data_1a5g_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 1a5g _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' L' L ' 1' B ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.512 0 N-CA-C 107.396 -1.335 . . . . 42.45 107.396 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 1' A ASP . . . . . . . . . . . . . 1.7 t70 -105.07 8.39 34.26 Favored 'General case' 0 CA--C 1.56 1.328 0 O-C-N 125.821 1.95 . . . . 45.4 111.061 175.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 1' ' ' CYS . . . . . . . . . . . . . 12.2 p -49.9 143.0 8.25 Favored 'General case' 0 C--O 1.25 1.104 0 CA-C-O 124.302 2.001 . . . . 29.3 113.584 -178.086 77.799 70.48 100.482 108.299 2.008 105.293 -54.818 -62.448 1 1 . 1 . 001 ecloud orig full ' L' L ' 2' ' ' GLY . . . . . . . . . . . . . . . 67.6 6.1 40.71 Favored Glycine 0 C--O 1.253 1.296 0 CA-C-O 114.082 -3.621 . . . . 24.49 116.506 173.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 3' ' ' LEU . . . . . . . . . . . . . 23.5 mt -106.04 110.17 22.36 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 103.651 -2.722 . . . . 22.6 103.651 175.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 4' ' ' ARG . . . . . 0.466 ' NH1' ' OD2' ' L' ' 14' ' ' ASP . 53.6 mtm180 -75.04 127.0 87.5 Favored Pre-proline 0 N--CA 1.494 1.746 0 CA-C-N 112.804 -1.998 . . . . 22.28 113.661 -175.396 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 5' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -48.54 -41.08 37.4 Favored 'Trans proline' 0 CA--C 1.479 -2.253 0 CA-C-O 117.273 -1.22 . . . . 25.51 113.939 178.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 6' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -97.39 5.37 49.9 Favored 'General case' 0 CA--C 1.488 -1.419 0 CA-C-N 122.895 2.589 . . . . 24.26 114.838 -173.617 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 7' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -132.73 -91.75 0.38 Allowed 'General case' 0 C--O 1.278 2.557 0 O-C-N 125.753 1.908 . . . . 24.89 106.984 -179.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 8' ' ' GLU . . . . . . . . . . . . . 35.5 mp0 -45.31 -45.2 12.08 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 117.934 2.568 . . . . 23.2 117.934 -179.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 9' ' ' LYS . . . . . . . . . . . . . 18.9 mttt -67.64 -18.52 64.98 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 126.24 1.816 . . . . 37.2 115.172 178.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 10' ' ' LYS . . . . . . . . . . . . . 76.9 mttt -112.09 -4.74 14.37 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 106.942 -1.503 . . . . 31.79 106.942 -179.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 11' ' ' SER . . . . . . . . . . . . . 39.6 t 62.03 37.31 14.91 Favored 'General case' 0 C--O 1.251 1.165 0 CA-C-O 125.542 2.592 . . . . 25.93 112.761 -175.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 12' ' ' LEU . . . . . . . . . . . . . 67.5 mt -104.52 146.93 28.19 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 106.37 -1.715 . . . . 26.41 106.37 172.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 13' ' ' GLU . . . . . . . . . . . . 0.344 54.0 mt-10 -111.3 142.76 43.11 Favored 'General case' 0 C--N 1.277 -2.548 0 CA-C-O 114.806 -2.521 . . . . 43.69 109.026 179.823 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 14' ' ' ASP . . . . . 0.466 ' OD2' ' NH1' ' L' ' 4' ' ' ARG 0.327 2.2 p30 -75.81 161.97 28.56 Favored 'General case' 0 C--N 1.305 -1.358 1 CA-C-O 132.531 5.919 . . . . 25.65 105.173 176.049 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' L' L ' 14' A LYS . . . . . . . . . . . . . 1.5 ttmt -53.0 -26.32 14.95 Favored 'General case' 0 C--N 1.305 -1.328 1 CA-C-N 107.719 -4.31 . . . . 43.88 110.109 -178.614 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 14' B THR . . . . . . . . . . . . . 80.4 p -135.67 6.47 3.21 Favored 'General case' 0 C--O 1.255 1.368 0 CA-C-O 112.905 -3.426 . . . . 28.52 112.088 -178.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' C GLU . . . . . . . . . . . . . 10.9 pt-20 -60.63 -26.91 67.38 Favored 'General case' 0 CA--C 1.486 -1.493 0 O-C-N 127.661 3.101 . . . . 27.57 113.307 -179.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' D ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.39 -31.65 72.87 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 117.896 -3.003 . . . . 50.0 111.538 -176.334 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 14' E GLU . . . . . . . . . . . . . 36.8 tt0 -58.0 -42.36 85.05 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-O 122.687 1.232 . . . . 32.58 108.194 -179.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' F LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.1 -67.8 0.26 Allowed 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 112.78 -2.009 . . . . 28.57 108.121 175.748 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 14' G LEU . . . . . . . . . . . . 0.328 2.6 mt -50.24 -38.87 42.77 Favored 'General case' 0 CA--C 1.481 -1.69 0 N-CA-C 116.329 1.974 . . . . 34.48 116.329 -179.224 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 14' H GLU . . . . . . . . . . . . . 86.8 mt-10 -68.0 -14.67 63.15 Favored 'General case' 0 C--O 1.268 2.04 0 CA-C-O 117.325 -1.322 . . . . 42.08 113.288 179.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' I SER . . . . . 0.758 ' C ' ' N ' ' L' ' 14' K ILE . 53.3 p -90.03 -24.37 21.21 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 127.417 2.948 . . . . 33.38 113.704 -178.798 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 14' J TYR . . . . . 0.875 ' C ' ' CG1' ' L' ' 14' K ILE . 7.5 m-30 -75.58 25.57 0.11 Allowed 'General case' 0 N--CA 1.49 1.574 0 CA-C-O 127.905 3.717 . . . . 39.3 101.3 -179.004 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 14' K ILE . . . . . 0.875 ' CG1' ' C ' ' L' ' 14' J TYR 0.435 0.3 OUTLIER . . . . . 0 N--CA 1.505 2.293 2 CA-C-O 132.686 5.993 . . . . 46.58 110.354 -172.852 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' H' H ' 16' ' ' ILE . . . . . . . . . . . . . 27.8 mm . . . . . 0 N--CA 1.44 -0.951 0 CA-C-O 115.812 -2.042 . . . . 23.12 107.804 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 17' ' ' VAL . . . . . . . . . . . . . 93.4 t -115.08 124.44 71.71 Favored 'Isoleucine or valine' 0 C--O 1.268 2.048 0 CA-C-O 113.989 -2.91 . . . . 28.88 111.188 -179.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 18' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 67.61 36.63 3.62 Favored 'General case' 0 C--N 1.318 -0.786 0 O-C-N 128.162 3.414 . . . . 45.53 111.426 179.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 19' ' ' GLY . . . . . . . . . . . . . . . -103.51 -155.9 24.45 Favored Glycine 0 CA--C 1.538 1.482 1 O-C-N 131.347 5.404 . . . . 31.91 108.764 179.445 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 20' ' ' SER . . . . . . . . . . . . . 2.7 p -154.11 160.42 41.93 Favored 'General case' 0 N--CA 1.503 2.219 0 CA-C-O 114.998 -2.429 . . . . 41.27 106.211 178.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 21' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -61.03 143.17 55.87 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 126.05 2.094 . . . . 34.99 107.53 -179.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 22' ' ' ALA . . . . . . . . . . . . 0.286 . . -75.8 159.63 30.83 Favored 'General case' 0 C--N 1.29 -1.985 0 N-CA-C 106.05 -1.833 . . . . 29.65 106.05 176.868 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 23' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -82.96 161.98 21.63 Favored 'General case' 0 C--O 1.26 1.638 0 C-N-CA 125.404 1.481 . . . . 34.6 107.962 172.189 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 24' ' ' ILE . . . . . . . . . . . . . 4.6 mm -65.08 140.36 19.86 Favored 'Isoleucine or valine' 0 C--O 1.246 0.918 0 N-CA-C 108.228 -1.027 . . . . 26.11 108.228 -179.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.92 21.12 55.11 Favored Glycine 0 C--N 1.279 -2.598 0 C-N-CA 126.897 2.189 . . . . 23.49 114.466 -178.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 26' ' ' MET . . . . . . . . . . . . . 3.7 ttt -74.35 -28.8 61.3 Favored 'General case' 0 C--O 1.262 1.751 0 O-C-N 119.59 -2.124 . . . . 26.79 113.979 -179.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 27' ' ' SER . . . . . . . . . . . . . 46.7 m -139.97 71.21 35.35 Favored Pre-proline 0 C--O 1.262 1.728 0 C-N-CA 130.374 3.47 . . . . 26.25 109.957 179.04 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 28' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -68.34 -0.61 6.0 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 O-C-N 123.167 1.088 . . . . 19.21 114.22 -178.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 29' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -99.16 -11.08 21.69 Favored 'General case' 0 C--O 1.242 0.681 0 O-C-N 118.917 -2.364 . . . . 21.67 108.411 179.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 30' ' ' GLN . . . . . . . . . . . . . 29.3 tp60 -62.08 129.8 42.52 Favored 'General case' 0 C--O 1.244 0.787 0 O-C-N 128.801 3.813 . . . . 27.29 110.881 178.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 31' ' ' VAL . . . . . . . . . . . . . 78.5 t -126.17 153.64 34.67 Favored 'Isoleucine or valine' 0 C--O 1.256 1.43 0 C-N-CA 125.752 1.621 . . . . 24.43 111.231 -176.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 32' ' ' MET . . . . . . . . . . . . . 49.0 ttm -114.44 127.33 55.77 Favored 'General case' 0 C--N 1.307 -1.273 0 N-CA-C 107.34 -1.356 . . . . 28.74 107.34 179.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 33' ' ' LEU . . . . . . . . . . . . 0.318 0.2 OUTLIER -89.59 112.04 23.14 Favored 'General case' 0 N--CA 1.511 2.617 0 O-C-N 128.236 3.46 . . . . 37.12 104.463 176.602 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 34' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -127.59 132.9 49.75 Favored 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 115.306 -2.557 . . . . 33.15 112.282 -172.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 35' ' ' ARG . . . . . . . . . . . . . 59.2 ttt180 -81.95 131.61 35.25 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 111.994 -2.366 . . . . 45.59 110.642 -179.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 36' ' ' LYS . . . . . . . . . . . . . 27.3 mttt -64.18 -40.75 96.77 Favored 'General case' 0 C--O 1.255 1.342 0 C-N-CA 126.41 1.884 . . . . 46.87 114.071 -179.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 36' A SER . . . . . . . . . . . . 0.321 0.6 OUTLIER -158.62 111.84 1.65 Allowed Pre-proline 0 C--O 1.272 2.272 0 CA-C-N 113.759 -1.564 . . . . 50.0 114.649 -175.459 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 37' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -64.22 159.76 68.04 Favored 'Cis proline' 0 C--N 1.293 -2.394 0 N-CA-C 105.423 -2.568 . . . . 47.04 105.423 -2.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 38' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -81.67 118.38 22.78 Favored 'General case' 0 N--CA 1.488 1.441 0 CA-C-O 113.057 -3.354 . . . . 47.51 103.091 -177.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 39' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -161.47 152.81 18.71 Favored 'General case' 0 C--N 1.307 -1.27 0 O-C-N 128.978 3.924 . . . . 49.84 112.448 -179.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 40' ' ' LEU . . . . . . . . . . . . . 7.2 tp -73.44 129.66 38.47 Favored 'General case' 0 CA--C 1.555 1.171 0 N-CA-C 105.024 -2.213 . . . . 38.06 105.024 176.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 41' ' ' LEU . . . . . 0.656 ' CD2' ' CD2' ' H' ' 64' ' ' LEU . 0.3 OUTLIER -99.33 -57.6 2.12 Favored 'General case' 0 C--N 1.294 -1.815 1 O-C-N 131.105 5.253 . . . . 33.55 111.38 178.292 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' H' H ' 42' ' ' CYS . . . . . . . . . . . . 0.337 1.3 m -163.37 174.05 12.45 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 123.71 0.631 . . . . 28.66 109.67 -178.167 -94.303 -155.108 -87.412 101.979 2.04 99.781 -87.907 -70.153 2 2 . 1 . 001 ecloud orig full ' H' H ' 43' ' ' GLY . . . . . . . . . . . . . . . -89.94 178.52 43.71 Favored Glycine 0 CA--C 1.544 1.899 0 N-CA-C 107.756 -2.138 . . . . 24.52 107.756 170.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 44' ' ' ALA . . . . . . . . . . . . . . . -170.13 176.88 4.44 Favored 'General case' 0 C--O 1.271 2.222 0 N-CA-C 105.104 -2.184 . . . . 23.67 105.104 -179.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 45' ' ' SER . . . . . . . . . . . . . 30.0 p -137.63 141.73 41.21 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 125.965 2.041 . . . . 25.04 110.884 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 46' ' ' LEU . . . . . . . . . . . . . 43.0 tp -87.73 120.65 29.26 Favored 'General case' 0 C--O 1.257 1.469 0 CA-C-O 115.542 -2.171 . . . . 24.43 107.847 -177.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 47' ' ' ILE . . . . . . . . . . . . . 14.5 pt -109.79 -8.72 11.45 Favored 'Isoleucine or valine' 0 C--O 1.254 1.302 0 CA-C-N 120.574 1.533 . . . . 24.5 113.131 -177.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 48' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -167.95 -178.42 3.76 Favored 'General case' 0 C--O 1.292 3.295 0 CA-C-O 113.934 -2.936 . . . . 30.5 103.689 178.423 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 49' ' ' ASP . . . . . 0.617 ' N ' ' OD1' ' H' ' 49' ' ' ASP . 19.2 p-10 -80.13 -3.24 48.03 Favored 'General case' 0 N--CA 1.486 1.35 0 CA-C-O 113.695 -3.05 . . . . 38.06 113.795 -177.444 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 50' ' ' ARG . . . . . 0.985 ' NH2' ' O ' ' H' ' 109' ' ' LYS . 5.5 mtp180 -125.25 -4.08 7.39 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 127.83 3.206 . . . . 46.08 112.257 -179.49 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 51' ' ' TRP . . . . . . . . . . . . . 89.3 m95 -119.94 133.8 55.45 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 127.124 2.765 . . . . 34.29 115.776 -177.123 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 52' ' ' VAL . . . . . . . . . . . . . 24.2 t -118.99 138.8 48.55 Favored 'Isoleucine or valine' 0 C--O 1.246 0.912 0 CA-C-O 116.802 -1.571 . . . . 26.69 109.345 173.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 53' ' ' LEU . . . . . . . . . . . . . 22.3 tp -109.33 131.86 54.66 Favored 'General case' 0 C--N 1.286 -2.159 1 C-N-CA 134.94 5.296 . . . . 23.76 107.868 -178.853 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 54' ' ' THR . . . . . . . . . . . . . 2.4 t -147.03 178.78 8.09 Favored 'General case' 0 C--O 1.255 1.356 0 O-C-N 128.465 3.603 . . . . 23.3 110.699 -179.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 55' ' ' ALA . . . . . . . . . . . . . . . -84.9 129.39 34.81 Favored 'General case' 0 C--O 1.27 2.15 0 N-CA-C 105.122 -2.177 . . . . 21.98 105.122 175.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.51 -33.39 65.97 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 126.031 2.082 . . . . 21.13 110.878 -179.91 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 57' ' ' HIS . . . . . . . . . . . . . 1.5 p-80 -67.05 -15.31 63.64 Favored 'General case' 0 C--N 1.278 -2.514 0 C-N-CA 120.06 -0.656 . . . . 22.68 112.665 -177.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 58' ' ' CYS . . . . . . . . . . . . . 91.4 m -71.39 -21.82 61.96 Favored 'General case' 0 C--O 1.261 1.701 0 O-C-N 117.919 -2.988 . . . . 24.46 110.02 176.033 -70.153 -87.907 -87.412 99.781 2.04 101.979 -155.108 -94.303 1 1 . 1 . 001 ecloud orig full ' H' H ' 59' ' ' LEU . . . . . . . . . . . . . 36.2 mt -103.36 -39.51 6.76 Favored 'General case' 0 C--O 1.244 0.782 0 N-CA-C 114.249 1.203 . . . . 29.45 114.249 -177.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' ' ' LEU . . . . . . . . . . . . . 7.6 tp -138.86 117.69 12.36 Favored 'General case' 0 C--O 1.202 -1.403 0 O-C-N 127.219 2.825 . . . . 26.87 111.542 -174.345 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' A TYR . . . . . . . . . . . . . 16.7 t80 -155.97 84.67 3.32 Favored Pre-proline 0 C--N 1.369 1.442 0 CA-C-N 110.018 -3.265 . . . . 27.61 107.736 179.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' B PRO . . . . . 0.409 ' N ' ' CD ' ' H' ' 60' C PRO . 74.5 Cg_exo -52.33 -43.73 51.8 Favored 'Trans proline' 0 N--CA 1.496 1.638 0 C-N-CA 123.956 3.104 . . . . 26.71 115.619 -177.758 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 60' C PRO . . . . . 0.409 ' CD ' ' N ' ' H' ' 60' B PRO . 91.2 Cg_exo -47.15 -27.17 6.08 Favored 'Trans proline' 0 C--O 1.255 1.365 0 C-N-CA 122.826 2.351 . . . . 29.17 114.166 175.573 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 60' D TRP . . . . . . . . . . . . . 54.3 m0 -114.09 13.93 18.2 Favored 'General case' 0 C--O 1.242 0.692 0 CA-C-O 115.2 -2.333 . . . . 32.83 110.893 -179.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' E ASP . . . . . . . . . . . . . 41.1 m-20 63.01 33.25 14.95 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 127.622 3.076 . . . . 40.43 112.572 178.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' F LYS . . . . . . . . . . . . . 7.2 tttt -103.87 114.39 28.6 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 124.798 1.311 . . . . 34.94 111.934 -179.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' G ASN . . . . . . . . . . . . . 55.8 t-20 -144.6 76.11 1.48 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 124.714 1.259 . . . . 42.02 108.942 176.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' H PHE . . . . . . . . . . . . . 65.9 m-85 -85.46 145.7 27.3 Favored 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 115.572 -2.451 . . . . 36.01 113.165 -175.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' I THR . . . . . . . . . . . . . 73.0 p -109.65 170.79 7.84 Favored 'General case' 0 N--CA 1.485 1.289 0 CA-C-O 125.341 2.496 . . . . 37.69 109.301 173.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 61' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -47.19 -37.72 10.69 Favored 'General case' 0 C--O 1.294 3.435 0 O-C-N 119.237 -2.164 . . . . 46.26 116.193 179.015 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 62' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -80.43 -11.04 59.74 Favored 'General case' 0 C--N 1.306 -1.287 1 O-C-N 115.961 -4.212 . . . . 50.0 112.589 -179.495 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 63' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -75.04 -28.68 60.52 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 115.733 -2.079 . . . . 46.12 110.689 -178.173 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 64' ' ' LEU . . . . . 0.656 ' CD2' ' CD2' ' H' ' 41' ' ' LEU . 0.5 OUTLIER -121.79 160.05 25.42 Favored 'General case' 0 C--N 1.325 -0.498 1 CA-C-O 132.137 5.732 . . . . 38.21 120.659 -174.636 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' H' H ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -129.95 137.28 50.25 Favored 'General case' 0 C--N 1.317 -0.847 1 CA-C-N 106.78 -4.736 . . . . 34.91 107.689 178.26 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 66' ' ' VAL . . . . . . . . . . . . . 17.9 m -109.97 132.09 59.19 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 N-CA-C 104.791 -2.3 . . . . 32.08 104.791 174.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 67' ' ' ARG . . . . . . . . . . . . . 63.7 mtp180 -116.04 114.37 24.47 Favored 'General case' 0 C--N 1.285 -2.197 0 C-N-CA 128.029 2.532 . . . . 30.46 109.196 -179.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 68' ' ' ILE . . . . . . . . . . . . . 7.0 mt -112.28 143.93 21.05 Favored 'Isoleucine or valine' 0 C--O 1.248 1.015 0 C-N-CA 125.931 1.692 . . . . 27.91 113.535 -178.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 69' ' ' GLY . . . . . . . . . . . . . . . 87.34 21.08 50.18 Favored Glycine 0 C--O 1.248 1.016 0 O-C-N 125.154 1.534 . . . . 26.4 115.892 177.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 70' ' ' LYS . . . . . 0.406 ' NZ ' ' OE1' ' H' ' 77' ' ' GLU . 11.8 mtpp -88.73 159.82 17.61 Favored 'General case' 0 CA--C 1.507 -0.708 0 CA-C-O 123.597 1.665 . . . . 29.73 111.373 -174.868 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 71' ' ' HIS . . . . . . . . . . . . . 75.7 t60 -133.78 -48.97 0.82 Allowed 'General case' 0 N--CA 1.493 1.723 1 CA-C-N 107.544 -4.389 . . . . 27.64 105.641 176.22 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 72' ' ' SER . . . . . . . . . . . . . 28.3 t -76.48 132.56 39.67 Favored 'General case' 0 C--O 1.243 0.736 0 CA-C-N 110.485 -3.052 . . . . 31.88 107.464 -178.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 73' ' ' ARG . . . . . 0.412 ' NE ' ' O ' ' H' ' 152' ' ' PRO . 43.1 ttp85 -65.08 -46.86 79.38 Favored 'General case' 0 C--O 1.262 1.727 0 O-C-N 127.563 3.039 . . . . 33.82 114.428 177.236 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 74' ' ' THR . . . . . . . . . . . . . 72.0 p -106.17 -32.28 8.29 Favored 'General case' 0 C--O 1.264 1.818 0 N-CA-C 119.637 3.199 . . . . 34.58 119.637 -177.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 75' ' ' ARG . . . . . . . . . . . . 0.309 26.1 mtt85 -63.39 139.44 58.77 Favored 'General case' 0 C--N 1.297 -1.675 0 CA-C-O 125.781 2.705 . . . . 50.0 114.709 179.657 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 76' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -83.63 90.66 7.31 Favored 'General case' 0 C--O 1.256 1.423 1 O-C-N 114.673 -5.017 . . . . 38.59 107.64 177.726 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 77' ' ' GLU . . . . . 0.406 ' OE1' ' NZ ' ' H' ' 70' ' ' LYS . 35.4 mt-10 -63.93 67.39 0.02 OUTLIER 'General case' 0 C--N 1.309 -1.17 0 N-CA-C 118.833 2.901 . . . . 31.24 118.833 -174.893 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 77' A ARG . . . . . . . . . . . . . 35.0 ttp85 -44.57 123.83 3.85 Favored 'General case' 0 C--O 1.26 1.61 1 C-N-CA 133.401 4.681 . . . . 32.47 111.272 179.752 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 78' ' ' ASN . . . . . . . . . . . . . 1.4 m120 75.08 -2.52 2.82 Favored 'General case' 0 C--O 1.252 1.206 0 O-C-N 125.006 1.442 . . . . 35.41 112.531 -178.1 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 79' ' ' ILE . . . . . . . . . . . . . 1.7 mt -109.24 -59.13 3.42 Favored 'Isoleucine or valine' 0 C--O 1.276 2.499 0 O-C-N 118.392 -2.693 . . . . 31.35 112.249 175.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 80' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -82.48 146.52 29.22 Favored 'General case' 0 C--O 1.268 2.061 0 CA-C-N 113.226 -1.807 . . . . 30.88 114.823 -177.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 81' ' ' LYS . . . . . . . . . . . . . 60.5 mmtt -116.27 128.46 55.6 Favored 'General case' 0 CA--C 1.556 1.2 0 CA-C-O 126.557 3.075 . . . . 48.29 109.192 175.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 82' ' ' ILE . . . . . . . . . . . . . 20.8 mt -106.57 110.05 30.19 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-O 114.903 -2.475 . . . . 35.88 111.758 -178.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 83' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -112.11 166.24 11.43 Favored 'General case' 0 CA--C 1.553 1.092 0 CA-C-O 127.903 3.716 . . . . 38.94 111.575 175.442 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 84' ' ' MET . . . . . . . . . . . . . 7.8 mtt -93.96 153.5 18.17 Favored 'General case' 0 N--CA 1.43 -1.444 1 C-N-CA 133.086 4.554 . . . . 46.21 106.923 175.053 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 85' ' ' LEU . . . . . 0.901 ' CD1' ' CE ' ' H' ' 106' ' ' MET . 4.2 mt -99.09 147.32 25.18 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 127.309 2.88 . . . . 38.35 105.558 179.402 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 86' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -97.29 -35.98 10.55 Favored 'General case' 0 C--N 1.293 -1.889 0 O-C-N 127.05 2.719 . . . . 48.12 107.223 173.786 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 87' ' ' LYS . . . . . . . . . . . . 0.386 4.6 mmtt -158.01 140.78 14.77 Favored 'General case' 0 C--O 1.262 1.753 0 N-CA-C 119.846 3.276 . . . . 43.74 119.846 -175.326 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 88' ' ' ILE . . . . . . . . . . . . . 5.8 mt -106.39 138.84 29.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 O-C-N 125.583 1.802 . . . . 37.24 109.677 171.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 89' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -130.48 112.05 12.85 Favored 'General case' 0 C--O 1.273 2.335 0 C-N-CA 129.8 3.24 . . . . 42.24 109.213 178.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 90' ' ' ILE . . . . . . . . . . . . . 43.1 mt -100.18 144.61 12.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 113.169 -1.832 . . . . 29.42 109.868 178.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 91' ' ' HIS . . . . . . . . . . . . . 41.0 t-80 -60.33 127.97 87.12 Favored Pre-proline 0 C--O 1.273 2.325 0 CA-C-O 125.113 2.387 . . . . 29.76 110.552 174.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 92' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -56.86 -31.91 90.43 Favored 'Trans proline' 0 N--CA 1.439 -1.714 0 C-N-CA 122.187 1.925 . . . . 30.84 114.158 -176.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 93' ' ' ARG . . . . . . . . . . . . . 23.0 mtp180 -106.72 29.37 7.04 Favored 'General case' 0 C--O 1.263 1.767 0 N-CA-C 115.825 1.787 . . . . 37.18 115.825 178.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 94' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -64.53 129.22 39.03 Favored 'General case' 0 N--CA 1.505 2.277 0 N-CA-C 103.098 -2.927 . . . . 25.36 103.098 175.109 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 95' ' ' ASN . . . . . . . . . . . . . 50.6 t-20 -101.72 84.47 2.57 Favored 'General case' 0 C--N 1.284 -2.259 0 C-N-CA 125.417 1.487 . . . . 32.21 112.394 -179.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 96' ' ' TRP . . . . . . . . . . . . . 52.1 p-90 -80.74 -3.0 49.26 Favored 'General case' 0 N--CA 1.489 1.478 0 CA-C-O 114.254 -2.784 . . . . 28.9 108.564 179.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 97' ' ' ARG . . . . . . . . . . . . . 72.3 mtt-85 -84.2 -33.78 24.09 Favored 'General case' 0 C--O 1.265 1.904 0 O-C-N 126.514 2.384 . . . . 40.79 114.679 -177.234 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 97' A GLU . . . . . . . . . . . . . 58.1 tt0 -113.69 -66.1 1.12 Allowed 'General case' 0 C--O 1.27 2.166 0 CA-C-O 116.586 -1.673 . . . . 35.65 113.323 -177.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 98' ' ' ASN . . . . . 0.426 ' ND2' ' O ' ' H' ' 175' ' ' ARG . 47.8 p-10 -136.43 21.08 3.15 Favored 'General case' 0 C--O 1.256 1.399 0 N-CA-C 117.314 2.339 . . . . 26.57 117.314 -168.316 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 99' ' ' LEU . . . . . . . . . . . . . 63.0 mt 60.53 28.75 18.43 Favored 'General case' 0 C--N 1.293 -1.888 0 C-N-CA 126.37 1.868 . . . . 26.33 109.205 -178.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 100' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -58.92 134.03 56.58 Favored 'General case' 0 C--N 1.292 -1.926 0 C-N-CA 125.027 1.331 . . . . 27.7 107.952 178.259 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 101' ' ' ARG . . . . . . . . . . . . . 48.9 mtt85 63.44 43.67 5.86 Favored 'General case' 0 N--CA 1.497 1.925 0 CA-C-O 121.929 0.871 . . . . 32.11 113.349 -175.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 102' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -76.99 78.98 3.53 Favored 'General case' 0 C--O 1.264 1.817 0 O-C-N 119.506 -1.997 . . . . 20.94 112.629 179.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 103' ' ' ILE . . . . . . . . . . . . . 13.3 tt -147.04 142.92 20.37 Favored 'Isoleucine or valine' 0 C--O 1.276 2.454 0 O-C-N 120.037 -1.664 . . . . 24.12 113.255 -176.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 104' ' ' ALA . . . . . . . . . . . . . . . -147.65 150.47 34.45 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-O 112.784 -3.484 . . . . 24.1 105.656 -179.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 105' ' ' LEU . . . . . . . . . . . . . 29.5 mt -112.82 147.65 36.52 Favored 'General case' 0 C--O 1.258 1.528 1 O-C-N 129.246 4.091 . . . . 27.73 106.85 173.63 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 106' ' ' MET . . . . . 0.901 ' CE ' ' CD1' ' H' ' 85' ' ' LEU . 70.8 mtp -129.32 127.75 41.75 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 126.055 2.097 . . . . 37.16 107.091 176.122 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 107' ' ' LYS . . . . . 0.433 ' CE ' ' NH1' ' H' ' 50' ' ' ARG . 33.6 tttt -100.14 124.78 45.95 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 127.919 2.488 . . . . 45.73 107.895 -177.921 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 108' ' ' LEU . . . . . 0.656 ' O ' ' NH2' ' H' ' 50' ' ' ARG . 71.9 mt -82.62 152.74 25.77 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 116.457 -2.097 . . . . 32.61 111.871 -174.975 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 109' ' ' LYS . . . . . 0.985 ' O ' ' NH2' ' H' ' 50' ' ' ARG 0.261 2.3 tptt -47.27 -48.17 24.81 Favored 'General case' 0 C--N 1.309 -1.166 0 O-C-N 127.681 3.113 . . . . 49.58 107.962 174.209 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 110' ' ' LYS . . . . . . . . . . . . . 2.1 mttm -143.46 158.88 56.58 Favored Pre-proline 0 N--CA 1.486 1.332 0 N-CA-C 108.613 -0.884 . . . . 50.0 108.613 -179.226 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 111' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_endo -70.46 140.86 40.99 Favored 'Trans proline' 0 C--N 1.311 -1.43 0 N-CA-C 106.501 -2.154 . . . . 36.59 106.501 -179.71 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 112' ' ' VAL . . . . . . . . . . . . . 10.9 p -92.38 155.07 3.13 Favored 'Isoleucine or valine' 0 C--O 1.26 1.617 0 N-CA-C 105.724 -1.954 . . . . 35.62 105.724 179.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 113' ' ' ALA . . . . . . . . . . . . . . . -98.24 137.54 36.84 Favored 'General case' 0 N--CA 1.483 1.189 0 O-C-N 126.132 2.145 . . . . 34.23 108.479 178.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 114' ' ' PHE . . . . . 0.504 ' CD1' ' N ' ' H' ' 114' ' ' PHE . 13.0 m-30 -66.96 159.63 28.11 Favored 'General case' 0 C--N 1.315 -0.901 0 O-C-N 127.784 3.177 . . . . 29.05 110.405 176.868 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 115' ' ' SER . . . . . . . . . . . . . 32.6 p -168.92 -173.0 1.71 Allowed 'General case' 0 C--O 1.261 1.681 0 CA-C-O 116.357 -1.782 . . . . 31.87 106.303 -176.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 116' ' ' ASP . . . . . . . . . . . . . 66.8 m-20 -62.69 -31.4 72.29 Favored 'General case' 0 C--O 1.304 3.972 0 CA-C-N 119.837 1.198 . . . . 28.0 112.615 -179.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 117' ' ' TYR . . . . . . . . . . . . . 15.0 m-85 -97.9 -19.04 18.34 Favored 'General case' 0 C--N 1.299 -1.623 0 C-N-CA 127.906 2.482 . . . . 31.85 117.535 -177.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 118' ' ' ILE . . . . . . . . . . . . . 19.4 mt -121.57 111.11 29.77 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.079 1 C-N-CA 133.601 4.761 . . . . 23.77 114.623 -178.958 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 119' ' ' HIS . . . . . . . . . . . . . 31.8 t60 -160.98 139.63 7.46 Favored Pre-proline 0 C--O 1.254 1.292 0 N-CA-C 107.017 -1.475 . . . . 24.37 107.017 -175.014 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 120' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -74.92 155.97 43.33 Favored 'Trans proline' 0 C--O 1.25 1.108 0 C-N-CA 124.16 3.24 . . . . 23.36 115.685 -176.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 121' ' ' VAL . . . . . . . . . . . . . 12.2 p -99.51 161.39 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 N-CA-C 104.733 -2.321 . . . . 20.75 104.733 177.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 122' ' ' CYS . . . . . . . . . . . . . 70.9 m -91.65 147.36 23.06 Favored 'General case' 0 C--O 1.242 0.678 0 CA-C-N 118.169 0.441 . . . . 21.59 110.32 177.647 -62.448 -54.818 100.482 105.293 2.008 108.299 70.48 77.799 1 1 . 1 . 001 ecloud orig full ' H' H ' 123' ' ' LEU . . . . . . . . . . . . . 22.0 mt -91.87 141.74 25.79 Favored Pre-proline 0 N--CA 1.491 1.605 0 N-CA-C 103.332 -2.84 . . . . 23.49 103.332 174.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 124' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -68.94 156.26 65.92 Favored 'Trans proline' 0 C--N 1.3 -2.004 0 CA-C-O 128.049 3.27 . . . . 27.08 111.854 179.177 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 125' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -111.83 161.45 16.34 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 102.417 -3.179 . . . . 39.83 102.417 175.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 126' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -45.44 -44.47 12.23 Favored 'General case' 0 C--O 1.26 1.616 0 CA-C-O 115.728 -2.082 . . . . 50.0 114.081 179.273 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 127' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -85.89 -29.39 23.7 Favored 'General case' 0 C--O 1.265 1.906 0 CA-C-N 124.944 3.52 . . . . 50.0 112.687 -176.25 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 128' ' ' THR . . . . . . . . . . . . . 11.9 m -58.49 -45.3 89.01 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 103.993 -2.595 . . . . 37.41 103.993 177.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 129' ' ' ALA . . . . . . . . . . . . . . . -62.7 -41.98 99.41 Favored 'General case' 0 C--O 1.245 0.823 0 O-C-N 127.218 2.824 . . . . 33.69 110.844 -179.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 129' A ALA . . . . . . . . . . . . . . . -58.88 -48.76 80.27 Favored 'General case' 0 C--O 1.264 1.836 0 CA-C-O 125.655 2.645 . . . . 32.87 113.594 -177.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 129' B SER . . . . . 0.58 ' O ' ' NE2' ' H' ' 131' ' ' GLN . 0.1 OUTLIER -81.29 -24.65 37.09 Favored 'General case' 0 C--O 1.252 1.191 0 CA-C-O 114.774 -2.536 . . . . 35.75 114.549 -179.445 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 129' C LEU . . . . . . . . . . . . . 55.7 mt -98.02 -30.36 12.75 Favored 'General case' 0 C--O 1.25 1.097 0 CA-C-N 123.459 2.845 . . . . 30.87 113.061 -174.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 130' ' ' LEU . . . . . . . . . . . . . 11.8 mt -79.79 75.0 6.48 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 125.505 1.753 . . . . 35.71 108.307 -176.125 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 131' ' ' GLN . . . . . 0.58 ' NE2' ' O ' ' H' ' 129' B SER . 60.1 mt-30 -130.89 131.19 44.37 Favored 'General case' 0 C--N 1.301 -1.534 0 C-N-CA 128.783 2.833 . . . . 42.34 113.288 -178.531 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 132' ' ' ALA . . . . . . . . . . . . . . . -50.7 138.01 19.0 Favored 'General case' 0 C--N 1.358 0.953 0 CA-C-O 111.936 -3.887 . . . . 32.01 104.721 -177.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 133' ' ' GLY . . . . . . . . . . . . . . . 100.69 -39.86 2.61 Favored Glycine 0 C--O 1.248 0.984 1 O-C-N 129.496 4.247 . . . . 29.82 112.15 -179.147 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 134' ' ' TYR . . . . . . . . . . . . . 3.8 m-30 -71.57 149.7 45.44 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-O 115.65 -2.119 . . . . 30.75 108.177 -178.447 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 135' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -102.76 149.75 24.16 Favored 'General case' 0 C--N 1.281 -2.413 0 CA-C-O 116.444 -1.741 . . . . 27.92 115.049 178.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 136' ' ' GLY . . . . . . . . . . . . . . . -126.91 175.02 18.13 Favored Glycine 0 N--CA 1.41 -3.087 0 C-N-CA 128.09 2.757 . . . . 19.26 107.108 173.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 137' ' ' ARG . . . . . . . . . . . . . 42.9 ttm180 -124.83 135.67 53.13 Favored 'General case' 0 C--N 1.294 -1.818 0 C-N-CA 128.181 2.592 . . . . 21.71 110.421 -177.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 138' ' ' VAL . . . . . . . . . . . . . 4.4 t -117.71 144.42 25.71 Favored 'Isoleucine or valine' 0 C--N 1.355 0.822 0 O-C-N 125.632 1.832 . . . . 22.32 107.656 178.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 139' ' ' THR . . . . . 0.455 ' CG2' ' CG2' ' H' ' 157' ' ' VAL . 11.6 p -133.75 152.29 51.84 Favored 'General case' 0 N--CA 1.5 2.046 0 CA-C-N 119.517 1.053 . . . . 22.46 110.0 179.639 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 140' ' ' GLY . . . . . . . . . . . . . . . 171.44 163.05 24.77 Favored Glycine 0 C--O 1.209 -1.453 0 C-N-CA 120.118 -1.039 . . . . 22.59 112.018 177.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 141' ' ' TRP . . . . . . . . . . . . . 19.2 m-90 -94.78 18.61 11.41 Favored 'General case' 0 C--N 1.32 -0.703 0 O-C-N 127.882 2.754 . . . . 27.97 112.149 174.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 142' ' ' GLY . . . . . . . . . . . . . . . -73.05 175.73 44.9 Favored Glycine 0 CA--C 1.545 1.951 0 CA-C-O 125.191 2.55 . . . . 31.6 113.205 -178.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 143' ' ' ASN . . . . . . . . . . . . . 49.0 m-20 -55.87 149.71 14.44 Favored 'General case' 0 CA--C 1.527 0.084 0 CA-C-N 110.952 -2.624 . . . . 36.64 109.572 -178.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 144' ' ' LEU . . . . . 0.404 ' N ' ' O ' ' H' ' 150' ' ' GLY . 22.3 mt -91.5 -20.37 21.8 Favored 'General case' 0 C--O 1.217 -0.62 1 CA-C-N 107.951 -4.204 . . . . 33.16 109.812 -177.829 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 145' ' ' LYS . . . . . . . . . . . . 0.277 57.7 mttm -142.51 150.71 40.83 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-N 112.181 -2.281 . . . . 43.5 108.603 -175.747 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 146' ' ' GLU . . . . . 0.401 ' OE2' ' NH2' ' H' ' 221' A ARG . 47.0 tt0 . . . . . 0 C--O 1.264 1.837 1 O-C-N 130.374 4.796 . . . . 38.3 108.456 176.093 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 150' ' ' GLY . . . . . 0.404 ' O ' ' N ' ' H' ' 144' ' ' LEU . . . . . . . . 0 N--CA 1.494 2.527 0 CA-C-O 123.652 1.696 . . . . 47.56 111.385 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 151' ' ' GLN . . . . . 0.469 ' NE2' ' O ' ' H' ' 518' ' ' HOH . 7.7 mt-30 -107.24 127.67 27.47 Favored Pre-proline 0 C--O 1.259 1.555 0 C-N-CA 124.299 1.039 . . . . 50.0 108.621 178.495 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 152' ' ' PRO . . . . . 0.412 ' O ' ' NE ' ' H' ' 73' ' ' ARG . 19.0 Cg_endo -68.22 168.76 18.38 Favored 'Trans proline' 0 CA--C 1.507 -0.85 0 O-C-N 124.599 1.841 . . . . 38.07 110.065 -178.286 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 153' ' ' SER . . . . . . . . . . . . . 24.6 t -93.93 -29.94 15.01 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 106.8 -1.555 . . . . 34.5 106.8 175.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 154' ' ' VAL . . . . . . . . . . . . . 30.2 m -136.34 166.84 25.63 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 CA-C-O 117.663 -1.161 . . . . 29.85 110.916 -179.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 155' ' ' LEU . . . . . . . . . . . . . 8.2 tp -52.27 141.79 18.35 Favored 'General case' 0 N--CA 1.48 1.06 0 O-C-N 127.782 3.177 . . . . 27.44 109.088 179.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 156' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -115.34 156.69 25.03 Favored 'General case' 0 C--N 1.29 -1.993 0 C-N-CA 129.172 2.989 . . . . 24.67 107.46 -179.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 157' ' ' VAL . . . . . 0.455 ' CG2' ' CG2' ' H' ' 139' ' ' THR . 22.7 t -137.53 154.89 30.45 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.379 0 CA-C-O 112.994 -3.384 . . . . 25.04 112.357 -179.416 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 158' ' ' VAL . . . . . . . . . . . . . 9.2 p -151.31 147.77 15.25 Favored 'Isoleucine or valine' 0 C--O 1.262 1.762 0 CA-C-O 114.24 -2.791 . . . . 21.35 106.213 174.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 159' ' ' ASN . . . . . . . . . . . . . 50.4 m-20 -108.93 127.9 54.46 Favored 'General case' 0 C--N 1.278 -2.526 0 C-N-CA 129.137 2.975 . . . . 27.85 106.241 175.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 160' ' ' LEU . . . . . . . . . . . . 0.317 76.5 mt -138.79 148.68 59.21 Favored Pre-proline 0 N--CA 1.505 2.299 0 CA-C-O 112.573 -3.584 . . . . 24.73 107.995 -175.987 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 161' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -79.84 152.28 22.1 Favored 'Trans proline' 0 C--N 1.285 -2.776 0 O-C-N 126.562 2.875 . . . . 25.39 114.7 179.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 162' ' ' ILE . . . . . . . . . . . . . 3.6 mt -77.08 136.52 24.29 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.902 0 N-CA-C 104.961 -2.237 . . . . 25.04 104.961 173.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 163' ' ' VAL . . . . . . . . . . . . . 57.6 t -102.7 146.45 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.373 0 CA-C-N 114.126 -1.397 . . . . 25.25 111.123 -179.269 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 164' ' ' GLU . . . . . 0.405 ' OE1' ' NZ ' ' H' ' 185' ' ' LYS . 0.6 OUTLIER -59.16 141.26 54.65 Favored 'General case' 0 C--O 1.259 1.596 0 O-C-N 119.264 -2.147 . . . . 47.27 109.916 177.206 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 165' ' ' ARG . . . . . 0.79 ' NH1' ' O ' ' H' ' 180' ' ' MET . 8.3 mtp85 -52.56 -41.88 85.35 Favored Pre-proline 0 C--N 1.297 -1.686 0 C-N-CA 127.653 2.381 . . . . 40.7 115.348 -175.884 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 166' ' ' PRO . . . . . 0.594 ' CD ' ' N ' ' H' ' 165' ' ' ARG . 45.3 Cg_exo -61.13 -47.01 13.42 Favored 'Trans proline' 0 N--CA 1.453 -0.863 0 C-N-CA 125.056 3.837 . . . . 28.28 111.222 -179.243 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 167' ' ' VAL . . . . . . . . . . . . . 51.0 t -62.29 -37.87 79.7 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.15 0 CA-C-N 112.994 -1.912 . . . . 27.16 106.224 179.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 168' ' ' CYS . . . . . . . . . . . . . 86.2 m -65.09 -50.23 66.93 Favored 'General case' 0 C--O 1.273 2.326 0 CA-C-N 115.114 -0.948 . . . . 27.88 109.222 179.127 -67.773 -65.501 -88.878 106.155 2.007 110.288 -72.735 81.022 1 1 . 1 . 001 ecloud orig full ' H' H ' 169' ' ' LYS . . . . . . . . . . . . . 16.6 mttt -57.24 -44.12 83.54 Favored 'General case' 0 C--O 1.255 1.372 0 CA-C-O 125.206 2.432 . . . . 48.7 113.344 -179.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 170' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -69.58 -5.47 24.69 Favored 'General case' 0 CA--C 1.498 -1.043 0 O-C-N 118.696 -2.502 . . . . 27.92 116.758 -177.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 171' ' ' SER . . . . . . . . . . . . . 10.8 p -96.68 -12.51 23.74 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 126.087 2.851 . . . . 27.07 110.535 -176.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 172' ' ' THR . . . . . . . . . . . . . 9.1 t -148.74 165.26 31.93 Favored 'General case' 0 CA--C 1.514 -0.423 0 O-C-N 118.776 -2.452 . . . . 24.94 113.481 -174.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 173' ' ' ARG . . . . . . . . . . . . . 13.0 mtp180 -91.93 -18.85 23.12 Favored 'General case' 0 C--O 1.259 1.581 0 CA-C-O 113.507 -3.139 . . . . 45.63 112.987 175.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 174' ' ' ILE . . . . . . . . . . . . . 36.8 mt -68.21 136.97 25.44 Favored 'Isoleucine or valine' 0 C--O 1.262 1.712 0 O-C-N 125.855 1.972 . . . . 28.81 109.674 177.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 175' ' ' ARG . . . . . 0.657 ' NH1' ' O ' ' H' ' 498' ' ' HOH . 63.5 ttp85 -73.05 123.18 23.03 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-O 124.471 2.082 . . . . 32.4 109.176 177.455 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 176' ' ' ILE . . . . . . . . . . . . . 1.1 mm -92.65 132.38 37.11 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.82 0 C-N-CA 129.587 3.155 . . . . 26.67 107.067 -177.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 177' ' ' THR . . . . . 0.619 ' O ' ' NH2' ' H' ' 165' ' ' ARG . 17.9 p -113.63 176.9 4.83 Favored 'General case' 0 C--O 1.252 1.207 0 O-C-N 125.481 1.738 . . . . 25.79 112.419 -179.915 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 178' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -70.75 -22.52 62.39 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 114.768 -2.539 . . . . 32.03 111.748 178.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 179' ' ' ASN . . . . . . . . . . . . . 50.6 m-20 -78.02 20.98 0.34 Allowed 'General case' 0 C--N 1.301 -1.52 0 CA-C-O 113.855 -2.974 . . . . 25.95 111.983 177.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 180' ' ' MET . . . . . 0.79 ' O ' ' NH1' ' H' ' 165' ' ' ARG . 66.8 mtt -140.6 151.5 44.71 Favored 'General case' 0 C--N 1.284 -2.255 0 O-C-N 128.955 3.909 . . . . 25.24 109.253 -177.131 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 181' ' ' PHE . . . . . . . . . . . . 0.288 43.4 p90 -138.23 159.29 42.42 Favored 'General case' 0 C--O 1.259 1.601 1 O-C-N 130.245 4.716 . . . . 20.06 105.277 169.986 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' H' H ' 182' ' ' CYS . . . . . . . . . . . . . 6.7 p -121.36 158.86 27.32 Favored 'General case' 0 N--CA 1.497 1.885 0 C-N-CA 117.166 -1.814 . . . . 24.11 107.34 173.117 81.022 -72.735 -88.878 110.288 2.007 106.155 -65.501 -67.773 1 1 . 1 . 001 ecloud orig full ' H' H ' 183' ' ' ALA . . . . . . . . . . . . 0.284 . . -147.88 146.84 29.22 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 124.179 0.992 . . . . 23.26 112.912 178.51 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 184' ' ' GLY . . . . . . . . . . . . . . . 156.66 169.83 21.08 Favored Glycine 0 C--N 1.317 -0.479 0 N-CA-C 107.193 -2.363 . . . . 24.26 107.193 176.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 184' A TYR . . . . . . . . . . . . . 71.2 m-85 -84.33 160.51 20.68 Favored 'General case' 0 C--O 1.264 1.821 0 N-CA-C 106.57 -1.641 . . . . 29.21 106.57 176.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 185' ' ' LYS . . . . . 0.405 ' NZ ' ' OE1' ' H' ' 164' ' ' GLU . 25.1 mttt -88.19 137.25 31.17 Favored Pre-proline 0 C--N 1.297 -1.711 0 C-N-CA 127.693 2.397 . . . . 38.35 108.209 174.045 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 186' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -38.52 -40.4 1.32 Allowed 'Trans proline' 0 C--O 1.236 0.387 0 C-N-CA 125.166 3.911 . . . . 40.31 109.955 -176.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 186' A ASP . . . . . 0.856 ' OD1' ' N ' ' H' ' 186' B GLU . 0.0 OUTLIER -61.98 -77.31 0.05 OUTLIER 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 109.527 -3.488 . . . . 50.0 106.605 179.352 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 186' B GLU . . . . . 0.856 ' N ' ' OD1' ' H' ' 186' A ASP . 77.1 mt-10 -20.21 -20.45 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.279 0 C-N-CA 131.367 3.867 . . . . 50.0 114.806 -175.212 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 186' C GLY . . . . . 0.845 ' N ' ' O ' ' H' ' 186' A ASP . . . 33.48 98.26 0.01 OUTLIER Glycine 0 CA--C 1.542 1.779 0 O-C-N 127.191 2.807 . . . . 44.55 108.456 179.47 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 186' D LYS . . . . . . . . . . . . . 10.9 ttmm 168.87 135.14 0.02 OUTLIER 'General case' 0 C--N 1.293 -1.854 2 C-N-CA 136.442 5.897 . . . . 40.89 99.104 178.267 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 187' ' ' ARG . . . . . 0.846 ' NH2' ' O ' ' H' ' 221' ' ' ASP . 28.8 mtp85 -115.52 -179.68 3.71 Favored 'General case' 0 C--N 1.287 -2.128 1 C-N-CA 132.302 4.241 . . . . 38.45 115.121 -176.173 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 188' ' ' GLY . . . . . . . . . . . . . . . 121.83 157.05 9.89 Favored Glycine 0 N--CA 1.414 -2.793 0 C-N-CA 126.905 2.193 . . . . 27.82 112.444 175.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 189' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -176.41 171.68 2.35 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-N 111.021 -2.59 . . . . 28.25 106.291 -178.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 190' ' ' ALA . . . . . . . . . . . . . . . -82.15 168.57 17.57 Favored 'General case' 0 CA--C 1.565 1.523 1 O-C-N 129.525 4.266 . . . . 23.36 102.954 173.31 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 191' ' ' CYS . . . . . . . . . . . . . 7.4 t -155.5 175.39 13.95 Favored 'General case' 0 C--N 1.289 -2.054 0 N-CA-C 107.8 -1.185 . . . . 28.02 107.8 178.813 -161.111 57.872 69.002 106.867 2.025 108.346 -179.15 -38.84 1 1 . 1 . 001 ecloud orig full ' H' H ' 192' ' ' GLU . . . . . . . . . . . . . 27.9 mp0 -51.16 136.3 24.24 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-O 113.713 -3.041 . . . . 39.71 110.426 -179.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 193' ' ' GLY . . . . . . . . . . . . . . . 99.67 -22.18 41.69 Favored Glycine 0 C--N 1.299 -1.473 1 CA-C-O 113.327 -4.04 . . . . 25.02 111.44 -177.635 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 194' ' ' ASP . . . . . 0.413 ' O ' ' C ' ' H' ' 195' ' ' SER . 81.7 m-20 -78.55 -29.43 46.37 Favored 'General case' 0 C--O 1.261 1.661 0 CA-C-O 124.491 2.091 . . . . 24.08 114.595 173.893 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 195' ' ' SER . . . . . 1.26 ' OG ' ' C ' ' H' ' 372' ' ' 00L . 7.7 m -27.5 134.38 0.03 OUTLIER 'General case' 0 C--O 1.207 -1.178 0 CA-C-O 126.744 3.164 . . . . 26.45 111.156 173.55 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 196' ' ' GLY . . . . . . . . . . . . . . . 77.24 6.5 86.34 Favored Glycine 0 N--CA 1.441 -1.025 0 C-N-CA 129.362 3.363 . . . . 23.11 114.729 174.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 197' ' ' GLY . . . . . . . . . . . . . . . -85.99 173.32 46.73 Favored Glycine 0 C--N 1.299 -1.487 0 N-CA-C 106.661 -2.575 . . . . 22.61 106.661 177.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 198' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_endo -87.89 148.72 7.05 Favored 'Trans proline' 0 N--CA 1.426 -2.446 0 N-CA-C 118.699 2.538 . . . . 22.81 118.699 -178.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 199' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -113.54 112.08 22.96 Favored 'General case' 0 CA--C 1.587 2.388 1 N-CA-C 99.035 -4.431 . . . . 20.07 99.035 168.97 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 200' ' ' VAL . . . . . . . . . . . . . 33.8 m -119.69 164.17 16.32 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.729 0 C-N-CA 116.613 -2.035 . . . . 19.92 105.875 -175.285 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 201' ' ' MET . . . . . . . . . . . . . 85.9 mtp -139.32 148.46 42.97 Favored 'General case' 0 C--N 1.294 -1.82 0 CA-C-N 112.755 -2.02 . . . . 23.91 105.985 179.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 202' ' ' LYS . . . . . . . . . . . . . 69.4 tttt -103.64 119.81 39.65 Favored 'General case' 0 C--N 1.279 -2.475 0 N-CA-C 106.545 -1.65 . . . . 22.44 106.545 178.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 203' ' ' SER . . . . . . . . . . . . . 17.6 t -72.18 135.52 82.27 Favored Pre-proline 0 N--CA 1.486 1.351 0 O-C-N 126.981 2.676 . . . . 22.78 110.136 178.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 204' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -79.89 -7.11 14.38 Favored 'Trans proline' 0 CA--C 1.553 1.428 0 CA-C-N 113.636 -1.237 . . . . 24.18 113.346 175.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 204' A PHE . . . . . . . . . . . . . 49.2 m-85 -86.72 -50.81 6.5 Favored 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 129.559 3.144 . . . . 26.84 112.047 -176.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 204' B ASN . . . . . 0.451 ' O ' ' CB ' ' H' ' 205' ' ' ASN . 0.1 OUTLIER -118.81 -3.5 10.76 Favored 'General case' 0 C--O 1.256 1.397 0 CA-C-O 116.092 -1.908 . . . . 28.46 115.217 -178.947 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 205' ' ' ASN . . . . . 0.451 ' CB ' ' O ' ' H' ' 204' B ASN 0.39 0.7 OUTLIER 67.9 17.72 9.64 Favored 'General case' 0 CA--C 1.502 -0.874 0 N-CA-C 117.658 2.466 . . . . 35.88 117.658 178.221 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' H' H ' 206' ' ' ARG . . . . . . . . . . . . . 76.8 mtt-85 -95.45 159.56 14.94 Favored 'General case' 0 C--O 1.261 1.702 0 O-C-N 125.759 1.912 . . . . 29.18 108.634 -178.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 207' ' ' TRP . . . . . . . . . . . . . 76.7 m95 -100.89 131.38 46.8 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 127.747 3.154 . . . . 21.56 104.516 179.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 208' ' ' TYR . . . . . . . . . . . . 0.287 36.8 m-85 -118.83 142.09 48.05 Favored 'General case' 0 N--CA 1.504 2.237 1 O-C-N 129.534 4.272 . . . . 26.66 109.019 -178.793 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' H' H ' 209' ' ' GLN . . . . . . . . . . . . . 46.1 tt0 -89.6 114.44 26.03 Favored 'General case' 0 C--N 1.293 -1.876 0 N-CA-C 107.907 -1.145 . . . . 20.25 107.907 176.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 210' ' ' MET . . . . . . . . . . . . . 41.2 mmm -94.28 -26.26 16.68 Favored 'General case' 0 C--O 1.246 0.895 0 CA-C-O 116.346 -1.787 . . . . 30.19 112.914 176.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 211' ' ' GLY . . . . . . . . . . . . . . . -145.09 170.69 26.45 Favored Glycine 0 CA--C 1.485 -1.802 0 CA-C-O 124.959 2.422 . . . . 19.52 115.024 -176.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 212' ' ' ILE . . . . . . . . . . . . . 63.2 mt -128.93 131.14 68.49 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.313 0 N-CA-C 103.147 -2.909 . . . . 18.7 103.147 177.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 213' ' ' VAL . . . . . . . . . . . . . 47.7 t -56.74 122.91 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 N-CA-C 106.534 -1.654 . . . . 18.25 106.534 176.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 214' ' ' SER . . . . . . . . . . . . . 22.8 t -117.01 -60.27 1.86 Allowed 'General case' 0 C--O 1.256 1.417 0 O-C-N 116.847 -3.658 . . . . 21.95 115.775 -176.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 215' ' ' TRP . . . . . . . . . . . . . 62.8 p-90 -159.06 171.39 20.07 Favored 'General case' 0 C--N 1.301 -1.543 0 CA-C-O 124.808 2.242 . . . . 21.8 112.2 -176.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 216' ' ' GLY . . . . . . . . . . . . . . . -178.61 -178.09 47.7 Favored Glycine 0 CA--C 1.534 1.262 0 CA-C-N 111.98 -2.373 . . . . 26.59 107.898 177.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 217' ' ' GLU . . . . . 0.476 ' N ' ' O ' ' H' ' 462' ' ' HOH . 31.0 mt-10 -130.2 102.57 6.28 Favored 'General case' 0 N--CA 1.509 2.517 0 CA-C-N 113.127 -1.537 . . . . 35.35 107.386 -178.633 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 219' ' ' GLY . . . . . . . . . . . . . . . 79.51 -162.66 47.68 Favored Glycine 1 N--CA 1.518 4.102 1 N-CA-C 103.081 -4.007 . . . . 29.14 103.081 -172.8 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' H' H ' 220' ' ' CYS . . . . . . . . . . . . . 3.7 m -147.43 132.6 18.35 Favored 'General case' 0 C--N 1.274 -2.71 0 C-N-CA 129.658 3.183 . . . . 30.84 106.501 178.561 -38.84 -179.15 69.002 108.346 2.025 106.867 57.872 -161.111 1 1 . 1 . 001 ecloud orig full ' H' H ' 221' ' ' ASP . . . . . 0.846 ' O ' ' NH2' ' H' ' 187' ' ' ARG . 27.3 t0 52.35 33.51 13.05 Favored 'General case' 0 C--O 1.272 2.271 0 C-N-CA 128.339 2.655 . . . . 32.32 114.438 178.39 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 221' A ARG . . . . . 0.401 ' NH2' ' OE2' ' H' ' 146' ' ' GLU . 7.6 mtt85 -78.13 147.31 34.66 Favored 'General case' 0 C--O 1.258 1.51 0 O-C-N 124.014 0.822 . . . . 42.08 110.146 175.402 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 222' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -66.51 142.52 57.5 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 118.056 -1.457 . . . . 45.51 107.125 178.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 223' ' ' GLY . . . . . . . . . . . . . . . 66.51 10.1 52.73 Favored Glycine 0 N--CA 1.43 -1.759 0 C-N-CA 128.814 3.102 . . . . 32.67 116.559 -179.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 224' ' ' LYS . . . . . . . . . . . . . 54.8 mmtt -113.26 146.19 39.77 Favored 'General case' 0 C--N 1.309 -1.153 0 C-N-CA 126.61 1.964 . . . . 34.64 109.296 174.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 225' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -128.41 154.55 45.92 Favored 'General case' 0 N--CA 1.434 -1.225 0 C-N-CA 128.301 2.64 . . . . 25.71 113.301 -176.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 226' ' ' GLY . . . . . . . . . . . . . . . -81.84 148.46 27.37 Favored Glycine 0 N--CA 1.493 2.439 0 N-CA-C 105.717 -2.953 . . . . 23.02 105.717 177.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 227' ' ' PHE . . . . . . . . . . . . . 47.9 m-85 -120.38 131.47 54.84 Favored 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 126.014 1.726 . . . . 21.43 108.717 179.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 228' ' ' TYR . . . . . . . . . . . . 0.353 98.8 m-85 -123.88 149.95 45.22 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 114.885 -2.483 . . . . 22.36 110.802 -177.094 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 229' ' ' THR . . . . . . . . . . . . . 8.7 m -69.97 129.56 39.82 Favored 'General case' 0 C--O 1.285 2.959 0 O-C-N 128.146 3.404 . . . . 22.47 107.436 174.002 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 230' ' ' HIS . . . . . . . . . . . . 0.294 29.7 t-80 -81.19 94.3 6.64 Favored 'General case' 0 C--N 1.277 -2.563 0 CA-C-N 122.622 2.465 . . . . 23.98 109.439 178.422 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 231' ' ' VAL . . . . . . . . . . . . . 61.3 t -52.94 -50.54 43.59 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.26 0 C-N-CA 129.004 2.921 . . . . 22.51 110.591 -176.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 232' ' ' PHE . . . . . . . . . . . . . 70.3 t80 -58.19 -40.36 81.35 Favored 'General case' 0 C--O 1.271 2.199 0 O-C-N 126.799 2.562 . . . . 29.32 111.743 -179.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 233' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.98 -23.27 66.3 Favored 'General case' 0 CA--C 1.508 -0.667 0 O-C-N 119.536 -1.978 . . . . 39.95 111.626 177.606 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 234' ' ' LEU . . . . . . . . . . . . . 13.6 mt -104.89 7.59 34.39 Favored 'General case' 0 CA--C 1.502 -0.88 0 CA-C-N 120.85 1.659 . . . . 29.56 115.212 178.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 235' ' ' LYS . . . . . . . . . . . . . 13.0 tttm -59.3 -36.15 75.09 Favored 'General case' 0 C--O 1.266 1.922 0 N-CA-C 114.414 1.264 . . . . 36.48 114.414 -176.285 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 236' ' ' LYS . . . . . . . . . . . . . 27.0 mttt -57.38 -47.26 82.16 Favored 'General case' 0 C--O 1.248 1.024 0 C-N-CA 118.006 -1.477 . . . . 50.0 108.168 179.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 237' ' ' TRP . . . . . 0.49 ' O ' ' CG1' ' H' ' 241' ' ' VAL . 71.4 t90 -60.76 -36.1 78.09 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 114.872 -2.731 . . . . 32.36 109.689 -176.921 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 238' ' ' ILE . . . . . . . . . . . . . 15.0 mt -66.99 -53.32 35.09 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.868 0 CA-C-N 115.877 -0.602 . . . . 33.07 112.192 -179.242 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 239' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -47.54 -58.39 4.28 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-O 127.222 3.391 . . . . 50.0 105.798 178.389 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 240' ' ' LYS . . . . . . . . . . . . . 1.5 tttt -43.45 -58.33 2.65 Favored 'General case' 0 C--O 1.273 2.33 0 CA-C-N 110.109 -3.223 . . . . 50.0 115.93 179.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 241' ' ' VAL . . . . . 0.49 ' CG1' ' O ' ' H' ' 237' ' ' TRP . 1.9 m -68.77 -27.33 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 CA-C-N 123.853 3.024 . . . . 40.84 112.827 -177.468 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 242' ' ' ILE . . . . . . . . . . . . 0.327 52.2 mt -68.75 -35.32 69.23 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 CA-C-O 116.791 -1.576 . . . . 44.57 109.938 -178.959 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 243' ' ' ASP . . . . . . . . . . . . 0.361 2.0 p-10 -81.39 -35.96 30.14 Favored 'General case' 0 C--O 1.262 1.729 0 CA-C-O 113.405 -3.188 . . . . 50.0 114.434 176.392 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 244' ' ' GLN . . . . . 0.678 ' CG ' ' CE2' ' H' ' 245' ' ' PHE . 2.7 tt0 -65.47 -52.08 55.53 Favored 'General case' 0 C--N 1.298 -1.635 0 CA-C-O 124.889 2.28 . . . . 50.0 108.023 178.751 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 245' ' ' PHE . . . . . 0.678 ' CE2' ' CG ' ' H' ' 244' ' ' GLN . 56.4 m-85 -92.46 1.41 57.26 Favored 'General case' 0 C--O 1.26 1.656 0 N-CA-C 118.388 2.736 . . . . 50.0 118.388 -173.775 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 246' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.291 3.659 1 CA-C-O 112.954 -4.248 . . . . 50.0 113.074 175.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 55' ' ' ASP . . . . . . . . . . . . 0.283 4.9 p-10 . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 121.273 0.559 . . . . 50.0 109.569 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 56' ' ' PHE . . . . . . . . . . . . . 36.2 m-85 -81.54 124.95 29.92 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.067 -0.97 . . . . 48.5 108.916 -179.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 57' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -64.86 139.94 58.81 Favored 'General case' 0 C--O 1.251 1.175 0 N-CA-C 103.423 -2.806 . . . . 50.0 103.423 174.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 58' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -57.08 144.09 35.91 Favored 'General case' 0 C--O 1.269 2.096 0 CA-C-N 111.667 -2.515 . . . . 50.0 108.668 -178.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 59' ' ' ILE . . . . . . . . . . . . . 8.2 pt -107.2 158.75 32.28 Favored Pre-proline 0 N--CA 1.476 0.864 0 O-C-N 126.906 2.629 . . . . 48.8 108.809 178.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 60' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -62.6 125.41 16.07 Favored 'Trans proline' 0 C--O 1.251 1.135 1 C-N-CA 125.947 4.431 . . . . 49.89 114.705 177.458 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' I' I ' 61' ' ' GLU . . . . . 0.485 ' C ' ' N ' ' I' ' 63' ' ' TYS . . . -44.34 -36.25 2.72 Favored 'General case' 0 N--CA 1.436 -1.152 0 C-N-CA 127.553 2.341 . . . . 50.0 115.289 -177.703 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' I' I ' 62' ' ' GLU . . . . . 0.551 ' N ' ' OE1' ' I' ' 62' ' ' GLU . 20.9 pm0 -61.18 -10.09 5.97 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 116.363 -2.135 . . . . 50.0 106.406 -177.73 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' I' I ' 63' ' ' TYS . . . . . 0.485 ' N ' ' C ' ' I' ' 61' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 64' ' ' LEU . . . . . . . . . . . . 0.309 13.2 mt . . . . . 0 C--O 1.291 3.281 1 CA-C-O 111.577 -4.059 . . . . 50.0 110.496 177.596 . . . . . . . . 2 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 ' H' H ' 372' ' ' 00L . . . . . 1.26 ' C ' ' OG ' ' H' ' 195' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 443' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 454' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 477' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 484' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 485' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 ' 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 ' 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 ' 420' ' ' 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 ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 426' ' ' 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 ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 431' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 ' 437' ' ' 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 ' 444' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 445' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 446' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 447' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 448' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 453' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 455' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 456' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 457' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 458' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 ' 462' ' ' HOH . . . . . 0.476 ' O ' ' N ' ' H' ' 217' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 463' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 464' ' ' 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 ' 467' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 468' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 469' ' ' 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 ' 478' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 479' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 480' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 481' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 482' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 483' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 486' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 487' ' ' 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 ' 496' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 497' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 498' ' ' HOH . . . . . 0.657 ' O ' ' NH1' ' H' ' 175' ' ' 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 ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 518' ' ' HOH . . . . . 0.469 ' O ' ' NE2' ' H' ' 151' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 ' 523' ' ' 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 ' 531' ' ' 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 ' I' I ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 1' B ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.512 0 N-CA-C 107.396 -1.335 . . . . 42.45 107.396 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 1' A ASP . . . . . 0.486 ' OD2' ' HE2' ' L' ' 9' ' ' LYS . 1.7 t70 -105.07 8.39 34.26 Favored 'General case' 0 CA--C 1.56 1.328 0 O-C-N 125.821 1.95 . . . . 45.4 111.061 175.038 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 1' ' ' CYS . . . . . . . . . . . . . 12.2 p -49.9 143.0 8.25 Favored 'General case' 0 C--O 1.25 1.104 0 CA-C-O 124.302 2.001 . . . . 29.3 113.584 -178.086 77.799 70.48 100.482 108.299 2.008 105.293 -54.818 -62.448 1 1 . 1 . 001 ecloud build full ' L' L ' 2' ' ' GLY . . . . . . . . . . . . . . . 67.6 6.1 40.71 Favored Glycine 0 C--O 1.253 1.296 0 CA-C-O 114.082 -3.621 . . . . 24.49 116.506 173.202 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 3' ' ' LEU . . . . . 0.403 HD22 ' O ' ' H' ' 535' ' ' HOH . 23.5 mt -106.04 110.17 22.36 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 103.651 -2.722 . . . . 22.6 103.651 175.759 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 4' ' ' ARG . . . . . 0.435 ' HB2' ' OE1' ' L' ' 8' ' ' GLU . 53.6 mtm180 -75.04 127.0 87.5 Favored Pre-proline 0 N--CA 1.494 1.746 0 CA-C-N 112.804 -1.998 . . . . 22.28 113.661 -175.396 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 5' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -48.54 -41.08 37.4 Favored 'Trans proline' 0 CA--C 1.479 -2.253 0 CA-C-O 117.273 -1.22 . . . . 25.51 113.939 178.185 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 6' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -97.39 5.37 49.9 Favored 'General case' 0 CA--C 1.488 -1.419 0 CA-C-N 122.895 2.589 . . . . 24.26 114.838 -173.617 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 7' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -132.73 -91.75 0.38 Allowed 'General case' 0 C--O 1.278 2.557 0 O-C-N 125.753 1.908 . . . . 24.89 106.984 -179.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 8' ' ' GLU . . . . . 0.435 ' OE1' ' HB2' ' L' ' 4' ' ' ARG . 35.5 mp0 -45.31 -45.2 12.08 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 117.934 2.568 . . . . 23.2 117.934 -179.213 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 9' ' ' LYS . . . . . 0.486 ' HE2' ' OD2' ' L' ' 1' A ASP . 18.9 mttt -67.64 -18.52 64.98 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 126.24 1.816 . . . . 37.2 115.172 178.597 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 10' ' ' LYS . . . . . . . . . . . . . 76.9 mttt -112.09 -4.74 14.37 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 106.942 -1.503 . . . . 31.79 106.942 -179.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 11' ' ' SER . . . . . . . . . . . . . 39.6 t 62.03 37.31 14.91 Favored 'General case' 0 C--O 1.251 1.165 0 CA-C-O 125.542 2.592 . . . . 25.93 112.761 -175.661 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 12' ' ' LEU . . . . . . . . . . . . . 67.5 mt -104.52 146.93 28.19 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 106.37 -1.715 . . . . 26.41 106.37 172.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 13' ' ' GLU . . . . . . . . . . . . 0.344 54.0 mt-10 -111.3 142.76 43.11 Favored 'General case' 0 C--N 1.277 -2.548 0 CA-C-O 114.806 -2.521 . . . . 43.69 109.026 179.823 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' ' ' ASP . . . . . . . . . . . . 0.327 2.2 p30 -75.81 161.97 28.56 Favored 'General case' 0 C--N 1.305 -1.358 1 CA-C-O 132.531 5.919 . . . . 25.65 105.173 176.049 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' L' L ' 14' A LYS . . . . . 0.796 ' HB2' ' OE2' ' H' ' 23' ' ' GLU . 1.5 ttmt -53.0 -26.32 14.95 Favored 'General case' 0 C--N 1.305 -1.328 1 CA-C-N 107.719 -4.31 . . . . 43.88 110.109 -178.614 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' L' L ' 14' B THR . . . . . . . . . . . . . 80.4 p -135.67 6.47 3.21 Favored 'General case' 0 C--O 1.255 1.368 0 CA-C-O 112.905 -3.426 . . . . 28.52 112.088 -178.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 14' C GLU . . . . . . . . . . . . . 10.9 pt-20 -60.63 -26.91 67.38 Favored 'General case' 0 CA--C 1.486 -1.493 0 O-C-N 127.661 3.101 . . . . 27.57 113.307 -179.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 14' D ARG . . . . . 0.623 ' O ' ' HG3' ' L' ' 14' H GLU . 0.0 OUTLIER -63.39 -31.65 72.87 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 117.896 -3.003 . . . . 50.0 111.538 -176.334 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' L' L ' 14' E GLU . . . . . . . . . . . . . 36.8 tt0 -58.0 -42.36 85.05 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-O 122.687 1.232 . . . . 32.58 108.194 -179.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 14' F LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.1 -67.8 0.26 Allowed 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 112.78 -2.009 . . . . 28.57 108.121 175.748 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' G LEU . . . . . . . . . . . . 0.328 2.6 mt -50.24 -38.87 42.77 Favored 'General case' 0 CA--C 1.481 -1.69 0 N-CA-C 116.329 1.974 . . . . 34.48 116.329 -179.224 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' H GLU . . . . . 0.623 ' HG3' ' O ' ' L' ' 14' D ARG . 86.8 mt-10 -68.0 -14.67 63.15 Favored 'General case' 0 C--O 1.268 2.04 0 CA-C-O 117.325 -1.322 . . . . 42.08 113.288 179.924 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' I SER . . . . . 0.945 ' C ' ' H ' ' L' ' 14' K ILE . 53.3 p -90.03 -24.37 21.21 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 127.417 2.948 . . . . 33.38 113.704 -178.798 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' J TYR . . . . . 1.101 ' C ' HG13 ' L' ' 14' K ILE . 7.5 m-30 -75.58 25.57 0.11 Allowed 'General case' 0 N--CA 1.49 1.574 0 CA-C-O 127.905 3.717 . . . . 39.3 101.3 -179.004 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' K ILE . . . . . 1.101 HG13 ' C ' ' L' ' 14' J TYR 0.435 0.3 OUTLIER . . . . . 0 N--CA 1.505 2.293 2 CA-C-O 132.686 5.993 . . . . 46.58 110.354 -172.852 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' H' H ' 16' ' ' ILE . . . . . 0.426 HD13 ' HA ' ' H' ' 190' ' ' ALA . 27.8 mm . . . . . 0 N--CA 1.44 -0.951 0 CA-C-O 115.812 -2.042 . . . . 23.12 107.804 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 17' ' ' VAL . . . . . 0.616 ' O ' ' HA2' ' H' ' 188' ' ' GLY . 93.4 t -115.08 124.44 71.71 Favored 'Isoleucine or valine' 0 C--O 1.268 2.048 0 CA-C-O 113.989 -2.91 . . . . 28.88 111.188 -179.32 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 18' ' ' GLU . . . . . 0.615 ' HG3' ' HB2' ' H' ' 187' ' ' ARG . 66.7 mm-40 67.61 36.63 3.62 Favored 'General case' 0 C--N 1.318 -0.786 0 O-C-N 128.162 3.414 . . . . 45.53 111.426 179.22 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 19' ' ' GLY . . . . . . . . . . . . . . . -103.51 -155.9 24.45 Favored Glycine 0 CA--C 1.538 1.482 1 O-C-N 131.347 5.404 . . . . 31.91 108.764 179.445 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 20' ' ' SER . . . . . . . . . . . . . 2.7 p -154.11 160.42 41.93 Favored 'General case' 0 N--CA 1.503 2.219 0 CA-C-O 114.998 -2.429 . . . . 41.27 106.211 178.424 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 21' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -61.03 143.17 55.87 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 126.05 2.094 . . . . 34.99 107.53 -179.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 22' ' ' ALA . . . . . . . . . . . . 0.286 . . -75.8 159.63 30.83 Favored 'General case' 0 C--N 1.29 -1.985 0 N-CA-C 106.05 -1.833 . . . . 29.65 106.05 176.868 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 23' ' ' GLU . . . . . 0.796 ' OE2' ' HB2' ' L' ' 14' A LYS . 31.0 mt-10 -82.96 161.98 21.63 Favored 'General case' 0 C--O 1.26 1.638 0 C-N-CA 125.404 1.481 . . . . 34.6 107.962 172.189 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 24' ' ' ILE . . . . . . . . . . . . . 4.6 mm -65.08 140.36 19.86 Favored 'Isoleucine or valine' 0 C--O 1.246 0.918 0 N-CA-C 108.228 -1.027 . . . . 26.11 108.228 -179.546 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.92 21.12 55.11 Favored Glycine 0 C--N 1.279 -2.598 0 C-N-CA 126.897 2.189 . . . . 23.49 114.466 -178.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 26' ' ' MET . . . . . . . . . . . . . 3.7 ttt -74.35 -28.8 61.3 Favored 'General case' 0 C--O 1.262 1.751 0 O-C-N 119.59 -2.124 . . . . 26.79 113.979 -179.099 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 27' ' ' SER . . . . . . . . . . . . . 46.7 m -139.97 71.21 35.35 Favored Pre-proline 0 C--O 1.262 1.728 0 C-N-CA 130.374 3.47 . . . . 26.25 109.957 179.04 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 28' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -68.34 -0.61 6.0 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 O-C-N 123.167 1.088 . . . . 19.21 114.22 -178.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 29' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -99.16 -11.08 21.69 Favored 'General case' 0 C--O 1.242 0.681 0 O-C-N 118.917 -2.364 . . . . 21.67 108.411 179.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 30' ' ' GLN . . . . . . . . . . . . . 29.3 tp60 -62.08 129.8 42.52 Favored 'General case' 0 C--O 1.244 0.787 0 O-C-N 128.801 3.813 . . . . 27.29 110.881 178.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 31' ' ' VAL . . . . . 0.458 HG12 ' N ' ' H' ' 32' ' ' MET . 78.5 t -126.17 153.64 34.67 Favored 'Isoleucine or valine' 0 C--O 1.256 1.43 0 C-N-CA 125.752 1.621 . . . . 24.43 111.231 -176.967 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 32' ' ' MET . . . . . 0.572 ' HG3' ' CD1' ' H' ' 40' ' ' LEU . 49.0 ttm -114.44 127.33 55.77 Favored 'General case' 0 C--N 1.307 -1.273 0 N-CA-C 107.34 -1.356 . . . . 28.74 107.34 179.901 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 33' ' ' LEU . . . . . 0.437 HD23 ' HA ' ' H' ' 33' ' ' LEU 0.318 0.2 OUTLIER -89.59 112.04 23.14 Favored 'General case' 0 N--CA 1.511 2.617 0 O-C-N 128.236 3.46 . . . . 37.12 104.463 176.602 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' H' H ' 34' ' ' PHE . . . . . 0.486 ' HE1' ' CD2' ' I' ' 56' ' ' PHE . 50.7 t80 -127.59 132.9 49.75 Favored 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 115.306 -2.557 . . . . 33.15 112.282 -172.425 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 35' ' ' ARG . . . . . 0.685 ' O ' ' HA ' ' H' ' 38' ' ' GLN . 59.2 ttt180 -81.95 131.61 35.25 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 111.994 -2.366 . . . . 45.59 110.642 -179.342 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 36' ' ' LYS . . . . . 0.621 ' HE2' HD13 ' H' ' 65' ' ' LEU . 27.3 mttt -64.18 -40.75 96.77 Favored 'General case' 0 C--O 1.255 1.342 0 C-N-CA 126.41 1.884 . . . . 46.87 114.071 -179.679 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 36' A SER . . . . . . . . . . . . 0.321 0.6 OUTLIER -158.62 111.84 1.65 Allowed Pre-proline 0 C--O 1.272 2.272 0 CA-C-N 113.759 -1.564 . . . . 50.0 114.649 -175.459 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 37' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -64.22 159.76 68.04 Favored 'Cis proline' 0 C--N 1.293 -2.394 0 N-CA-C 105.423 -2.568 . . . . 47.04 105.423 -2.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 38' ' ' GLN . . . . . 0.685 ' HA ' ' O ' ' H' ' 35' ' ' ARG . 17.3 mt-30 -81.67 118.38 22.78 Favored 'General case' 0 N--CA 1.488 1.441 0 CA-C-O 113.057 -3.354 . . . . 47.51 103.091 -177.418 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 39' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -161.47 152.81 18.71 Favored 'General case' 0 C--N 1.307 -1.27 0 O-C-N 128.978 3.924 . . . . 49.84 112.448 -179.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 40' ' ' LEU . . . . . 0.572 ' CD1' ' HG3' ' H' ' 32' ' ' MET . 7.2 tp -73.44 129.66 38.47 Favored 'General case' 0 CA--C 1.555 1.171 0 N-CA-C 105.024 -2.213 . . . . 38.06 105.024 176.49 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 41' ' ' LEU . . . . . 0.799 ' O ' ' H2X' ' H' ' 372' ' ' 00L . 0.3 OUTLIER -99.33 -57.6 2.12 Favored 'General case' 0 C--N 1.294 -1.815 1 O-C-N 131.105 5.253 . . . . 33.55 111.38 178.292 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' H' H ' 42' ' ' CYS . . . . . . . . . . . . 0.337 1.3 m -163.37 174.05 12.45 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 123.71 0.631 . . . . 28.66 109.67 -178.167 -94.303 -155.108 -87.412 101.979 2.04 99.781 -87.907 -70.153 2 2 . 1 . 001 ecloud build full ' H' H ' 43' ' ' GLY . . . . . . . . . . . . . . . -89.94 178.52 43.71 Favored Glycine 0 CA--C 1.544 1.899 0 N-CA-C 107.756 -2.138 . . . . 24.52 107.756 170.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 44' ' ' ALA . . . . . . . . . . . . . . . -170.13 176.88 4.44 Favored 'General case' 0 C--O 1.271 2.222 0 N-CA-C 105.104 -2.184 . . . . 23.67 105.104 -179.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 45' ' ' SER . . . . . . . . . . . . . 30.0 p -137.63 141.73 41.21 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 125.965 2.041 . . . . 25.04 110.884 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 46' ' ' LEU . . . . . . . . . . . . . 43.0 tp -87.73 120.65 29.26 Favored 'General case' 0 C--O 1.257 1.469 0 CA-C-O 115.542 -2.171 . . . . 24.43 107.847 -177.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 47' ' ' ILE . . . . . . . . . . . . . 14.5 pt -109.79 -8.72 11.45 Favored 'Isoleucine or valine' 0 C--O 1.254 1.302 0 CA-C-N 120.574 1.533 . . . . 24.5 113.131 -177.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 48' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -167.95 -178.42 3.76 Favored 'General case' 0 C--O 1.292 3.295 0 CA-C-O 113.934 -2.936 . . . . 30.5 103.689 178.423 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 49' ' ' ASP . . . . . 0.541 ' N ' ' OD1' ' H' ' 49' ' ' ASP . 19.2 p-10 -80.13 -3.24 48.03 Favored 'General case' 0 N--CA 1.486 1.35 0 CA-C-O 113.695 -3.05 . . . . 38.06 113.795 -177.444 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 50' ' ' ARG . . . . . 0.985 ' NH2' ' O ' ' H' ' 109' ' ' LYS . 5.5 mtp180 -125.25 -4.08 7.39 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 127.83 3.206 . . . . 46.08 112.257 -179.49 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 51' ' ' TRP . . . . . . . . . . . . . 89.3 m95 -119.94 133.8 55.45 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 127.124 2.765 . . . . 34.29 115.776 -177.123 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 52' ' ' VAL . . . . . . . . . . . . . 24.2 t -118.99 138.8 48.55 Favored 'Isoleucine or valine' 0 C--O 1.246 0.912 0 CA-C-O 116.802 -1.571 . . . . 26.69 109.345 173.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 53' ' ' LEU . . . . . . . . . . . . . 22.3 tp -109.33 131.86 54.66 Favored 'General case' 0 C--N 1.286 -2.159 1 C-N-CA 134.94 5.296 . . . . 23.76 107.868 -178.853 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 54' ' ' THR . . . . . . . . . . . . . 2.4 t -147.03 178.78 8.09 Favored 'General case' 0 C--O 1.255 1.356 0 O-C-N 128.465 3.603 . . . . 23.3 110.699 -179.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 55' ' ' ALA . . . . . . . . . . . . . . . -84.9 129.39 34.81 Favored 'General case' 0 C--O 1.27 2.15 0 N-CA-C 105.122 -2.177 . . . . 21.98 105.122 175.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.51 -33.39 65.97 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 126.031 2.082 . . . . 21.13 110.878 -179.91 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 57' ' ' HIS . . . . . . . . . . . . . 1.5 p-80 -67.05 -15.31 63.64 Favored 'General case' 0 C--N 1.278 -2.514 0 C-N-CA 120.06 -0.656 . . . . 22.68 112.665 -177.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 58' ' ' CYS . . . . . . . . . . . . . 91.4 m -71.39 -21.82 61.96 Favored 'General case' 0 C--O 1.261 1.701 0 O-C-N 117.919 -2.988 . . . . 24.46 110.02 176.033 -70.153 -87.907 -87.412 99.781 2.04 101.979 -155.108 -94.303 1 1 . 1 . 001 ecloud build full ' H' H ' 59' ' ' LEU . . . . . 0.644 HD22 HD13 ' H' ' 88' ' ' ILE . 36.2 mt -103.36 -39.51 6.76 Favored 'General case' 0 C--O 1.244 0.782 0 N-CA-C 114.249 1.203 . . . . 29.45 114.249 -177.205 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 60' ' ' LEU . . . . . . . . . . . . . 7.6 tp -138.86 117.69 12.36 Favored 'General case' 0 C--O 1.202 -1.403 0 O-C-N 127.219 2.825 . . . . 26.87 111.542 -174.345 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' A TYR . . . . . . . . . . . . . 16.7 t80 -155.97 84.67 3.32 Favored Pre-proline 0 C--N 1.369 1.442 0 CA-C-N 110.018 -3.265 . . . . 27.61 107.736 179.026 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' B PRO . . . . . 0.409 ' N ' ' CD ' ' H' ' 60' C PRO . 74.5 Cg_exo -52.33 -43.73 51.8 Favored 'Trans proline' 0 N--CA 1.496 1.638 0 C-N-CA 123.956 3.104 . . . . 26.71 115.619 -177.758 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 60' C PRO . . . . . 0.409 ' CD ' ' N ' ' H' ' 60' B PRO . 91.2 Cg_exo -47.15 -27.17 6.08 Favored 'Trans proline' 0 C--O 1.255 1.365 0 C-N-CA 122.826 2.351 . . . . 29.17 114.166 175.573 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 60' D TRP . . . . . . . . . . . . . 54.3 m0 -114.09 13.93 18.2 Favored 'General case' 0 C--O 1.242 0.692 0 CA-C-O 115.2 -2.333 . . . . 32.83 110.893 -179.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' E ASP . . . . . . . . . . . . . 41.1 m-20 63.01 33.25 14.95 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 127.622 3.076 . . . . 40.43 112.572 178.782 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' F LYS . . . . . . . . . . . . . 7.2 tttt -103.87 114.39 28.6 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 124.798 1.311 . . . . 34.94 111.934 -179.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' G ASN . . . . . . . . . . . . . 55.8 t-20 -144.6 76.11 1.48 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 124.714 1.259 . . . . 42.02 108.942 176.019 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' H PHE . . . . . . . . . . . . . 65.9 m-85 -85.46 145.7 27.3 Favored 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 115.572 -2.451 . . . . 36.01 113.165 -175.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' I THR . . . . . . . . . . . . . 73.0 p -109.65 170.79 7.84 Favored 'General case' 0 N--CA 1.485 1.289 0 CA-C-O 125.341 2.496 . . . . 37.69 109.301 173.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 61' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -47.19 -37.72 10.69 Favored 'General case' 0 C--O 1.294 3.435 0 O-C-N 119.237 -2.164 . . . . 46.26 116.193 179.015 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 62' ' ' ASN . . . . . 0.409 ' O ' ' HE3' ' H' ' 36' ' ' LYS . 0.1 OUTLIER -80.43 -11.04 59.74 Favored 'General case' 0 C--N 1.306 -1.287 1 O-C-N 115.961 -4.212 . . . . 50.0 112.589 -179.495 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' H' H ' 63' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -75.04 -28.68 60.52 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 115.733 -2.079 . . . . 46.12 110.689 -178.173 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 64' ' ' LEU . . . . . 0.656 ' CD2' ' CD2' ' H' ' 41' ' ' LEU . 0.5 OUTLIER -121.79 160.05 25.42 Favored 'General case' 0 C--N 1.325 -0.498 1 CA-C-O 132.137 5.732 . . . . 38.21 120.659 -174.636 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' H' H ' 65' ' ' LEU . . . . . 0.621 HD13 ' HE2' ' H' ' 36' ' ' LYS . 0.1 OUTLIER -129.95 137.28 50.25 Favored 'General case' 0 C--N 1.317 -0.847 1 CA-C-N 106.78 -4.736 . . . . 34.91 107.689 178.26 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' H' H ' 66' ' ' VAL . . . . . 0.586 HG13 HD21 ' H' ' 85' ' ' LEU . 17.9 m -109.97 132.09 59.19 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 N-CA-C 104.791 -2.3 . . . . 32.08 104.791 174.365 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 67' ' ' ARG . . . . . . . . . . . . . 63.7 mtp180 -116.04 114.37 24.47 Favored 'General case' 0 C--N 1.285 -2.197 0 C-N-CA 128.029 2.532 . . . . 30.46 109.196 -179.279 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 68' ' ' ILE . . . . . . . . . . . . . 7.0 mt -112.28 143.93 21.05 Favored 'Isoleucine or valine' 0 C--O 1.248 1.015 0 C-N-CA 125.931 1.692 . . . . 27.91 113.535 -178.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 69' ' ' GLY . . . . . . . . . . . . . . . 87.34 21.08 50.18 Favored Glycine 0 C--O 1.248 1.016 0 O-C-N 125.154 1.534 . . . . 26.4 115.892 177.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 70' ' ' LYS . . . . . 0.503 ' HE3' ' O ' ' H' ' 72' ' ' SER . 11.8 mtpp -88.73 159.82 17.61 Favored 'General case' 0 CA--C 1.507 -0.708 0 CA-C-O 123.597 1.665 . . . . 29.73 111.373 -174.868 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 71' ' ' HIS . . . . . . . . . . . . . 75.7 t60 -133.78 -48.97 0.82 Allowed 'General case' 0 N--CA 1.493 1.723 1 CA-C-N 107.544 -4.389 . . . . 27.64 105.641 176.22 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 72' ' ' SER . . . . . 0.503 ' O ' ' HE3' ' H' ' 70' ' ' LYS . 28.3 t -76.48 132.56 39.67 Favored 'General case' 0 C--O 1.243 0.736 0 CA-C-N 110.485 -3.052 . . . . 31.88 107.464 -178.144 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 73' ' ' ARG . . . . . . . . . . . . . 43.1 ttp85 -65.08 -46.86 79.38 Favored 'General case' 0 C--O 1.262 1.727 0 O-C-N 127.563 3.039 . . . . 33.82 114.428 177.236 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 74' ' ' THR . . . . . . . . . . . . . 72.0 p -106.17 -32.28 8.29 Favored 'General case' 0 C--O 1.264 1.818 0 N-CA-C 119.637 3.199 . . . . 34.58 119.637 -177.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 75' ' ' ARG . . . . . . . . . . . . 0.309 26.1 mtt85 -63.39 139.44 58.77 Favored 'General case' 0 C--N 1.297 -1.675 0 CA-C-O 125.781 2.705 . . . . 50.0 114.709 179.657 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 76' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -83.63 90.66 7.31 Favored 'General case' 0 C--O 1.256 1.423 1 O-C-N 114.673 -5.017 . . . . 38.59 107.64 177.726 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 77' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -63.93 67.39 0.02 OUTLIER 'General case' 0 C--N 1.309 -1.17 0 N-CA-C 118.833 2.901 . . . . 31.24 118.833 -174.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 77' A ARG . . . . . . . . . . . . . 35.0 ttp85 -44.57 123.83 3.85 Favored 'General case' 0 C--O 1.26 1.61 1 C-N-CA 133.401 4.681 . . . . 32.47 111.272 179.752 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 78' ' ' ASN . . . . . . . . . . . . . 11.0 m-20 75.08 -2.52 2.82 Favored 'General case' 0 C--O 1.252 1.206 0 O-C-N 125.006 1.442 . . . . 35.41 112.531 -178.1 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 79' ' ' ILE . . . . . 0.429 HG23 ' CD2' ' H' ' 117' ' ' TYR . 1.7 mt -109.24 -59.13 3.42 Favored 'Isoleucine or valine' 0 C--O 1.276 2.499 0 O-C-N 118.392 -2.693 . . . . 31.35 112.249 175.736 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 80' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -82.48 146.52 29.22 Favored 'General case' 0 C--O 1.268 2.061 0 CA-C-N 113.226 -1.807 . . . . 30.88 114.823 -177.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 81' ' ' LYS . . . . . . . . . . . . . 60.5 mmtt -116.27 128.46 55.6 Favored 'General case' 0 CA--C 1.556 1.2 0 CA-C-O 126.557 3.075 . . . . 48.29 109.192 175.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 82' ' ' ILE . . . . . . . . . . . . . 20.8 mt -106.57 110.05 30.19 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-O 114.903 -2.475 . . . . 35.88 111.758 -178.664 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 83' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -112.11 166.24 11.43 Favored 'General case' 0 CA--C 1.553 1.092 0 CA-C-O 127.903 3.716 . . . . 38.94 111.575 175.442 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 84' ' ' MET . . . . . . . . . . . . . 7.8 mtt -93.96 153.5 18.17 Favored 'General case' 0 N--CA 1.43 -1.444 1 C-N-CA 133.086 4.554 . . . . 46.21 106.923 175.053 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 85' ' ' LEU . . . . . 1.028 HD13 ' CE ' ' H' ' 106' ' ' MET . 4.2 mt -99.09 147.32 25.18 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 127.309 2.88 . . . . 38.35 105.558 179.402 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 86' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -97.29 -35.98 10.55 Favored 'General case' 0 C--N 1.293 -1.889 0 O-C-N 127.05 2.719 . . . . 48.12 107.223 173.786 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 87' ' ' LYS . . . . . 0.686 ' HB3' ' CE1' ' H' ' 89' ' ' TYR 0.386 4.6 mmtt -158.01 140.78 14.77 Favored 'General case' 0 C--O 1.262 1.753 0 N-CA-C 119.846 3.276 . . . . 43.74 119.846 -175.326 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 88' ' ' ILE . . . . . 0.644 HD13 HD22 ' H' ' 59' ' ' LEU . 5.8 mt -106.39 138.84 29.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 O-C-N 125.583 1.802 . . . . 37.24 109.677 171.796 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 89' ' ' TYR . . . . . 0.686 ' CE1' ' HB3' ' H' ' 87' ' ' LYS . 35.0 m-85 -130.48 112.05 12.85 Favored 'General case' 0 C--O 1.273 2.335 0 C-N-CA 129.8 3.24 . . . . 42.24 109.213 178.205 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 90' ' ' ILE . . . . . . . . . . . . . 43.1 mt -100.18 144.61 12.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 113.169 -1.832 . . . . 29.42 109.868 178.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 91' ' ' HIS . . . . . 0.46 ' CE1' ' HD3' ' H' ' 101' ' ' ARG . 41.0 t-80 -60.33 127.97 87.12 Favored Pre-proline 0 C--O 1.273 2.325 0 CA-C-O 125.113 2.387 . . . . 29.76 110.552 174.203 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 92' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -56.86 -31.91 90.43 Favored 'Trans proline' 0 N--CA 1.439 -1.714 0 C-N-CA 122.187 1.925 . . . . 30.84 114.158 -176.822 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 93' ' ' ARG . . . . . . . . . . . . . 23.0 mtp180 -106.72 29.37 7.04 Favored 'General case' 0 C--O 1.263 1.767 0 N-CA-C 115.825 1.787 . . . . 37.18 115.825 178.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 94' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -64.53 129.22 39.03 Favored 'General case' 0 N--CA 1.505 2.277 0 N-CA-C 103.098 -2.927 . . . . 25.36 103.098 175.109 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 95' ' ' ASN . . . . . . . . . . . . . 50.6 t-20 -101.72 84.47 2.57 Favored 'General case' 0 C--N 1.284 -2.259 0 C-N-CA 125.417 1.487 . . . . 32.21 112.394 -179.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 96' ' ' TRP . . . . . . . . . . . . . 52.1 p-90 -80.74 -3.0 49.26 Favored 'General case' 0 N--CA 1.489 1.478 0 CA-C-O 114.254 -2.784 . . . . 28.9 108.564 179.955 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 97' ' ' ARG . . . . . 0.809 ' HD2' ' O ' ' H' ' 500' ' ' HOH . 72.3 mtt-85 -84.2 -33.78 24.09 Favored 'General case' 0 C--O 1.265 1.904 0 O-C-N 126.514 2.384 . . . . 40.79 114.679 -177.234 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 97' A GLU . . . . . . . . . . . . . 58.1 tt0 -113.69 -66.1 1.12 Allowed 'General case' 0 C--O 1.27 2.166 0 CA-C-O 116.586 -1.673 . . . . 35.65 113.323 -177.656 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 98' ' ' ASN . . . . . . . . . . . . . 47.8 p-10 -136.43 21.08 3.15 Favored 'General case' 0 C--O 1.256 1.399 0 N-CA-C 117.314 2.339 . . . . 26.57 117.314 -168.316 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 99' ' ' LEU . . . . . . . . . . . . . 63.0 mt 60.53 28.75 18.43 Favored 'General case' 0 C--N 1.293 -1.888 0 C-N-CA 126.37 1.868 . . . . 26.33 109.205 -178.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 100' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -58.92 134.03 56.58 Favored 'General case' 0 C--N 1.292 -1.926 0 C-N-CA 125.027 1.331 . . . . 27.7 107.952 178.259 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 101' ' ' ARG . . . . . 0.46 ' HD3' ' CE1' ' H' ' 91' ' ' HIS . 48.9 mtt85 63.44 43.67 5.86 Favored 'General case' 0 N--CA 1.497 1.925 0 CA-C-O 121.929 0.871 . . . . 32.11 113.349 -175.743 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 102' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -76.99 78.98 3.53 Favored 'General case' 0 C--O 1.264 1.817 0 O-C-N 119.506 -1.997 . . . . 20.94 112.629 179.358 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 103' ' ' ILE . . . . . . . . . . . . . 13.3 tt -147.04 142.92 20.37 Favored 'Isoleucine or valine' 0 C--O 1.276 2.454 0 O-C-N 120.037 -1.664 . . . . 24.12 113.255 -176.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 104' ' ' ALA . . . . . . . . . . . . . . . -147.65 150.47 34.45 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-O 112.784 -3.484 . . . . 24.1 105.656 -179.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 105' ' ' LEU . . . . . . . . . . . . . 29.5 mt -112.82 147.65 36.52 Favored 'General case' 0 C--O 1.258 1.528 1 O-C-N 129.246 4.091 . . . . 27.73 106.85 173.63 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 106' ' ' MET . . . . . 1.028 ' CE ' HD13 ' H' ' 85' ' ' LEU . 70.8 mtp -129.32 127.75 41.75 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 126.055 2.097 . . . . 37.16 107.091 176.122 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 107' ' ' LYS . . . . . 0.838 ' HE2' ' NH1' ' H' ' 50' ' ' ARG . 33.6 tttt -100.14 124.78 45.95 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 127.919 2.488 . . . . 45.73 107.895 -177.921 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 108' ' ' LEU . . . . . 0.656 ' O ' ' NH2' ' H' ' 50' ' ' ARG . 71.9 mt -82.62 152.74 25.77 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 116.457 -2.097 . . . . 32.61 111.871 -174.975 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 109' ' ' LYS . . . . . 0.985 ' O ' ' NH2' ' H' ' 50' ' ' ARG 0.261 2.3 tptt -47.27 -48.17 24.81 Favored 'General case' 0 C--N 1.309 -1.166 0 O-C-N 127.681 3.113 . . . . 49.58 107.962 174.209 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 110' ' ' LYS . . . . . 0.485 ' HB3' ' HD2' ' H' ' 111' ' ' PRO . 2.1 mttm -143.46 158.88 56.58 Favored Pre-proline 0 N--CA 1.486 1.332 0 N-CA-C 108.613 -0.884 . . . . 50.0 108.613 -179.226 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 111' ' ' PRO . . . . . 0.485 ' HD2' ' HB3' ' H' ' 110' ' ' LYS . 8.3 Cg_endo -70.46 140.86 40.99 Favored 'Trans proline' 0 C--N 1.311 -1.43 0 N-CA-C 106.501 -2.154 . . . . 36.59 106.501 -179.71 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 112' ' ' VAL . . . . . . . . . . . . . 10.9 p -92.38 155.07 3.13 Favored 'Isoleucine or valine' 0 C--O 1.26 1.617 0 N-CA-C 105.724 -1.954 . . . . 35.62 105.724 179.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 113' ' ' ALA . . . . . . . . . . . . . . . -98.24 137.54 36.84 Favored 'General case' 0 N--CA 1.483 1.189 0 O-C-N 126.132 2.145 . . . . 34.23 108.479 178.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 114' ' ' PHE . . . . . 0.504 ' CD1' ' N ' ' H' ' 114' ' ' PHE . 13.0 m-30 -66.96 159.63 28.11 Favored 'General case' 0 C--N 1.315 -0.901 0 O-C-N 127.784 3.177 . . . . 29.05 110.405 176.868 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 115' ' ' SER . . . . . . . . . . . . . 32.6 p -168.92 -173.0 1.71 Allowed 'General case' 0 C--O 1.261 1.681 0 CA-C-O 116.357 -1.782 . . . . 31.87 106.303 -176.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 116' ' ' ASP . . . . . . . . . . . . . 66.8 m-20 -62.69 -31.4 72.29 Favored 'General case' 0 C--O 1.304 3.972 0 CA-C-N 119.837 1.198 . . . . 28.0 112.615 -179.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 117' ' ' TYR . . . . . 0.429 ' CD2' HG23 ' H' ' 79' ' ' ILE . 15.0 m-85 -97.9 -19.04 18.34 Favored 'General case' 0 C--N 1.299 -1.623 0 C-N-CA 127.906 2.482 . . . . 31.85 117.535 -177.421 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 118' ' ' ILE . . . . . . . . . . . . . 19.4 mt -121.57 111.11 29.77 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.079 1 C-N-CA 133.601 4.761 . . . . 23.77 114.623 -178.958 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 119' ' ' HIS . . . . . . . . . . . . . 31.8 t60 -160.98 139.63 7.46 Favored Pre-proline 0 C--O 1.254 1.292 0 N-CA-C 107.017 -1.475 . . . . 24.37 107.017 -175.014 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 120' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -74.92 155.97 43.33 Favored 'Trans proline' 0 C--O 1.25 1.108 0 C-N-CA 124.16 3.24 . . . . 23.36 115.685 -176.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 121' ' ' VAL . . . . . . . . . . . . . 12.2 p -99.51 161.39 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 N-CA-C 104.733 -2.321 . . . . 20.75 104.733 177.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 122' ' ' CYS . . . . . . . . . . . . . 70.9 m -91.65 147.36 23.06 Favored 'General case' 0 C--O 1.242 0.678 0 CA-C-N 118.169 0.441 . . . . 21.59 110.32 177.647 -62.448 -54.818 100.482 105.293 2.008 108.299 70.48 77.799 1 1 . 1 . 001 ecloud build full ' H' H ' 123' ' ' LEU . . . . . . . . . . . . . 22.0 mt -91.87 141.74 25.79 Favored Pre-proline 0 N--CA 1.491 1.605 0 N-CA-C 103.332 -2.84 . . . . 23.49 103.332 174.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 124' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -68.94 156.26 65.92 Favored 'Trans proline' 0 C--N 1.3 -2.004 0 CA-C-O 128.049 3.27 . . . . 27.08 111.854 179.177 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 125' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -111.83 161.45 16.34 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 102.417 -3.179 . . . . 39.83 102.417 175.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 126' ' ' ARG . . . . . 0.573 ' HA ' ' CZ ' ' H' ' 232' ' ' PHE . 1.0 OUTLIER -45.44 -44.47 12.23 Favored 'General case' 0 C--O 1.26 1.616 0 CA-C-O 115.728 -2.082 . . . . 50.0 114.081 179.273 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 127' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -85.89 -29.39 23.7 Favored 'General case' 0 C--O 1.265 1.906 0 CA-C-N 124.944 3.52 . . . . 50.0 112.687 -176.25 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 128' ' ' THR . . . . . . . . . . . . . 11.9 m -58.49 -45.3 89.01 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 103.993 -2.595 . . . . 37.41 103.993 177.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 129' ' ' ALA . . . . . . . . . . . . . . . -62.7 -41.98 99.41 Favored 'General case' 0 C--O 1.245 0.823 0 O-C-N 127.218 2.824 . . . . 33.69 110.844 -179.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 129' A ALA . . . . . . . . . . . . . . . -58.88 -48.76 80.27 Favored 'General case' 0 C--O 1.264 1.836 0 CA-C-O 125.655 2.645 . . . . 32.87 113.594 -177.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 129' B SER . . . . . 0.563 ' O ' ' NE2' ' H' ' 131' ' ' GLN . 0.1 OUTLIER -81.29 -24.65 37.09 Favored 'General case' 0 C--O 1.252 1.191 0 CA-C-O 114.774 -2.536 . . . . 35.75 114.549 -179.445 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 129' C LEU . . . . . . . . . . . . . 55.7 mt -98.02 -30.36 12.75 Favored 'General case' 0 C--O 1.25 1.097 0 CA-C-N 123.459 2.845 . . . . 30.87 113.061 -174.098 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 130' ' ' LEU . . . . . . . . . . . . . 11.8 mt -79.79 75.0 6.48 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 125.505 1.753 . . . . 35.71 108.307 -176.125 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 131' ' ' GLN . . . . . 0.563 ' NE2' ' O ' ' H' ' 129' B SER . 60.1 mt-30 -130.89 131.19 44.37 Favored 'General case' 0 C--N 1.301 -1.534 0 C-N-CA 128.783 2.833 . . . . 42.34 113.288 -178.531 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 132' ' ' ALA . . . . . . . . . . . . . . . -50.7 138.01 19.0 Favored 'General case' 0 C--N 1.358 0.953 0 CA-C-O 111.936 -3.887 . . . . 32.01 104.721 -177.846 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 133' ' ' GLY . . . . . . . . . . . . . . . 100.69 -39.86 2.61 Favored Glycine 0 C--O 1.248 0.984 1 O-C-N 129.496 4.247 . . . . 29.82 112.15 -179.147 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 134' ' ' TYR . . . . . . . . . . . . . 3.8 m-30 -71.57 149.7 45.44 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-O 115.65 -2.119 . . . . 30.75 108.177 -178.447 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 135' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -102.76 149.75 24.16 Favored 'General case' 0 C--N 1.281 -2.413 0 CA-C-O 116.444 -1.741 . . . . 27.92 115.049 178.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 136' ' ' GLY . . . . . . . . . . . . . . . -126.91 175.02 18.13 Favored Glycine 0 N--CA 1.41 -3.087 0 C-N-CA 128.09 2.757 . . . . 19.26 107.108 173.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 137' ' ' ARG . . . . . . . . . . . . . 42.9 ttm180 -124.83 135.67 53.13 Favored 'General case' 0 C--N 1.294 -1.818 0 C-N-CA 128.181 2.592 . . . . 21.71 110.421 -177.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 138' ' ' VAL . . . . . . . . . . . . . 4.4 t -117.71 144.42 25.71 Favored 'Isoleucine or valine' 0 C--N 1.355 0.822 0 O-C-N 125.632 1.832 . . . . 22.32 107.656 178.272 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 139' ' ' THR . . . . . 1.1 HG22 HG22 ' H' ' 157' ' ' VAL . 11.6 p -133.75 152.29 51.84 Favored 'General case' 0 N--CA 1.5 2.046 0 CA-C-N 119.517 1.053 . . . . 22.46 110.0 179.639 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 140' ' ' GLY . . . . . . . . . . . . . . . 171.44 163.05 24.77 Favored Glycine 0 C--O 1.209 -1.453 0 C-N-CA 120.118 -1.039 . . . . 22.59 112.018 177.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 141' ' ' TRP . . . . . . . . . . . . . 19.2 m-90 -94.78 18.61 11.41 Favored 'General case' 0 C--N 1.32 -0.703 0 O-C-N 127.882 2.754 . . . . 27.97 112.149 174.471 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 142' ' ' GLY . . . . . . . . . . . . . . . -73.05 175.73 44.9 Favored Glycine 0 CA--C 1.545 1.951 0 CA-C-O 125.191 2.55 . . . . 31.6 113.205 -178.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 143' ' ' ASN . . . . . 0.406 ' HA ' ' O ' ' H' ' 150' ' ' GLY . 49.0 m-20 -55.87 149.71 14.44 Favored 'General case' 0 CA--C 1.527 0.084 0 CA-C-N 110.952 -2.624 . . . . 36.64 109.572 -178.776 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 144' ' ' LEU . . . . . . . . . . . . . 22.3 mt -91.5 -20.37 21.8 Favored 'General case' 0 C--O 1.217 -0.62 1 CA-C-N 107.951 -4.204 . . . . 33.16 109.812 -177.829 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 145' ' ' LYS . . . . . . . . . . . . 0.277 57.7 mttm -142.51 150.71 40.83 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-N 112.181 -2.281 . . . . 43.5 108.603 -175.747 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 146' ' ' GLU . . . . . . . . . . . . . 47.0 tt0 . . . . . 0 C--O 1.264 1.837 1 O-C-N 130.374 4.796 . . . . 38.3 108.456 176.093 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 150' ' ' GLY . . . . . 0.406 ' O ' ' HA ' ' H' ' 143' ' ' ASN . . . . . . . . 0 N--CA 1.494 2.527 0 CA-C-O 123.652 1.696 . . . . 47.56 111.385 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 151' ' ' GLN . . . . . 0.442 ' NE2' ' O ' ' H' ' 518' ' ' HOH . 7.7 mt-30 -107.24 127.67 27.47 Favored Pre-proline 0 C--O 1.259 1.555 0 C-N-CA 124.299 1.039 . . . . 50.0 108.621 178.495 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 152' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -68.22 168.76 18.38 Favored 'Trans proline' 0 CA--C 1.507 -0.85 0 O-C-N 124.599 1.841 . . . . 38.07 110.065 -178.286 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 153' ' ' SER . . . . . . . . . . . . . 24.6 t -93.93 -29.94 15.01 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 106.8 -1.555 . . . . 34.5 106.8 175.789 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 154' ' ' VAL . . . . . . . . . . . . . 30.2 m -136.34 166.84 25.63 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 CA-C-O 117.663 -1.161 . . . . 29.85 110.916 -179.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 155' ' ' LEU . . . . . . . . . . . . . 8.2 tp -52.27 141.79 18.35 Favored 'General case' 0 N--CA 1.48 1.06 0 O-C-N 127.782 3.177 . . . . 27.44 109.088 179.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 156' ' ' GLN . . . . . . . . . . . . . 78.1 mm-40 -115.34 156.69 25.03 Favored 'General case' 0 C--N 1.29 -1.993 0 C-N-CA 129.172 2.989 . . . . 24.67 107.46 -179.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 157' ' ' VAL . . . . . 1.1 HG22 HG22 ' H' ' 139' ' ' THR . 22.7 t -137.53 154.89 30.45 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.379 0 CA-C-O 112.994 -3.384 . . . . 25.04 112.357 -179.416 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 158' ' ' VAL . . . . . . . . . . . . . 9.2 p -151.31 147.77 15.25 Favored 'Isoleucine or valine' 0 C--O 1.262 1.762 0 CA-C-O 114.24 -2.791 . . . . 21.35 106.213 174.222 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 159' ' ' ASN . . . . . . . . . . . . . 50.4 m-20 -108.93 127.9 54.46 Favored 'General case' 0 C--N 1.278 -2.526 0 C-N-CA 129.137 2.975 . . . . 27.85 106.241 175.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 160' ' ' LEU . . . . . . . . . . . . 0.317 76.5 mt -138.79 148.68 59.21 Favored Pre-proline 0 N--CA 1.505 2.299 0 CA-C-O 112.573 -3.584 . . . . 24.73 107.995 -175.987 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 161' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -79.84 152.28 22.1 Favored 'Trans proline' 0 C--N 1.285 -2.776 0 O-C-N 126.562 2.875 . . . . 25.39 114.7 179.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 162' ' ' ILE . . . . . . . . . . . . . 3.6 mt -77.08 136.52 24.29 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.902 0 N-CA-C 104.961 -2.237 . . . . 25.04 104.961 173.675 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 163' ' ' VAL . . . . . 0.512 HG23 ' HA ' ' H' ' 183' ' ' ALA . 57.6 t -102.7 146.45 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.373 0 CA-C-N 114.126 -1.397 . . . . 25.25 111.123 -179.269 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 164' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.16 141.26 54.65 Favored 'General case' 0 C--O 1.259 1.596 0 O-C-N 119.264 -2.147 . . . . 47.27 109.916 177.206 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 165' ' ' ARG . . . . . 0.768 ' NH1' ' O ' ' H' ' 180' ' ' MET . 8.3 mtp85 -52.56 -41.88 85.35 Favored Pre-proline 0 C--N 1.297 -1.686 0 C-N-CA 127.653 2.381 . . . . 40.7 115.348 -175.884 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 166' ' ' PRO . . . . . 0.594 ' CD ' ' N ' ' H' ' 165' ' ' ARG . 45.3 Cg_exo -61.13 -47.01 13.42 Favored 'Trans proline' 0 N--CA 1.453 -0.863 0 C-N-CA 125.056 3.837 . . . . 28.28 111.222 -179.243 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 167' ' ' VAL . . . . . 0.477 HG11 ' HE2' ' H' ' 185' ' ' LYS . 51.0 t -62.29 -37.87 79.7 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.15 0 CA-C-N 112.994 -1.912 . . . . 27.16 106.224 179.807 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 168' ' ' CYS . . . . . . . . . . . . . 86.2 m -65.09 -50.23 66.93 Favored 'General case' 0 C--O 1.273 2.326 0 CA-C-N 115.114 -0.948 . . . . 27.88 109.222 179.127 -67.773 -65.501 -88.878 106.155 2.007 110.288 -72.735 81.022 1 1 . 1 . 001 ecloud build full ' H' H ' 169' ' ' LYS . . . . . . . . . . . . . 16.6 mttt -57.24 -44.12 83.54 Favored 'General case' 0 C--O 1.255 1.372 0 CA-C-O 125.206 2.432 . . . . 48.7 113.344 -179.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 170' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -69.58 -5.47 24.69 Favored 'General case' 0 CA--C 1.498 -1.043 0 O-C-N 118.696 -2.502 . . . . 27.92 116.758 -177.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 171' ' ' SER . . . . . . . . . . . . . 10.8 p -96.68 -12.51 23.74 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 126.087 2.851 . . . . 27.07 110.535 -176.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 172' ' ' THR . . . . . . . . . . . . . 9.1 t -148.74 165.26 31.93 Favored 'General case' 0 CA--C 1.514 -0.423 0 O-C-N 118.776 -2.452 . . . . 24.94 113.481 -174.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 173' ' ' ARG . . . . . . . . . . . . . 13.0 mtp180 -91.93 -18.85 23.12 Favored 'General case' 0 C--O 1.259 1.581 0 CA-C-O 113.507 -3.139 . . . . 45.63 112.987 175.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 174' ' ' ILE . . . . . . . . . . . . . 36.8 mt -68.21 136.97 25.44 Favored 'Isoleucine or valine' 0 C--O 1.262 1.712 0 O-C-N 125.855 1.972 . . . . 28.81 109.674 177.581 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 175' ' ' ARG . . . . . 0.56 ' NH1' ' O ' ' H' ' 498' ' ' HOH . 63.5 ttp85 -73.05 123.18 23.03 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-O 124.471 2.082 . . . . 32.4 109.176 177.455 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 176' ' ' ILE . . . . . 0.426 ' CD1' ' HZ2' ' H' ' 215' ' ' TRP . 1.1 mm -92.65 132.38 37.11 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.82 0 C-N-CA 129.587 3.155 . . . . 26.67 107.067 -177.556 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 177' ' ' THR . . . . . 0.619 ' O ' ' NH2' ' H' ' 165' ' ' ARG . 17.9 p -113.63 176.9 4.83 Favored 'General case' 0 C--O 1.252 1.207 0 O-C-N 125.481 1.738 . . . . 25.79 112.419 -179.915 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 178' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -70.75 -22.52 62.39 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 114.768 -2.539 . . . . 32.03 111.748 178.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 179' ' ' ASN . . . . . . . . . . . . . 50.6 m-20 -78.02 20.98 0.34 Allowed 'General case' 0 C--N 1.301 -1.52 0 CA-C-O 113.855 -2.974 . . . . 25.95 111.983 177.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 180' ' ' MET . . . . . 0.768 ' O ' ' NH1' ' H' ' 165' ' ' ARG . 66.8 mtt -140.6 151.5 44.71 Favored 'General case' 0 C--N 1.284 -2.255 0 O-C-N 128.955 3.909 . . . . 25.24 109.253 -177.131 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 181' ' ' PHE . . . . . . . . . . . . 0.288 43.4 p90 -138.23 159.29 42.42 Favored 'General case' 0 C--O 1.259 1.601 1 O-C-N 130.245 4.716 . . . . 20.06 105.277 169.986 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' H' H ' 182' ' ' CYS . . . . . 0.438 ' HB3' ' CE2' ' H' ' 227' ' ' PHE . 6.7 p -121.36 158.86 27.32 Favored 'General case' 0 N--CA 1.497 1.885 0 C-N-CA 117.166 -1.814 . . . . 24.11 107.34 173.117 81.022 -72.735 -88.878 110.288 2.007 106.155 -65.501 -67.773 2 2 . 1 . 001 ecloud build full ' H' H ' 183' ' ' ALA . . . . . 0.512 ' HA ' HG23 ' H' ' 163' ' ' VAL 0.284 . . -147.88 146.84 29.22 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 124.179 0.992 . . . . 23.26 112.912 178.51 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 184' ' ' GLY . . . . . . . . . . . . . . . 156.66 169.83 21.08 Favored Glycine 0 C--N 1.317 -0.479 0 N-CA-C 107.193 -2.363 . . . . 24.26 107.193 176.706 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 184' A TYR . . . . . . . . . . . . . 71.2 m-85 -84.33 160.51 20.68 Favored 'General case' 0 C--O 1.264 1.821 0 N-CA-C 106.57 -1.641 . . . . 29.21 106.57 176.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 185' ' ' LYS . . . . . 0.477 ' HE2' HG11 ' H' ' 167' ' ' VAL . 25.1 mttt -88.19 137.25 31.17 Favored Pre-proline 0 C--N 1.297 -1.711 0 C-N-CA 127.693 2.397 . . . . 38.35 108.209 174.045 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 186' ' ' PRO . . . . . 0.476 ' HD3' ' O ' ' H' ' 438' ' ' HOH . 9.4 Cg_endo -38.52 -40.4 1.32 Allowed 'Trans proline' 0 C--O 1.236 0.387 0 C-N-CA 125.166 3.911 . . . . 40.31 109.955 -176.873 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 186' A ASP . . . . . 0.856 ' OD1' ' N ' ' H' ' 186' B GLU . 0.0 OUTLIER -61.98 -77.31 0.05 OUTLIER 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 109.527 -3.488 . . . . 50.0 106.605 179.352 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 186' B GLU . . . . . 0.856 ' N ' ' OD1' ' H' ' 186' A ASP . 77.1 mt-10 -20.21 -20.45 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.279 0 C-N-CA 131.367 3.867 . . . . 50.0 114.806 -175.212 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 186' C GLY . . . . . 0.845 ' N ' ' O ' ' H' ' 186' A ASP . . . 33.48 98.26 0.01 OUTLIER Glycine 0 CA--C 1.542 1.779 0 O-C-N 127.191 2.807 . . . . 44.55 108.456 179.47 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 186' D LYS . . . . . . . . . . . . . 10.9 ttmm 168.87 135.14 0.02 OUTLIER 'General case' 0 C--N 1.293 -1.854 2 C-N-CA 136.442 5.897 . . . . 40.89 99.104 178.267 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 187' ' ' ARG . . . . . 0.841 ' NH2' ' O ' ' H' ' 221' ' ' ASP . 28.8 mtp85 -115.52 -179.68 3.71 Favored 'General case' 0 C--N 1.287 -2.128 1 C-N-CA 132.302 4.241 . . . . 38.45 115.121 -176.173 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 188' ' ' GLY . . . . . 0.616 ' HA2' ' O ' ' H' ' 17' ' ' VAL . . . 121.83 157.05 9.89 Favored Glycine 0 N--CA 1.414 -2.793 0 C-N-CA 126.905 2.193 . . . . 27.82 112.444 175.313 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 189' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -176.41 171.68 2.35 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-N 111.021 -2.59 . . . . 28.25 106.291 -178.26 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 190' ' ' ALA . . . . . 0.426 ' HA ' HD13 ' H' ' 16' ' ' ILE . . . -82.15 168.57 17.57 Favored 'General case' 0 CA--C 1.565 1.523 1 O-C-N 129.525 4.266 . . . . 23.36 102.954 173.31 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 191' ' ' CYS . . . . . . . . . . . . . 7.4 t -155.5 175.39 13.95 Favored 'General case' 0 C--N 1.289 -2.054 0 N-CA-C 107.8 -1.185 . . . . 28.02 107.8 178.813 -161.111 57.872 69.002 106.867 2.025 108.346 -179.15 -38.84 1 1 . 1 . 001 ecloud build full ' H' H ' 192' ' ' GLU . . . . . . . . . . . . . 27.9 mp0 -51.16 136.3 24.24 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-O 113.713 -3.041 . . . . 39.71 110.426 -179.222 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 193' ' ' GLY . . . . . . . . . . . . . . . 99.67 -22.18 41.69 Favored Glycine 0 C--N 1.299 -1.473 1 CA-C-O 113.327 -4.04 . . . . 25.02 111.44 -177.635 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 194' ' ' ASP . . . . . 0.413 ' O ' ' C ' ' H' ' 195' ' ' SER . 81.7 m-20 -78.55 -29.43 46.37 Favored 'General case' 0 C--O 1.261 1.661 0 CA-C-O 124.491 2.091 . . . . 24.08 114.595 173.893 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 195' ' ' SER . . . . . 1.26 ' OG ' ' C ' ' H' ' 372' ' ' 00L . 7.7 m -27.5 134.38 0.03 OUTLIER 'General case' 0 C--O 1.207 -1.178 0 CA-C-O 126.744 3.164 . . . . 26.45 111.156 173.55 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 196' ' ' GLY . . . . . . . . . . . . . . . 77.24 6.5 86.34 Favored Glycine 0 N--CA 1.441 -1.025 0 C-N-CA 129.362 3.363 . . . . 23.11 114.729 174.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 197' ' ' GLY . . . . . . . . . . . . . . . -85.99 173.32 46.73 Favored Glycine 0 C--N 1.299 -1.487 0 N-CA-C 106.661 -2.575 . . . . 22.61 106.661 177.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 198' ' ' PRO . . . . . 0.471 ' HB2' HG13 ' H' ' 200' ' ' VAL . 16.9 Cg_endo -87.89 148.72 7.05 Favored 'Trans proline' 0 N--CA 1.426 -2.446 0 N-CA-C 118.699 2.538 . . . . 22.81 118.699 -178.165 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 199' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -113.54 112.08 22.96 Favored 'General case' 0 CA--C 1.587 2.388 1 N-CA-C 99.035 -4.431 . . . . 20.07 99.035 168.97 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 200' ' ' VAL . . . . . 0.471 HG13 ' HB2' ' H' ' 198' ' ' PRO . 33.8 m -119.69 164.17 16.32 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.729 0 C-N-CA 116.613 -2.035 . . . . 19.92 105.875 -175.285 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 201' ' ' MET . . . . . . . . . . . . . 85.9 mtp -139.32 148.46 42.97 Favored 'General case' 0 C--N 1.294 -1.82 0 CA-C-N 112.755 -2.02 . . . . 23.91 105.985 179.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 202' ' ' LYS . . . . . . . . . . . . . 69.4 tttt -103.64 119.81 39.65 Favored 'General case' 0 C--N 1.279 -2.475 0 N-CA-C 106.545 -1.65 . . . . 22.44 106.545 178.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 203' ' ' SER . . . . . . . . . . . . . 17.6 t -72.18 135.52 82.27 Favored Pre-proline 0 N--CA 1.486 1.351 0 O-C-N 126.981 2.676 . . . . 22.78 110.136 178.9 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 204' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -79.89 -7.11 14.38 Favored 'Trans proline' 0 CA--C 1.553 1.428 0 CA-C-N 113.636 -1.237 . . . . 24.18 113.346 175.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 204' A PHE . . . . . . . . . . . . . 49.2 m-85 -86.72 -50.81 6.5 Favored 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 129.559 3.144 . . . . 26.84 112.047 -176.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 204' B ASN . . . . . 0.56 ' O ' ' HB2' ' H' ' 205' ' ' ASN . 35.9 p30 -118.81 -3.5 10.76 Favored 'General case' 0 C--O 1.256 1.397 0 CA-C-O 116.092 -1.908 . . . . 28.46 115.217 -178.947 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 205' ' ' ASN . . . . . 0.56 ' HB2' ' O ' ' H' ' 204' B ASN 0.39 0.7 OUTLIER 67.9 17.72 9.64 Favored 'General case' 0 CA--C 1.502 -0.874 0 N-CA-C 117.658 2.466 . . . . 35.88 117.658 178.221 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' H' H ' 206' ' ' ARG . . . . . . . . . . . . . 76.8 mtt-85 -95.45 159.56 14.94 Favored 'General case' 0 C--O 1.261 1.702 0 O-C-N 125.759 1.912 . . . . 29.18 108.634 -178.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 207' ' ' TRP . . . . . . . . . . . . . 76.7 m95 -100.89 131.38 46.8 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 127.747 3.154 . . . . 21.56 104.516 179.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 208' ' ' TYR . . . . . . . . . . . . 0.287 36.8 m-85 -118.83 142.09 48.05 Favored 'General case' 0 N--CA 1.504 2.237 1 O-C-N 129.534 4.272 . . . . 26.66 109.019 -178.793 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' H' H ' 209' ' ' GLN . . . . . . . . . . . . . 46.1 tt0 -89.6 114.44 26.03 Favored 'General case' 0 C--N 1.293 -1.876 0 N-CA-C 107.907 -1.145 . . . . 20.25 107.907 176.098 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 210' ' ' MET . . . . . . . . . . . . . 41.2 mmm -94.28 -26.26 16.68 Favored 'General case' 0 C--O 1.246 0.895 0 CA-C-O 116.346 -1.787 . . . . 30.19 112.914 176.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 211' ' ' GLY . . . . . . . . . . . . . . . -145.09 170.69 26.45 Favored Glycine 0 CA--C 1.485 -1.802 0 CA-C-O 124.959 2.422 . . . . 19.52 115.024 -176.669 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 212' ' ' ILE . . . . . 0.406 ' O ' ' HA ' ' H' ' 228' ' ' TYR . 63.2 mt -128.93 131.14 68.49 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.313 0 N-CA-C 103.147 -2.909 . . . . 18.7 103.147 177.843 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 213' ' ' VAL . . . . . . . . . . . . . 47.7 t -56.74 122.91 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 N-CA-C 106.534 -1.654 . . . . 18.25 106.534 176.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 214' ' ' SER . . . . . . . . . . . . . 22.8 t -117.01 -60.27 1.86 Allowed 'General case' 0 C--O 1.256 1.417 0 O-C-N 116.847 -3.658 . . . . 21.95 115.775 -176.109 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 215' ' ' TRP . . . . . 0.426 ' HZ2' ' CD1' ' H' ' 176' ' ' ILE . 62.8 p-90 -159.06 171.39 20.07 Favored 'General case' 0 C--N 1.301 -1.543 0 CA-C-O 124.808 2.242 . . . . 21.8 112.2 -176.893 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 216' ' ' GLY . . . . . . . . . . . . . . . -178.61 -178.09 47.7 Favored Glycine 0 CA--C 1.534 1.262 0 CA-C-N 111.98 -2.373 . . . . 26.59 107.898 177.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 217' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -130.2 102.57 6.28 Favored 'General case' 0 N--CA 1.509 2.517 0 CA-C-N 113.127 -1.537 . . . . 35.35 107.386 -178.633 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 219' ' ' GLY . . . . . . . . . . . . . . . 79.51 -162.66 47.68 Favored Glycine 1 N--CA 1.518 4.102 1 N-CA-C 103.081 -4.007 . . . . 29.14 103.081 -172.8 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' H' H ' 220' ' ' CYS . . . . . . . . . . . . . 3.7 m -147.43 132.6 18.35 Favored 'General case' 0 C--N 1.274 -2.71 0 C-N-CA 129.658 3.183 . . . . 30.84 106.501 178.561 -38.84 -179.15 69.002 108.346 2.025 106.867 57.872 -161.111 1 1 . 1 . 001 ecloud build full ' H' H ' 221' ' ' ASP . . . . . 0.841 ' O ' ' NH2' ' H' ' 187' ' ' ARG . 27.3 t0 52.35 33.51 13.05 Favored 'General case' 0 C--O 1.272 2.271 0 C-N-CA 128.339 2.655 . . . . 32.32 114.438 178.39 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 221' A ARG . . . . . . . . . . . . . 7.6 mtt85 -78.13 147.31 34.66 Favored 'General case' 0 C--O 1.258 1.51 0 O-C-N 124.014 0.822 . . . . 42.08 110.146 175.402 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 222' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -66.51 142.52 57.5 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 118.056 -1.457 . . . . 45.51 107.125 178.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 223' ' ' GLY . . . . . . . . . . . . . . . 66.51 10.1 52.73 Favored Glycine 0 N--CA 1.43 -1.759 0 C-N-CA 128.814 3.102 . . . . 32.67 116.559 -179.476 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 224' ' ' LYS . . . . . 0.472 ' HE2' ' O ' ' H' ' 528' ' ' HOH . 54.8 mmtt -113.26 146.19 39.77 Favored 'General case' 0 C--N 1.309 -1.153 0 C-N-CA 126.61 1.964 . . . . 34.64 109.296 174.888 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 225' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -128.41 154.55 45.92 Favored 'General case' 0 N--CA 1.434 -1.225 0 C-N-CA 128.301 2.64 . . . . 25.71 113.301 -176.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 226' ' ' GLY . . . . . 0.408 ' O ' ' HB2' ' H' ' 182' ' ' CYS . . . -81.84 148.46 27.37 Favored Glycine 0 N--CA 1.493 2.439 0 N-CA-C 105.717 -2.953 . . . . 23.02 105.717 177.139 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 227' ' ' PHE . . . . . 0.438 ' CE2' ' HB3' ' H' ' 182' ' ' CYS . 47.9 m-85 -120.38 131.47 54.84 Favored 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 126.014 1.726 . . . . 21.43 108.717 179.743 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 228' ' ' TYR . . . . . 0.406 ' HA ' ' O ' ' H' ' 212' ' ' ILE 0.353 98.8 m-85 -123.88 149.95 45.22 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 114.885 -2.483 . . . . 22.36 110.802 -177.094 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 229' ' ' THR . . . . . . . . . . . . . 8.7 m -69.97 129.56 39.82 Favored 'General case' 0 C--O 1.285 2.959 0 O-C-N 128.146 3.404 . . . . 22.47 107.436 174.002 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 230' ' ' HIS . . . . . . . . . . . . 0.294 29.7 t-80 -81.19 94.3 6.64 Favored 'General case' 0 C--N 1.277 -2.563 0 CA-C-N 122.622 2.465 . . . . 23.98 109.439 178.422 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 231' ' ' VAL . . . . . . . . . . . . . 61.3 t -52.94 -50.54 43.59 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.26 0 C-N-CA 129.004 2.921 . . . . 22.51 110.591 -176.619 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 232' ' ' PHE . . . . . 0.573 ' CZ ' ' HA ' ' H' ' 126' ' ' ARG . 70.3 t80 -58.19 -40.36 81.35 Favored 'General case' 0 C--O 1.271 2.199 0 O-C-N 126.799 2.562 . . . . 29.32 111.743 -179.55 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 233' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.98 -23.27 66.3 Favored 'General case' 0 CA--C 1.508 -0.667 0 O-C-N 119.536 -1.978 . . . . 39.95 111.626 177.606 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 234' ' ' LEU . . . . . . . . . . . . . 13.6 mt -104.89 7.59 34.39 Favored 'General case' 0 CA--C 1.502 -0.88 0 CA-C-N 120.85 1.659 . . . . 29.56 115.212 178.926 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 235' ' ' LYS . . . . . 0.488 ' HA ' HD12 ' H' ' 238' ' ' ILE . 13.0 tttm -59.3 -36.15 75.09 Favored 'General case' 0 C--O 1.266 1.922 0 N-CA-C 114.414 1.264 . . . . 36.48 114.414 -176.285 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 236' ' ' LYS . . . . . 0.508 ' HB2' ' O ' ' H' ' 517' ' ' HOH . 27.0 mttt -57.38 -47.26 82.16 Favored 'General case' 0 C--O 1.248 1.024 0 C-N-CA 118.006 -1.477 . . . . 50.0 108.168 179.58 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 237' ' ' TRP . . . . . 0.631 ' O ' HG13 ' H' ' 241' ' ' VAL . 71.4 t90 -60.76 -36.1 78.09 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 114.872 -2.731 . . . . 32.36 109.689 -176.921 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 238' ' ' ILE . . . . . 0.488 HD12 ' HA ' ' H' ' 235' ' ' LYS . 15.0 mt -66.99 -53.32 35.09 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.868 0 CA-C-N 115.877 -0.602 . . . . 33.07 112.192 -179.242 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 239' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -47.54 -58.39 4.28 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-O 127.222 3.391 . . . . 50.0 105.798 178.389 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 240' ' ' LYS . . . . . . . . . . . . . 1.5 tttt -43.45 -58.33 2.65 Favored 'General case' 0 C--O 1.273 2.33 0 CA-C-N 110.109 -3.223 . . . . 50.0 115.93 179.119 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 241' ' ' VAL . . . . . 0.631 HG13 ' O ' ' H' ' 237' ' ' TRP . 1.9 m -68.77 -27.33 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 CA-C-N 123.853 3.024 . . . . 40.84 112.827 -177.468 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 242' ' ' ILE . . . . . . . . . . . . 0.327 52.2 mt -68.75 -35.32 69.23 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 CA-C-O 116.791 -1.576 . . . . 44.57 109.938 -178.959 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 243' ' ' ASP . . . . . . . . . . . . 0.361 2.0 p-10 -81.39 -35.96 30.14 Favored 'General case' 0 C--O 1.262 1.729 0 CA-C-O 113.405 -3.188 . . . . 50.0 114.434 176.392 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 244' ' ' GLN . . . . . 0.954 ' HG2' ' CD2' ' H' ' 245' ' ' PHE . 0.1 OUTLIER -65.47 -52.08 55.53 Favored 'General case' 0 C--N 1.298 -1.635 0 CA-C-O 124.889 2.28 . . . . 50.0 108.023 178.751 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 245' ' ' PHE . . . . . 0.954 ' CD2' ' HG2' ' H' ' 244' ' ' GLN . 56.4 m-85 -92.46 1.41 57.26 Favored 'General case' 0 C--O 1.26 1.656 0 N-CA-C 118.388 2.736 . . . . 50.0 118.388 -173.775 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 246' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.291 3.659 1 CA-C-O 112.954 -4.248 . . . . 50.0 113.074 175.329 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 55' ' ' ASP . . . . . . . . . . . . 0.283 4.9 p-10 . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 121.273 0.559 . . . . 50.0 109.569 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 56' ' ' PHE . . . . . 0.486 ' CD2' ' HE1' ' H' ' 34' ' ' PHE . 36.2 m-85 -81.54 124.95 29.92 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.067 -0.97 . . . . 48.5 108.916 -179.999 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 57' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -64.86 139.94 58.81 Favored 'General case' 0 C--O 1.251 1.175 0 N-CA-C 103.423 -2.806 . . . . 50.0 103.423 174.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 58' ' ' GLU . . . . . 0.502 ' CD ' ' H ' ' I' ' 58' ' ' GLU . 1.2 mp0 -57.08 144.09 35.91 Favored 'General case' 0 C--O 1.269 2.096 0 CA-C-N 111.667 -2.515 . . . . 50.0 108.668 -178.817 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 59' ' ' ILE . . . . . . . . . . . . . 8.2 pt -107.2 158.75 32.28 Favored Pre-proline 0 N--CA 1.476 0.864 0 O-C-N 126.906 2.629 . . . . 48.8 108.809 178.088 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 60' ' ' PRO . . . . . 0.432 ' O ' ' HB3' ' I' ' 63' ' ' TYS . 4.3 Cg_exo -62.6 125.41 16.07 Favored 'Trans proline' 0 C--O 1.251 1.135 1 C-N-CA 125.947 4.431 . . . . 49.89 114.705 177.458 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' I' I ' 61' ' ' GLU . . . . . 0.485 ' C ' ' N ' ' I' ' 63' ' ' TYS . . . -44.34 -36.25 2.72 Favored 'General case' 0 N--CA 1.436 -1.152 0 C-N-CA 127.553 2.341 . . . . 50.0 115.289 -177.703 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 62' ' ' GLU . . . . . 0.483 ' OE1' ' N ' ' I' ' 62' ' ' GLU . 20.9 pm0 -61.18 -10.09 5.97 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 116.363 -2.135 . . . . 50.0 106.406 -177.73 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 63' ' ' TYS . . . . . 0.485 ' N ' ' C ' ' I' ' 61' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 64' ' ' LEU . . . . . . . . . . . . 0.309 13.2 mt . . . . . 0 C--O 1.291 3.281 1 CA-C-O 111.577 -4.059 . . . . 50.0 110.496 177.596 . . . . . . . . 2 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 ' H' H ' 372' ' ' 00L . . . . . 1.26 ' C ' ' OG ' ' H' ' 195' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 443' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 454' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 477' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 484' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 485' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 ' 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 ' 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 ' 420' ' ' 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 ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 426' ' ' 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 ' 430' ' ' 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 ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 438' ' ' HOH . . . . . 0.476 ' O ' ' HD3' ' H' ' 186' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 ' 444' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 445' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 446' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 447' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 448' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 453' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 455' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 456' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 457' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 458' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 ' 462' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 463' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 464' ' ' 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 ' 467' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 468' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 469' ' ' 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 ' 478' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 479' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 480' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 481' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 482' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 483' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 486' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 487' ' ' 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 ' 496' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 497' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 498' ' ' HOH . . . . . 0.56 ' O ' ' NH1' ' H' ' 175' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 499' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 500' ' ' HOH . . . . . 0.809 ' O ' ' HD2' ' H' ' 97' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 501' ' ' HOH . . . . . 0.52 ' O ' ' HB3' ' H' ' 126' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 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 ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 517' ' ' HOH . . . . . 0.508 ' O ' ' HB2' ' H' ' 236' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 518' ' ' HOH . . . . . 0.442 ' O ' ' NE2' ' H' ' 151' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 ' 523' ' ' 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 . . . . . 0.472 ' O ' ' HE2' ' H' ' 224' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 531' ' ' 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 . . . . . 0.403 ' O ' HD22 ' L' ' 3' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 1' B ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.512 0 N-CA-C 107.396 -1.335 . . . . 42.45 107.396 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 1' A ASP . . . . . 0.486 ' OD2' ' HE2' ' L' ' 9' ' ' LYS . 1.7 t70 -105.07 8.39 34.26 Favored 'General case' 0 CA--C 1.56 1.328 0 O-C-N 125.821 1.95 . . . . 45.4 111.061 175.038 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 1' ' ' CYS . . . . . . . . . . . . . 12.2 p -49.9 143.0 8.25 Favored 'General case' 0 C--O 1.25 1.104 0 CA-C-O 124.302 2.001 . . . . 29.3 113.584 -178.086 77.799 70.48 100.482 108.299 2.008 105.293 -54.818 -62.448 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 2' ' ' GLY . . . . . . . . . . . . . . . 67.6 6.1 40.71 Favored Glycine 0 C--O 1.253 1.296 0 CA-C-O 114.082 -3.621 . . . . 24.49 116.506 173.202 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 3' ' ' LEU . . . . . 0.403 HD22 ' O ' ' H' ' 535' ' ' HOH . 23.5 mt -106.04 110.17 22.36 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 103.651 -2.722 . . . . 22.6 103.651 175.759 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 4' ' ' ARG . . . . . 0.435 ' HB2' ' OE1' ' L' ' 8' ' ' GLU . 53.6 mtm180 -75.04 127.0 87.5 Favored Pre-proline 0 N--CA 1.494 1.746 0 CA-C-N 112.804 -1.998 . . . . 22.28 113.661 -175.396 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 5' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -48.54 -41.08 37.4 Favored 'Trans proline' 0 CA--C 1.479 -2.253 0 CA-C-O 117.273 -1.22 . . . . 25.51 113.939 178.185 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 6' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -97.39 5.37 49.9 Favored 'General case' 0 CA--C 1.488 -1.419 0 CA-C-N 122.895 2.589 . . . . 24.26 114.838 -173.617 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 7' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -132.73 -91.75 0.38 Allowed 'General case' 0 C--O 1.278 2.557 0 O-C-N 125.753 1.908 . . . . 24.89 106.984 -179.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 8' ' ' GLU . . . . . 0.435 ' OE1' ' HB2' ' L' ' 4' ' ' ARG . 35.5 mp0 -45.31 -45.2 12.08 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 117.934 2.568 . . . . 23.2 117.934 -179.213 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 9' ' ' LYS . . . . . 0.486 ' HE2' ' OD2' ' L' ' 1' A ASP . 18.9 mttt -67.64 -18.52 64.98 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 126.24 1.816 . . . . 37.2 115.172 178.597 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 10' ' ' LYS . . . . . . . . . . . . . 76.9 mttt -112.09 -4.74 14.37 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 106.942 -1.503 . . . . 31.79 106.942 -179.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 11' ' ' SER . . . . . . . . . . . . . 39.6 t 62.03 37.31 14.91 Favored 'General case' 0 C--O 1.251 1.165 0 CA-C-O 125.542 2.592 . . . . 25.93 112.761 -175.661 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 12' ' ' LEU . . . . . . . . . . . . . 67.5 mt -104.52 146.93 28.19 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 106.37 -1.715 . . . . 26.41 106.37 172.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 13' ' ' GLU . . . . . . . . . . . . 0.344 54.0 mt-10 -111.3 142.76 43.11 Favored 'General case' 0 C--N 1.277 -2.548 0 CA-C-O 114.806 -2.521 . . . . 43.69 109.026 179.823 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' ' ' ASP . . . . . . . . . . . . 0.327 2.2 p30 -75.81 161.97 28.56 Favored 'General case' 0 C--N 1.305 -1.358 1 CA-C-O 132.531 5.919 . . . . 25.65 105.173 176.049 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' A LYS . . . . . 0.796 ' HB2' ' OE2' ' H' ' 23' ' ' GLU . 1.5 ttmt -53.0 -26.32 14.95 Favored 'General case' 0 C--N 1.305 -1.328 1 CA-C-N 107.719 -4.31 . . . . 43.88 110.109 -178.614 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' L' L ' 14' B THR . . . . . . . . . . . . . 80.4 p -135.67 6.47 3.21 Favored 'General case' 0 C--O 1.255 1.368 0 CA-C-O 112.905 -3.426 . . . . 28.52 112.088 -178.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 14' C GLU . . . . . . . . . . . . . 10.9 pt-20 -60.63 -26.91 67.38 Favored 'General case' 0 CA--C 1.486 -1.493 0 O-C-N 127.661 3.101 . . . . 27.57 113.307 -179.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 14' D ARG . . . . . 0.623 ' O ' ' HG3' ' L' ' 14' H GLU . 0.0 OUTLIER -63.39 -31.65 72.87 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 117.896 -3.003 . . . . 50.0 111.538 -176.334 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' L' L ' 14' E GLU . . . . . . . . . . . . . 36.8 tt0 -58.0 -42.36 85.05 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-O 122.687 1.232 . . . . 32.58 108.194 -179.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 14' F LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.1 -67.8 0.26 Allowed 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 112.78 -2.009 . . . . 28.57 108.121 175.748 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' G LEU . . . . . . . . . . . . 0.328 2.6 mt -50.24 -38.87 42.77 Favored 'General case' 0 CA--C 1.481 -1.69 0 N-CA-C 116.329 1.974 . . . . 34.48 116.329 -179.224 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' H GLU . . . . . 0.623 ' HG3' ' O ' ' L' ' 14' D ARG . 86.8 mt-10 -68.0 -14.67 63.15 Favored 'General case' 0 C--O 1.268 2.04 0 CA-C-O 117.325 -1.322 . . . . 42.08 113.288 179.924 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' I SER . . . . . 0.945 ' C ' ' H ' ' L' ' 14' K ILE . 53.3 p -90.03 -24.37 21.21 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 127.417 2.948 . . . . 33.38 113.704 -178.798 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' J TYR . . . . . 1.101 ' C ' HG13 ' L' ' 14' K ILE . 7.5 m-30 -75.58 25.57 0.11 Allowed 'General case' 0 N--CA 1.49 1.574 0 CA-C-O 127.905 3.717 . . . . 39.3 101.3 -179.004 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' K ILE . . . . . 1.101 HG13 ' C ' ' L' ' 14' J TYR 0.435 0.3 OUTLIER . . . . . 0 N--CA 1.505 2.293 2 CA-C-O 132.686 5.993 . . . . 46.58 110.354 -172.852 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' H' H ' 16' ' ' ILE . . . . . 0.426 HD13 ' HA ' ' H' ' 190' ' ' ALA . 27.8 mm . . . . . 0 N--CA 1.44 -0.951 0 CA-C-O 115.812 -2.042 . . . . 23.12 107.804 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 17' ' ' VAL . . . . . 0.616 ' O ' ' HA2' ' H' ' 188' ' ' GLY . 93.4 t -115.08 124.44 71.71 Favored 'Isoleucine or valine' 0 C--O 1.268 2.048 0 CA-C-O 113.989 -2.91 . . . . 28.88 111.188 -179.32 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 18' ' ' GLU . . . . . 0.615 ' HG3' ' HB2' ' H' ' 187' ' ' ARG . 66.7 mm-40 67.61 36.63 3.62 Favored 'General case' 0 C--N 1.318 -0.786 0 O-C-N 128.162 3.414 . . . . 45.53 111.426 179.22 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 19' ' ' GLY . . . . . . . . . . . . . . . -103.51 -155.9 24.45 Favored Glycine 0 CA--C 1.538 1.482 1 O-C-N 131.347 5.404 . . . . 31.91 108.764 179.445 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 20' ' ' SER . . . . . . . . . . . . . 2.7 p -154.11 160.42 41.93 Favored 'General case' 0 N--CA 1.503 2.219 0 CA-C-O 114.998 -2.429 . . . . 41.27 106.211 178.424 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 21' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -61.03 143.17 55.87 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 126.05 2.094 . . . . 34.99 107.53 -179.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 22' ' ' ALA . . . . . . . . . . . . 0.286 . . -75.8 159.63 30.83 Favored 'General case' 0 C--N 1.29 -1.985 0 N-CA-C 106.05 -1.833 . . . . 29.65 106.05 176.868 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 23' ' ' GLU . . . . . 0.796 ' OE2' ' HB2' ' L' ' 14' A LYS . 31.0 mt-10 -82.96 161.98 21.63 Favored 'General case' 0 C--O 1.26 1.638 0 C-N-CA 125.404 1.481 . . . . 34.6 107.962 172.189 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 24' ' ' ILE . . . . . . . . . . . . . 4.6 mm -65.08 140.36 19.86 Favored 'Isoleucine or valine' 0 C--O 1.246 0.918 0 N-CA-C 108.228 -1.027 . . . . 26.11 108.228 -179.546 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.92 21.12 55.11 Favored Glycine 0 C--N 1.279 -2.598 0 C-N-CA 126.897 2.189 . . . . 23.49 114.466 -178.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 26' ' ' MET . . . . . . . . . . . . . 3.7 ttt -74.35 -28.8 61.3 Favored 'General case' 0 C--O 1.262 1.751 0 O-C-N 119.59 -2.124 . . . . 26.79 113.979 -179.099 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 27' ' ' SER . . . . . . . . . . . . . 46.7 m -139.97 71.21 35.35 Favored Pre-proline 0 C--O 1.262 1.728 0 C-N-CA 130.374 3.47 . . . . 26.25 109.957 179.04 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 28' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -68.34 -0.61 6.0 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 O-C-N 123.167 1.088 . . . . 19.21 114.22 -178.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 29' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -99.16 -11.08 21.69 Favored 'General case' 0 C--O 1.242 0.681 0 O-C-N 118.917 -2.364 . . . . 21.67 108.411 179.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 30' ' ' GLN . . . . . . . . . . . . . 29.3 tp60 -62.08 129.8 42.52 Favored 'General case' 0 C--O 1.244 0.787 0 O-C-N 128.801 3.813 . . . . 27.29 110.881 178.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 31' ' ' VAL . . . . . 0.458 HG12 ' N ' ' H' ' 32' ' ' MET . 78.5 t -126.17 153.64 34.67 Favored 'Isoleucine or valine' 0 C--O 1.256 1.43 0 C-N-CA 125.752 1.621 . . . . 24.43 111.231 -176.967 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 32' ' ' MET . . . . . 0.572 ' HG3' ' CD1' ' H' ' 40' ' ' LEU . 49.0 ttm -114.44 127.33 55.77 Favored 'General case' 0 C--N 1.307 -1.273 0 N-CA-C 107.34 -1.356 . . . . 28.74 107.34 179.901 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 33' ' ' LEU . . . . . 0.437 HD23 ' HA ' ' H' ' 33' ' ' LEU 0.318 0.2 OUTLIER -89.59 112.04 23.14 Favored 'General case' 0 N--CA 1.511 2.617 0 O-C-N 128.236 3.46 . . . . 37.12 104.463 176.602 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' H' H ' 34' ' ' PHE . . . . . 0.486 ' HE1' ' CD2' ' I' ' 56' ' ' PHE . 50.7 t80 -127.59 132.9 49.75 Favored 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 115.306 -2.557 . . . . 33.15 112.282 -172.425 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 35' ' ' ARG . . . . . 0.685 ' O ' ' HA ' ' H' ' 38' ' ' GLN . 59.2 ttt180 -81.95 131.61 35.25 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 111.994 -2.366 . . . . 45.59 110.642 -179.342 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 36' ' ' LYS . . . . . 0.621 ' HE2' HD13 ' H' ' 65' ' ' LEU . 27.3 mttt -64.18 -40.75 96.77 Favored 'General case' 0 C--O 1.255 1.342 0 C-N-CA 126.41 1.884 . . . . 46.87 114.071 -179.679 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 36' A SER . . . . . . . . . . . . 0.321 0.6 OUTLIER -158.62 111.84 1.65 Allowed Pre-proline 0 C--O 1.272 2.272 0 CA-C-N 113.759 -1.564 . . . . 50.0 114.649 -175.459 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 37' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -64.22 159.76 68.04 Favored 'Cis proline' 0 C--N 1.293 -2.394 0 N-CA-C 105.423 -2.568 . . . . 47.04 105.423 -2.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 38' ' ' GLN . . . . . 0.685 ' HA ' ' O ' ' H' ' 35' ' ' ARG . 57.0 mt-30 -81.67 118.38 22.78 Favored 'General case' 0 N--CA 1.488 1.441 0 CA-C-O 113.057 -3.354 . . . . 47.51 103.091 -177.418 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 39' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -161.47 152.81 18.71 Favored 'General case' 0 C--N 1.307 -1.27 0 O-C-N 128.978 3.924 . . . . 49.84 112.448 -179.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 40' ' ' LEU . . . . . 0.572 ' CD1' ' HG3' ' H' ' 32' ' ' MET . 7.2 tp -73.44 129.66 38.47 Favored 'General case' 0 CA--C 1.555 1.171 0 N-CA-C 105.024 -2.213 . . . . 38.06 105.024 176.49 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 41' ' ' LEU . . . . . 0.799 ' O ' ' H2X' ' H' ' 372' ' ' 00L . 0.3 OUTLIER -99.33 -57.6 2.12 Favored 'General case' 0 C--N 1.294 -1.815 1 O-C-N 131.105 5.253 . . . . 33.55 111.38 178.292 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' H' H ' 42' ' ' CYS . . . . . . . . . . . . 0.337 1.3 m -163.37 174.05 12.45 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 123.71 0.631 . . . . 28.66 109.67 -178.167 -94.303 -155.108 -87.412 101.979 2.04 99.781 -87.907 -70.153 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 43' ' ' GLY . . . . . . . . . . . . . . . -89.94 178.52 43.71 Favored Glycine 0 CA--C 1.544 1.899 0 N-CA-C 107.756 -2.138 . . . . 24.52 107.756 170.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 44' ' ' ALA . . . . . . . . . . . . . . . -170.13 176.88 4.44 Favored 'General case' 0 C--O 1.271 2.222 0 N-CA-C 105.104 -2.184 . . . . 23.67 105.104 -179.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 45' ' ' SER . . . . . . . . . . . . . 30.0 p -137.63 141.73 41.21 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 125.965 2.041 . . . . 25.04 110.884 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 46' ' ' LEU . . . . . . . . . . . . . 43.0 tp -87.73 120.65 29.26 Favored 'General case' 0 C--O 1.257 1.469 0 CA-C-O 115.542 -2.171 . . . . 24.43 107.847 -177.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 47' ' ' ILE . . . . . . . . . . . . . 14.5 pt -109.79 -8.72 11.45 Favored 'Isoleucine or valine' 0 C--O 1.254 1.302 0 CA-C-N 120.574 1.533 . . . . 24.5 113.131 -177.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 48' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -167.95 -178.42 3.76 Favored 'General case' 0 C--O 1.292 3.295 0 CA-C-O 113.934 -2.936 . . . . 30.5 103.689 178.423 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 49' ' ' ASP . . . . . 0.541 ' N ' ' OD1' ' H' ' 49' ' ' ASP . 19.2 p-10 -80.13 -3.24 48.03 Favored 'General case' 0 N--CA 1.486 1.35 0 CA-C-O 113.695 -3.05 . . . . 38.06 113.795 -177.444 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 50' ' ' ARG . . . . . 0.985 ' NH2' ' O ' ' H' ' 109' ' ' LYS . 5.5 mtp180 -125.25 -4.08 7.39 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 127.83 3.206 . . . . 46.08 112.257 -179.49 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 51' ' ' TRP . . . . . . . . . . . . . 89.3 m95 -119.94 133.8 55.45 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 127.124 2.765 . . . . 34.29 115.776 -177.123 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 52' ' ' VAL . . . . . . . . . . . . . 24.2 t -118.99 138.8 48.55 Favored 'Isoleucine or valine' 0 C--O 1.246 0.912 0 CA-C-O 116.802 -1.571 . . . . 26.69 109.345 173.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 53' ' ' LEU . . . . . . . . . . . . . 22.3 tp -109.33 131.86 54.66 Favored 'General case' 0 C--N 1.286 -2.159 1 C-N-CA 134.94 5.296 . . . . 23.76 107.868 -178.853 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 54' ' ' THR . . . . . . . . . . . . . 2.4 t -147.03 178.78 8.09 Favored 'General case' 0 C--O 1.255 1.356 0 O-C-N 128.465 3.603 . . . . 23.3 110.699 -179.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 55' ' ' ALA . . . . . . . . . . . . . . . -84.9 129.39 34.81 Favored 'General case' 0 C--O 1.27 2.15 0 N-CA-C 105.122 -2.177 . . . . 21.98 105.122 175.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.51 -33.39 65.97 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 126.031 2.082 . . . . 21.13 110.878 -179.91 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 57' ' ' HIS . . . . . . . . . . . . . 1.5 p-80 -67.05 -15.31 63.64 Favored 'General case' 0 C--N 1.278 -2.514 0 C-N-CA 120.06 -0.656 . . . . 22.68 112.665 -177.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 58' ' ' CYS . . . . . . . . . . . . . 91.4 m -71.39 -21.82 61.96 Favored 'General case' 0 C--O 1.261 1.701 0 O-C-N 117.919 -2.988 . . . . 24.46 110.02 176.033 -70.153 -87.907 -87.412 99.781 2.04 101.979 -155.108 -94.303 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 59' ' ' LEU . . . . . 0.644 HD22 HD13 ' H' ' 88' ' ' ILE . 36.2 mt -103.36 -39.51 6.76 Favored 'General case' 0 C--O 1.244 0.782 0 N-CA-C 114.249 1.203 . . . . 29.45 114.249 -177.205 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 60' ' ' LEU . . . . . . . . . . . . . 7.6 tp -138.86 117.69 12.36 Favored 'General case' 0 C--O 1.202 -1.403 0 O-C-N 127.219 2.825 . . . . 26.87 111.542 -174.345 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' A TYR . . . . . . . . . . . . . 16.7 t80 -155.97 84.67 3.32 Favored Pre-proline 0 C--N 1.369 1.442 0 CA-C-N 110.018 -3.265 . . . . 27.61 107.736 179.026 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' B PRO . . . . . 0.409 ' N ' ' CD ' ' H' ' 60' C PRO . 74.5 Cg_exo -52.33 -43.73 51.8 Favored 'Trans proline' 0 N--CA 1.496 1.638 0 C-N-CA 123.956 3.104 . . . . 26.71 115.619 -177.758 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 60' C PRO . . . . . 0.409 ' CD ' ' N ' ' H' ' 60' B PRO . 91.2 Cg_exo -47.15 -27.17 6.08 Favored 'Trans proline' 0 C--O 1.255 1.365 0 C-N-CA 122.826 2.351 . . . . 29.17 114.166 175.573 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 60' D TRP . . . . . . . . . . . . . 54.3 m0 -114.09 13.93 18.2 Favored 'General case' 0 C--O 1.242 0.692 0 CA-C-O 115.2 -2.333 . . . . 32.83 110.893 -179.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' E ASP . . . . . . . . . . . . . 41.1 m-20 63.01 33.25 14.95 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 127.622 3.076 . . . . 40.43 112.572 178.782 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' F LYS . . . . . . . . . . . . . 7.2 tttt -103.87 114.39 28.6 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 124.798 1.311 . . . . 34.94 111.934 -179.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' G ASN . . . . . . . . . . . . . 55.8 t-20 -144.6 76.11 1.48 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 124.714 1.259 . . . . 42.02 108.942 176.019 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' H PHE . . . . . . . . . . . . . 65.9 m-85 -85.46 145.7 27.3 Favored 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 115.572 -2.451 . . . . 36.01 113.165 -175.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' I THR . . . . . . . . . . . . . 73.0 p -109.65 170.79 7.84 Favored 'General case' 0 N--CA 1.485 1.289 0 CA-C-O 125.341 2.496 . . . . 37.69 109.301 173.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 61' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -47.19 -37.72 10.69 Favored 'General case' 0 C--O 1.294 3.435 0 O-C-N 119.237 -2.164 . . . . 46.26 116.193 179.015 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 62' ' ' ASN . . . . . 0.409 ' O ' ' HE3' ' H' ' 36' ' ' LYS . 0.1 OUTLIER -80.43 -11.04 59.74 Favored 'General case' 0 C--N 1.306 -1.287 1 O-C-N 115.961 -4.212 . . . . 50.0 112.589 -179.495 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' H' H ' 63' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -75.04 -28.68 60.52 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 115.733 -2.079 . . . . 46.12 110.689 -178.173 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 64' ' ' LEU . . . . . 0.656 ' CD2' ' CD2' ' H' ' 41' ' ' LEU . 0.5 OUTLIER -121.79 160.05 25.42 Favored 'General case' 0 C--N 1.325 -0.498 1 CA-C-O 132.137 5.732 . . . . 38.21 120.659 -174.636 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' H' H ' 65' ' ' LEU . . . . . 0.621 HD13 ' HE2' ' H' ' 36' ' ' LYS . 0.1 OUTLIER -129.95 137.28 50.25 Favored 'General case' 0 C--N 1.317 -0.847 1 CA-C-N 106.78 -4.736 . . . . 34.91 107.689 178.26 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' H' H ' 66' ' ' VAL . . . . . 0.586 HG13 HD21 ' H' ' 85' ' ' LEU . 17.9 m -109.97 132.09 59.19 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 N-CA-C 104.791 -2.3 . . . . 32.08 104.791 174.365 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 67' ' ' ARG . . . . . . . . . . . . . 63.7 mtp180 -116.04 114.37 24.47 Favored 'General case' 0 C--N 1.285 -2.197 0 C-N-CA 128.029 2.532 . . . . 30.46 109.196 -179.279 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 68' ' ' ILE . . . . . . . . . . . . . 7.0 mt -112.28 143.93 21.05 Favored 'Isoleucine or valine' 0 C--O 1.248 1.015 0 C-N-CA 125.931 1.692 . . . . 27.91 113.535 -178.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 69' ' ' GLY . . . . . . . . . . . . . . . 87.34 21.08 50.18 Favored Glycine 0 C--O 1.248 1.016 0 O-C-N 125.154 1.534 . . . . 26.4 115.892 177.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 70' ' ' LYS . . . . . 0.503 ' HE3' ' O ' ' H' ' 72' ' ' SER . 11.8 mtpp -88.73 159.82 17.61 Favored 'General case' 0 CA--C 1.507 -0.708 0 CA-C-O 123.597 1.665 . . . . 29.73 111.373 -174.868 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 71' ' ' HIS . . . . . . . . . . . . . 75.7 t60 -133.78 -48.97 0.82 Allowed 'General case' 0 N--CA 1.493 1.723 1 CA-C-N 107.544 -4.389 . . . . 27.64 105.641 176.22 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 72' ' ' SER . . . . . 0.503 ' O ' ' HE3' ' H' ' 70' ' ' LYS . 28.3 t -76.48 132.56 39.67 Favored 'General case' 0 C--O 1.243 0.736 0 CA-C-N 110.485 -3.052 . . . . 31.88 107.464 -178.144 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 73' ' ' ARG . . . . . . . . . . . . . 43.1 ttp85 -65.08 -46.86 79.38 Favored 'General case' 0 C--O 1.262 1.727 0 O-C-N 127.563 3.039 . . . . 33.82 114.428 177.236 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 74' ' ' THR . . . . . . . . . . . . . 72.0 p -106.17 -32.28 8.29 Favored 'General case' 0 C--O 1.264 1.818 0 N-CA-C 119.637 3.199 . . . . 34.58 119.637 -177.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 75' ' ' ARG . . . . . . . . . . . . 0.309 26.1 mtt85 -63.39 139.44 58.77 Favored 'General case' 0 C--N 1.297 -1.675 0 CA-C-O 125.781 2.705 . . . . 50.0 114.709 179.657 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 76' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -83.63 90.66 7.31 Favored 'General case' 0 C--O 1.256 1.423 1 O-C-N 114.673 -5.017 . . . . 38.59 107.64 177.726 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 77' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -63.93 67.39 0.02 OUTLIER 'General case' 0 C--N 1.309 -1.17 0 N-CA-C 118.833 2.901 . . . . 31.24 118.833 -174.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 77' A ARG . . . . . . . . . . . . . 35.0 ttp85 -44.57 123.83 3.85 Favored 'General case' 0 C--O 1.26 1.61 1 C-N-CA 133.401 4.681 . . . . 32.47 111.272 179.752 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 78' ' ' ASN . . . . . . . . . . . . . 1.4 m120 75.08 -2.52 2.82 Favored 'General case' 0 C--O 1.252 1.206 0 O-C-N 125.006 1.442 . . . . 35.41 112.531 -178.1 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 79' ' ' ILE . . . . . 0.429 HG23 ' CD2' ' H' ' 117' ' ' TYR . 1.7 mt -109.24 -59.13 3.42 Favored 'Isoleucine or valine' 0 C--O 1.276 2.499 0 O-C-N 118.392 -2.693 . . . . 31.35 112.249 175.736 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 80' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -82.48 146.52 29.22 Favored 'General case' 0 C--O 1.268 2.061 0 CA-C-N 113.226 -1.807 . . . . 30.88 114.823 -177.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 81' ' ' LYS . . . . . . . . . . . . . 60.5 mmtt -116.27 128.46 55.6 Favored 'General case' 0 CA--C 1.556 1.2 0 CA-C-O 126.557 3.075 . . . . 48.29 109.192 175.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 82' ' ' ILE . . . . . . . . . . . . . 20.8 mt -106.57 110.05 30.19 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-O 114.903 -2.475 . . . . 35.88 111.758 -178.664 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 83' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -112.11 166.24 11.43 Favored 'General case' 0 CA--C 1.553 1.092 0 CA-C-O 127.903 3.716 . . . . 38.94 111.575 175.442 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 84' ' ' MET . . . . . . . . . . . . . 7.8 mtt -93.96 153.5 18.17 Favored 'General case' 0 N--CA 1.43 -1.444 1 C-N-CA 133.086 4.554 . . . . 46.21 106.923 175.053 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 85' ' ' LEU . . . . . 1.028 HD13 ' CE ' ' H' ' 106' ' ' MET . 4.2 mt -99.09 147.32 25.18 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 127.309 2.88 . . . . 38.35 105.558 179.402 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 86' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -97.29 -35.98 10.55 Favored 'General case' 0 C--N 1.293 -1.889 0 O-C-N 127.05 2.719 . . . . 48.12 107.223 173.786 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 87' ' ' LYS . . . . . 0.686 ' HB3' ' CE1' ' H' ' 89' ' ' TYR 0.386 4.6 mmtt -158.01 140.78 14.77 Favored 'General case' 0 C--O 1.262 1.753 0 N-CA-C 119.846 3.276 . . . . 43.74 119.846 -175.326 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 88' ' ' ILE . . . . . 0.644 HD13 HD22 ' H' ' 59' ' ' LEU . 5.8 mt -106.39 138.84 29.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 O-C-N 125.583 1.802 . . . . 37.24 109.677 171.796 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 89' ' ' TYR . . . . . 0.686 ' CE1' ' HB3' ' H' ' 87' ' ' LYS . 35.0 m-85 -130.48 112.05 12.85 Favored 'General case' 0 C--O 1.273 2.335 0 C-N-CA 129.8 3.24 . . . . 42.24 109.213 178.205 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 90' ' ' ILE . . . . . . . . . . . . . 43.1 mt -100.18 144.61 12.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 113.169 -1.832 . . . . 29.42 109.868 178.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 91' ' ' HIS . . . . . 0.46 ' CE1' ' HD3' ' H' ' 101' ' ' ARG . 41.0 t-80 -60.33 127.97 87.12 Favored Pre-proline 0 C--O 1.273 2.325 0 CA-C-O 125.113 2.387 . . . . 29.76 110.552 174.203 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 92' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -56.86 -31.91 90.43 Favored 'Trans proline' 0 N--CA 1.439 -1.714 0 C-N-CA 122.187 1.925 . . . . 30.84 114.158 -176.822 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 93' ' ' ARG . . . . . . . . . . . . . 23.0 mtp180 -106.72 29.37 7.04 Favored 'General case' 0 C--O 1.263 1.767 0 N-CA-C 115.825 1.787 . . . . 37.18 115.825 178.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 94' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -64.53 129.22 39.03 Favored 'General case' 0 N--CA 1.505 2.277 0 N-CA-C 103.098 -2.927 . . . . 25.36 103.098 175.109 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 95' ' ' ASN . . . . . . . . . . . . . 50.6 t-20 -101.72 84.47 2.57 Favored 'General case' 0 C--N 1.284 -2.259 0 C-N-CA 125.417 1.487 . . . . 32.21 112.394 -179.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 96' ' ' TRP . . . . . . . . . . . . . 52.1 p-90 -80.74 -3.0 49.26 Favored 'General case' 0 N--CA 1.489 1.478 0 CA-C-O 114.254 -2.784 . . . . 28.9 108.564 179.955 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 97' ' ' ARG . . . . . 0.809 ' HD2' ' O ' ' H' ' 500' ' ' HOH . 72.3 mtt-85 -84.2 -33.78 24.09 Favored 'General case' 0 C--O 1.265 1.904 0 O-C-N 126.514 2.384 . . . . 40.79 114.679 -177.234 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 97' A GLU . . . . . . . . . . . . . 58.1 tt0 -113.69 -66.1 1.12 Allowed 'General case' 0 C--O 1.27 2.166 0 CA-C-O 116.586 -1.673 . . . . 35.65 113.323 -177.656 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 98' ' ' ASN . . . . . . . . . . . . . 47.8 p-10 -136.43 21.08 3.15 Favored 'General case' 0 C--O 1.256 1.399 0 N-CA-C 117.314 2.339 . . . . 26.57 117.314 -168.316 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 99' ' ' LEU . . . . . . . . . . . . . 63.0 mt 60.53 28.75 18.43 Favored 'General case' 0 C--N 1.293 -1.888 0 C-N-CA 126.37 1.868 . . . . 26.33 109.205 -178.164 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 100' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -58.92 134.03 56.58 Favored 'General case' 0 C--N 1.292 -1.926 0 C-N-CA 125.027 1.331 . . . . 27.7 107.952 178.259 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 101' ' ' ARG . . . . . 0.46 ' HD3' ' CE1' ' H' ' 91' ' ' HIS . 48.9 mtt85 63.44 43.67 5.86 Favored 'General case' 0 N--CA 1.497 1.925 0 CA-C-O 121.929 0.871 . . . . 32.11 113.349 -175.743 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 102' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -76.99 78.98 3.53 Favored 'General case' 0 C--O 1.264 1.817 0 O-C-N 119.506 -1.997 . . . . 20.94 112.629 179.358 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 103' ' ' ILE . . . . . . . . . . . . . 13.3 tt -147.04 142.92 20.37 Favored 'Isoleucine or valine' 0 C--O 1.276 2.454 0 O-C-N 120.037 -1.664 . . . . 24.12 113.255 -176.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 104' ' ' ALA . . . . . . . . . . . . . . . -147.65 150.47 34.45 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-O 112.784 -3.484 . . . . 24.1 105.656 -179.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 105' ' ' LEU . . . . . . . . . . . . . 29.5 mt -112.82 147.65 36.52 Favored 'General case' 0 C--O 1.258 1.528 1 O-C-N 129.246 4.091 . . . . 27.73 106.85 173.63 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 106' ' ' MET . . . . . 1.028 ' CE ' HD13 ' H' ' 85' ' ' LEU . 70.8 mtp -129.32 127.75 41.75 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 126.055 2.097 . . . . 37.16 107.091 176.122 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 107' ' ' LYS . . . . . 0.838 ' HE2' ' NH1' ' H' ' 50' ' ' ARG . 33.6 tttt -100.14 124.78 45.95 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 127.919 2.488 . . . . 45.73 107.895 -177.921 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 108' ' ' LEU . . . . . 0.656 ' O ' ' NH2' ' H' ' 50' ' ' ARG . 71.9 mt -82.62 152.74 25.77 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 116.457 -2.097 . . . . 32.61 111.871 -174.975 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 109' ' ' LYS . . . . . 0.985 ' O ' ' NH2' ' H' ' 50' ' ' ARG 0.261 2.3 tptt -47.27 -48.17 24.81 Favored 'General case' 0 C--N 1.309 -1.166 0 O-C-N 127.681 3.113 . . . . 49.58 107.962 174.209 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 110' ' ' LYS . . . . . 0.485 ' HB3' ' HD2' ' H' ' 111' ' ' PRO . 2.1 mttm -143.46 158.88 56.58 Favored Pre-proline 0 N--CA 1.486 1.332 0 N-CA-C 108.613 -0.884 . . . . 50.0 108.613 -179.226 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 111' ' ' PRO . . . . . 0.485 ' HD2' ' HB3' ' H' ' 110' ' ' LYS . 8.3 Cg_endo -70.46 140.86 40.99 Favored 'Trans proline' 0 C--N 1.311 -1.43 0 N-CA-C 106.501 -2.154 . . . . 36.59 106.501 -179.71 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 112' ' ' VAL . . . . . . . . . . . . . 10.9 p -92.38 155.07 3.13 Favored 'Isoleucine or valine' 0 C--O 1.26 1.617 0 N-CA-C 105.724 -1.954 . . . . 35.62 105.724 179.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 113' ' ' ALA . . . . . . . . . . . . . . . -98.24 137.54 36.84 Favored 'General case' 0 N--CA 1.483 1.189 0 O-C-N 126.132 2.145 . . . . 34.23 108.479 178.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 114' ' ' PHE . . . . . 0.504 ' CD1' ' N ' ' H' ' 114' ' ' PHE . 13.0 m-30 -66.96 159.63 28.11 Favored 'General case' 0 C--N 1.315 -0.901 0 O-C-N 127.784 3.177 . . . . 29.05 110.405 176.868 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 115' ' ' SER . . . . . . . . . . . . . 32.6 p -168.92 -173.0 1.71 Allowed 'General case' 0 C--O 1.261 1.681 0 CA-C-O 116.357 -1.782 . . . . 31.87 106.303 -176.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 116' ' ' ASP . . . . . . . . . . . . . 66.8 m-20 -62.69 -31.4 72.29 Favored 'General case' 0 C--O 1.304 3.972 0 CA-C-N 119.837 1.198 . . . . 28.0 112.615 -179.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 117' ' ' TYR . . . . . 0.429 ' CD2' HG23 ' H' ' 79' ' ' ILE . 15.0 m-85 -97.9 -19.04 18.34 Favored 'General case' 0 C--N 1.299 -1.623 0 C-N-CA 127.906 2.482 . . . . 31.85 117.535 -177.421 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 118' ' ' ILE . . . . . . . . . . . . . 19.4 mt -121.57 111.11 29.77 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.079 1 C-N-CA 133.601 4.761 . . . . 23.77 114.623 -178.958 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 119' ' ' HIS . . . . . . . . . . . . . 31.8 t60 -160.98 139.63 7.46 Favored Pre-proline 0 C--O 1.254 1.292 0 N-CA-C 107.017 -1.475 . . . . 24.37 107.017 -175.014 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 120' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -74.92 155.97 43.33 Favored 'Trans proline' 0 C--O 1.25 1.108 0 C-N-CA 124.16 3.24 . . . . 23.36 115.685 -176.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 121' ' ' VAL . . . . . . . . . . . . . 12.2 p -99.51 161.39 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 N-CA-C 104.733 -2.321 . . . . 20.75 104.733 177.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 122' ' ' CYS . . . . . . . . . . . . . 70.9 m -91.65 147.36 23.06 Favored 'General case' 0 C--O 1.242 0.678 0 CA-C-N 118.169 0.441 . . . . 21.59 110.32 177.647 -62.448 -54.818 100.482 105.293 2.008 108.299 70.48 77.799 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 123' ' ' LEU . . . . . . . . . . . . . 22.0 mt -91.87 141.74 25.79 Favored Pre-proline 0 N--CA 1.491 1.605 0 N-CA-C 103.332 -2.84 . . . . 23.49 103.332 174.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 124' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -68.94 156.26 65.92 Favored 'Trans proline' 0 C--N 1.3 -2.004 0 CA-C-O 128.049 3.27 . . . . 27.08 111.854 179.177 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 125' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -111.83 161.45 16.34 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 102.417 -3.179 . . . . 39.83 102.417 175.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 126' ' ' ARG . . . . . 0.573 ' HA ' ' CZ ' ' H' ' 232' ' ' PHE . 1.0 OUTLIER -45.44 -44.47 12.23 Favored 'General case' 0 C--O 1.26 1.616 0 CA-C-O 115.728 -2.082 . . . . 50.0 114.081 179.273 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 127' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -85.89 -29.39 23.7 Favored 'General case' 0 C--O 1.265 1.906 0 CA-C-N 124.944 3.52 . . . . 50.0 112.687 -176.25 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 128' ' ' THR . . . . . . . . . . . . . 11.9 m -58.49 -45.3 89.01 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 103.993 -2.595 . . . . 37.41 103.993 177.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 129' ' ' ALA . . . . . . . . . . . . . . . -62.7 -41.98 99.41 Favored 'General case' 0 C--O 1.245 0.823 0 O-C-N 127.218 2.824 . . . . 33.69 110.844 -179.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 129' A ALA . . . . . . . . . . . . . . . -58.88 -48.76 80.27 Favored 'General case' 0 C--O 1.264 1.836 0 CA-C-O 125.655 2.645 . . . . 32.87 113.594 -177.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 129' B SER . . . . . 0.563 ' O ' ' NE2' ' H' ' 131' ' ' GLN . 0.1 OUTLIER -81.29 -24.65 37.09 Favored 'General case' 0 C--O 1.252 1.191 0 CA-C-O 114.774 -2.536 . . . . 35.75 114.549 -179.445 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 129' C LEU . . . . . . . . . . . . . 55.7 mt -98.02 -30.36 12.75 Favored 'General case' 0 C--O 1.25 1.097 0 CA-C-N 123.459 2.845 . . . . 30.87 113.061 -174.098 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 130' ' ' LEU . . . . . . . . . . . . . 11.8 mt -79.79 75.0 6.48 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 125.505 1.753 . . . . 35.71 108.307 -176.125 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 131' ' ' GLN . . . . . 0.563 ' NE2' ' O ' ' H' ' 129' B SER . 60.1 mt-30 -130.89 131.19 44.37 Favored 'General case' 0 C--N 1.301 -1.534 0 C-N-CA 128.783 2.833 . . . . 42.34 113.288 -178.531 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 132' ' ' ALA . . . . . . . . . . . . . . . -50.7 138.01 19.0 Favored 'General case' 0 C--N 1.358 0.953 0 CA-C-O 111.936 -3.887 . . . . 32.01 104.721 -177.846 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 133' ' ' GLY . . . . . . . . . . . . . . . 100.69 -39.86 2.61 Favored Glycine 0 C--O 1.248 0.984 1 O-C-N 129.496 4.247 . . . . 29.82 112.15 -179.147 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 134' ' ' TYR . . . . . . . . . . . . . 3.8 m-30 -71.57 149.7 45.44 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-O 115.65 -2.119 . . . . 30.75 108.177 -178.447 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 135' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -102.76 149.75 24.16 Favored 'General case' 0 C--N 1.281 -2.413 0 CA-C-O 116.444 -1.741 . . . . 27.92 115.049 178.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 136' ' ' GLY . . . . . . . . . . . . . . . -126.91 175.02 18.13 Favored Glycine 0 N--CA 1.41 -3.087 0 C-N-CA 128.09 2.757 . . . . 19.26 107.108 173.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 137' ' ' ARG . . . . . . . . . . . . . 42.9 ttm180 -124.83 135.67 53.13 Favored 'General case' 0 C--N 1.294 -1.818 0 C-N-CA 128.181 2.592 . . . . 21.71 110.421 -177.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 138' ' ' VAL . . . . . . . . . . . . . 4.4 t -117.71 144.42 25.71 Favored 'Isoleucine or valine' 0 C--N 1.355 0.822 0 O-C-N 125.632 1.832 . . . . 22.32 107.656 178.272 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 139' ' ' THR . . . . . 1.1 HG22 HG22 ' H' ' 157' ' ' VAL . 11.6 p -133.75 152.29 51.84 Favored 'General case' 0 N--CA 1.5 2.046 0 CA-C-N 119.517 1.053 . . . . 22.46 110.0 179.639 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 140' ' ' GLY . . . . . . . . . . . . . . . 171.44 163.05 24.77 Favored Glycine 0 C--O 1.209 -1.453 0 C-N-CA 120.118 -1.039 . . . . 22.59 112.018 177.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 141' ' ' TRP . . . . . . . . . . . . . 19.2 m-90 -94.78 18.61 11.41 Favored 'General case' 0 C--N 1.32 -0.703 0 O-C-N 127.882 2.754 . . . . 27.97 112.149 174.471 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 142' ' ' GLY . . . . . . . . . . . . . . . -73.05 175.73 44.9 Favored Glycine 0 CA--C 1.545 1.951 0 CA-C-O 125.191 2.55 . . . . 31.6 113.205 -178.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 143' ' ' ASN . . . . . 0.406 ' HA ' ' O ' ' H' ' 150' ' ' GLY . 49.0 m-20 -55.87 149.71 14.44 Favored 'General case' 0 CA--C 1.527 0.084 0 CA-C-N 110.952 -2.624 . . . . 36.64 109.572 -178.776 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 144' ' ' LEU . . . . . . . . . . . . . 22.3 mt -91.5 -20.37 21.8 Favored 'General case' 0 C--O 1.217 -0.62 1 CA-C-N 107.951 -4.204 . . . . 33.16 109.812 -177.829 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 145' ' ' LYS . . . . . . . . . . . . 0.277 57.7 mttm -142.51 150.71 40.83 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-N 112.181 -2.281 . . . . 43.5 108.603 -175.747 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 146' ' ' GLU . . . . . . . . . . . . . 47.0 tt0 . . . . . 0 C--O 1.264 1.837 1 O-C-N 130.374 4.796 . . . . 38.3 108.456 176.093 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 150' ' ' GLY . . . . . 0.406 ' O ' ' HA ' ' H' ' 143' ' ' ASN . . . . . . . . 0 N--CA 1.494 2.527 0 CA-C-O 123.652 1.696 . . . . 47.56 111.385 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 151' ' ' GLN . . . . . 0.442 ' NE2' ' O ' ' H' ' 518' ' ' HOH . 7.7 mt-30 -107.24 127.67 27.47 Favored Pre-proline 0 C--O 1.259 1.555 0 C-N-CA 124.299 1.039 . . . . 50.0 108.621 178.495 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 152' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -68.22 168.76 18.38 Favored 'Trans proline' 0 CA--C 1.507 -0.85 0 O-C-N 124.599 1.841 . . . . 38.07 110.065 -178.286 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 153' ' ' SER . . . . . . . . . . . . . 24.6 t -93.93 -29.94 15.01 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 106.8 -1.555 . . . . 34.5 106.8 175.789 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 154' ' ' VAL . . . . . . . . . . . . . 30.2 m -136.34 166.84 25.63 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 CA-C-O 117.663 -1.161 . . . . 29.85 110.916 -179.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 155' ' ' LEU . . . . . . . . . . . . . 8.2 tp -52.27 141.79 18.35 Favored 'General case' 0 N--CA 1.48 1.06 0 O-C-N 127.782 3.177 . . . . 27.44 109.088 179.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 156' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -115.34 156.69 25.03 Favored 'General case' 0 C--N 1.29 -1.993 0 C-N-CA 129.172 2.989 . . . . 24.67 107.46 -179.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 157' ' ' VAL . . . . . 1.1 HG22 HG22 ' H' ' 139' ' ' THR . 22.7 t -137.53 154.89 30.45 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.379 0 CA-C-O 112.994 -3.384 . . . . 25.04 112.357 -179.416 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 158' ' ' VAL . . . . . . . . . . . . . 9.2 p -151.31 147.77 15.25 Favored 'Isoleucine or valine' 0 C--O 1.262 1.762 0 CA-C-O 114.24 -2.791 . . . . 21.35 106.213 174.222 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 159' ' ' ASN . . . . . . . . . . . . . 50.4 m-20 -108.93 127.9 54.46 Favored 'General case' 0 C--N 1.278 -2.526 0 C-N-CA 129.137 2.975 . . . . 27.85 106.241 175.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 160' ' ' LEU . . . . . . . . . . . . 0.317 76.5 mt -138.79 148.68 59.21 Favored Pre-proline 0 N--CA 1.505 2.299 0 CA-C-O 112.573 -3.584 . . . . 24.73 107.995 -175.987 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 161' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -79.84 152.28 22.1 Favored 'Trans proline' 0 C--N 1.285 -2.776 0 O-C-N 126.562 2.875 . . . . 25.39 114.7 179.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 162' ' ' ILE . . . . . . . . . . . . . 3.6 mt -77.08 136.52 24.29 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.902 0 N-CA-C 104.961 -2.237 . . . . 25.04 104.961 173.675 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 163' ' ' VAL . . . . . 0.512 HG23 ' HA ' ' H' ' 183' ' ' ALA . 57.6 t -102.7 146.45 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.373 0 CA-C-N 114.126 -1.397 . . . . 25.25 111.123 -179.269 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 164' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.16 141.26 54.65 Favored 'General case' 0 C--O 1.259 1.596 0 O-C-N 119.264 -2.147 . . . . 47.27 109.916 177.206 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 165' ' ' ARG . . . . . 0.768 ' NH1' ' O ' ' H' ' 180' ' ' MET . 8.3 mtp85 -52.56 -41.88 85.35 Favored Pre-proline 0 C--N 1.297 -1.686 0 C-N-CA 127.653 2.381 . . . . 40.7 115.348 -175.884 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 166' ' ' PRO . . . . . 0.594 ' CD ' ' N ' ' H' ' 165' ' ' ARG . 45.3 Cg_exo -61.13 -47.01 13.42 Favored 'Trans proline' 0 N--CA 1.453 -0.863 0 C-N-CA 125.056 3.837 . . . . 28.28 111.222 -179.243 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 167' ' ' VAL . . . . . 0.477 HG11 ' HE2' ' H' ' 185' ' ' LYS . 51.0 t -62.29 -37.87 79.7 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.15 0 CA-C-N 112.994 -1.912 . . . . 27.16 106.224 179.807 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 168' ' ' CYS . . . . . . . . . . . . . 86.2 m -65.09 -50.23 66.93 Favored 'General case' 0 C--O 1.273 2.326 0 CA-C-N 115.114 -0.948 . . . . 27.88 109.222 179.127 -67.773 -65.501 -88.878 106.155 2.007 110.288 -72.735 81.022 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 169' ' ' LYS . . . . . . . . . . . . . 16.6 mttt -57.24 -44.12 83.54 Favored 'General case' 0 C--O 1.255 1.372 0 CA-C-O 125.206 2.432 . . . . 48.7 113.344 -179.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 170' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -69.58 -5.47 24.69 Favored 'General case' 0 CA--C 1.498 -1.043 0 O-C-N 118.696 -2.502 . . . . 27.92 116.758 -177.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 171' ' ' SER . . . . . . . . . . . . . 10.8 p -96.68 -12.51 23.74 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 126.087 2.851 . . . . 27.07 110.535 -176.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 172' ' ' THR . . . . . . . . . . . . . 9.1 t -148.74 165.26 31.93 Favored 'General case' 0 CA--C 1.514 -0.423 0 O-C-N 118.776 -2.452 . . . . 24.94 113.481 -174.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 173' ' ' ARG . . . . . . . . . . . . . 13.0 mtp180 -91.93 -18.85 23.12 Favored 'General case' 0 C--O 1.259 1.581 0 CA-C-O 113.507 -3.139 . . . . 45.63 112.987 175.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 174' ' ' ILE . . . . . . . . . . . . . 36.8 mt -68.21 136.97 25.44 Favored 'Isoleucine or valine' 0 C--O 1.262 1.712 0 O-C-N 125.855 1.972 . . . . 28.81 109.674 177.581 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 175' ' ' ARG . . . . . 0.56 ' NH1' ' O ' ' H' ' 498' ' ' HOH . 63.5 ttp85 -73.05 123.18 23.03 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-O 124.471 2.082 . . . . 32.4 109.176 177.455 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 176' ' ' ILE . . . . . 0.426 ' CD1' ' HZ2' ' H' ' 215' ' ' TRP . 1.1 mm -92.65 132.38 37.11 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.82 0 C-N-CA 129.587 3.155 . . . . 26.67 107.067 -177.556 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 177' ' ' THR . . . . . 0.619 ' O ' ' NH2' ' H' ' 165' ' ' ARG . 17.9 p -113.63 176.9 4.83 Favored 'General case' 0 C--O 1.252 1.207 0 O-C-N 125.481 1.738 . . . . 25.79 112.419 -179.915 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 178' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -70.75 -22.52 62.39 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 114.768 -2.539 . . . . 32.03 111.748 178.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 179' ' ' ASN . . . . . . . . . . . . . 50.6 m-20 -78.02 20.98 0.34 Allowed 'General case' 0 C--N 1.301 -1.52 0 CA-C-O 113.855 -2.974 . . . . 25.95 111.983 177.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 180' ' ' MET . . . . . 0.768 ' O ' ' NH1' ' H' ' 165' ' ' ARG . 66.8 mtt -140.6 151.5 44.71 Favored 'General case' 0 C--N 1.284 -2.255 0 O-C-N 128.955 3.909 . . . . 25.24 109.253 -177.131 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 181' ' ' PHE . . . . . . . . . . . . 0.288 43.4 p90 -138.23 159.29 42.42 Favored 'General case' 0 C--O 1.259 1.601 1 O-C-N 130.245 4.716 . . . . 20.06 105.277 169.986 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' H' H ' 182' ' ' CYS . . . . . 0.438 ' HB3' ' CE2' ' H' ' 227' ' ' PHE . 6.7 p -121.36 158.86 27.32 Favored 'General case' 0 N--CA 1.497 1.885 0 C-N-CA 117.166 -1.814 . . . . 24.11 107.34 173.117 81.022 -72.735 -88.878 110.288 2.007 106.155 -65.501 -67.773 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 183' ' ' ALA . . . . . 0.512 ' HA ' HG23 ' H' ' 163' ' ' VAL 0.284 . . -147.88 146.84 29.22 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 124.179 0.992 . . . . 23.26 112.912 178.51 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 184' ' ' GLY . . . . . . . . . . . . . . . 156.66 169.83 21.08 Favored Glycine 0 C--N 1.317 -0.479 0 N-CA-C 107.193 -2.363 . . . . 24.26 107.193 176.706 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 184' A TYR . . . . . . . . . . . . . 71.2 m-85 -84.33 160.51 20.68 Favored 'General case' 0 C--O 1.264 1.821 0 N-CA-C 106.57 -1.641 . . . . 29.21 106.57 176.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 185' ' ' LYS . . . . . 0.477 ' HE2' HG11 ' H' ' 167' ' ' VAL . 25.1 mttt -88.19 137.25 31.17 Favored Pre-proline 0 C--N 1.297 -1.711 0 C-N-CA 127.693 2.397 . . . . 38.35 108.209 174.045 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 186' ' ' PRO . . . . . 0.476 ' HD3' ' O ' ' H' ' 438' ' ' HOH . 9.4 Cg_endo -38.52 -40.4 1.32 Allowed 'Trans proline' 0 C--O 1.236 0.387 0 C-N-CA 125.166 3.911 . . . . 40.31 109.955 -176.873 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 186' A ASP . . . . . 0.856 ' OD1' ' N ' ' H' ' 186' B GLU . 0.0 OUTLIER -61.98 -77.31 0.05 OUTLIER 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 109.527 -3.488 . . . . 50.0 106.605 179.352 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 186' B GLU . . . . . 0.856 ' N ' ' OD1' ' H' ' 186' A ASP . 77.1 mt-10 -20.21 -20.45 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.279 0 C-N-CA 131.367 3.867 . . . . 50.0 114.806 -175.212 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 186' C GLY . . . . . 0.845 ' N ' ' O ' ' H' ' 186' A ASP . . . 33.48 98.26 0.01 OUTLIER Glycine 0 CA--C 1.542 1.779 0 O-C-N 127.191 2.807 . . . . 44.55 108.456 179.47 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 186' D LYS . . . . . . . . . . . . . 10.9 ttmm 168.87 135.14 0.02 OUTLIER 'General case' 0 C--N 1.293 -1.854 2 C-N-CA 136.442 5.897 . . . . 40.89 99.104 178.267 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 187' ' ' ARG . . . . . 0.841 ' NH2' ' O ' ' H' ' 221' ' ' ASP . 28.8 mtp85 -115.52 -179.68 3.71 Favored 'General case' 0 C--N 1.287 -2.128 1 C-N-CA 132.302 4.241 . . . . 38.45 115.121 -176.173 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 188' ' ' GLY . . . . . 0.616 ' HA2' ' O ' ' H' ' 17' ' ' VAL . . . 121.83 157.05 9.89 Favored Glycine 0 N--CA 1.414 -2.793 0 C-N-CA 126.905 2.193 . . . . 27.82 112.444 175.313 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 189' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -176.41 171.68 2.35 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-N 111.021 -2.59 . . . . 28.25 106.291 -178.26 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 190' ' ' ALA . . . . . 0.426 ' HA ' HD13 ' H' ' 16' ' ' ILE . . . -82.15 168.57 17.57 Favored 'General case' 0 CA--C 1.565 1.523 1 O-C-N 129.525 4.266 . . . . 23.36 102.954 173.31 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 191' ' ' CYS . . . . . . . . . . . . . 7.4 t -155.5 175.39 13.95 Favored 'General case' 0 C--N 1.289 -2.054 0 N-CA-C 107.8 -1.185 . . . . 28.02 107.8 178.813 -161.111 57.872 69.002 106.867 2.025 108.346 -179.15 -38.84 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 192' ' ' GLU . . . . . . . . . . . . . 27.9 mp0 -51.16 136.3 24.24 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-O 113.713 -3.041 . . . . 39.71 110.426 -179.222 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 193' ' ' GLY . . . . . . . . . . . . . . . 99.67 -22.18 41.69 Favored Glycine 0 C--N 1.299 -1.473 1 CA-C-O 113.327 -4.04 . . . . 25.02 111.44 -177.635 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 194' ' ' ASP . . . . . 0.413 ' O ' ' C ' ' H' ' 195' ' ' SER . 81.7 m-20 -78.55 -29.43 46.37 Favored 'General case' 0 C--O 1.261 1.661 0 CA-C-O 124.491 2.091 . . . . 24.08 114.595 173.893 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 195' ' ' SER . . . . . 1.26 ' OG ' ' C ' ' H' ' 372' ' ' 00L . 7.7 m -27.5 134.38 0.03 OUTLIER 'General case' 0 C--O 1.207 -1.178 0 CA-C-O 126.744 3.164 . . . . 26.45 111.156 173.55 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 196' ' ' GLY . . . . . . . . . . . . . . . 77.24 6.5 86.34 Favored Glycine 0 N--CA 1.441 -1.025 0 C-N-CA 129.362 3.363 . . . . 23.11 114.729 174.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 197' ' ' GLY . . . . . . . . . . . . . . . -85.99 173.32 46.73 Favored Glycine 0 C--N 1.299 -1.487 0 N-CA-C 106.661 -2.575 . . . . 22.61 106.661 177.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 198' ' ' PRO . . . . . 0.471 ' HB2' HG13 ' H' ' 200' ' ' VAL . 16.9 Cg_endo -87.89 148.72 7.05 Favored 'Trans proline' 0 N--CA 1.426 -2.446 0 N-CA-C 118.699 2.538 . . . . 22.81 118.699 -178.165 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 199' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -113.54 112.08 22.96 Favored 'General case' 0 CA--C 1.587 2.388 1 N-CA-C 99.035 -4.431 . . . . 20.07 99.035 168.97 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 200' ' ' VAL . . . . . 0.471 HG13 ' HB2' ' H' ' 198' ' ' PRO . 33.8 m -119.69 164.17 16.32 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.729 0 C-N-CA 116.613 -2.035 . . . . 19.92 105.875 -175.285 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 201' ' ' MET . . . . . . . . . . . . . 85.9 mtp -139.32 148.46 42.97 Favored 'General case' 0 C--N 1.294 -1.82 0 CA-C-N 112.755 -2.02 . . . . 23.91 105.985 179.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 202' ' ' LYS . . . . . . . . . . . . . 69.4 tttt -103.64 119.81 39.65 Favored 'General case' 0 C--N 1.279 -2.475 0 N-CA-C 106.545 -1.65 . . . . 22.44 106.545 178.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 203' ' ' SER . . . . . . . . . . . . . 17.6 t -72.18 135.52 82.27 Favored Pre-proline 0 N--CA 1.486 1.351 0 O-C-N 126.981 2.676 . . . . 22.78 110.136 178.9 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 204' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -79.89 -7.11 14.38 Favored 'Trans proline' 0 CA--C 1.553 1.428 0 CA-C-N 113.636 -1.237 . . . . 24.18 113.346 175.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 204' A PHE . . . . . . . . . . . . . 49.2 m-85 -86.72 -50.81 6.5 Favored 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 129.559 3.144 . . . . 26.84 112.047 -176.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 204' B ASN . . . . . 0.63 ' ND2' ' H ' ' H' ' 206' ' ' ARG . 0.1 OUTLIER -118.81 -3.5 10.76 Favored 'General case' 0 C--O 1.256 1.397 0 CA-C-O 116.092 -1.908 . . . . 28.46 115.217 -178.947 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 205' ' ' ASN . . . . . 0.56 ' HB2' ' O ' ' H' ' 204' B ASN 0.39 0.7 OUTLIER 67.9 17.72 9.64 Favored 'General case' 0 CA--C 1.502 -0.874 0 N-CA-C 117.658 2.466 . . . . 35.88 117.658 178.221 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' H' H ' 206' ' ' ARG . . . . . 0.63 ' H ' ' ND2' ' H' ' 204' B ASN . 76.8 mtt-85 -95.45 159.56 14.94 Favored 'General case' 0 C--O 1.261 1.702 0 O-C-N 125.759 1.912 . . . . 29.18 108.634 -178.208 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 207' ' ' TRP . . . . . . . . . . . . . 76.7 m95 -100.89 131.38 46.8 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 127.747 3.154 . . . . 21.56 104.516 179.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 208' ' ' TYR . . . . . . . . . . . . 0.287 36.8 m-85 -118.83 142.09 48.05 Favored 'General case' 0 N--CA 1.504 2.237 1 O-C-N 129.534 4.272 . . . . 26.66 109.019 -178.793 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' H' H ' 209' ' ' GLN . . . . . . . . . . . . . 46.1 tt0 -89.6 114.44 26.03 Favored 'General case' 0 C--N 1.293 -1.876 0 N-CA-C 107.907 -1.145 . . . . 20.25 107.907 176.098 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 210' ' ' MET . . . . . . . . . . . . . 41.2 mmm -94.28 -26.26 16.68 Favored 'General case' 0 C--O 1.246 0.895 0 CA-C-O 116.346 -1.787 . . . . 30.19 112.914 176.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 211' ' ' GLY . . . . . . . . . . . . . . . -145.09 170.69 26.45 Favored Glycine 0 CA--C 1.485 -1.802 0 CA-C-O 124.959 2.422 . . . . 19.52 115.024 -176.669 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 212' ' ' ILE . . . . . 0.406 ' O ' ' HA ' ' H' ' 228' ' ' TYR . 63.2 mt -128.93 131.14 68.49 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.313 0 N-CA-C 103.147 -2.909 . . . . 18.7 103.147 177.843 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 213' ' ' VAL . . . . . . . . . . . . . 47.7 t -56.74 122.91 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 N-CA-C 106.534 -1.654 . . . . 18.25 106.534 176.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 214' ' ' SER . . . . . . . . . . . . . 22.8 t -117.01 -60.27 1.86 Allowed 'General case' 0 C--O 1.256 1.417 0 O-C-N 116.847 -3.658 . . . . 21.95 115.775 -176.109 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 215' ' ' TRP . . . . . 0.426 ' HZ2' ' CD1' ' H' ' 176' ' ' ILE . 62.8 p-90 -159.06 171.39 20.07 Favored 'General case' 0 C--N 1.301 -1.543 0 CA-C-O 124.808 2.242 . . . . 21.8 112.2 -176.893 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 216' ' ' GLY . . . . . . . . . . . . . . . -178.61 -178.09 47.7 Favored Glycine 0 CA--C 1.534 1.262 0 CA-C-N 111.98 -2.373 . . . . 26.59 107.898 177.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 217' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -130.2 102.57 6.28 Favored 'General case' 0 N--CA 1.509 2.517 0 CA-C-N 113.127 -1.537 . . . . 35.35 107.386 -178.633 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 219' ' ' GLY . . . . . . . . . . . . . . . 79.51 -162.66 47.68 Favored Glycine 1 N--CA 1.518 4.102 1 N-CA-C 103.081 -4.007 . . . . 29.14 103.081 -172.8 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' H' H ' 220' ' ' CYS . . . . . . . . . . . . . 3.7 m -147.43 132.6 18.35 Favored 'General case' 0 C--N 1.274 -2.71 0 C-N-CA 129.658 3.183 . . . . 30.84 106.501 178.561 -38.84 -179.15 69.002 108.346 2.025 106.867 57.872 -161.111 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 221' ' ' ASP . . . . . 0.841 ' O ' ' NH2' ' H' ' 187' ' ' ARG . 27.3 t0 52.35 33.51 13.05 Favored 'General case' 0 C--O 1.272 2.271 0 C-N-CA 128.339 2.655 . . . . 32.32 114.438 178.39 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 221' A ARG . . . . . . . . . . . . . 7.6 mtt85 -78.13 147.31 34.66 Favored 'General case' 0 C--O 1.258 1.51 0 O-C-N 124.014 0.822 . . . . 42.08 110.146 175.402 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 222' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -66.51 142.52 57.5 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 118.056 -1.457 . . . . 45.51 107.125 178.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 223' ' ' GLY . . . . . . . . . . . . . . . 66.51 10.1 52.73 Favored Glycine 0 N--CA 1.43 -1.759 0 C-N-CA 128.814 3.102 . . . . 32.67 116.559 -179.476 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 224' ' ' LYS . . . . . 0.472 ' HE2' ' O ' ' H' ' 528' ' ' HOH . 54.8 mmtt -113.26 146.19 39.77 Favored 'General case' 0 C--N 1.309 -1.153 0 C-N-CA 126.61 1.964 . . . . 34.64 109.296 174.888 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 225' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -128.41 154.55 45.92 Favored 'General case' 0 N--CA 1.434 -1.225 0 C-N-CA 128.301 2.64 . . . . 25.71 113.301 -176.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 226' ' ' GLY . . . . . 0.408 ' O ' ' HB2' ' H' ' 182' ' ' CYS . . . -81.84 148.46 27.37 Favored Glycine 0 N--CA 1.493 2.439 0 N-CA-C 105.717 -2.953 . . . . 23.02 105.717 177.139 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 227' ' ' PHE . . . . . 0.438 ' CE2' ' HB3' ' H' ' 182' ' ' CYS . 47.9 m-85 -120.38 131.47 54.84 Favored 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 126.014 1.726 . . . . 21.43 108.717 179.743 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 228' ' ' TYR . . . . . 0.406 ' HA ' ' O ' ' H' ' 212' ' ' ILE 0.353 98.8 m-85 -123.88 149.95 45.22 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 114.885 -2.483 . . . . 22.36 110.802 -177.094 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 229' ' ' THR . . . . . . . . . . . . . 8.7 m -69.97 129.56 39.82 Favored 'General case' 0 C--O 1.285 2.959 0 O-C-N 128.146 3.404 . . . . 22.47 107.436 174.002 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 230' ' ' HIS . . . . . . . . . . . . 0.294 29.7 t-80 -81.19 94.3 6.64 Favored 'General case' 0 C--N 1.277 -2.563 0 CA-C-N 122.622 2.465 . . . . 23.98 109.439 178.422 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 231' ' ' VAL . . . . . . . . . . . . . 61.3 t -52.94 -50.54 43.59 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.26 0 C-N-CA 129.004 2.921 . . . . 22.51 110.591 -176.619 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 232' ' ' PHE . . . . . 0.573 ' CZ ' ' HA ' ' H' ' 126' ' ' ARG . 70.3 t80 -58.19 -40.36 81.35 Favored 'General case' 0 C--O 1.271 2.199 0 O-C-N 126.799 2.562 . . . . 29.32 111.743 -179.55 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 233' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.98 -23.27 66.3 Favored 'General case' 0 CA--C 1.508 -0.667 0 O-C-N 119.536 -1.978 . . . . 39.95 111.626 177.606 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 234' ' ' LEU . . . . . . . . . . . . . 13.6 mt -104.89 7.59 34.39 Favored 'General case' 0 CA--C 1.502 -0.88 0 CA-C-N 120.85 1.659 . . . . 29.56 115.212 178.926 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 235' ' ' LYS . . . . . 0.488 ' HA ' HD12 ' H' ' 238' ' ' ILE . 13.0 tttm -59.3 -36.15 75.09 Favored 'General case' 0 C--O 1.266 1.922 0 N-CA-C 114.414 1.264 . . . . 36.48 114.414 -176.285 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 236' ' ' LYS . . . . . 0.508 ' HB2' ' O ' ' H' ' 517' ' ' HOH . 27.0 mttt -57.38 -47.26 82.16 Favored 'General case' 0 C--O 1.248 1.024 0 C-N-CA 118.006 -1.477 . . . . 50.0 108.168 179.58 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 237' ' ' TRP . . . . . 0.631 ' O ' HG13 ' H' ' 241' ' ' VAL . 71.4 t90 -60.76 -36.1 78.09 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 114.872 -2.731 . . . . 32.36 109.689 -176.921 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 238' ' ' ILE . . . . . 0.488 HD12 ' HA ' ' H' ' 235' ' ' LYS . 15.0 mt -66.99 -53.32 35.09 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.868 0 CA-C-N 115.877 -0.602 . . . . 33.07 112.192 -179.242 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 239' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -47.54 -58.39 4.28 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-O 127.222 3.391 . . . . 50.0 105.798 178.389 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 240' ' ' LYS . . . . . . . . . . . . . 1.5 tttt -43.45 -58.33 2.65 Favored 'General case' 0 C--O 1.273 2.33 0 CA-C-N 110.109 -3.223 . . . . 50.0 115.93 179.119 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 241' ' ' VAL . . . . . 0.631 HG13 ' O ' ' H' ' 237' ' ' TRP . 1.9 m -68.77 -27.33 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 CA-C-N 123.853 3.024 . . . . 40.84 112.827 -177.468 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 242' ' ' ILE . . . . . . . . . . . . 0.327 52.2 mt -68.75 -35.32 69.23 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 CA-C-O 116.791 -1.576 . . . . 44.57 109.938 -178.959 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 243' ' ' ASP . . . . . . . . . . . . 0.361 2.0 p-10 -81.39 -35.96 30.14 Favored 'General case' 0 C--O 1.262 1.729 0 CA-C-O 113.405 -3.188 . . . . 50.0 114.434 176.392 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 244' ' ' GLN . . . . . 0.954 ' HG2' ' CD2' ' H' ' 245' ' ' PHE . 2.7 tt0 -65.47 -52.08 55.53 Favored 'General case' 0 C--N 1.298 -1.635 0 CA-C-O 124.889 2.28 . . . . 50.0 108.023 178.751 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 245' ' ' PHE . . . . . 0.954 ' CD2' ' HG2' ' H' ' 244' ' ' GLN . 56.4 m-85 -92.46 1.41 57.26 Favored 'General case' 0 C--O 1.26 1.656 0 N-CA-C 118.388 2.736 . . . . 50.0 118.388 -173.775 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 246' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.291 3.659 1 CA-C-O 112.954 -4.248 . . . . 50.0 113.074 175.329 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 55' ' ' ASP . . . . . . . . . . . . 0.283 4.9 p-10 . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 121.273 0.559 . . . . 50.0 109.569 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 56' ' ' PHE . . . . . 0.486 ' CD2' ' HE1' ' H' ' 34' ' ' PHE . 36.2 m-85 -81.54 124.95 29.92 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.067 -0.97 . . . . 48.5 108.916 -179.999 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 57' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -64.86 139.94 58.81 Favored 'General case' 0 C--O 1.251 1.175 0 N-CA-C 103.423 -2.806 . . . . 50.0 103.423 174.392 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 58' ' ' GLU . . . . . 0.502 ' CD ' ' H ' ' I' ' 58' ' ' GLU . 1.2 mp0 -57.08 144.09 35.91 Favored 'General case' 0 C--O 1.269 2.096 0 CA-C-N 111.667 -2.515 . . . . 50.0 108.668 -178.817 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 59' ' ' ILE . . . . . . . . . . . . . 8.2 pt -107.2 158.75 32.28 Favored Pre-proline 0 N--CA 1.476 0.864 0 O-C-N 126.906 2.629 . . . . 48.8 108.809 178.088 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 60' ' ' PRO . . . . . 0.432 ' O ' ' HB3' ' I' ' 63' ' ' TYS . 4.3 Cg_exo -62.6 125.41 16.07 Favored 'Trans proline' 0 C--O 1.251 1.135 1 C-N-CA 125.947 4.431 . . . . 49.89 114.705 177.458 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' I' I ' 61' ' ' GLU . . . . . 0.485 ' C ' ' N ' ' I' ' 63' ' ' TYS . . . -44.34 -36.25 2.72 Favored 'General case' 0 N--CA 1.436 -1.152 0 C-N-CA 127.553 2.341 . . . . 50.0 115.289 -177.703 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 62' ' ' GLU . . . . . 0.483 ' OE1' ' N ' ' I' ' 62' ' ' GLU . 20.9 pm0 -61.18 -10.09 5.97 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 116.363 -2.135 . . . . 50.0 106.406 -177.73 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 63' ' ' TYS . . . . . 0.485 ' N ' ' C ' ' I' ' 61' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 64' ' ' LEU . . . . . . . . . . . . 0.309 13.2 mt . . . . . 0 C--O 1.291 3.281 1 CA-C-O 111.577 -4.059 . . . . 50.0 110.496 177.596 . . . . . . . . 2 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 ' H' H ' 372' ' ' 00L . . . . . 1.26 ' C ' ' OG ' ' H' ' 195' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 443' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 454' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 477' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 484' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 485' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 ' 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 ' 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 ' 420' ' ' 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 ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 426' ' ' 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 ' 430' ' ' 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 ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 438' ' ' HOH . . . . . 0.476 ' O ' ' HD3' ' H' ' 186' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 ' 444' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 445' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 446' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 447' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 448' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 453' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 455' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 456' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 457' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 458' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 ' 462' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 463' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 464' ' ' 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 ' 467' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 468' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 469' ' ' 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 ' 478' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 479' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 480' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 481' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 482' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 483' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 486' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 487' ' ' 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 ' 496' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 497' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 498' ' ' HOH . . . . . 0.56 ' O ' ' NH1' ' H' ' 175' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 499' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 500' ' ' HOH . . . . . 0.809 ' O ' ' HD2' ' H' ' 97' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 501' ' ' HOH . . . . . 0.52 ' O ' ' HB3' ' H' ' 126' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 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 ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 517' ' ' HOH . . . . . 0.508 ' O ' ' HB2' ' H' ' 236' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 518' ' ' HOH . . . . . 0.442 ' O ' ' NE2' ' H' ' 151' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 ' 523' ' ' 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 . . . . . 0.472 ' O ' ' HE2' ' H' ' 224' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 531' ' ' 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 . . . . . 0.403 ' O ' HD22 ' L' ' 3' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_