.792 ' HE2' ' O ' ' L' ' 515' ' ' HOH . 10.0 mtpt -115.48 1.51 13.66 Favored 'General case' 0 C--N 1.297 -1.7 0 CA-C-N 121.498 1.954 . . . . 33.95 107.009 -178.892 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 11' ' ' SER . . . . . . . . . . . . . 15.2 t 58.69 40.37 23.39 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 128.079 3.362 . . . . 25.47 113.096 -176.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 12' ' ' LEU . . . . . . . . . . . . . 85.4 mt -109.41 146.98 33.56 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 105.961 -1.866 . . . . 23.67 105.961 176.167 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 13' ' ' GLU . . . . . . . . . . . . . 80.2 mt-10 -106.39 144.43 33.09 Favored 'General case' 0 C--N 1.296 -1.759 0 O-C-N 126.317 2.261 . . . . 39.63 111.969 -178.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 14' ' ' ASP . . . . . . . . . . . . 0.25 2.0 p30 -74.23 166.66 23.06 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 126.342 2.276 . . . . 23.76 105.722 175.358 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' A LYS . . . . . . . . . . . . 0.356 0.0 OUTLIER -68.98 -7.44 35.39 Favored 'General case' 0 N--CA 1.428 -1.547 0 N-CA-C 117.618 2.451 . . . . 39.99 117.618 -175.186 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' L' L ' 14' B THR . . . . . . . . . . . . . 31.0 p -137.25 12.67 3.04 Favored 'General case' 0 C--N 1.291 -1.96 0 CA-C-N 123.573 2.897 . . . . 23.55 108.368 179.59 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 14' C GLU . . . . . . . . . . . . . 13.3 pt-20 -69.92 -25.26 63.59 Favored 'General case' 0 C--O 1.266 1.962 0 C-N-CA 112.918 -3.513 . . . . 23.72 110.947 179.993 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 14' D ARG . . . . . . . . . . . . . 21.6 ptt180 -53.35 -43.1 67.47 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 119.755 1.161 . . . . 49.36 111.1 179.603 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 14' E GLU . . . . . . . . . . . . . 19.9 tt0 -51.4 -47.66 62.87 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 128.732 2.813 . . . . 33.42 110.737 177.445 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 14' F LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.34 -64.38 0.97 Allowed 'General case' 0 C--N 1.315 -0.934 0 O-C-N 121.446 -0.784 . . . . 24.26 110.456 174.383 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' G LEU . . . . . . . . . . . . . 3.6 mm? -51.16 -40.16 57.96 Favored 'General case' 0 C--N 1.311 -1.076 0 C-N-CA 125.431 1.493 . . . . 29.9 113.022 -178.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 14' H GLU . . . . . 0.914 ' HA ' ' HA ' ' L' ' 14' L ASP . 89.1 mt-10 -69.51 -7.7 40.54 Favored 'General case' 0 C--O 1.25 1.127 0 O-C-N 119.262 -2.149 . . . . 35.62 114.604 177.907 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' I SER . . . . . 0.905 ' C ' ' H ' ' L' ' 14' K ILE . 21.0 p -97.6 -21.55 17.0 Favored 'General case' 0 C--O 1.257 1.473 0 O-C-N 124.698 1.249 . . . . 29.22 111.526 -178.39 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' J TYR . . . . . 0.975 ' C ' HG12 ' L' ' 14' K ILE . 6.4 m-30 -82.91 38.53 0.59 Allowed 'General case' 0 N--CA 1.509 2.515 1 N-CA-C 98.499 -4.63 . . . . 34.12 98.499 -179.322 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' L' L ' 14' K ILE . . . . . 0.975 HG12 ' C ' ' L' ' 14' J TYR 0.312 0.2 OUTLIER 48.49 68.5 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.101 1 CA-C-N 105.568 -5.287 . . . . 41.93 108.912 -172.824 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' L' L ' 14' L ASP . . . . . 0.914 ' HA ' ' HA ' ' L' ' 14' H GLU 0.351 5.7 t0 . . . . . 0 CA--C 1.566 1.593 0 C-N-CA 130.432 3.493 . . . . 47.4 106.779 -175.697 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 16' ' ' ILE . . . . . . . . . . . . . 46.4 mm . . . . . 0 N--CA 1.449 -0.505 0 N-CA-C 107.56 -1.274 . . . . 21.87 107.56 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 17' ' ' VAL . . . . . 0.66 ' O ' ' HA2' ' H' ' 188' ' ' GLY . 16.1 t -101.46 125.42 55.5 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.473 0 CA-C-N 113.453 -1.703 . . . . 26.68 113.311 176.196 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 18' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 64.02 43.36 5.21 Favored 'General case' 0 C--O 1.248 0.996 0 CA-C-N 114.975 -1.011 . . . . 38.11 112.058 176.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 19' ' ' GLY . . . . . . . . . . . . . . . -109.01 -166.04 20.57 Favored Glycine 0 CA--C 1.536 1.394 0 N-CA-C 106.373 -2.691 . . . . 30.47 106.373 178.401 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 20' ' ' SER . . . . . . . . . . . . . 2.3 p -142.17 162.74 34.72 Favored 'General case' 0 N--CA 1.501 2.123 0 N-CA-C 106.213 -1.773 . . . . 34.61 106.213 177.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 21' ' ' ASP . . . . . 0.625 ' OD1' ' NE2' ' H' ' 156' ' ' GLN . 98.6 m-20 -59.65 142.55 52.73 Favored 'General case' 0 C--N 1.287 -2.145 0 CA-C-N 120.091 1.314 . . . . 33.19 108.809 -179.424 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 22' ' ' ALA . . . . . . . . . . . . . . . -79.39 160.36 26.72 Favored 'General case' 0 C--N 1.285 -2.219 0 N-CA-C 105.159 -2.163 . . . . 25.74 105.159 177.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 23' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -83.99 155.17 22.9 Favored 'General case' 0 C--O 1.276 2.449 0 C-N-CA 125.842 1.657 . . . . 29.84 106.543 174.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 24' ' ' ILE . . . . . . . . . . . . . 37.4 mm -65.67 138.25 23.42 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.294 0 N-CA-C 104.359 -2.46 . . . . 23.39 104.359 -179.025 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 25' ' ' GLY . . . . . . . . . . . . . . . 70.85 8.91 64.98 Favored Glycine 0 C--N 1.287 -2.165 0 C-N-CA 126.733 2.111 . . . . 21.03 116.175 -179.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 26' ' ' MET . . . . . 0.931 ' HE3' ' O ' ' H' ' 458' ' ' HOH . 1.1 ttt -64.3 -42.71 96.24 Favored 'General case' 0 C--O 1.256 1.439 0 CA-C-O 115.873 -2.013 . . . . 26.22 115.667 178.789 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 27' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -133.06 79.03 63.72 Favored Pre-proline 0 C--O 1.255 1.365 0 CA-C-N 123.034 2.652 . . . . 22.09 107.099 178.175 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 28' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -66.77 -8.53 21.63 Favored 'Trans proline' 0 C--N 1.287 -2.671 0 CA-C-O 128.9 3.625 . . . . 18.19 114.614 -172.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 29' ' ' TRP . . . . . . . . . . . . . 8.0 p90 -93.9 -6.85 44.69 Favored 'General case' 0 C--O 1.275 2.412 0 O-C-N 117.729 -3.107 . . . . 18.5 109.605 -179.386 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 30' ' ' GLN . . . . . . . . . . . . . 49.6 tp60 -64.34 123.62 19.62 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-O 123.6 1.667 . . . . 21.4 110.265 178.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 31' ' ' VAL . . . . . . . . . . . . . 80.6 t -115.81 144.03 24.38 Favored 'Isoleucine or valine' 0 C--O 1.28 2.706 0 CA-C-N 114.263 -1.335 . . . . 19.56 110.876 179.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 32' ' ' MET . . . . . 0.634 ' HG3' HD12 ' H' ' 40' ' ' LEU . 35.7 ttm -107.71 126.28 52.41 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 106.531 -1.655 . . . . 23.53 106.531 175.414 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 33' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -86.68 113.3 22.44 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 106.079 -1.823 . . . . 31.72 106.079 175.505 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 34' ' ' PHE . . . . . . . . . . . . . 22.4 t80 -120.99 127.79 52.11 Favored 'General case' 0 CA--C 1.505 -0.752 0 CA-C-O 126.505 3.05 . . . . 33.19 116.99 -171.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 35' ' ' ARG . . . . . 0.762 ' O ' ' HA ' ' H' ' 38' ' ' GLN . 3.6 ttt180 -82.51 123.68 29.4 Favored 'General case' 0 C--O 1.246 0.888 0 CA-C-N 111.774 -2.467 . . . . 43.08 111.584 178.811 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 36' ' ' LYS . . . . . 0.601 ' HG2' HD23 ' I' ' 64' ' ' LEU . 78.9 mttt -67.78 -47.83 68.07 Favored 'General case' 0 C--O 1.253 1.253 0 O-C-N 125.924 2.015 . . . . 42.91 111.135 178.997 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 36' A SER . . . . . . . . . . . . . 0.6 OUTLIER -140.79 112.24 6.91 Favored Pre-proline 0 N--CA 1.487 1.398 0 N-CA-C 115.85 1.796 . . . . 49.1 115.85 -179.477 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 37' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -70.3 155.86 94.53 Favored 'Cis proline' 0 C--O 1.256 1.415 0 CA-C-N 121.805 1.68 . . . . 44.33 107.805 -2.269 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 38' ' ' GLN . . . . . 0.762 ' HA ' ' O ' ' H' ' 35' ' ' ARG . 58.3 mt-30 -75.72 113.41 13.14 Favored 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 107.133 -1.432 . . . . 48.26 107.133 -178.338 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 39' ' ' GLU . . . . . 0.463 ' OE2' ' HD3' ' H' ' 35' ' ' ARG . 6.8 pt-20 -164.44 146.03 8.4 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 125.217 1.573 . . . . 45.27 111.5 -177.418 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 40' ' ' LEU . . . . . 0.634 HD12 ' HG3' ' H' ' 32' ' ' MET . 2.1 tp -61.78 129.19 39.81 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-O 114.965 -2.445 . . . . 36.23 106.765 -179.46 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 41' ' ' LEU . . . . . 0.444 ' CD2' ' CD2' ' H' ' 64' ' ' LEU . 4.0 tp -93.98 -53.07 4.13 Favored 'General case' 0 C--N 1.316 -0.853 1 O-C-N 129.915 4.51 . . . . 34.17 112.201 176.543 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 42' ' ' CYS . . . . . . . . . . . . 0.25 6.8 m -165.79 175.03 9.06 Favored 'General case' 0 C--O 1.25 1.092 0 CA-C-O 122.716 1.246 . . . . 25.44 110.489 -174.96 -85.048 -157.271 -94.33 101.944 1.944 109.731 -81.066 -81.491 2 2 . 1 . 001 ecloud build full ' H' H ' 43' ' ' GLY . . . . . . . . . . . . . . . -94.38 -178.63 38.44 Favored Glycine 0 C--O 1.281 3.063 0 N-CA-C 104.961 -3.255 . . . . 21.07 104.961 173.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 44' ' ' ALA . . . . . . . . . . . . . . . -174.51 177.44 2.16 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-O 112.533 -3.603 . . . . 15.59 102.485 -179.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 45' ' ' SER . . . . . . . . . . . . . 58.3 p -144.51 152.21 40.25 Favored 'General case' 0 CA--C 1.507 -0.697 1 O-C-N 129.736 4.397 . . . . 18.62 112.503 176.626 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 46' ' ' LEU . . . . . 0.696 HD22 ' O ' ' H' ' 48' ' ' SER 0.285 0.0 OUTLIER -87.2 124.58 33.45 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 114.268 -2.777 . . . . 22.73 107.891 -179.921 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' H' H ' 47' ' ' ILE . . . . . . . . . . . . 0.327 46.8 pt -107.58 -19.02 6.96 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.888 0 C-N-CA 128.307 2.643 . . . . 23.72 110.65 179.413 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 48' ' ' SER . . . . . 0.696 ' O ' HD22 ' H' ' 46' ' ' LEU . 28.6 p -163.62 -176.76 4.83 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 119.676 -1.89 . . . . 28.28 108.267 173.857 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 49' ' ' ASP . . . . . 0.53 ' HB3' ' CZ ' ' H' ' 114' ' ' PHE . 37.9 p-10 -71.94 -9.91 59.02 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-O 115.479 -2.201 . . . . 38.48 112.559 -176.882 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 50' ' ' ARG . . . . . 0.661 ' HD3' ' O ' ' H' ' 108' ' ' LEU . 0.0 OUTLIER -129.38 3.58 5.13 Favored 'General case' 0 N--CA 1.497 1.911 0 C-N-CA 116.136 -2.226 . . . . 33.58 114.706 -178.659 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 51' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -128.28 132.31 48.7 Favored 'General case' 0 CA--C 1.501 -0.911 0 O-C-N 126.66 2.475 . . . . 28.99 113.014 -176.341 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 52' ' ' VAL . . . . . . . . . . . . . 25.1 t -118.84 141.65 37.56 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 CA-C-N 112.367 -2.197 . . . . 23.12 107.241 177.61 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 53' ' ' LEU . . . . . . . . . . . . . 47.0 tp -111.08 133.72 53.23 Favored 'General case' 0 C--N 1.299 -1.605 0 O-C-N 118.034 -2.916 . . . . 20.28 110.214 178.391 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 54' ' ' THR . . . . . . . . . . . . . 5.8 t -148.6 -173.57 4.38 Favored 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 105.434 -2.061 . . . . 18.55 105.434 178.153 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 55' ' ' ALA . . . . . . . . . . . . . . . -85.95 135.12 33.79 Favored 'General case' 0 C--N 1.286 -2.152 0 CA-C-O 114.521 -2.657 . . . . 18.81 108.517 176.099 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.09 -30.62 69.37 Favored 'General case' 0 C--N 1.284 -2.259 0 CA-C-N 123.871 3.032 . . . . 21.37 111.127 177.361 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 57' ' ' HIS . . . . . 0.509 ' HD2' ' H3 ' ' H' ' 372' ' ' 0ZE . 2.8 p-80 -69.34 -10.28 57.17 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-N 119.74 1.155 . . . . 23.83 112.854 -176.803 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 58' ' ' CYS . . . . . . . . . . . . . 17.1 m -79.19 -24.08 43.43 Favored 'General case' 0 C--O 1.248 0.988 0 CA-C-O 114.383 -2.723 . . . . 22.5 108.789 173.992 -81.491 -81.066 -94.33 109.731 1.944 101.944 -157.271 -85.048 1 1 . 1 . 001 ecloud build full ' H' H ' 59' ' ' LEU . . . . . . . . . . . . . 10.3 mt -102.25 -41.45 6.36 Favored 'General case' 0 C--O 1.255 1.38 0 O-C-N 125.486 1.741 . . . . 25.94 113.915 178.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' ' ' LEU . . . . . . . . . . . . . 15.7 tp -131.57 113.66 13.91 Favored 'General case' 0 C--N 1.298 -1.643 0 C-N-CA 128.69 2.796 . . . . 25.17 114.36 -178.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' A TYR . . . . . . . . . . . . . 9.9 t80 -147.81 79.47 9.34 Favored Pre-proline 0 C--O 1.264 1.83 0 C-N-CA 127.286 2.234 . . . . 27.61 106.969 178.356 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' B PRO . . . . . 0.412 ' N ' ' CD ' ' H' ' 60' C PRO . 83.4 Cg_exo -50.31 -40.43 52.56 Favored 'Trans proline' 0 C--O 1.258 1.484 0 O-C-N 125.573 2.354 . . . . 26.84 115.822 -175.654 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 60' C PRO . . . . . 0.412 ' CD ' ' N ' ' H' ' 60' B PRO . 26.7 Cg_exo -53.61 -20.99 17.84 Favored 'Trans proline' 0 C--O 1.27 2.114 0 C-N-CA 121.773 1.649 . . . . 29.25 113.558 179.038 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 60' D TRP . . . . . 0.539 ' CH2' ' H42' ' H' ' 372' ' ' 0ZE . 46.4 m0 -121.08 13.58 11.31 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-O 116.876 -1.535 . . . . 37.93 109.14 -174.344 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 60' E ASP . . . . . 0.811 ' OD2' ' O ' ' H' ' 511' ' ' HOH . 46.1 m-20 58.05 42.3 22.76 Favored 'General case' 0 C--N 1.287 -2.116 1 O-C-N 130.046 4.591 . . . . 38.57 110.981 -177.996 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 60' F LYS . . . . . 0.625 ' HG2' ' O ' ' H' ' 497' ' ' HOH . 12.7 mptt -99.73 126.25 45.76 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 127.238 2.836 . . . . 39.17 109.136 175.781 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 60' G ASN . . . . . 0.536 ' OD1' ' O ' ' H' ' 60' G ASN . 49.4 t-20 -160.11 61.7 0.35 Allowed 'General case' 0 C--O 1.247 0.95 0 C-N-CA 116.667 -2.013 . . . . 36.53 114.358 -179.202 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 60' H PHE . . . . . . . . . . . . . 64.7 m-85 -64.38 148.17 50.99 Favored 'General case' 0 C--N 1.299 -1.606 0 CA-C-O 125.49 2.567 . . . . 37.1 115.514 -179.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' I THR . . . . . 0.477 ' O ' ' HB2' ' H' ' 63' ' ' ASP . 15.8 p -123.71 163.17 21.65 Favored 'General case' 0 CA--C 1.549 0.941 0 CA-C-N 110.537 -3.029 . . . . 39.07 106.813 177.386 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 61' ' ' GLU . . . . . 0.951 ' OE1' ' HA ' ' H' ' 87' ' ' LYS . 0.7 OUTLIER -41.14 -52.22 3.32 Favored 'General case' 0 C--O 1.255 1.373 0 CA-C-N 110.203 -3.18 . . . . 50.0 109.361 179.617 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 62' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -63.85 -27.12 68.95 Favored 'General case' 0 C--N 1.299 -1.626 0 CA-C-O 126.943 3.258 . . . . 50.0 115.975 -175.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 63' ' ' ASP . . . . . 0.477 ' HB2' ' O ' ' H' ' 60' I THR . 92.3 m-20 -68.85 -30.82 69.42 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 115.607 -2.139 . . . . 46.0 114.346 -177.559 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 64' ' ' LEU . . . . . 0.583 ' HB2' HD11 ' H' ' 85' ' ' LEU . 13.2 mt -114.61 161.91 17.45 Favored 'General case' 0 C--N 1.314 -0.964 1 O-C-N 129.614 4.321 . . . . 38.56 120.327 -171.874 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 65' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -133.74 143.1 48.26 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 110.226 -3.17 . . . . 33.71 108.884 173.892 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 t -107.36 116.61 51.34 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.327 0 C-N-CA 125.854 1.662 . . . . 30.86 112.45 176.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 67' ' ' ARG . . . . . . . . . . . . . 43.7 mtp180 -110.0 113.43 26.15 Favored 'General case' 0 C--O 1.265 1.894 0 CA-C-O 125.893 2.758 . . . . 26.34 114.119 178.363 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 68' ' ' ILE . . . . . . . . . . . . . 1.5 mt -109.07 136.62 44.4 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.975 0 C-N-CA 129.237 3.015 . . . . 27.1 118.622 -177.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 69' ' ' GLY . . . . . . . . . . . . . . . 89.56 20.49 44.25 Favored Glycine 0 C--O 1.259 1.662 0 C-N-CA 126.86 2.171 . . . . 24.17 113.325 175.71 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 70' ' ' LYS . . . . . 0.635 ' HE3' ' O ' ' H' ' 72' ' ' SER . 20.4 mtpp -80.76 155.05 26.88 Favored 'General case' 0 CA--C 1.501 -0.925 0 CA-C-N 110.652 -2.774 . . . . 25.01 114.908 -177.737 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 71' ' ' HIS . . . . . 0.57 ' CD2' HG22 ' H' ' 154' ' ' VAL . 74.4 t60 -132.29 -59.36 0.93 Allowed 'General case' 0 C--O 1.257 1.456 0 CA-C-O 124.55 2.119 . . . . 24.05 106.813 176.812 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 72' ' ' SER . . . . . 0.858 ' OG ' ' HG2' ' H' ' 75' ' ' ARG . 3.3 t -71.73 139.74 49.24 Favored 'General case' 0 N--CA 1.504 2.269 0 CA-C-N 112.995 -1.911 . . . . 25.09 107.611 177.902 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 73' ' ' ARG . . . . . . . . . . . . . 55.1 ttp85 -67.74 -59.57 3.22 Favored 'General case' 0 C--O 1.266 1.928 0 CA-C-O 125.28 2.467 . . . . 31.55 111.879 177.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 74' ' ' THR . . . . . . . . . . . . . 30.2 p -88.34 -34.27 17.69 Favored 'General case' 0 C--O 1.264 1.845 0 N-CA-C 118.714 2.857 . . . . 32.94 118.714 -178.472 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 75' ' ' ARG . . . . . 1.023 ' HG3' HH11 ' H' ' 75' ' ' ARG . 0.2 OUTLIER -60.11 148.77 34.77 Favored 'General case' 0 N--CA 1.44 -0.926 0 CA-C-N 123.073 2.67 . . . . 31.15 112.82 179.86 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 76' ' ' TYR . . . . . . . . . . . . . 17.8 t80 -95.17 117.49 30.33 Favored 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 101.271 -3.603 . . . . 33.43 101.271 173.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 77' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -92.06 80.28 5.13 Favored 'General case' 0 CA--C 1.494 -1.185 0 CA-C-O 127.085 3.326 . . . . 29.04 112.478 -171.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 77' A ARG . . . . . 0.446 ' O ' ' HB2' ' H' ' 78' ' ' ASN . 47.3 ttp85 -55.22 127.78 30.89 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 110.292 -3.14 . . . . 29.5 107.226 -174.689 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 78' ' ' ASN . . . . . 0.446 ' HB2' ' O ' ' H' ' 77' A ARG . 73.7 m-20 75.14 -5.55 2.14 Favored 'General case' 0 C--O 1.252 1.236 0 O-C-N 126.341 2.276 . . . . 31.27 114.851 -179.3 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 79' ' ' ILE . . . . . . . . . . . . . 44.8 mt -107.11 -63.32 1.88 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 CA-C-O 122.6 1.19 . . . . 29.38 110.765 177.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 80' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -76.33 152.04 36.5 Favored 'General case' 0 CA--C 1.498 -1.037 0 CA-C-O 123.807 1.765 . . . . 27.58 112.473 -179.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 81' ' ' LYS . . . . . . . . . . . . . 20.1 mtpt -126.68 135.56 51.32 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 105.434 -2.061 . . . . 45.76 105.434 176.114 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 82' ' ' ILE . . . . . . . . . . . . . 1.2 mt -111.75 132.65 59.78 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.199 0 C-N-CA 127.367 2.267 . . . . 34.14 105.096 -176.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 83' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -132.2 171.99 12.97 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 119.752 1.16 . . . . 37.53 108.157 -178.194 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 84' ' ' MET . . . . . . . . . . . . . 47.9 mtt -113.04 145.08 41.51 Favored 'General case' 0 C--O 1.252 1.207 1 O-C-N 129.431 4.207 . . . . 49.29 110.784 179.412 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 85' ' ' LEU . . . . . 0.776 HD13 ' CE ' ' H' ' 106' ' ' MET . 0.5 OUTLIER -87.65 143.56 27.12 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 112.152 -2.295 . . . . 36.28 106.579 179.878 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 86' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -99.15 -35.15 10.1 Favored 'General case' 0 C--N 1.285 -2.204 0 C-N-CA 126.887 2.075 . . . . 45.06 107.521 173.789 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 87' ' ' LYS . . . . . 0.951 ' HA ' ' OE1' ' H' ' 61' ' ' GLU . 0.2 OUTLIER -166.1 142.81 5.15 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 122.616 1.198 . . . . 43.83 112.744 -176.55 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 88' ' ' ILE . . . . . 0.419 HG21 HD13 ' H' ' 88' ' ' ILE . 3.1 mt -109.03 137.96 38.55 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.146 0 N-CA-C 107.173 -1.418 . . . . 33.81 107.173 176.073 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 89' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -129.42 125.3 36.21 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 104.83 -2.285 . . . . 40.66 104.83 177.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 90' ' ' ILE . . . . . . . . . . . . . 15.3 mt -111.95 145.53 17.97 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 O-C-N 128.765 3.79 . . . . 27.34 106.593 -178.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 91' ' ' HIS . . . . . 0.515 ' CE1' ' HD3' ' H' ' 101' ' ' ARG . 40.3 t-80 -55.57 125.32 60.02 Favored Pre-proline 0 C--O 1.252 1.189 0 CA-C-O 123.328 1.537 . . . . 25.42 111.296 175.909 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 92' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -50.03 -34.55 38.5 Favored 'Trans proline' 0 N--CA 1.447 -1.225 0 C-N-CA 122.374 2.049 . . . . 27.31 111.245 178.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 93' ' ' ARG . . . . . . . . . . . . . 60.3 mtp180 -109.46 27.33 9.66 Favored 'General case' 0 C--O 1.249 1.064 0 N-CA-C 115.956 1.836 . . . . 34.15 115.956 -178.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 94' ' ' TYR . . . . . 0.49 ' CZ ' ' HB3' ' H' ' 96' ' ' TRP . 2.1 t80 -54.86 127.22 27.6 Favored 'General case' 0 C--O 1.262 1.728 0 CA-C-O 115.245 -2.312 . . . . 24.82 105.623 172.119 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 95' ' ' ASN . . . . . . . . . . . . . 62.0 t-20 -108.04 85.07 2.05 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-N 120.656 1.571 . . . . 28.91 112.592 -178.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 96' ' ' TRP . . . . . 0.49 ' HB3' ' CZ ' ' H' ' 94' ' ' TYR . 64.2 p-90 -81.38 -19.26 43.04 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 115.547 -2.168 . . . . 26.0 111.189 -175.73 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 97' ' ' ARG . . . . . 0.572 ' NH2' ' O ' ' H' ' 498' ' ' HOH . 54.5 mtt-85 -71.57 -39.17 70.79 Favored 'General case' 0 C--O 1.276 2.472 1 O-C-N 129.437 4.211 . . . . 34.32 113.578 -179.28 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 97' A GLU . . . . . . . . . . . . . 17.9 tt0 -111.86 -65.93 1.13 Allowed 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 115.581 -2.448 . . . . 36.68 117.017 -177.612 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 98' ' ' ASN . . . . . 0.511 ' OD1' ' N ' ' H' ' 98' ' ' ASN . 21.9 p30 -134.44 23.83 3.75 Favored 'General case' 0 C--O 1.292 3.342 0 N-CA-C 119.122 3.008 . . . . 27.16 119.122 -176.785 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 99' ' ' LEU . . . . . 0.467 ' O ' ' HB2' ' H' ' 102' ' ' ASP . 7.2 mt 62.49 34.54 15.28 Favored 'General case' 0 C--N 1.312 -1.059 0 C-N-CA 129.856 3.262 . . . . 24.41 111.579 -179.128 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 100' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -69.92 132.03 45.35 Favored 'General case' 0 C--N 1.287 -2.133 0 O-C-N 125.95 2.031 . . . . 21.42 106.605 -177.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 101' ' ' ARG . . . . . 0.515 ' HD3' ' CE1' ' H' ' 91' ' ' HIS . 58.0 mtt85 64.83 44.23 3.73 Favored 'General case' 0 CA--C 1.558 1.256 0 O-C-N 128.684 3.74 . . . . 31.03 112.145 -176.2 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 102' ' ' ASP . . . . . 0.467 ' HB2' ' O ' ' H' ' 99' ' ' LEU . 42.2 t0 -77.5 83.49 3.91 Favored 'General case' 0 C--N 1.287 -2.113 0 C-N-CA 125.519 1.527 . . . . 17.29 111.802 178.455 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 103' ' ' ILE . . . . . 0.438 HD11 HD11 ' H' ' 238' ' ' ILE . 16.5 tt -155.32 146.49 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 CA-C-N 112.86 -1.973 . . . . 19.13 111.29 -177.303 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 104' ' ' ALA . . . . . . . . . . . . . . . -153.64 148.28 26.29 Favored 'General case' 0 C--O 1.206 -1.218 0 N-CA-C 106.539 -1.652 . . . . 20.06 106.539 179.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 105' ' ' LEU . . . . . . . . . . . . . 43.4 mt -109.17 147.75 32.01 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 105.227 -2.138 . . . . 25.81 105.227 176.567 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 106' ' ' MET . . . . . 0.776 ' CE ' HD13 ' H' ' 85' ' ' LEU . 62.6 mtp -125.15 125.25 43.41 Favored 'General case' 0 C--N 1.299 -1.587 0 N-CA-C 103.967 -2.605 . . . . 34.07 103.967 177.543 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 107' ' ' LYS . . . . . . . . . . . . . 53.7 tttt -97.27 122.9 40.82 Favored 'General case' 0 C--O 1.265 1.901 0 N-CA-C 107.095 -1.446 . . . . 37.6 107.095 179.738 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 108' ' ' LEU . . . . . 0.661 ' O ' ' HD3' ' H' ' 50' ' ' ARG . 76.5 mt -76.19 145.19 40.02 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 125.377 1.673 . . . . 30.4 112.272 -177.53 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 109' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.23 -40.52 74.24 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 125.115 1.509 . . . . 42.42 109.846 178.264 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 110' ' ' LYS . . . . . 0.424 ' HE2' ' O ' ' H' ' 529' ' ' HOH . 1.2 mttt -139.6 156.06 71.4 Favored Pre-proline 0 N--CA 1.489 1.521 0 O-C-N 119.355 -2.091 . . . . 46.58 107.257 176.776 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 111' ' ' PRO . . . . . 0.412 ' HA ' ' HG2' ' H' ' 50' ' ' ARG . 16.1 Cg_exo -71.65 135.71 26.65 Favored 'Trans proline' 0 C--O 1.272 2.216 0 O-C-N 125.7 2.421 . . . . 36.43 108.76 -179.656 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 112' ' ' VAL . . . . . . . . . . . . . 7.6 p -87.85 157.95 3.11 Favored 'Isoleucine or valine' 0 C--O 1.259 1.58 0 N-CA-C 106.927 -1.508 . . . . 34.97 106.927 -179.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 113' ' ' ALA . . . . . . . . . . . . . . . -102.42 136.51 42.13 Favored 'General case' 0 N--CA 1.479 0.997 0 O-C-N 126.393 2.308 . . . . 31.76 106.83 -179.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 114' ' ' PHE . . . . . 0.53 ' CZ ' ' HB3' ' H' ' 49' ' ' ASP . 16.3 m-30 -74.8 155.17 37.88 Favored 'General case' 0 CA--C 1.507 -0.702 1 O-C-N 129.461 4.226 . . . . 26.69 107.302 -175.346 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 115' ' ' SER . . . . . . . . . . . . . 3.1 p -160.33 -173.32 3.95 Favored 'General case' 0 C--O 1.269 2.096 0 O-C-N 128.851 3.845 . . . . 22.88 102.881 -176.446 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 116' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -59.84 -29.29 68.17 Favored 'General case' 0 C--N 1.283 -2.303 0 O-C-N 127.148 2.78 . . . . 24.33 109.997 178.605 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 117' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -109.49 0.59 19.34 Favored 'General case' 0 C--O 1.266 1.934 0 O-C-N 128.205 3.441 . . . . 25.13 117.513 -176.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 118' ' ' ILE . . . . . . . . . . . . . 12.9 mt -130.76 115.45 30.88 Favored 'Isoleucine or valine' 0 C--N 1.267 -2.984 0 C-N-CA 130.721 3.608 . . . . 21.68 113.209 -177.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 119' ' ' HIS . . . . . . . . . . . . . 25.3 t60 -167.16 134.64 1.99 Allowed Pre-proline 0 N--CA 1.51 2.566 0 C-N-CA 114.362 -2.935 . . . . 22.49 108.625 -176.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 120' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -74.08 155.8 47.35 Favored 'Trans proline' 0 C--O 1.259 1.555 0 C-N-CA 121.949 1.766 . . . . 18.67 114.522 -176.122 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 121' ' ' VAL . . . . . . . . . . . . . 14.8 p -98.47 161.55 2.97 Favored 'Isoleucine or valine' 0 C--O 1.263 1.785 0 N-CA-C 102.859 -3.015 . . . . 18.21 102.859 178.412 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 122' ' ' CYS . . . . . . . . . . . . . 78.9 m -91.18 154.44 19.32 Favored 'General case' 0 C--O 1.254 1.294 0 O-C-N 119.767 -1.833 . . . . 20.91 109.037 178.99 -60.626 -56.326 103.946 101.178 2.011 104.647 69.94 75.182 1 1 . 1 . 001 ecloud build full ' H' H ' 123' ' ' LEU . . . . . . . . . . . . . 37.1 mt -101.67 138.35 19.82 Favored Pre-proline 0 C--N 1.295 -1.802 0 N-CA-C 103.957 -2.608 . . . . 23.14 103.957 177.025 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 124' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -71.81 155.8 57.71 Favored 'Trans proline' 0 CA--C 1.497 -1.326 0 O-C-N 126.476 2.83 . . . . 27.63 110.066 -176.085 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 125' ' ' ASP . . . . . 0.405 ' OD1' ' HB2' ' H' ' 127' ' ' GLU . 3.4 p30 -106.43 162.39 13.74 Favored 'General case' 0 C--O 1.269 2.117 0 N-CA-C 103.295 -2.854 . . . . 41.41 103.295 174.331 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 126' ' ' ARG . . . . . 0.506 ' HA ' ' CZ ' ' H' ' 232' ' ' PHE . 22.7 ttt180 -46.87 -41.05 15.14 Favored 'General case' 0 CA--C 1.512 -0.484 0 O-C-N 125.675 1.859 . . . . 50.0 113.644 -179.228 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 127' ' ' GLU . . . . . 0.419 ' CD ' ' H ' ' H' ' 127' ' ' GLU . 0.0 OUTLIER -65.4 -46.43 80.06 Favored 'General case' 0 C--N 1.293 -1.878 0 C-N-CA 127.345 2.258 . . . . 41.23 112.37 179.502 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 128' ' ' THR . . . . . . . . . . . . 0.315 88.0 m -67.93 -37.75 82.03 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 117.947 -1.025 . . . . 31.56 108.361 -176.614 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.46 -40.05 89.78 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 124.491 2.091 . . . . 28.89 113.428 178.279 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 129' A ALA . . . . . . . . . . . . . . . -64.69 -52.85 55.05 Favored 'General case' 0 C--O 1.253 1.272 0 C-N-CA 126.088 1.755 . . . . 29.55 113.797 -176.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 129' B SER . . . . . . . . . . . . . 0.8 OUTLIER -72.34 -26.83 62.08 Favored 'General case' 0 C--N 1.314 -0.976 1 CA-C-O 110.579 -4.534 . . . . 32.01 111.904 179.906 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 129' C LEU . . . . . . . . . . . . . 66.0 mt -100.29 -33.17 10.51 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 128.775 3.797 . . . . 28.1 116.616 -173.466 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 130' ' ' LEU . . . . . 0.749 ' CD2' HD13 ' H' ' 162' ' ' ILE 0.263 2.0 mt -79.77 80.29 6.18 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 128.785 3.803 . . . . 29.18 108.892 -176.396 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 131' ' ' GLN . . . . . . . . . . . . . 63.1 mt-30 -136.74 135.82 38.43 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 112.525 -2.125 . . . . 38.39 116.155 179.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 132' ' ' ALA . . . . . . . . . . . . . . . -48.24 132.47 16.12 Favored 'General case' 0 C--O 1.246 0.899 0 C-N-CA 125.905 1.682 . . . . 25.21 106.574 177.255 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 133' ' ' GLY . . . . . . . . . . . . . . . 93.34 -34.22 4.7 Favored Glycine 0 N--CA 1.424 -2.134 0 O-C-N 127.827 3.204 . . . . 22.17 117.452 -175.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 134' ' ' TYR . . . . . 0.474 ' OH ' HD11 ' L' ' 14' K ILE . 3.2 m-30 -62.28 141.56 58.19 Favored 'General case' 0 C--N 1.291 -1.95 0 O-C-N 118.396 -2.826 . . . . 29.17 107.733 177.305 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 135' ' ' LYS . . . . . 0.623 ' HE2' ' OH ' ' H' ' 184' A TYR . 46.9 mttp -99.43 147.25 25.45 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 116.286 -1.816 . . . . 26.28 109.292 -178.889 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 136' ' ' GLY . . . . . 0.489 ' HA3' ' CZ ' ' H' ' 199' ' ' PHE . . . -124.16 -179.79 15.87 Favored Glycine 0 CA--C 1.563 3.031 2 O-C-N 129.708 4.38 . . . . 18.52 102.56 174.899 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 137' ' ' ARG . . . . . . . . . . . . . 21.1 ttm180 -133.92 136.24 44.12 Favored 'General case' 0 C--O 1.206 -1.217 0 N-CA-C 105.211 -2.144 . . . . 16.36 105.211 -176.402 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 138' ' ' VAL . . . . . . . . . . . . . 8.0 t -120.53 143.98 30.81 Favored 'Isoleucine or valine' 0 C--N 1.37 1.462 0 N-CA-C 103.523 -2.769 . . . . 16.82 103.523 178.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 139' ' ' THR . . . . . 0.489 HG22 HG13 ' H' ' 157' ' ' VAL . 18.1 p -133.58 156.95 46.91 Favored 'General case' 0 N--CA 1.485 1.312 0 O-C-N 126.452 2.345 . . . . 16.73 109.34 177.476 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 140' ' ' GLY . . . . . . . . . . . . . . . 169.54 167.38 30.0 Favored Glycine 0 C--O 1.213 -1.188 0 O-C-N 120.415 -1.428 . . . . 19.99 112.459 178.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 141' ' ' TRP . . . . . . . . . . . . . 5.8 m-90 -101.66 8.59 41.62 Favored 'General case' 0 C--O 1.248 0.998 0 O-C-N 127.784 2.697 . . . . 25.29 111.859 -179.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 142' ' ' GLY . . . . . . . . . . . . . . . -65.29 175.02 15.57 Favored Glycine 0 N--CA 1.436 -1.36 0 C-N-CA 127.782 2.61 . . . . 28.14 115.523 -179.024 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 143' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -53.17 142.06 21.61 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 123.847 1.784 . . . . 37.55 111.415 -178.381 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 144' ' ' LEU . . . . . . . . . . . . . 93.2 mt -87.41 -16.27 35.38 Favored 'General case' 0 C--O 1.246 0.873 0 CA-C-N 108.81 -3.814 . . . . 31.12 112.11 -179.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 145' ' ' LYS . . . . . . . . . . . . . 18.7 mtpt -147.87 150.51 34.26 Favored 'General case' 0 C--N 1.288 -2.108 0 O-C-N 126.009 2.068 . . . . 45.41 106.35 -177.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 146' ' ' GLU . . . . . . . . . . . . . 46.1 tt0 . . . . . 0 C--O 1.268 2.057 0 O-C-N 124.922 1.389 . . . . 37.9 113.412 -178.747 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 150' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.931 0 N-CA-C 115.743 1.057 . . . . 41.26 115.743 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 151' ' ' GLN . . . . . 1.06 ' HG2' ' O ' ' H' ' 447' ' ' HOH . 10.1 mp0 -122.83 140.43 33.23 Favored Pre-proline 0 N--CA 1.495 1.817 0 N-CA-C 102.662 -3.088 . . . . 47.36 102.662 178.235 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 152' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -72.75 165.52 32.52 Favored 'Trans proline' 0 CA--C 1.502 -1.083 0 O-C-N 127.553 3.396 . . . . 36.42 108.557 -173.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 153' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.41 -19.46 21.27 Favored 'General case' 0 C--N 1.295 -1.777 0 N-CA-C 107.153 -1.425 . . . . 34.55 107.153 174.205 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 154' ' ' VAL . . . . . 0.57 HG22 ' CD2' ' H' ' 71' ' ' HIS 0.316 0.5 OUTLIER -138.23 165.77 24.81 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.705 0 N-CA-C 108.551 -0.907 . . . . 28.31 108.551 -178.419 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' H' H ' 155' ' ' LEU . . . . . . . . . . . . . 45.3 tp -55.89 139.46 45.9 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 117.341 -1.314 . . . . 24.15 109.081 -179.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 156' ' ' GLN . . . . . 0.625 ' NE2' ' OD1' ' H' ' 21' ' ' ASP . 85.7 mm-40 -105.67 155.24 19.44 Favored 'General case' 0 C--N 1.29 -2.018 0 CA-C-O 115.822 -2.037 . . . . 25.43 109.295 179.567 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 157' ' ' VAL . . . . . 0.489 HG13 HG22 ' H' ' 139' ' ' THR . 0.2 OUTLIER -136.2 152.92 30.76 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 N-CA-C 107.29 -1.374 . . . . 25.86 107.29 177.369 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 158' ' ' VAL . . . . . . . . . . . . . 9.4 p -151.94 142.4 15.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 124.789 1.306 . . . . 20.74 108.377 170.266 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 159' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -101.75 131.08 48.24 Favored 'General case' 0 C--N 1.307 -1.239 0 C-N-CA 127.982 2.513 . . . . 24.71 107.319 174.273 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 160' ' ' LEU . . . . . . . . . . . . . 82.9 mt -141.19 145.76 40.04 Favored Pre-proline 0 C--N 1.28 -2.433 0 CA-C-N 121.757 2.071 . . . . 23.1 109.815 -175.236 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 161' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -83.79 149.57 12.59 Favored 'Trans proline' 0 CA--C 1.483 -2.067 0 O-C-N 126.148 2.657 . . . . 19.57 112.661 179.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 162' ' ' ILE . . . . . 0.749 HD13 ' CD2' ' H' ' 130' ' ' LEU . 84.6 mt -76.84 139.94 17.97 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.436 0 N-CA-C 104.423 -2.436 . . . . 20.68 104.423 175.272 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 163' ' ' VAL . . . . . . . . . . . . . 46.4 t -107.48 146.98 12.99 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.042 0 C-N-CA 128.995 2.918 . . . . 21.17 109.374 -178.703 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 164' ' ' GLU . . . . . 0.755 ' OE1' HG21 ' H' ' 167' ' ' VAL . 7.3 mp0 -62.97 139.12 58.73 Favored 'General case' 0 C--N 1.311 -1.086 0 O-C-N 117.558 -3.214 . . . . 40.33 108.407 177.17 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 165' ' ' ARG . . . . . 1.021 ' HE ' ' HE3' ' H' ' 169' ' ' LYS . 54.5 ttt180 -45.37 -40.42 12.66 Favored Pre-proline 0 C--N 1.306 -1.316 0 C-N-CA 127.905 2.482 . . . . 44.94 114.527 -179.302 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 166' ' ' PRO . . . . . 0.483 ' HD2' ' C ' ' H' ' 164' ' ' GLU . 36.7 Cg_endo -70.89 -41.82 2.61 Favored 'Trans proline' 0 CA--C 1.494 -1.503 0 C-N-CA 123.016 2.477 . . . . 25.75 111.974 -179.246 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 167' ' ' VAL . . . . . 0.755 HG21 ' OE1' ' H' ' 164' ' ' GLU . 43.1 t -61.84 -41.7 91.71 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.305 0 CA-C-N 121.635 2.016 . . . . 23.31 108.799 177.053 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 168' ' ' CYS . . . . . . . . . . . . . 94.6 m -55.88 -59.75 4.45 Favored 'General case' 0 C--O 1.247 0.953 0 CA-C-N 113.4 -1.727 . . . . 22.68 108.309 179.628 -66.175 -59.985 -93.202 105.129 2.014 104.726 -75.726 84.429 1 1 . 1 . 001 ecloud build full ' H' H ' 169' ' ' LYS . . . . . 1.021 ' HE3' ' HE ' ' H' ' 165' ' ' ARG . 37.7 mttt -55.15 -42.19 72.79 Favored 'General case' 0 C--O 1.258 1.525 0 C-N-CA 125.529 1.532 . . . . 29.43 114.555 -176.133 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 170' ' ' ASP . . . . . . . . . . . . . 86.0 m-20 -75.74 -8.23 56.33 Favored 'General case' 0 C--N 1.296 -1.72 0 C-N-CA 127.723 2.409 . . . . 24.07 113.86 179.648 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 171' ' ' SER . . . . . . . . . . . . . 88.7 p -91.01 -7.89 50.66 Favored 'General case' 0 C--O 1.275 2.398 0 CA-C-N 120.078 1.308 . . . . 23.35 108.563 178.203 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 172' ' ' THR . . . . . . . . . . . . . 4.4 t -145.27 169.5 18.11 Favored 'General case' 0 C--N 1.299 -1.6 0 CA-C-O 116.01 -1.948 . . . . 21.37 110.258 -175.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 173' ' ' ARG . . . . . . . . . . . . . 45.3 mtp180 -99.16 -9.94 23.12 Favored 'General case' 0 C--O 1.253 1.263 1 O-C-N 130.101 4.625 . . . . 35.26 110.424 176.533 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 174' ' ' ILE . . . . . . . . . . . . . 98.9 mt -80.56 136.72 22.74 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.1 0 O-C-N 124.621 1.2 . . . . 29.02 111.437 178.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 175' ' ' ARG . . . . . . . . . . . . . 52.7 ttp85 -70.38 123.14 21.01 Favored 'General case' 0 C--O 1.26 1.612 0 CA-C-N 119.184 0.902 . . . . 31.75 110.429 -177.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 176' ' ' ILE . . . . . . . . . . . . . 4.1 mm -88.44 139.18 17.77 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.794 0 C-N-CA 129.022 2.929 . . . . 24.13 108.711 177.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 177' ' ' THR . . . . . . . . . . . . . 2.4 p -118.04 166.41 12.58 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-O 115.209 -2.329 . . . . 22.69 109.067 -177.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 178' ' ' ASP . . . . . . . . . . . . . 83.6 m-20 -61.71 -17.17 54.64 Favored 'General case' 0 C--N 1.275 -2.655 0 C-N-CA 130.246 3.418 . . . . 28.03 110.647 177.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 179' ' ' ASN . . . . . . . . . . . . . 27.2 m-80 -87.47 14.46 8.11 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-O 113.771 -3.014 . . . . 19.25 109.394 177.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 180' ' ' MET . . . . . . . . . . . . . 48.0 mtt -130.8 159.49 37.17 Favored 'General case' 0 C--N 1.294 -1.822 0 O-C-N 126.919 2.637 . . . . 22.07 109.692 179.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 181' ' ' PHE . . . . . . . . . . . . . 27.3 p90 -145.85 159.3 43.41 Favored 'General case' 0 C--N 1.287 -2.133 0 O-C-N 127.54 3.025 . . . . 17.21 103.53 170.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 182' ' ' CYS . . . . . 0.438 ' HA ' ' O ' ' H' ' 226' ' ' GLY . 1.9 p -123.51 155.51 37.42 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 126.897 2.623 . . . . 22.66 107.571 177.448 84.429 -75.726 -93.202 104.726 2.014 105.129 -59.985 -66.175 2 2 . 1 . 001 ecloud build full ' H' H ' 183' ' ' ALA . . . . . . . . . . . . . . . -144.55 147.46 33.23 Favored 'General case' 0 C--O 1.196 -1.755 0 O-C-N 125.839 1.962 . . . . 20.73 112.859 -178.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 184' ' ' GLY . . . . . . . . . . . . . . . 149.71 168.86 15.42 Favored Glycine 0 N--CA 1.427 -1.936 0 C-N-CA 125.657 1.599 . . . . 22.32 110.21 -178.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 184' A TYR . . . . . 0.623 ' OH ' ' HE2' ' H' ' 135' ' ' LYS . 66.1 m-85 -88.91 166.29 14.05 Favored 'General case' 0 C--O 1.252 1.197 0 CA-C-O 124.206 1.955 . . . . 26.5 107.423 176.858 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 185' ' ' LYS . . . . . 0.538 ' N ' ' OE1' ' H' ' 186' B GLU . 6.6 mttp -94.06 158.34 36.29 Favored Pre-proline 0 N--CA 1.512 2.661 0 CA-C-N 110.796 -2.911 . . . . 33.74 105.016 179.301 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 186' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -54.93 -19.96 21.32 Favored 'Trans proline' 0 C--O 1.24 0.58 0 C-N-CA 123.757 2.971 . . . . 37.99 112.673 -177.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 186' A ASP . . . . . 0.628 ' O ' ' N ' ' H' ' 186' C GLY 0.318 1.1 m-20 -68.79 -77.78 0.07 Allowed 'General case' 0 C--N 1.278 -2.515 1 C-N-CA 138.265 6.626 . . . . 50.0 111.269 176.206 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' H' H ' 186' B GLU . . . . . 0.538 ' OE1' ' N ' ' H' ' 185' ' ' LYS 0.262 34.8 mt-10 -34.48 -14.8 0.0 OUTLIER 'General case' 0 C--O 1.261 1.671 0 O-C-N 128.639 3.712 . . . . 50.0 112.566 -174.862 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 186' C GLY . . . . . 0.628 ' N ' ' O ' ' H' ' 186' A ASP . . . 39.22 57.4 2.14 Favored Glycine 0 C--O 1.258 1.638 0 CA-C-O 126.628 3.349 . . . . 44.32 116.999 177.381 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 186' D LYS . . . . . . . . . . . . . 9.2 mttm -154.29 141.84 19.81 Favored 'General case' 0 C--N 1.295 -1.79 1 C-N-CA 138.31 6.644 . . . . 45.91 103.063 176.812 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 187' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -128.01 -177.78 4.26 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 124.451 1.095 . . . . 35.79 109.007 -178.147 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 188' ' ' GLY . . . . . 0.66 ' HA2' ' O ' ' H' ' 17' ' ' VAL . . . 132.42 150.25 6.45 Favored Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 114.208 -1.36 . . . . 27.91 109.974 179.0 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 189' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -172.75 166.1 5.34 Favored 'General case' 0 C--N 1.289 -2.054 0 C-N-CA 127.787 2.435 . . . . 24.07 105.218 -178.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 190' ' ' ALA . . . . . . . . . . . . . . . -80.82 173.24 12.8 Favored 'General case' 0 C--N 1.286 -2.195 0 N-CA-C 101.501 -3.518 . . . . 24.22 101.501 168.899 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 191' ' ' CYS . . . . . . . . . . . . . 6.6 t -157.45 176.22 12.95 Favored 'General case' 0 C--N 1.288 -2.082 0 N-CA-C 106.361 -1.718 . . . . 25.44 106.361 179.35 -160.242 52.814 79.6 106.814 2.021 103.696 -174.922 -51.78 1 1 . 1 . 001 ecloud build full ' H' H ' 192' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -48.57 134.23 15.86 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-O 114.34 -2.743 . . . . 46.49 107.315 178.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 193' ' ' GLY . . . . . . . . . . . . . . . 94.17 -15.81 62.37 Favored Glycine 0 C--N 1.289 -2.058 1 O-C-N 129.412 4.195 . . . . 23.13 115.42 -177.909 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 194' ' ' ASP . . . . . . . . . . . . . 76.0 m-20 -80.38 -21.68 42.1 Favored 'General case' 0 C--N 1.312 -1.045 0 C-N-CA 128.09 2.556 . . . . 23.92 109.232 177.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 195' ' ' SER . . . . . 1.258 ' OG ' ' C ' ' H' ' 372' ' ' 0ZE . 2.8 m -39.79 135.61 1.2 Allowed 'General case' 0 C--O 1.202 -1.42 0 O-C-N 124.718 1.261 . . . . 26.03 110.385 178.323 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 196' ' ' GLY . . . . . . . . . . . . . . . 82.11 -1.37 87.09 Favored Glycine 0 CA--C 1.484 -1.897 0 O-C-N 126.819 2.574 . . . . 17.8 116.77 176.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 197' ' ' GLY . . . . . . . . . . . . . . . -75.24 163.54 54.03 Favored Glycine 0 C--O 1.216 -1.015 0 N-CA-C 108.438 -1.865 . . . . 17.65 108.438 177.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 198' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -87.26 138.53 4.79 Favored 'Trans proline' 0 N--CA 1.435 -1.913 0 O-C-N 125.243 2.181 . . . . 17.45 116.619 -179.017 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 199' ' ' PHE . . . . . 0.489 ' CZ ' ' HA3' ' H' ' 136' ' ' GLY . 33.9 t80 -102.09 115.7 31.1 Favored 'General case' 0 N--CA 1.511 2.611 1 N-CA-C 99.705 -4.183 . . . . 16.34 99.705 169.838 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 200' ' ' VAL . . . . . 0.41 HG12 ' HA ' ' H' ' 209' ' ' GLN . 35.2 m -121.6 159.34 24.15 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.344 0 O-C-N 119.187 -2.195 . . . . 16.98 109.236 -176.158 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 201' ' ' MET . . . . . . . . . . . . . 67.5 mtp -133.52 149.05 51.7 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 105.003 -2.221 . . . . 18.79 105.003 178.15 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 202' ' ' LYS . . . . . 0.428 ' HE3' ' O ' ' H' ' 205' ' ' ASN . 69.5 tttt -98.78 119.24 37.21 Favored 'General case' 0 C--O 1.262 1.749 0 CA-C-O 117.155 -1.402 . . . . 18.41 108.693 178.545 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 203' ' ' SER . . . . . . . . . . . . . 18.3 t -61.56 128.31 89.87 Favored Pre-proline 0 C--N 1.303 -1.454 0 CA-C-N 120.737 1.608 . . . . 18.36 112.998 175.718 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 204' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -74.98 -16.95 19.97 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 122.699 2.266 . . . . 21.29 111.862 173.836 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 204' A PHE . . . . . . . . . . . . . 22.4 m-85 -80.69 -50.81 9.43 Favored 'General case' 0 C--N 1.307 -1.272 0 O-C-N 117.377 -3.327 . . . . 26.68 115.98 177.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 204' B ASN . . . . . 0.594 ' O ' ' HB2' ' H' ' 205' ' ' ASN . 46.7 p30 -119.27 0.58 11.19 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 119.432 -0.907 . . . . 24.41 113.046 -179.425 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 205' ' ' ASN . . . . . 0.594 ' HB2' ' O ' ' H' ' 204' B ASN 0.276 1.5 m120 67.2 17.85 10.33 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 116.589 2.07 . . . . 32.88 116.589 176.346 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 206' ' ' ARG . . . . . . . . . . . . . 76.3 mtt-85 -93.65 151.24 19.79 Favored 'General case' 0 C--N 1.267 -3.017 0 O-C-N 128.161 3.413 . . . . 25.87 111.086 179.714 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 207' ' ' TRP . . . . . . . . . . . . . 93.0 m95 -91.41 130.33 37.27 Favored 'General case' 0 C--N 1.306 -1.283 0 O-C-N 125.842 1.964 . . . . 14.15 108.231 177.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 208' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -120.91 140.58 51.62 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 127.306 2.243 . . . . 17.75 110.531 -177.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 209' ' ' GLN . . . . . 0.41 ' HA ' HG12 ' H' ' 200' ' ' VAL . 41.7 tt0 -97.68 118.44 34.22 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-O 114.856 -2.497 . . . . 15.02 104.648 -176.621 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 210' ' ' MET . . . . . . . . . . . . . 49.2 mmm -102.68 -22.09 14.01 Favored 'General case' 0 C--O 1.214 -0.797 0 O-C-N 126.405 2.316 . . . . 24.92 114.22 -177.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 211' ' ' GLY . . . . . 0.434 ' HA2' ' O ' ' H' ' 229' ' ' THR . . . -144.21 168.32 26.64 Favored Glycine 0 C--O 1.248 0.979 0 O-C-N 124.225 0.953 . . . . 14.78 111.583 -178.123 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 212' ' ' ILE . . . . . 0.436 HD12 ' HB ' ' H' ' 229' ' ' THR . 10.6 mt -126.57 132.83 69.82 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.655 0 N-CA-C 105.755 -1.942 . . . . 13.47 105.755 174.245 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 213' ' ' VAL . . . . . . . . . . . . . 51.6 t -53.27 118.33 1.06 Allowed 'Isoleucine or valine' 0 C--O 1.277 2.528 0 CA-C-O 127.127 3.346 . . . . 14.39 107.538 173.111 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 214' ' ' SER . . . . . . . . . . . . . 12.2 t -110.83 -66.85 1.04 Allowed 'General case' 0 C--O 1.278 2.586 0 O-C-N 117.879 -3.013 . . . . 18.52 116.172 -179.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 215' ' ' TRP . . . . . . . . . . . . . 62.9 p-90 -160.24 162.08 33.61 Favored 'General case' 0 CA--C 1.489 -1.386 0 N-CA-C 116.316 1.969 . . . . 20.99 116.316 -174.387 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 216' ' ' GLY . . . . . . . . . . . . . . . -160.74 -172.56 28.19 Favored Glycine 0 N--CA 1.487 2.047 0 N-CA-C 105.183 -3.167 . . . . 23.46 105.183 176.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 217' ' ' GLU . . . . . 0.474 ' HA ' ' H16' ' H' ' 372' ' ' 0ZE . 47.9 mt-10 -129.52 102.93 6.6 Favored 'General case' 0 C--N 1.279 -2.474 0 N-CA-C 104.145 -2.539 . . . . 32.51 104.145 178.016 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 219' ' ' GLY . . . . . . . . . . . . . . . 74.72 -168.15 54.7 Favored Glycine 1 N--CA 1.523 4.45 1 N-CA-C 101.476 -4.65 . . . . 24.89 101.476 -173.78 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' H' H ' 220' ' ' CYS . . . . . . . . . . . . . 36.8 m -137.2 128.57 28.16 Favored 'General case' 0 C--N 1.291 -1.953 0 N-CA-C 106.827 -1.545 . . . . 27.13 106.827 -179.575 -51.78 -174.922 79.6 103.696 2.021 106.814 52.814 -160.242 1 1 . 1 . 001 ecloud build full ' H' H ' 221' ' ' ASP . . . . . . . . . . . . . 26.5 t0 58.54 31.91 21.55 Favored 'General case' 0 C--O 1.257 1.485 0 O-C-N 127.092 2.745 . . . . 28.25 112.675 174.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 221' A ARG . . . . . . . . . . . . . 1.0 OUTLIER -81.37 141.93 33.51 Favored 'General case' 0 C--O 1.256 1.42 0 N-CA-C 107.216 -1.402 . . . . 41.38 107.216 173.933 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 222' ' ' ASP . . . . . . . . . . . . . 49.6 m-20 -63.31 136.7 57.84 Favored 'General case' 0 C--O 1.243 0.722 0 C-N-CA 119.891 -0.723 . . . . 39.04 110.92 177.642 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 223' ' ' GLY . . . . . . . . . . . . . . . 81.88 4.07 90.41 Favored Glycine 0 C--O 1.255 1.441 0 CA-C-N 119.381 0.991 . . . . 30.47 113.155 177.059 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 224' ' ' LYS . . . . . . . . . . . . . 16.2 mmtt -123.47 151.44 42.72 Favored 'General case' 0 CA--C 1.563 1.448 0 C-N-CA 125.365 1.466 . . . . 36.52 107.748 176.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 225' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -131.32 155.75 46.66 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-O 125.221 2.438 . . . . 26.22 113.037 -175.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 226' ' ' GLY . . . . . 0.438 ' O ' ' HA ' ' H' ' 182' ' ' CYS . . . -85.93 144.23 20.15 Favored Glycine 0 CA--C 1.543 1.819 0 N-CA-C 103.459 -3.857 . . . . 20.28 103.459 175.557 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 227' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -112.79 135.52 53.45 Favored 'General case' 0 C--O 1.252 1.234 0 C-N-CA 127.711 2.404 . . . . 21.82 108.897 175.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 228' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -120.45 144.38 47.99 Favored 'General case' 0 CA--C 1.494 -1.191 0 O-C-N 128.856 3.847 . . . . 17.69 113.489 -178.564 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 229' ' ' THR . . . . . 0.436 ' HB ' HD12 ' H' ' 212' ' ' ILE . 16.3 m -66.65 130.87 44.62 Favored 'General case' 0 C--O 1.244 0.777 0 N-CA-C 107.708 -1.219 . . . . 17.57 107.708 169.136 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 230' ' ' HIS . . . . . 0.513 ' CE1' ' HG3' ' H' ' 233' ' ' ARG . 6.1 t-80 -84.11 97.9 9.59 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 119.132 -2.23 . . . . 23.65 107.967 -179.966 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 231' ' ' VAL . . . . . . . . . . . . . 74.5 t -58.94 -46.86 91.18 Favored 'Isoleucine or valine' 0 C--O 1.253 1.284 0 CA-C-O 114.541 -2.647 . . . . 18.05 114.43 -176.519 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 232' ' ' PHE . . . . . 0.506 ' CZ ' ' HA ' ' H' ' 126' ' ' ARG . 83.3 t80 -63.18 -28.13 69.84 Favored 'General case' 0 N--CA 1.511 2.595 0 C-N-CA 114.569 -2.852 . . . . 23.3 112.994 -179.067 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 233' ' ' ARG . . . . . 0.513 ' HG3' ' CE1' ' H' ' 230' ' ' HIS . 5.5 mtp-105 -67.42 -23.34 65.53 Favored 'General case' 0 N--CA 1.438 -1.051 1 O-C-N 115.181 -4.7 . . . . 42.08 111.27 178.48 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 234' ' ' LEU . . . . . . . . . . . . . 39.6 mt -104.97 6.05 33.19 Favored 'General case' 0 C--O 1.248 1.008 0 CA-C-N 119.647 1.112 . . . . 26.71 110.241 -179.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 235' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -50.2 -39.83 45.33 Favored 'General case' 0 C--O 1.244 0.807 0 CA-C-O 123.162 1.458 . . . . 37.79 113.604 -179.474 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 236' ' ' LYS . . . . . 0.772 ' HE2' ' O ' ' H' ' 540' ' ' HOH . 0.1 OUTLIER -60.44 -48.5 81.47 Favored 'General case' 0 C--O 1.256 1.415 0 CA-C-N 114.497 -1.229 . . . . 40.79 110.28 -177.541 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 237' ' ' TRP . . . . . . . . . . . . . 56.5 t90 -58.05 -42.23 85.0 Favored 'General case' 0 C--N 1.319 -0.744 0 C-N-CA 125.269 1.427 . . . . 30.79 113.304 178.474 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 238' ' ' ILE . . . . . 0.438 HD11 HD11 ' H' ' 103' ' ' ILE . 67.1 mt -63.01 -43.64 99.2 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.021 0 C-N-CA 124.975 1.31 . . . . 32.99 109.724 -179.324 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 239' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -55.4 -59.74 4.38 Favored 'General case' 0 C--N 1.301 -1.509 0 CA-C-O 124.678 2.18 . . . . 48.02 109.691 179.222 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 240' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -41.69 -57.22 2.38 Favored 'General case' 0 C--O 1.257 1.495 0 CA-C-N 109.296 -3.593 . . . . 49.47 107.889 177.323 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 241' ' ' VAL . . . . . . . . . . . . . 39.7 t -57.55 -46.78 86.17 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.372 0 N-CA-C 114.96 1.467 . . . . 39.83 114.96 -179.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 242' ' ' ILE . . . . . . . . . . . . . 76.8 mt -70.92 -40.28 76.25 Favored 'Isoleucine or valine' 0 C--O 1.256 1.432 0 CA-C-N 113.876 -1.511 . . . . 45.54 112.373 -172.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 243' ' ' ASP . . . . . . . . . . . . 0.464 29.6 p30 -91.41 -6.47 52.78 Favored 'General case' 0 C--O 1.262 1.753 0 C-N-CA 114.421 -2.912 . . . . 50.0 113.01 -177.273 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 244' ' ' GLN . . . . . 0.615 ' HG2' ' CD2' ' H' ' 245' ' ' PHE . 0.0 OUTLIER -96.5 -19.29 19.23 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 106.698 -1.593 . . . . 50.0 106.698 176.443 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 245' ' ' PHE . . . . . 0.615 ' CD2' ' HG2' ' H' ' 244' ' ' GLN . 81.7 m-85 -122.15 4.31 9.81 Favored 'General case' 0 C--O 1.261 1.709 0 N-CA-C 117.264 2.32 . . . . 50.0 117.264 -177.288 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 246' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.296 -1.664 0 CA-C-O 116.648 -2.196 . . . . 49.5 114.95 176.793 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 55' ' ' ASP . . . . . . . . . . . . . 1.8 t70 . . . . . 0 N--CA 1.516 2.838 0 CA-C-O 126.573 3.082 . . . . 50.0 105.008 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 56' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -74.04 132.73 42.63 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 110.872 -2.876 . . . . 50.0 110.817 179.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 57' ' ' GLU . . . . . 0.502 ' HG2' ' O ' ' I' ' 58' ' ' GLU . 20.7 tt0 -73.08 146.93 45.43 Favored 'General case' 0 CA--C 1.557 1.213 0 N-CA-C 101.071 -3.677 . . . . 50.0 101.071 177.638 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 58' ' ' GLU . . . . . 0.667 ' CD ' ' H ' ' I' ' 58' ' ' GLU 0.263 2.2 mp0 -62.58 137.22 58.21 Favored 'General case' 0 C--N 1.283 -2.299 0 O-C-N 127.483 2.989 . . . . 50.0 108.803 179.644 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' I' I ' 59' ' ' ILE . . . . . . . . . . . . . 11.1 pt -105.39 161.3 23.19 Favored Pre-proline 0 N--CA 1.478 0.944 0 CA-C-O 117.38 -1.295 . . . . 50.0 107.56 177.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 60' ' ' PRO . . . . . 0.621 ' HD2' ' HD2' ' I' ' 63' ' ' TYS . 20.0 Cg_exo -68.42 149.36 74.88 Favored 'Trans proline' 0 C--N 1.312 -1.383 0 C-N-CA 124.318 3.346 . . . . 50.0 111.034 -179.174 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 61' ' ' GLU . . . . . 0.549 ' C ' ' N ' ' I' ' 63' ' ' TYS . . . -64.86 -36.98 86.1 Favored 'General case' 0 C--O 1.262 1.749 0 N-CA-C 117.583 2.438 . . . . 50.0 117.583 -176.1 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 62' ' ' GLU . . . . . 0.576 ' OE2' ' HB2' ' I' ' 60' ' ' PRO . 2.7 pm0 -50.46 -11.53 0.08 Allowed 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 108.728 -0.842 . . . . 50.0 108.728 -178.022 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 63' ' ' TYS . . . . . 0.621 ' HD2' ' HD2' ' I' ' 60' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 64' ' ' LEU . . . . . 0.601 HD23 ' HG2' ' H' ' 36' ' ' LYS . 10.9 mt . . . . . 0 C--O 1.282 2.815 0 CA-C-O 112.556 -3.592 . . . . 50.0 115.593 -175.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 372' ' ' 0ZE . . . . . 1.258 ' C ' ' OG ' ' H' ' 195' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 391' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 392' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 445' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 456' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 467' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 469' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 480' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 482' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 486' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 515' ' ' HOH . . . . . 0.792 ' O ' ' HE2' ' L' ' 10' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 401' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 422' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 428' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 431' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 432' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 435' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 436' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 438' ' ' HOH . . . . . 0.473 ' O ' ' HG3' ' H' ' 97' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 439' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 440' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 441' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 442' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 443' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 444' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 447' ' ' HOH . . . . . 1.06 ' O ' ' HG2' ' H' ' 151' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 449' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 450' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 453' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 454' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 455' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 457' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 458' ' ' HOH . . . . . 0.931 ' O ' ' HE3' ' H' ' 26' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 459' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 460' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 461' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 463' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 465' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 466' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 468' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 470' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 471' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 472' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 473' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 474' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 475' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 476' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 477' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 478' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 479' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 481' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 484' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 485' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 488' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 489' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 490' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 491' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 492' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 493' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 494' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 495' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 497' ' ' HOH . . . . . 0.76 ' O ' ' H4 ' ' H' ' 372' ' ' 0ZE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 498' ' ' HOH . . . . . 0.572 ' O ' ' NH2' ' H' ' 97' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 499' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 500' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 0 . 1 . 001 ecloud build full ' H' H ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 511' ' ' HOH . . . . . 0.811 ' O ' ' OD2' ' H' ' 60' E ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 517' ' ' HOH . . . . . 0.593 ' O ' ' HB2' ' H' ' 236' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 529' ' ' HOH . . . . . 0.424 ' O ' ' HE2' ' H' ' 110' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 535' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 537' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 538' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 539' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 540' ' ' HOH . . . . . 0.772 ' O ' ' HE2' ' H' ' 236' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 446' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 462' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 496' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 536' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 1' C GLU . . . . . . . . . . . . . 2.3 mm-40 . . . . . 0 C--O 1.246 0.887 0 CA-C-O 120.667 0.27 . . . . 50.0 110.902 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 1' B ALA . . . . . . . . . . . . . . . -152.12 -46.59 0.11 Allowed 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 125.542 1.537 . . . . 41.22 108.654 -179.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 1' A ASP . . . . . . . . . . . . . 2.5 t0 -104.24 5.71 34.97 Favored 'General case' 0 CA--C 1.549 0.935 0 CA-C-N 110.925 -2.852 . . . . 44.79 109.142 177.798 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 1' ' ' CYS . . . . . . . . . . . . . 14.4 p -52.16 154.9 2.12 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 126.341 2.972 . . . . 28.0 112.82 -178.822 75.182 69.94 103.946 104.647 2.011 101.178 -56.326 -60.626 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 2' ' ' GLY . . . . . . . . . . . . . . . 55.59 9.61 2.6 Favored Glycine 0 N--CA 1.399 -3.8 0 CA-C-O 114.321 -3.488 . . . . 22.18 117.822 175.843 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 3' ' ' LEU . . . . . . . . . . . . . 67.7 mt -107.76 113.08 26.09 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 121.806 2.803 . . . . 20.6 105.775 172.168 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 4' ' ' ARG . . . . . . . . . . . . . 90.8 mtm180 -74.94 122.74 88.14 Favored Pre-proline 0 C--N 1.302 -1.495 0 CA-C-O 123.532 1.634 . . . . 19.76 114.156 -176.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 5' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -52.6 -32.92 56.26 Favored 'Trans proline' 0 C--O 1.259 1.53 0 CA-C-O 114.11 -2.537 . . . . 21.71 110.032 179.105 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -100.15 8.01 44.17 Favored 'General case' 0 C--N 1.303 -1.44 1 CA-C-N 127.398 4.635 . . . . 19.28 117.015 -175.715 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' L' L ' 7' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -138.29 -84.46 0.29 Allowed 'General case' 0 N--CA 1.502 2.173 0 N-CA-C 105.202 -2.147 . . . . 21.82 105.202 -176.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 8' ' ' GLU . . . . . . . . . . . . . 45.6 mp0 -49.29 -55.39 12.88 Favored 'General case' 0 C--O 1.254 1.341 0 N-CA-C 115.184 1.55 . . . . 21.8 115.184 -178.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 9' ' ' LYS . . . . . . . . . . . . . 17.0 mmtm -58.4 -19.4 35.67 Favored 'General case' 0 C--N 1.311 -1.093 0 C-N-CA 128.928 2.891 . . . . 29.56 112.714 -177.199 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 10' ' ' LYS . . . . . 0.792 ' HE2' ' O ' ' L' ' 515' ' ' HOH . 10.0 mtpt -115.48 1.51 13.66 Favored 'General case' 0 C--N 1.297 -1.7 0 CA-C-N 121.498 1.954 . . . . 33.95 107.009 -178.892 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 11' ' ' SER . . . . . . . . . . . . . 15.2 t 58.69 40.37 23.39 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 128.079 3.362 . . . . 25.47 113.096 -176.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 12' ' ' LEU . . . . . . . . . . . . . 85.4 mt -109.41 146.98 33.56 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 105.961 -1.866 . . . . 23.67 105.961 176.167 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 13' ' ' GLU . . . . . . . . . . . . . 80.2 mt-10 -106.39 144.43 33.09 Favored 'General case' 0 C--N 1.296 -1.759 0 O-C-N 126.317 2.261 . . . . 39.63 111.969 -178.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 14' ' ' ASP . . . . . . . . . . . . 0.25 2.0 p30 -74.23 166.66 23.06 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 126.342 2.276 . . . . 23.76 105.722 175.358 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' A LYS . . . . . . . . . . . . 0.356 0.0 OUTLIER -68.98 -7.44 35.39 Favored 'General case' 0 N--CA 1.428 -1.547 0 N-CA-C 117.618 2.451 . . . . 39.99 117.618 -175.186 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' L' L ' 14' B THR . . . . . . . . . . . . . 31.0 p -137.25 12.67 3.04 Favored 'General case' 0 C--N 1.291 -1.96 0 CA-C-N 123.573 2.897 . . . . 23.55 108.368 179.59 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 14' C GLU . . . . . . . . . . . . . 13.3 pt-20 -69.92 -25.26 63.59 Favored 'General case' 0 C--O 1.266 1.962 0 C-N-CA 112.918 -3.513 . . . . 23.72 110.947 179.993 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 14' D ARG . . . . . . . . . . . . . 21.6 ptt180 -53.35 -43.1 67.47 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 119.755 1.161 . . . . 49.36 111.1 179.603 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 14' E GLU . . . . . . . . . . . . . 19.9 tt0 -51.4 -47.66 62.87 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 128.732 2.813 . . . . 33.42 110.737 177.445 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 14' F LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.34 -64.38 0.97 Allowed 'General case' 0 C--N 1.315 -0.934 0 O-C-N 121.446 -0.784 . . . . 24.26 110.456 174.383 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' G LEU . . . . . . . . . . . . . 3.6 mm? -51.16 -40.16 57.96 Favored 'General case' 0 C--N 1.311 -1.076 0 C-N-CA 125.431 1.493 . . . . 29.9 113.022 -178.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 14' H GLU . . . . . 0.914 ' HA ' ' HA ' ' L' ' 14' L ASP . 89.1 mt-10 -69.51 -7.7 40.54 Favored 'General case' 0 C--O 1.25 1.127 0 O-C-N 119.262 -2.149 . . . . 35.62 114.604 177.907 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' I SER . . . . . 0.905 ' C ' ' H ' ' L' ' 14' K ILE . 21.0 p -97.6 -21.55 17.0 Favored 'General case' 0 C--O 1.257 1.473 0 O-C-N 124.698 1.249 . . . . 29.22 111.526 -178.39 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' J TYR . . . . . 0.975 ' C ' HG12 ' L' ' 14' K ILE . 6.4 m-30 -82.91 38.53 0.59 Allowed 'General case' 0 N--CA 1.509 2.515 1 N-CA-C 98.499 -4.63 . . . . 34.12 98.499 -179.322 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' L' L ' 14' K ILE . . . . . 0.975 HG12 ' C ' ' L' ' 14' J TYR 0.312 0.2 OUTLIER 48.49 68.5 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.101 1 CA-C-N 105.568 -5.287 . . . . 41.93 108.912 -172.824 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' L' L ' 14' L ASP . . . . . 0.914 ' HA ' ' HA ' ' L' ' 14' H GLU 0.351 5.7 t0 . . . . . 0 CA--C 1.566 1.593 0 C-N-CA 130.432 3.493 . . . . 47.4 106.779 -175.697 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 16' ' ' ILE . . . . . . . . . . . . . 46.4 mm . . . . . 0 N--CA 1.449 -0.505 0 N-CA-C 107.56 -1.274 . . . . 21.87 107.56 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 17' ' ' VAL . . . . . 0.66 ' O ' ' HA2' ' H' ' 188' ' ' GLY . 16.1 t -101.46 125.42 55.5 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.473 0 CA-C-N 113.453 -1.703 . . . . 26.68 113.311 176.196 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 18' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 64.02 43.36 5.21 Favored 'General case' 0 C--O 1.248 0.996 0 CA-C-N 114.975 -1.011 . . . . 38.11 112.058 176.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 19' ' ' GLY . . . . . . . . . . . . . . . -109.01 -166.04 20.57 Favored Glycine 0 CA--C 1.536 1.394 0 N-CA-C 106.373 -2.691 . . . . 30.47 106.373 178.401 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 20' ' ' SER . . . . . . . . . . . . . 2.3 p -142.17 162.74 34.72 Favored 'General case' 0 N--CA 1.501 2.123 0 N-CA-C 106.213 -1.773 . . . . 34.61 106.213 177.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 21' ' ' ASP . . . . . 0.475 ' OD1' ' OE1' ' H' ' 156' ' ' GLN . 98.6 m-20 -59.65 142.55 52.73 Favored 'General case' 0 C--N 1.287 -2.145 0 CA-C-N 120.091 1.314 . . . . 33.19 108.809 -179.424 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 22' ' ' ALA . . . . . . . . . . . . . . . -79.39 160.36 26.72 Favored 'General case' 0 C--N 1.285 -2.219 0 N-CA-C 105.159 -2.163 . . . . 25.74 105.159 177.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 23' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -83.99 155.17 22.9 Favored 'General case' 0 C--O 1.276 2.449 0 C-N-CA 125.842 1.657 . . . . 29.84 106.543 174.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 24' ' ' ILE . . . . . . . . . . . . . 37.4 mm -65.67 138.25 23.42 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.294 0 N-CA-C 104.359 -2.46 . . . . 23.39 104.359 -179.025 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 25' ' ' GLY . . . . . . . . . . . . . . . 70.85 8.91 64.98 Favored Glycine 0 C--N 1.287 -2.165 0 C-N-CA 126.733 2.111 . . . . 21.03 116.175 -179.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 26' ' ' MET . . . . . 0.931 ' HE3' ' O ' ' H' ' 458' ' ' HOH . 1.1 ttt -64.3 -42.71 96.24 Favored 'General case' 0 C--O 1.256 1.439 0 CA-C-O 115.873 -2.013 . . . . 26.22 115.667 178.789 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 27' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -133.06 79.03 63.72 Favored Pre-proline 0 C--O 1.255 1.365 0 CA-C-N 123.034 2.652 . . . . 22.09 107.099 178.175 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 28' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -66.77 -8.53 21.63 Favored 'Trans proline' 0 C--N 1.287 -2.671 0 CA-C-O 128.9 3.625 . . . . 18.19 114.614 -172.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 29' ' ' TRP . . . . . . . . . . . . . 8.0 p90 -93.9 -6.85 44.69 Favored 'General case' 0 C--O 1.275 2.412 0 O-C-N 117.729 -3.107 . . . . 18.5 109.605 -179.386 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 30' ' ' GLN . . . . . . . . . . . . . 49.6 tp60 -64.34 123.62 19.62 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-O 123.6 1.667 . . . . 21.4 110.265 178.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 31' ' ' VAL . . . . . . . . . . . . . 80.6 t -115.81 144.03 24.38 Favored 'Isoleucine or valine' 0 C--O 1.28 2.706 0 CA-C-N 114.263 -1.335 . . . . 19.56 110.876 179.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 32' ' ' MET . . . . . 0.634 ' HG3' HD12 ' H' ' 40' ' ' LEU . 35.7 ttm -107.71 126.28 52.41 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 106.531 -1.655 . . . . 23.53 106.531 175.414 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 33' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -86.68 113.3 22.44 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 106.079 -1.823 . . . . 31.72 106.079 175.505 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 34' ' ' PHE . . . . . . . . . . . . . 22.4 t80 -120.99 127.79 52.11 Favored 'General case' 0 CA--C 1.505 -0.752 0 CA-C-O 126.505 3.05 . . . . 33.19 116.99 -171.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 35' ' ' ARG . . . . . 0.762 ' O ' ' HA ' ' H' ' 38' ' ' GLN . 3.6 ttt180 -82.51 123.68 29.4 Favored 'General case' 0 C--O 1.246 0.888 0 CA-C-N 111.774 -2.467 . . . . 43.08 111.584 178.811 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 36' ' ' LYS . . . . . 0.601 ' HG2' HD23 ' I' ' 64' ' ' LEU . 78.9 mttt -67.78 -47.83 68.07 Favored 'General case' 0 C--O 1.253 1.253 0 O-C-N 125.924 2.015 . . . . 42.91 111.135 178.997 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 36' A SER . . . . . . . . . . . . . 0.6 OUTLIER -140.79 112.24 6.91 Favored Pre-proline 0 N--CA 1.487 1.398 0 N-CA-C 115.85 1.796 . . . . 49.1 115.85 -179.477 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 37' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -70.3 155.86 94.53 Favored 'Cis proline' 0 C--O 1.256 1.415 0 CA-C-N 121.805 1.68 . . . . 44.33 107.805 -2.269 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 38' ' ' GLN . . . . . 0.762 ' HA ' ' O ' ' H' ' 35' ' ' ARG . 58.3 mt-30 -75.72 113.41 13.14 Favored 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 107.133 -1.432 . . . . 48.26 107.133 -178.338 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 39' ' ' GLU . . . . . 0.463 ' OE2' ' HD3' ' H' ' 35' ' ' ARG . 6.8 pt-20 -164.44 146.03 8.4 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 125.217 1.573 . . . . 45.27 111.5 -177.418 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 40' ' ' LEU . . . . . 0.634 HD12 ' HG3' ' H' ' 32' ' ' MET . 2.1 tp -61.78 129.19 39.81 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-O 114.965 -2.445 . . . . 36.23 106.765 -179.46 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 41' ' ' LEU . . . . . 0.444 ' CD2' ' CD2' ' H' ' 64' ' ' LEU . 4.0 tp -93.98 -53.07 4.13 Favored 'General case' 0 C--N 1.316 -0.853 1 O-C-N 129.915 4.51 . . . . 34.17 112.201 176.543 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 42' ' ' CYS . . . . . . . . . . . . 0.25 6.8 m -165.79 175.03 9.06 Favored 'General case' 0 C--O 1.25 1.092 0 CA-C-O 122.716 1.246 . . . . 25.44 110.489 -174.96 -85.048 -157.271 -94.33 101.944 1.944 109.731 -81.066 -81.491 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 43' ' ' GLY . . . . . . . . . . . . . . . -94.38 -178.63 38.44 Favored Glycine 0 C--O 1.281 3.063 0 N-CA-C 104.961 -3.255 . . . . 21.07 104.961 173.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 44' ' ' ALA . . . . . . . . . . . . . . . -174.51 177.44 2.16 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-O 112.533 -3.603 . . . . 15.59 102.485 -179.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 45' ' ' SER . . . . . . . . . . . . . 58.3 p -144.51 152.21 40.25 Favored 'General case' 0 CA--C 1.507 -0.697 1 O-C-N 129.736 4.397 . . . . 18.62 112.503 176.626 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 46' ' ' LEU . . . . . 0.696 HD22 ' O ' ' H' ' 48' ' ' SER 0.285 0.0 OUTLIER -87.2 124.58 33.45 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 114.268 -2.777 . . . . 22.73 107.891 -179.921 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' H' H ' 47' ' ' ILE . . . . . . . . . . . . 0.327 46.8 pt -107.58 -19.02 6.96 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.888 0 C-N-CA 128.307 2.643 . . . . 23.72 110.65 179.413 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 48' ' ' SER . . . . . 0.696 ' O ' HD22 ' H' ' 46' ' ' LEU . 28.6 p -163.62 -176.76 4.83 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 119.676 -1.89 . . . . 28.28 108.267 173.857 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 49' ' ' ASP . . . . . 0.53 ' HB3' ' CZ ' ' H' ' 114' ' ' PHE . 37.9 p-10 -71.94 -9.91 59.02 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-O 115.479 -2.201 . . . . 38.48 112.559 -176.882 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 50' ' ' ARG . . . . . 0.661 ' HD3' ' O ' ' H' ' 108' ' ' LEU . 0.0 OUTLIER -129.38 3.58 5.13 Favored 'General case' 0 N--CA 1.497 1.911 0 C-N-CA 116.136 -2.226 . . . . 33.58 114.706 -178.659 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 51' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -128.28 132.31 48.7 Favored 'General case' 0 CA--C 1.501 -0.911 0 O-C-N 126.66 2.475 . . . . 28.99 113.014 -176.341 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 52' ' ' VAL . . . . . . . . . . . . . 25.1 t -118.84 141.65 37.56 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 CA-C-N 112.367 -2.197 . . . . 23.12 107.241 177.61 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 53' ' ' LEU . . . . . . . . . . . . . 47.0 tp -111.08 133.72 53.23 Favored 'General case' 0 C--N 1.299 -1.605 0 O-C-N 118.034 -2.916 . . . . 20.28 110.214 178.391 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 54' ' ' THR . . . . . . . . . . . . . 5.8 t -148.6 -173.57 4.38 Favored 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 105.434 -2.061 . . . . 18.55 105.434 178.153 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 55' ' ' ALA . . . . . . . . . . . . . . . -85.95 135.12 33.79 Favored 'General case' 0 C--N 1.286 -2.152 0 CA-C-O 114.521 -2.657 . . . . 18.81 108.517 176.099 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.09 -30.62 69.37 Favored 'General case' 0 C--N 1.284 -2.259 0 CA-C-N 123.871 3.032 . . . . 21.37 111.127 177.361 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 57' ' ' HIS . . . . . 0.509 ' HD2' ' H3 ' ' H' ' 372' ' ' 0ZE . 2.8 p-80 -69.34 -10.28 57.17 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-N 119.74 1.155 . . . . 23.83 112.854 -176.803 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 58' ' ' CYS . . . . . . . . . . . . . 17.1 m -79.19 -24.08 43.43 Favored 'General case' 0 C--O 1.248 0.988 0 CA-C-O 114.383 -2.723 . . . . 22.5 108.789 173.992 -81.491 -81.066 -94.33 109.731 1.944 101.944 -157.271 -85.048 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 59' ' ' LEU . . . . . . . . . . . . . 10.3 mt -102.25 -41.45 6.36 Favored 'General case' 0 C--O 1.255 1.38 0 O-C-N 125.486 1.741 . . . . 25.94 113.915 178.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' ' ' LEU . . . . . . . . . . . . . 15.7 tp -131.57 113.66 13.91 Favored 'General case' 0 C--N 1.298 -1.643 0 C-N-CA 128.69 2.796 . . . . 25.17 114.36 -178.066 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' A TYR . . . . . . . . . . . . . 9.9 t80 -147.81 79.47 9.34 Favored Pre-proline 0 C--O 1.264 1.83 0 C-N-CA 127.286 2.234 . . . . 27.61 106.969 178.356 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' B PRO . . . . . 0.412 ' N ' ' CD ' ' H' ' 60' C PRO . 83.4 Cg_exo -50.31 -40.43 52.56 Favored 'Trans proline' 0 C--O 1.258 1.484 0 O-C-N 125.573 2.354 . . . . 26.84 115.822 -175.654 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 60' C PRO . . . . . 0.412 ' CD ' ' N ' ' H' ' 60' B PRO . 26.7 Cg_exo -53.61 -20.99 17.84 Favored 'Trans proline' 0 C--O 1.27 2.114 0 C-N-CA 121.773 1.649 . . . . 29.25 113.558 179.038 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 60' D TRP . . . . . 0.539 ' CH2' ' H42' ' H' ' 372' ' ' 0ZE . 46.4 m0 -121.08 13.58 11.31 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-O 116.876 -1.535 . . . . 37.93 109.14 -174.344 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 60' E ASP . . . . . 0.811 ' OD2' ' O ' ' H' ' 511' ' ' HOH . 46.1 m-20 58.05 42.3 22.76 Favored 'General case' 0 C--N 1.287 -2.116 1 O-C-N 130.046 4.591 . . . . 38.57 110.981 -177.996 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 60' F LYS . . . . . 0.625 ' HG2' ' O ' ' H' ' 497' ' ' HOH . 12.7 mptt -99.73 126.25 45.76 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 127.238 2.836 . . . . 39.17 109.136 175.781 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 60' G ASN . . . . . 0.536 ' OD1' ' O ' ' H' ' 60' G ASN . 49.4 t-20 -160.11 61.7 0.35 Allowed 'General case' 0 C--O 1.247 0.95 0 C-N-CA 116.667 -2.013 . . . . 36.53 114.358 -179.202 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 60' H PHE . . . . . . . . . . . . . 64.7 m-85 -64.38 148.17 50.99 Favored 'General case' 0 C--N 1.299 -1.606 0 CA-C-O 125.49 2.567 . . . . 37.1 115.514 -179.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' I THR . . . . . 0.477 ' O ' ' HB2' ' H' ' 63' ' ' ASP . 15.8 p -123.71 163.17 21.65 Favored 'General case' 0 CA--C 1.549 0.941 0 CA-C-N 110.537 -3.029 . . . . 39.07 106.813 177.386 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 61' ' ' GLU . . . . . 0.951 ' OE1' ' HA ' ' H' ' 87' ' ' LYS . 0.7 OUTLIER -41.14 -52.22 3.32 Favored 'General case' 0 C--O 1.255 1.373 0 CA-C-N 110.203 -3.18 . . . . 50.0 109.361 179.617 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 62' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -63.85 -27.12 68.95 Favored 'General case' 0 C--N 1.299 -1.626 0 CA-C-O 126.943 3.258 . . . . 50.0 115.975 -175.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 63' ' ' ASP . . . . . 0.477 ' HB2' ' O ' ' H' ' 60' I THR . 92.3 m-20 -68.85 -30.82 69.42 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 115.607 -2.139 . . . . 46.0 114.346 -177.559 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 64' ' ' LEU . . . . . 0.583 ' HB2' HD11 ' H' ' 85' ' ' LEU . 13.2 mt -114.61 161.91 17.45 Favored 'General case' 0 C--N 1.314 -0.964 1 O-C-N 129.614 4.321 . . . . 38.56 120.327 -171.874 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 65' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -133.74 143.1 48.26 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 110.226 -3.17 . . . . 33.71 108.884 173.892 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 t -107.36 116.61 51.34 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.327 0 C-N-CA 125.854 1.662 . . . . 30.86 112.45 176.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 67' ' ' ARG . . . . . . . . . . . . . 43.7 mtp180 -110.0 113.43 26.15 Favored 'General case' 0 C--O 1.265 1.894 0 CA-C-O 125.893 2.758 . . . . 26.34 114.119 178.363 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 68' ' ' ILE . . . . . . . . . . . . . 1.5 mt -109.07 136.62 44.4 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.975 0 C-N-CA 129.237 3.015 . . . . 27.1 118.622 -177.392 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 69' ' ' GLY . . . . . . . . . . . . . . . 89.56 20.49 44.25 Favored Glycine 0 C--O 1.259 1.662 0 C-N-CA 126.86 2.171 . . . . 24.17 113.325 175.71 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 70' ' ' LYS . . . . . 0.635 ' HE3' ' O ' ' H' ' 72' ' ' SER . 20.4 mtpp -80.76 155.05 26.88 Favored 'General case' 0 CA--C 1.501 -0.925 0 CA-C-N 110.652 -2.774 . . . . 25.01 114.908 -177.737 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 71' ' ' HIS . . . . . 0.57 ' CD2' HG22 ' H' ' 154' ' ' VAL . 74.4 t60 -132.29 -59.36 0.93 Allowed 'General case' 0 C--O 1.257 1.456 0 CA-C-O 124.55 2.119 . . . . 24.05 106.813 176.812 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 72' ' ' SER . . . . . 0.858 ' OG ' ' HG2' ' H' ' 75' ' ' ARG . 3.3 t -71.73 139.74 49.24 Favored 'General case' 0 N--CA 1.504 2.269 0 CA-C-N 112.995 -1.911 . . . . 25.09 107.611 177.902 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 73' ' ' ARG . . . . . . . . . . . . . 55.1 ttp85 -67.74 -59.57 3.22 Favored 'General case' 0 C--O 1.266 1.928 0 CA-C-O 125.28 2.467 . . . . 31.55 111.879 177.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 74' ' ' THR . . . . . . . . . . . . . 30.2 p -88.34 -34.27 17.69 Favored 'General case' 0 C--O 1.264 1.845 0 N-CA-C 118.714 2.857 . . . . 32.94 118.714 -178.472 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 75' ' ' ARG . . . . . 1.023 ' HG3' HH11 ' H' ' 75' ' ' ARG . 0.2 OUTLIER -60.11 148.77 34.77 Favored 'General case' 0 N--CA 1.44 -0.926 0 CA-C-N 123.073 2.67 . . . . 31.15 112.82 179.86 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 76' ' ' TYR . . . . . . . . . . . . . 17.8 t80 -95.17 117.49 30.33 Favored 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 101.271 -3.603 . . . . 33.43 101.271 173.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 77' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -92.06 80.28 5.13 Favored 'General case' 0 CA--C 1.494 -1.185 0 CA-C-O 127.085 3.326 . . . . 29.04 112.478 -171.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 77' A ARG . . . . . 0.446 ' O ' ' HB2' ' H' ' 78' ' ' ASN . 47.3 ttp85 -55.22 127.78 30.89 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 110.292 -3.14 . . . . 29.5 107.226 -174.689 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 78' ' ' ASN . . . . . 0.446 ' HB2' ' O ' ' H' ' 77' A ARG . 4.4 m120 75.14 -5.55 2.14 Favored 'General case' 0 C--O 1.252 1.236 0 O-C-N 126.341 2.276 . . . . 31.27 114.851 -179.3 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 79' ' ' ILE . . . . . . . . . . . . . 44.8 mt -107.11 -63.32 1.88 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 CA-C-O 122.6 1.19 . . . . 29.38 110.765 177.968 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 80' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -76.33 152.04 36.5 Favored 'General case' 0 CA--C 1.498 -1.037 0 CA-C-O 123.807 1.765 . . . . 27.58 112.473 -179.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 81' ' ' LYS . . . . . . . . . . . . . 20.1 mtpt -126.68 135.56 51.32 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 105.434 -2.061 . . . . 45.76 105.434 176.114 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 82' ' ' ILE . . . . . . . . . . . . . 1.2 mt -111.75 132.65 59.78 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.199 0 C-N-CA 127.367 2.267 . . . . 34.14 105.096 -176.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 83' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -132.2 171.99 12.97 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 119.752 1.16 . . . . 37.53 108.157 -178.194 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 84' ' ' MET . . . . . . . . . . . . . 47.9 mtt -113.04 145.08 41.51 Favored 'General case' 0 C--O 1.252 1.207 1 O-C-N 129.431 4.207 . . . . 49.29 110.784 179.412 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 85' ' ' LEU . . . . . 0.776 HD13 ' CE ' ' H' ' 106' ' ' MET . 0.5 OUTLIER -87.65 143.56 27.12 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 112.152 -2.295 . . . . 36.28 106.579 179.878 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 86' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -99.15 -35.15 10.1 Favored 'General case' 0 C--N 1.285 -2.204 0 C-N-CA 126.887 2.075 . . . . 45.06 107.521 173.789 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 87' ' ' LYS . . . . . 0.951 ' HA ' ' OE1' ' H' ' 61' ' ' GLU . 0.2 OUTLIER -166.1 142.81 5.15 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 122.616 1.198 . . . . 43.83 112.744 -176.55 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 88' ' ' ILE . . . . . 0.419 HG21 HD13 ' H' ' 88' ' ' ILE . 3.1 mt -109.03 137.96 38.55 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.146 0 N-CA-C 107.173 -1.418 . . . . 33.81 107.173 176.073 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 89' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -129.42 125.3 36.21 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 104.83 -2.285 . . . . 40.66 104.83 177.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 90' ' ' ILE . . . . . . . . . . . . . 15.3 mt -111.95 145.53 17.97 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 O-C-N 128.765 3.79 . . . . 27.34 106.593 -178.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 91' ' ' HIS . . . . . 0.515 ' CE1' ' HD3' ' H' ' 101' ' ' ARG . 40.3 t-80 -55.57 125.32 60.02 Favored Pre-proline 0 C--O 1.252 1.189 0 CA-C-O 123.328 1.537 . . . . 25.42 111.296 175.909 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 92' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -50.03 -34.55 38.5 Favored 'Trans proline' 0 N--CA 1.447 -1.225 0 C-N-CA 122.374 2.049 . . . . 27.31 111.245 178.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 93' ' ' ARG . . . . . . . . . . . . . 60.3 mtp180 -109.46 27.33 9.66 Favored 'General case' 0 C--O 1.249 1.064 0 N-CA-C 115.956 1.836 . . . . 34.15 115.956 -178.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 94' ' ' TYR . . . . . 0.49 ' CZ ' ' HB3' ' H' ' 96' ' ' TRP . 2.1 t80 -54.86 127.22 27.6 Favored 'General case' 0 C--O 1.262 1.728 0 CA-C-O 115.245 -2.312 . . . . 24.82 105.623 172.119 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 95' ' ' ASN . . . . . . . . . . . . . 62.0 t-20 -108.04 85.07 2.05 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-N 120.656 1.571 . . . . 28.91 112.592 -178.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 96' ' ' TRP . . . . . 0.49 ' HB3' ' CZ ' ' H' ' 94' ' ' TYR . 64.2 p-90 -81.38 -19.26 43.04 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 115.547 -2.168 . . . . 26.0 111.189 -175.73 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 97' ' ' ARG . . . . . 0.572 ' NH2' ' O ' ' H' ' 498' ' ' HOH . 54.5 mtt-85 -71.57 -39.17 70.79 Favored 'General case' 0 C--O 1.276 2.472 1 O-C-N 129.437 4.211 . . . . 34.32 113.578 -179.28 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 97' A GLU . . . . . . . . . . . . . 17.9 tt0 -111.86 -65.93 1.13 Allowed 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 115.581 -2.448 . . . . 36.68 117.017 -177.612 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 98' ' ' ASN . . . . . 0.511 ' OD1' ' N ' ' H' ' 98' ' ' ASN . 21.9 p30 -134.44 23.83 3.75 Favored 'General case' 0 C--O 1.292 3.342 0 N-CA-C 119.122 3.008 . . . . 27.16 119.122 -176.785 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 99' ' ' LEU . . . . . 0.467 ' O ' ' HB2' ' H' ' 102' ' ' ASP . 7.2 mt 62.49 34.54 15.28 Favored 'General case' 0 C--N 1.312 -1.059 0 C-N-CA 129.856 3.262 . . . . 24.41 111.579 -179.128 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 100' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -69.92 132.03 45.35 Favored 'General case' 0 C--N 1.287 -2.133 0 O-C-N 125.95 2.031 . . . . 21.42 106.605 -177.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 101' ' ' ARG . . . . . 0.515 ' HD3' ' CE1' ' H' ' 91' ' ' HIS . 58.0 mtt85 64.83 44.23 3.73 Favored 'General case' 0 CA--C 1.558 1.256 0 O-C-N 128.684 3.74 . . . . 31.03 112.145 -176.2 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 102' ' ' ASP . . . . . 0.467 ' HB2' ' O ' ' H' ' 99' ' ' LEU . 42.2 t0 -77.5 83.49 3.91 Favored 'General case' 0 C--N 1.287 -2.113 0 C-N-CA 125.519 1.527 . . . . 17.29 111.802 178.455 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 103' ' ' ILE . . . . . 0.438 HD11 HD11 ' H' ' 238' ' ' ILE . 16.5 tt -155.32 146.49 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 CA-C-N 112.86 -1.973 . . . . 19.13 111.29 -177.303 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 104' ' ' ALA . . . . . . . . . . . . . . . -153.64 148.28 26.29 Favored 'General case' 0 C--O 1.206 -1.218 0 N-CA-C 106.539 -1.652 . . . . 20.06 106.539 179.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 105' ' ' LEU . . . . . . . . . . . . . 43.4 mt -109.17 147.75 32.01 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 105.227 -2.138 . . . . 25.81 105.227 176.567 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 106' ' ' MET . . . . . 0.776 ' CE ' HD13 ' H' ' 85' ' ' LEU . 62.6 mtp -125.15 125.25 43.41 Favored 'General case' 0 C--N 1.299 -1.587 0 N-CA-C 103.967 -2.605 . . . . 34.07 103.967 177.543 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 107' ' ' LYS . . . . . . . . . . . . . 53.7 tttt -97.27 122.9 40.82 Favored 'General case' 0 C--O 1.265 1.901 0 N-CA-C 107.095 -1.446 . . . . 37.6 107.095 179.738 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 108' ' ' LEU . . . . . 0.661 ' O ' ' HD3' ' H' ' 50' ' ' ARG . 76.5 mt -76.19 145.19 40.02 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 125.377 1.673 . . . . 30.4 112.272 -177.53 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 109' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.23 -40.52 74.24 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 125.115 1.509 . . . . 42.42 109.846 178.264 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 110' ' ' LYS . . . . . 0.424 ' HE2' ' O ' ' H' ' 529' ' ' HOH . 1.2 mttt -139.6 156.06 71.4 Favored Pre-proline 0 N--CA 1.489 1.521 0 O-C-N 119.355 -2.091 . . . . 46.58 107.257 176.776 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 111' ' ' PRO . . . . . 0.412 ' HA ' ' HG2' ' H' ' 50' ' ' ARG . 16.1 Cg_exo -71.65 135.71 26.65 Favored 'Trans proline' 0 C--O 1.272 2.216 0 O-C-N 125.7 2.421 . . . . 36.43 108.76 -179.656 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 112' ' ' VAL . . . . . . . . . . . . . 7.6 p -87.85 157.95 3.11 Favored 'Isoleucine or valine' 0 C--O 1.259 1.58 0 N-CA-C 106.927 -1.508 . . . . 34.97 106.927 -179.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 113' ' ' ALA . . . . . . . . . . . . . . . -102.42 136.51 42.13 Favored 'General case' 0 N--CA 1.479 0.997 0 O-C-N 126.393 2.308 . . . . 31.76 106.83 -179.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 114' ' ' PHE . . . . . 0.53 ' CZ ' ' HB3' ' H' ' 49' ' ' ASP . 16.3 m-30 -74.8 155.17 37.88 Favored 'General case' 0 CA--C 1.507 -0.702 1 O-C-N 129.461 4.226 . . . . 26.69 107.302 -175.346 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 115' ' ' SER . . . . . . . . . . . . . 3.1 p -160.33 -173.32 3.95 Favored 'General case' 0 C--O 1.269 2.096 0 O-C-N 128.851 3.845 . . . . 22.88 102.881 -176.446 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 116' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -59.84 -29.29 68.17 Favored 'General case' 0 C--N 1.283 -2.303 0 O-C-N 127.148 2.78 . . . . 24.33 109.997 178.605 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 117' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -109.49 0.59 19.34 Favored 'General case' 0 C--O 1.266 1.934 0 O-C-N 128.205 3.441 . . . . 25.13 117.513 -176.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 118' ' ' ILE . . . . . . . . . . . . . 12.9 mt -130.76 115.45 30.88 Favored 'Isoleucine or valine' 0 C--N 1.267 -2.984 0 C-N-CA 130.721 3.608 . . . . 21.68 113.209 -177.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 119' ' ' HIS . . . . . . . . . . . . . 25.3 t60 -167.16 134.64 1.99 Allowed Pre-proline 0 N--CA 1.51 2.566 0 C-N-CA 114.362 -2.935 . . . . 22.49 108.625 -176.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 120' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -74.08 155.8 47.35 Favored 'Trans proline' 0 C--O 1.259 1.555 0 C-N-CA 121.949 1.766 . . . . 18.67 114.522 -176.122 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 121' ' ' VAL . . . . . . . . . . . . . 14.8 p -98.47 161.55 2.97 Favored 'Isoleucine or valine' 0 C--O 1.263 1.785 0 N-CA-C 102.859 -3.015 . . . . 18.21 102.859 178.412 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 122' ' ' CYS . . . . . . . . . . . . . 78.9 m -91.18 154.44 19.32 Favored 'General case' 0 C--O 1.254 1.294 0 O-C-N 119.767 -1.833 . . . . 20.91 109.037 178.99 -60.626 -56.326 103.946 101.178 2.011 104.647 69.94 75.182 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 123' ' ' LEU . . . . . . . . . . . . . 37.1 mt -101.67 138.35 19.82 Favored Pre-proline 0 C--N 1.295 -1.802 0 N-CA-C 103.957 -2.608 . . . . 23.14 103.957 177.025 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 124' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -71.81 155.8 57.71 Favored 'Trans proline' 0 CA--C 1.497 -1.326 0 O-C-N 126.476 2.83 . . . . 27.63 110.066 -176.085 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 125' ' ' ASP . . . . . 0.405 ' OD1' ' HB2' ' H' ' 127' ' ' GLU . 3.4 p30 -106.43 162.39 13.74 Favored 'General case' 0 C--O 1.269 2.117 0 N-CA-C 103.295 -2.854 . . . . 41.41 103.295 174.331 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 126' ' ' ARG . . . . . 0.506 ' HA ' ' CZ ' ' H' ' 232' ' ' PHE . 22.7 ttt180 -46.87 -41.05 15.14 Favored 'General case' 0 CA--C 1.512 -0.484 0 O-C-N 125.675 1.859 . . . . 50.0 113.644 -179.228 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 127' ' ' GLU . . . . . 0.419 ' CD ' ' H ' ' H' ' 127' ' ' GLU . 0.0 OUTLIER -65.4 -46.43 80.06 Favored 'General case' 0 C--N 1.293 -1.878 0 C-N-CA 127.345 2.258 . . . . 41.23 112.37 179.502 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 128' ' ' THR . . . . . . . . . . . . 0.315 88.0 m -67.93 -37.75 82.03 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 117.947 -1.025 . . . . 31.56 108.361 -176.614 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.46 -40.05 89.78 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 124.491 2.091 . . . . 28.89 113.428 178.279 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 129' A ALA . . . . . . . . . . . . . . . -64.69 -52.85 55.05 Favored 'General case' 0 C--O 1.253 1.272 0 C-N-CA 126.088 1.755 . . . . 29.55 113.797 -176.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 129' B SER . . . . . . . . . . . . . 0.8 OUTLIER -72.34 -26.83 62.08 Favored 'General case' 0 C--N 1.314 -0.976 1 CA-C-O 110.579 -4.534 . . . . 32.01 111.904 179.906 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 129' C LEU . . . . . . . . . . . . . 66.0 mt -100.29 -33.17 10.51 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 128.775 3.797 . . . . 28.1 116.616 -173.466 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 130' ' ' LEU . . . . . 0.749 ' CD2' HD13 ' H' ' 162' ' ' ILE 0.263 2.0 mt -79.77 80.29 6.18 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 128.785 3.803 . . . . 29.18 108.892 -176.396 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 131' ' ' GLN . . . . . . . . . . . . . 63.1 mt-30 -136.74 135.82 38.43 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 112.525 -2.125 . . . . 38.39 116.155 179.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 132' ' ' ALA . . . . . . . . . . . . . . . -48.24 132.47 16.12 Favored 'General case' 0 C--O 1.246 0.899 0 C-N-CA 125.905 1.682 . . . . 25.21 106.574 177.255 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 133' ' ' GLY . . . . . . . . . . . . . . . 93.34 -34.22 4.7 Favored Glycine 0 N--CA 1.424 -2.134 0 O-C-N 127.827 3.204 . . . . 22.17 117.452 -175.438 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 134' ' ' TYR . . . . . 0.474 ' OH ' HD11 ' L' ' 14' K ILE . 3.2 m-30 -62.28 141.56 58.19 Favored 'General case' 0 C--N 1.291 -1.95 0 O-C-N 118.396 -2.826 . . . . 29.17 107.733 177.305 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 135' ' ' LYS . . . . . 0.623 ' HE2' ' OH ' ' H' ' 184' A TYR . 46.9 mttp -99.43 147.25 25.45 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 116.286 -1.816 . . . . 26.28 109.292 -178.889 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 136' ' ' GLY . . . . . 0.489 ' HA3' ' CZ ' ' H' ' 199' ' ' PHE . . . -124.16 -179.79 15.87 Favored Glycine 0 CA--C 1.563 3.031 2 O-C-N 129.708 4.38 . . . . 18.52 102.56 174.899 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 137' ' ' ARG . . . . . . . . . . . . . 21.1 ttm180 -133.92 136.24 44.12 Favored 'General case' 0 C--O 1.206 -1.217 0 N-CA-C 105.211 -2.144 . . . . 16.36 105.211 -176.402 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 138' ' ' VAL . . . . . . . . . . . . . 8.0 t -120.53 143.98 30.81 Favored 'Isoleucine or valine' 0 C--N 1.37 1.462 0 N-CA-C 103.523 -2.769 . . . . 16.82 103.523 178.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 139' ' ' THR . . . . . 0.489 HG22 HG13 ' H' ' 157' ' ' VAL . 18.1 p -133.58 156.95 46.91 Favored 'General case' 0 N--CA 1.485 1.312 0 O-C-N 126.452 2.345 . . . . 16.73 109.34 177.476 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 140' ' ' GLY . . . . . . . . . . . . . . . 169.54 167.38 30.0 Favored Glycine 0 C--O 1.213 -1.188 0 O-C-N 120.415 -1.428 . . . . 19.99 112.459 178.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 141' ' ' TRP . . . . . . . . . . . . . 5.8 m-90 -101.66 8.59 41.62 Favored 'General case' 0 C--O 1.248 0.998 0 O-C-N 127.784 2.697 . . . . 25.29 111.859 -179.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 142' ' ' GLY . . . . . . . . . . . . . . . -65.29 175.02 15.57 Favored Glycine 0 N--CA 1.436 -1.36 0 C-N-CA 127.782 2.61 . . . . 28.14 115.523 -179.024 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 143' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -53.17 142.06 21.61 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 123.847 1.784 . . . . 37.55 111.415 -178.381 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 144' ' ' LEU . . . . . . . . . . . . . 93.2 mt -87.41 -16.27 35.38 Favored 'General case' 0 C--O 1.246 0.873 0 CA-C-N 108.81 -3.814 . . . . 31.12 112.11 -179.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 145' ' ' LYS . . . . . . . . . . . . . 18.7 mtpt -147.87 150.51 34.26 Favored 'General case' 0 C--N 1.288 -2.108 0 O-C-N 126.009 2.068 . . . . 45.41 106.35 -177.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 146' ' ' GLU . . . . . . . . . . . . . 46.1 tt0 . . . . . 0 C--O 1.268 2.057 0 O-C-N 124.922 1.389 . . . . 37.9 113.412 -178.747 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 150' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.931 0 N-CA-C 115.743 1.057 . . . . 41.26 115.743 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 151' ' ' GLN . . . . . 1.06 ' HG2' ' O ' ' H' ' 447' ' ' HOH . 10.1 mp0 -122.83 140.43 33.23 Favored Pre-proline 0 N--CA 1.495 1.817 0 N-CA-C 102.662 -3.088 . . . . 47.36 102.662 178.235 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 152' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -72.75 165.52 32.52 Favored 'Trans proline' 0 CA--C 1.502 -1.083 0 O-C-N 127.553 3.396 . . . . 36.42 108.557 -173.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 153' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.41 -19.46 21.27 Favored 'General case' 0 C--N 1.295 -1.777 0 N-CA-C 107.153 -1.425 . . . . 34.55 107.153 174.205 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 154' ' ' VAL . . . . . 0.57 HG22 ' CD2' ' H' ' 71' ' ' HIS 0.316 0.5 OUTLIER -138.23 165.77 24.81 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.705 0 N-CA-C 108.551 -0.907 . . . . 28.31 108.551 -178.419 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' H' H ' 155' ' ' LEU . . . . . . . . . . . . . 45.3 tp -55.89 139.46 45.9 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 117.341 -1.314 . . . . 24.15 109.081 -179.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 156' ' ' GLN . . . . . 0.475 ' OE1' ' OD1' ' H' ' 21' ' ' ASP . 24.4 mm100 -105.67 155.24 19.44 Favored 'General case' 0 C--N 1.29 -2.018 0 CA-C-O 115.822 -2.037 . . . . 25.43 109.295 179.567 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 157' ' ' VAL . . . . . 0.489 HG13 HG22 ' H' ' 139' ' ' THR . 0.2 OUTLIER -136.2 152.92 30.76 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 N-CA-C 107.29 -1.374 . . . . 25.86 107.29 177.369 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 158' ' ' VAL . . . . . . . . . . . . . 9.4 p -151.94 142.4 15.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 124.789 1.306 . . . . 20.74 108.377 170.266 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 159' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -101.75 131.08 48.24 Favored 'General case' 0 C--N 1.307 -1.239 0 C-N-CA 127.982 2.513 . . . . 24.71 107.319 174.273 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 160' ' ' LEU . . . . . . . . . . . . . 82.9 mt -141.19 145.76 40.04 Favored Pre-proline 0 C--N 1.28 -2.433 0 CA-C-N 121.757 2.071 . . . . 23.1 109.815 -175.236 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 161' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -83.79 149.57 12.59 Favored 'Trans proline' 0 CA--C 1.483 -2.067 0 O-C-N 126.148 2.657 . . . . 19.57 112.661 179.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 162' ' ' ILE . . . . . 0.749 HD13 ' CD2' ' H' ' 130' ' ' LEU . 84.6 mt -76.84 139.94 17.97 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.436 0 N-CA-C 104.423 -2.436 . . . . 20.68 104.423 175.272 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 163' ' ' VAL . . . . . . . . . . . . . 46.4 t -107.48 146.98 12.99 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.042 0 C-N-CA 128.995 2.918 . . . . 21.17 109.374 -178.703 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 164' ' ' GLU . . . . . 0.755 ' OE1' HG21 ' H' ' 167' ' ' VAL . 7.3 mp0 -62.97 139.12 58.73 Favored 'General case' 0 C--N 1.311 -1.086 0 O-C-N 117.558 -3.214 . . . . 40.33 108.407 177.17 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 165' ' ' ARG . . . . . 1.021 ' HE ' ' HE3' ' H' ' 169' ' ' LYS . 54.5 ttt180 -45.37 -40.42 12.66 Favored Pre-proline 0 C--N 1.306 -1.316 0 C-N-CA 127.905 2.482 . . . . 44.94 114.527 -179.302 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 166' ' ' PRO . . . . . 0.483 ' HD2' ' C ' ' H' ' 164' ' ' GLU . 36.7 Cg_endo -70.89 -41.82 2.61 Favored 'Trans proline' 0 CA--C 1.494 -1.503 0 C-N-CA 123.016 2.477 . . . . 25.75 111.974 -179.246 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 167' ' ' VAL . . . . . 0.755 HG21 ' OE1' ' H' ' 164' ' ' GLU . 43.1 t -61.84 -41.7 91.71 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.305 0 CA-C-N 121.635 2.016 . . . . 23.31 108.799 177.053 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 168' ' ' CYS . . . . . . . . . . . . . 94.6 m -55.88 -59.75 4.45 Favored 'General case' 0 C--O 1.247 0.953 0 CA-C-N 113.4 -1.727 . . . . 22.68 108.309 179.628 -66.175 -59.985 -93.202 105.129 2.014 104.726 -75.726 84.429 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 169' ' ' LYS . . . . . 1.021 ' HE3' ' HE ' ' H' ' 165' ' ' ARG . 37.7 mttt -55.15 -42.19 72.79 Favored 'General case' 0 C--O 1.258 1.525 0 C-N-CA 125.529 1.532 . . . . 29.43 114.555 -176.133 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 170' ' ' ASP . . . . . . . . . . . . . 86.0 m-20 -75.74 -8.23 56.33 Favored 'General case' 0 C--N 1.296 -1.72 0 C-N-CA 127.723 2.409 . . . . 24.07 113.86 179.648 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 171' ' ' SER . . . . . . . . . . . . . 88.7 p -91.01 -7.89 50.66 Favored 'General case' 0 C--O 1.275 2.398 0 CA-C-N 120.078 1.308 . . . . 23.35 108.563 178.203 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 172' ' ' THR . . . . . . . . . . . . . 4.4 t -145.27 169.5 18.11 Favored 'General case' 0 C--N 1.299 -1.6 0 CA-C-O 116.01 -1.948 . . . . 21.37 110.258 -175.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 173' ' ' ARG . . . . . . . . . . . . . 45.3 mtp180 -99.16 -9.94 23.12 Favored 'General case' 0 C--O 1.253 1.263 1 O-C-N 130.101 4.625 . . . . 35.26 110.424 176.533 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 174' ' ' ILE . . . . . . . . . . . . . 98.9 mt -80.56 136.72 22.74 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.1 0 O-C-N 124.621 1.2 . . . . 29.02 111.437 178.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 175' ' ' ARG . . . . . . . . . . . . . 52.7 ttp85 -70.38 123.14 21.01 Favored 'General case' 0 C--O 1.26 1.612 0 CA-C-N 119.184 0.902 . . . . 31.75 110.429 -177.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 176' ' ' ILE . . . . . . . . . . . . . 4.1 mm -88.44 139.18 17.77 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.794 0 C-N-CA 129.022 2.929 . . . . 24.13 108.711 177.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 177' ' ' THR . . . . . . . . . . . . . 2.4 p -118.04 166.41 12.58 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-O 115.209 -2.329 . . . . 22.69 109.067 -177.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 178' ' ' ASP . . . . . . . . . . . . . 83.6 m-20 -61.71 -17.17 54.64 Favored 'General case' 0 C--N 1.275 -2.655 0 C-N-CA 130.246 3.418 . . . . 28.03 110.647 177.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 179' ' ' ASN . . . . . . . . . . . . . 27.2 m-80 -87.47 14.46 8.11 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-O 113.771 -3.014 . . . . 19.25 109.394 177.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 180' ' ' MET . . . . . . . . . . . . . 48.0 mtt -130.8 159.49 37.17 Favored 'General case' 0 C--N 1.294 -1.822 0 O-C-N 126.919 2.637 . . . . 22.07 109.692 179.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 181' ' ' PHE . . . . . . . . . . . . . 27.3 p90 -145.85 159.3 43.41 Favored 'General case' 0 C--N 1.287 -2.133 0 O-C-N 127.54 3.025 . . . . 17.21 103.53 170.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 182' ' ' CYS . . . . . 0.438 ' HA ' ' O ' ' H' ' 226' ' ' GLY . 1.9 p -123.51 155.51 37.42 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 126.897 2.623 . . . . 22.66 107.571 177.448 84.429 -75.726 -93.202 104.726 2.014 105.129 -59.985 -66.175 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 183' ' ' ALA . . . . . . . . . . . . . . . -144.55 147.46 33.23 Favored 'General case' 0 C--O 1.196 -1.755 0 O-C-N 125.839 1.962 . . . . 20.73 112.859 -178.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 184' ' ' GLY . . . . . . . . . . . . . . . 149.71 168.86 15.42 Favored Glycine 0 N--CA 1.427 -1.936 0 C-N-CA 125.657 1.599 . . . . 22.32 110.21 -178.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 184' A TYR . . . . . 0.623 ' OH ' ' HE2' ' H' ' 135' ' ' LYS . 66.1 m-85 -88.91 166.29 14.05 Favored 'General case' 0 C--O 1.252 1.197 0 CA-C-O 124.206 1.955 . . . . 26.5 107.423 176.858 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 185' ' ' LYS . . . . . 0.538 ' N ' ' OE1' ' H' ' 186' B GLU . 6.6 mttp -94.06 158.34 36.29 Favored Pre-proline 0 N--CA 1.512 2.661 0 CA-C-N 110.796 -2.911 . . . . 33.74 105.016 179.301 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 186' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -54.93 -19.96 21.32 Favored 'Trans proline' 0 C--O 1.24 0.58 0 C-N-CA 123.757 2.971 . . . . 37.99 112.673 -177.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 186' A ASP . . . . . 0.628 ' O ' ' N ' ' H' ' 186' C GLY 0.318 1.1 m-20 -68.79 -77.78 0.07 Allowed 'General case' 0 C--N 1.278 -2.515 1 C-N-CA 138.265 6.626 . . . . 50.0 111.269 176.206 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' H' H ' 186' B GLU . . . . . 0.538 ' OE1' ' N ' ' H' ' 185' ' ' LYS 0.262 34.8 mt-10 -34.48 -14.8 0.0 OUTLIER 'General case' 0 C--O 1.261 1.671 0 O-C-N 128.639 3.712 . . . . 50.0 112.566 -174.862 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 186' C GLY . . . . . 0.628 ' N ' ' O ' ' H' ' 186' A ASP . . . 39.22 57.4 2.14 Favored Glycine 0 C--O 1.258 1.638 0 CA-C-O 126.628 3.349 . . . . 44.32 116.999 177.381 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 186' D LYS . . . . . . . . . . . . . 9.2 mttm -154.29 141.84 19.81 Favored 'General case' 0 C--N 1.295 -1.79 1 C-N-CA 138.31 6.644 . . . . 45.91 103.063 176.812 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 187' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -128.01 -177.78 4.26 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 124.451 1.095 . . . . 35.79 109.007 -178.147 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 188' ' ' GLY . . . . . 0.66 ' HA2' ' O ' ' H' ' 17' ' ' VAL . . . 132.42 150.25 6.45 Favored Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 114.208 -1.36 . . . . 27.91 109.974 179.0 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 189' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -172.75 166.1 5.34 Favored 'General case' 0 C--N 1.289 -2.054 0 C-N-CA 127.787 2.435 . . . . 24.07 105.218 -178.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 190' ' ' ALA . . . . . . . . . . . . . . . -80.82 173.24 12.8 Favored 'General case' 0 C--N 1.286 -2.195 0 N-CA-C 101.501 -3.518 . . . . 24.22 101.501 168.899 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 191' ' ' CYS . . . . . . . . . . . . . 6.6 t -157.45 176.22 12.95 Favored 'General case' 0 C--N 1.288 -2.082 0 N-CA-C 106.361 -1.718 . . . . 25.44 106.361 179.35 -160.242 52.814 79.6 106.814 2.021 103.696 -174.922 -51.78 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 192' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -48.57 134.23 15.86 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-O 114.34 -2.743 . . . . 46.49 107.315 178.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 193' ' ' GLY . . . . . . . . . . . . . . . 94.17 -15.81 62.37 Favored Glycine 0 C--N 1.289 -2.058 1 O-C-N 129.412 4.195 . . . . 23.13 115.42 -177.909 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 194' ' ' ASP . . . . . . . . . . . . . 76.0 m-20 -80.38 -21.68 42.1 Favored 'General case' 0 C--N 1.312 -1.045 0 C-N-CA 128.09 2.556 . . . . 23.92 109.232 177.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 195' ' ' SER . . . . . 1.258 ' OG ' ' C ' ' H' ' 372' ' ' 0ZE . 2.8 m -39.79 135.61 1.2 Allowed 'General case' 0 C--O 1.202 -1.42 0 O-C-N 124.718 1.261 . . . . 26.03 110.385 178.323 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 196' ' ' GLY . . . . . . . . . . . . . . . 82.11 -1.37 87.09 Favored Glycine 0 CA--C 1.484 -1.897 0 O-C-N 126.819 2.574 . . . . 17.8 116.77 176.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 197' ' ' GLY . . . . . . . . . . . . . . . -75.24 163.54 54.03 Favored Glycine 0 C--O 1.216 -1.015 0 N-CA-C 108.438 -1.865 . . . . 17.65 108.438 177.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 198' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -87.26 138.53 4.79 Favored 'Trans proline' 0 N--CA 1.435 -1.913 0 O-C-N 125.243 2.181 . . . . 17.45 116.619 -179.017 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 199' ' ' PHE . . . . . 0.489 ' CZ ' ' HA3' ' H' ' 136' ' ' GLY . 33.9 t80 -102.09 115.7 31.1 Favored 'General case' 0 N--CA 1.511 2.611 1 N-CA-C 99.705 -4.183 . . . . 16.34 99.705 169.838 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 200' ' ' VAL . . . . . 0.41 HG12 ' HA ' ' H' ' 209' ' ' GLN . 35.2 m -121.6 159.34 24.15 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.344 0 O-C-N 119.187 -2.195 . . . . 16.98 109.236 -176.158 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 201' ' ' MET . . . . . . . . . . . . . 67.5 mtp -133.52 149.05 51.7 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 105.003 -2.221 . . . . 18.79 105.003 178.15 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 202' ' ' LYS . . . . . 0.428 ' HE3' ' O ' ' H' ' 205' ' ' ASN . 69.5 tttt -98.78 119.24 37.21 Favored 'General case' 0 C--O 1.262 1.749 0 CA-C-O 117.155 -1.402 . . . . 18.41 108.693 178.545 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 203' ' ' SER . . . . . 0.522 ' HB3' ' ND2' ' H' ' 204' B ASN . 18.3 t -61.56 128.31 89.87 Favored Pre-proline 0 C--N 1.303 -1.454 0 CA-C-N 120.737 1.608 . . . . 18.36 112.998 175.718 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 204' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -74.98 -16.95 19.97 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 122.699 2.266 . . . . 21.29 111.862 173.836 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 204' A PHE . . . . . . . . . . . . . 22.4 m-85 -80.69 -50.81 9.43 Favored 'General case' 0 C--N 1.307 -1.272 0 O-C-N 117.377 -3.327 . . . . 26.68 115.98 177.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 204' B ASN . . . . . 0.594 ' O ' ' HB2' ' H' ' 205' ' ' ASN . 0.1 OUTLIER -119.27 0.58 11.19 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 119.432 -0.907 . . . . 24.41 113.046 -179.425 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 205' ' ' ASN . . . . . 0.594 ' HB2' ' O ' ' H' ' 204' B ASN 0.276 1.5 m120 67.2 17.85 10.33 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 116.589 2.07 . . . . 32.88 116.589 176.346 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 206' ' ' ARG . . . . . . . . . . . . . 76.3 mtt-85 -93.65 151.24 19.79 Favored 'General case' 0 C--N 1.267 -3.017 0 O-C-N 128.161 3.413 . . . . 25.87 111.086 179.714 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 207' ' ' TRP . . . . . . . . . . . . . 93.0 m95 -91.41 130.33 37.27 Favored 'General case' 0 C--N 1.306 -1.283 0 O-C-N 125.842 1.964 . . . . 14.15 108.231 177.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 208' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -120.91 140.58 51.62 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 127.306 2.243 . . . . 17.75 110.531 -177.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 209' ' ' GLN . . . . . 0.41 ' HA ' HG12 ' H' ' 200' ' ' VAL . 41.7 tt0 -97.68 118.44 34.22 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-O 114.856 -2.497 . . . . 15.02 104.648 -176.621 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 210' ' ' MET . . . . . . . . . . . . . 49.2 mmm -102.68 -22.09 14.01 Favored 'General case' 0 C--O 1.214 -0.797 0 O-C-N 126.405 2.316 . . . . 24.92 114.22 -177.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 211' ' ' GLY . . . . . 0.434 ' HA2' ' O ' ' H' ' 229' ' ' THR . . . -144.21 168.32 26.64 Favored Glycine 0 C--O 1.248 0.979 0 O-C-N 124.225 0.953 . . . . 14.78 111.583 -178.123 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 212' ' ' ILE . . . . . 0.436 HD12 ' HB ' ' H' ' 229' ' ' THR . 10.6 mt -126.57 132.83 69.82 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.655 0 N-CA-C 105.755 -1.942 . . . . 13.47 105.755 174.245 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 213' ' ' VAL . . . . . . . . . . . . . 51.6 t -53.27 118.33 1.06 Allowed 'Isoleucine or valine' 0 C--O 1.277 2.528 0 CA-C-O 127.127 3.346 . . . . 14.39 107.538 173.111 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 214' ' ' SER . . . . . . . . . . . . . 12.2 t -110.83 -66.85 1.04 Allowed 'General case' 0 C--O 1.278 2.586 0 O-C-N 117.879 -3.013 . . . . 18.52 116.172 -179.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 215' ' ' TRP . . . . . . . . . . . . . 62.9 p-90 -160.24 162.08 33.61 Favored 'General case' 0 CA--C 1.489 -1.386 0 N-CA-C 116.316 1.969 . . . . 20.99 116.316 -174.387 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 216' ' ' GLY . . . . . . . . . . . . . . . -160.74 -172.56 28.19 Favored Glycine 0 N--CA 1.487 2.047 0 N-CA-C 105.183 -3.167 . . . . 23.46 105.183 176.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 217' ' ' GLU . . . . . 0.474 ' HA ' ' H16' ' H' ' 372' ' ' 0ZE . 47.9 mt-10 -129.52 102.93 6.6 Favored 'General case' 0 C--N 1.279 -2.474 0 N-CA-C 104.145 -2.539 . . . . 32.51 104.145 178.016 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 219' ' ' GLY . . . . . . . . . . . . . . . 74.72 -168.15 54.7 Favored Glycine 1 N--CA 1.523 4.45 1 N-CA-C 101.476 -4.65 . . . . 24.89 101.476 -173.78 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' H' H ' 220' ' ' CYS . . . . . . . . . . . . . 36.8 m -137.2 128.57 28.16 Favored 'General case' 0 C--N 1.291 -1.953 0 N-CA-C 106.827 -1.545 . . . . 27.13 106.827 -179.575 -51.78 -174.922 79.6 103.696 2.021 106.814 52.814 -160.242 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 221' ' ' ASP . . . . . . . . . . . . . 26.5 t0 58.54 31.91 21.55 Favored 'General case' 0 C--O 1.257 1.485 0 O-C-N 127.092 2.745 . . . . 28.25 112.675 174.507 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 221' A ARG . . . . . . . . . . . . . 1.0 OUTLIER -81.37 141.93 33.51 Favored 'General case' 0 C--O 1.256 1.42 0 N-CA-C 107.216 -1.402 . . . . 41.38 107.216 173.933 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 222' ' ' ASP . . . . . . . . . . . . . 49.6 m-20 -63.31 136.7 57.84 Favored 'General case' 0 C--O 1.243 0.722 0 C-N-CA 119.891 -0.723 . . . . 39.04 110.92 177.642 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 223' ' ' GLY . . . . . . . . . . . . . . . 81.88 4.07 90.41 Favored Glycine 0 C--O 1.255 1.441 0 CA-C-N 119.381 0.991 . . . . 30.47 113.155 177.059 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 224' ' ' LYS . . . . . . . . . . . . . 16.2 mmtt -123.47 151.44 42.72 Favored 'General case' 0 CA--C 1.563 1.448 0 C-N-CA 125.365 1.466 . . . . 36.52 107.748 176.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 225' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -131.32 155.75 46.66 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-O 125.221 2.438 . . . . 26.22 113.037 -175.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 226' ' ' GLY . . . . . 0.438 ' O ' ' HA ' ' H' ' 182' ' ' CYS . . . -85.93 144.23 20.15 Favored Glycine 0 CA--C 1.543 1.819 0 N-CA-C 103.459 -3.857 . . . . 20.28 103.459 175.557 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 227' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -112.79 135.52 53.45 Favored 'General case' 0 C--O 1.252 1.234 0 C-N-CA 127.711 2.404 . . . . 21.82 108.897 175.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 228' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -120.45 144.38 47.99 Favored 'General case' 0 CA--C 1.494 -1.191 0 O-C-N 128.856 3.847 . . . . 17.69 113.489 -178.564 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 229' ' ' THR . . . . . 0.436 ' HB ' HD12 ' H' ' 212' ' ' ILE . 16.3 m -66.65 130.87 44.62 Favored 'General case' 0 C--O 1.244 0.777 0 N-CA-C 107.708 -1.219 . . . . 17.57 107.708 169.136 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 230' ' ' HIS . . . . . 0.513 ' CE1' ' HG3' ' H' ' 233' ' ' ARG . 6.1 t-80 -84.11 97.9 9.59 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 119.132 -2.23 . . . . 23.65 107.967 -179.966 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 231' ' ' VAL . . . . . . . . . . . . . 74.5 t -58.94 -46.86 91.18 Favored 'Isoleucine or valine' 0 C--O 1.253 1.284 0 CA-C-O 114.541 -2.647 . . . . 18.05 114.43 -176.519 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 232' ' ' PHE . . . . . 0.506 ' CZ ' ' HA ' ' H' ' 126' ' ' ARG . 83.3 t80 -63.18 -28.13 69.84 Favored 'General case' 0 N--CA 1.511 2.595 0 C-N-CA 114.569 -2.852 . . . . 23.3 112.994 -179.067 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 233' ' ' ARG . . . . . 0.513 ' HG3' ' CE1' ' H' ' 230' ' ' HIS . 5.5 mtp-105 -67.42 -23.34 65.53 Favored 'General case' 0 N--CA 1.438 -1.051 1 O-C-N 115.181 -4.7 . . . . 42.08 111.27 178.48 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 234' ' ' LEU . . . . . . . . . . . . . 39.6 mt -104.97 6.05 33.19 Favored 'General case' 0 C--O 1.248 1.008 0 CA-C-N 119.647 1.112 . . . . 26.71 110.241 -179.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 235' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -50.2 -39.83 45.33 Favored 'General case' 0 C--O 1.244 0.807 0 CA-C-O 123.162 1.458 . . . . 37.79 113.604 -179.474 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 236' ' ' LYS . . . . . 0.772 ' HE2' ' O ' ' H' ' 540' ' ' HOH . 0.1 OUTLIER -60.44 -48.5 81.47 Favored 'General case' 0 C--O 1.256 1.415 0 CA-C-N 114.497 -1.229 . . . . 40.79 110.28 -177.541 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 237' ' ' TRP . . . . . . . . . . . . . 56.5 t90 -58.05 -42.23 85.0 Favored 'General case' 0 C--N 1.319 -0.744 0 C-N-CA 125.269 1.427 . . . . 30.79 113.304 178.474 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 238' ' ' ILE . . . . . 0.438 HD11 HD11 ' H' ' 103' ' ' ILE . 67.1 mt -63.01 -43.64 99.2 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.021 0 C-N-CA 124.975 1.31 . . . . 32.99 109.724 -179.324 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 239' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -55.4 -59.74 4.38 Favored 'General case' 0 C--N 1.301 -1.509 0 CA-C-O 124.678 2.18 . . . . 48.02 109.691 179.222 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 240' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -41.69 -57.22 2.38 Favored 'General case' 0 C--O 1.257 1.495 0 CA-C-N 109.296 -3.593 . . . . 49.47 107.889 177.323 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 241' ' ' VAL . . . . . . . . . . . . . 39.7 t -57.55 -46.78 86.17 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.372 0 N-CA-C 114.96 1.467 . . . . 39.83 114.96 -179.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 242' ' ' ILE . . . . . . . . . . . . . 76.8 mt -70.92 -40.28 76.25 Favored 'Isoleucine or valine' 0 C--O 1.256 1.432 0 CA-C-N 113.876 -1.511 . . . . 45.54 112.373 -172.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 243' ' ' ASP . . . . . . . . . . . . 0.464 29.6 p30 -91.41 -6.47 52.78 Favored 'General case' 0 C--O 1.262 1.753 0 C-N-CA 114.421 -2.912 . . . . 50.0 113.01 -177.273 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 244' ' ' GLN . . . . . 0.615 ' HG2' ' CD2' ' H' ' 245' ' ' PHE . 0.0 OUTLIER -96.5 -19.29 19.23 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 106.698 -1.593 . . . . 50.0 106.698 176.443 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 245' ' ' PHE . . . . . 0.615 ' CD2' ' HG2' ' H' ' 244' ' ' GLN . 81.7 m-85 -122.15 4.31 9.81 Favored 'General case' 0 C--O 1.261 1.709 0 N-CA-C 117.264 2.32 . . . . 50.0 117.264 -177.288 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 246' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.296 -1.664 0 CA-C-O 116.648 -2.196 . . . . 49.5 114.95 176.793 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 55' ' ' ASP . . . . . . . . . . . . . 1.8 t70 . . . . . 0 N--CA 1.516 2.838 0 CA-C-O 126.573 3.082 . . . . 50.0 105.008 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 56' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -74.04 132.73 42.63 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 110.872 -2.876 . . . . 50.0 110.817 179.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 57' ' ' GLU . . . . . 0.502 ' HG2' ' O ' ' I' ' 58' ' ' GLU . 20.7 tt0 -73.08 146.93 45.43 Favored 'General case' 0 CA--C 1.557 1.213 0 N-CA-C 101.071 -3.677 . . . . 50.0 101.071 177.638 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 58' ' ' GLU . . . . . 0.667 ' CD ' ' H ' ' I' ' 58' ' ' GLU 0.263 2.2 mp0 -62.58 137.22 58.21 Favored 'General case' 0 C--N 1.283 -2.299 0 O-C-N 127.483 2.989 . . . . 50.0 108.803 179.644 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' I' I ' 59' ' ' ILE . . . . . . . . . . . . . 11.1 pt -105.39 161.3 23.19 Favored Pre-proline 0 N--CA 1.478 0.944 0 CA-C-O 117.38 -1.295 . . . . 50.0 107.56 177.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 60' ' ' PRO . . . . . 0.621 ' HD2' ' HD2' ' I' ' 63' ' ' TYS . 20.0 Cg_exo -68.42 149.36 74.88 Favored 'Trans proline' 0 C--N 1.312 -1.383 0 C-N-CA 124.318 3.346 . . . . 50.0 111.034 -179.174 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 61' ' ' GLU . . . . . 0.549 ' C ' ' N ' ' I' ' 63' ' ' TYS . . . -64.86 -36.98 86.1 Favored 'General case' 0 C--O 1.262 1.749 0 N-CA-C 117.583 2.438 . . . . 50.0 117.583 -176.1 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 62' ' ' GLU . . . . . 0.576 ' OE2' ' HB2' ' I' ' 60' ' ' PRO . 2.7 pm0 -50.46 -11.53 0.08 Allowed 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 108.728 -0.842 . . . . 50.0 108.728 -178.022 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 63' ' ' TYS . . . . . 0.621 ' HD2' ' HD2' ' I' ' 60' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 64' ' ' LEU . . . . . 0.601 HD23 ' HG2' ' H' ' 36' ' ' LYS . 10.9 mt . . . . . 0 C--O 1.282 2.815 0 CA-C-O 112.556 -3.592 . . . . 50.0 115.593 -175.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 372' ' ' 0ZE . . . . . 1.258 ' C ' ' OG ' ' H' ' 195' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 391' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 392' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 445' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 456' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 467' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 469' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 480' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 482' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 486' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 515' ' ' HOH . . . . . 0.792 ' O ' ' HE2' ' L' ' 10' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 401' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 422' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 428' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 431' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 432' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 435' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 436' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 438' ' ' HOH . . . . . 0.473 ' O ' ' HG3' ' H' ' 97' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 439' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 440' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 441' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 442' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 443' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 444' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 447' ' ' HOH . . . . . 1.06 ' O ' ' HG2' ' H' ' 151' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 449' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 450' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 453' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 454' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 455' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 457' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 458' ' ' HOH . . . . . 0.931 ' O ' ' HE3' ' H' ' 26' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 459' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 460' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 461' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 463' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 465' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 466' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 468' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 470' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 471' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 472' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 473' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 474' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 475' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 476' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 477' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 478' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 479' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 481' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 484' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 485' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 488' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 489' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 490' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 491' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 492' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 493' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 494' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 495' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 497' ' ' HOH . . . . . 0.76 ' O ' ' H4 ' ' H' ' 372' ' ' 0ZE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 498' ' ' HOH . . . . . 0.572 ' O ' ' NH2' ' H' ' 97' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 499' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 500' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 0 . 1 . 001 ecloud nobuild full ' H' H ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 511' ' ' HOH . . . . . 0.811 ' O ' ' OD2' ' H' ' 60' E ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 517' ' ' HOH . . . . . 0.593 ' O ' ' HB2' ' H' ' 236' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 529' ' ' HOH . . . . . 0.424 ' O ' ' HE2' ' H' ' 110' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 535' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 537' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 538' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 539' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 540' ' ' HOH . . . . . 0.772 ' O ' ' HE2' ' H' ' 236' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 446' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 462' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 496' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 536' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_