data_1a61_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 1a61 _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 1.494 1.755 0 CA-C-O 125.476 2.56 . . . . 46.33 111.922 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 1' A ASP . . . . . 0.673 ' CA ' ' O ' ' L' ' 478' ' ' HOH . 12.8 t0 -100.77 21.56 13.35 Favored 'General case' 0 C--O 1.258 1.523 0 CA-C-N 108.712 -3.858 . . . . 50.0 107.406 171.27 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 1' ' ' CYS . . . . . . . . . . . . . 14.3 p -57.13 148.31 22.32 Favored 'General case' 0 CA--C 1.534 0.346 1 CA-C-O 130.174 4.797 . . . . 26.47 114.667 -178.786 75.452 72.874 101.901 103.597 2.012 103.964 -57.875 -60.52 2 2 . 1 . 001 ecloud orig full ' L' L ' 2' ' ' GLY . . . . . . . . . . . . . . . 56.54 23.51 43.17 Favored Glycine 0 C--O 1.256 1.48 0 CA-C-O 113.509 -3.939 . . . . 19.12 113.874 174.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 3' ' ' LEU . . . . . . . . . . . . . 85.4 mt -115.27 102.52 9.95 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-O 113.86 -2.971 . . . . 19.36 105.969 175.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 4' ' ' ARG . . . . . . . . . . . . . 76.1 mtm180 -65.04 131.09 95.09 Favored Pre-proline 0 N--CA 1.488 1.455 0 O-C-N 129.01 3.944 . . . . 20.2 115.337 -171.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 5' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -58.79 -27.32 83.48 Favored 'Trans proline' 0 C--O 1.269 2.063 0 CA-C-O 113.403 -2.832 . . . . 26.57 112.658 177.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 6' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -100.97 -1.65 33.86 Favored 'General case' 0 C--O 1.252 1.209 1 O-C-N 113.12 -5.988 . . . . 24.05 112.644 -178.097 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' L' L ' 7' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -125.0 -84.03 0.64 Allowed 'General case' 0 N--CA 1.503 2.179 0 C-N-CA 115.895 -2.322 . . . . 26.02 108.955 -172.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 8' ' ' GLU . . . . . . . . . . . . . 20.1 mp0 -55.77 -51.39 67.56 Favored 'General case' 0 C--N 1.306 -1.306 0 C-N-CA 128.249 2.62 . . . . 22.2 110.705 -176.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 9' ' ' LYS . . . . . 0.483 ' CE ' ' OD2' ' L' ' 1' A ASP . 4.1 mmtp -60.21 -16.01 29.43 Favored 'General case' 0 C--N 1.328 -0.355 0 O-C-N 126.428 2.33 . . . . 32.13 113.069 179.377 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 10' ' ' LYS . . . . . 0.617 ' NZ ' ' O ' ' L' ' 423' ' ' HOH . 17.7 mtpt -116.76 2.31 12.88 Favored 'General case' 0 C--O 1.261 1.666 0 O-C-N 119.35 -2.094 . . . . 32.07 109.498 -179.645 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 11' ' ' SER . . . . . . . . . . . . . 4.0 t 59.59 38.35 22.23 Favored 'General case' 0 C--O 1.258 1.549 0 N-CA-C 115.771 1.767 . . . . 24.9 115.771 -176.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 12' ' ' LEU . . . . . . . . . . . . . 86.0 mt -109.38 145.26 36.38 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 105.626 -1.99 . . . . 28.25 105.626 175.28 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 13' ' ' GLU . . . . . . . . . . . . 0.364 69.8 mt-10 -106.18 143.44 34.3 Favored 'General case' 0 C--O 1.279 2.621 0 CA-C-O 113.931 -2.938 . . . . 42.62 110.029 176.825 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 14' ' ' ASP . . . . . 0.462 ' OD2' ' NH1' ' H' ' 137' ' ' ARG . 1.5 p30 -74.04 156.79 37.12 Favored 'General case' 0 C--O 1.258 1.55 0 O-C-N 128.289 3.493 . . . . 24.09 105.174 171.348 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 14' A LYS . . . . . 0.497 ' NZ ' ' O ' ' L' ' 514' ' ' HOH 0.273 0.0 OUTLIER -68.28 -6.53 24.4 Favored 'General case' 0 C--O 1.254 1.325 0 CA-C-O 112.336 -3.697 . . . . 50.0 116.12 -172.333 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' L' L ' 14' B THR . . . . . . . . . . . . . 51.6 p -130.56 4.12 4.63 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-N 124.764 3.438 . . . . 26.63 109.026 175.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' C GLU . . . . . . . . . . . . . 12.7 pt-20 -61.27 -31.61 71.42 Favored 'General case' 0 C--O 1.257 1.481 0 O-C-N 126.536 2.397 . . . . 28.98 111.769 -176.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' D ARG . . . . . 0.786 ' NH1' ' OE2' ' L' ' 14' H GLU . 0.0 OUTLIER -61.1 -27.4 68.34 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 116.67 -2.012 . . . . 50.0 114.631 177.785 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' L' L ' 14' E GLU . . . . . . . . . . . . . 14.3 tt0 -61.07 -49.89 75.53 Favored 'General case' 0 C--N 1.308 -1.237 0 C-N-CA 127.314 2.245 . . . . 38.4 106.261 -179.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' F LEU . . . . . . . . . . . . . 2.7 mp -49.73 -68.02 0.21 Allowed 'General case' 0 C--O 1.242 0.668 0 CA-C-O 116.887 -1.53 . . . . 28.78 112.008 170.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' G LEU . . . . . . . . . . . . . 3.7 mm? -56.48 -33.31 65.83 Favored 'General case' 0 C--N 1.306 -1.325 0 CA-C-O 124.367 2.032 . . . . 33.16 113.678 -170.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' H GLU . . . . . 0.786 ' OE2' ' NH1' ' L' ' 14' D ARG . 61.8 mt-10 -67.49 -26.14 66.21 Favored 'General case' 0 C--N 1.291 -1.939 0 CA-C-O 113.057 -3.354 . . . . 33.87 110.652 178.981 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 14' I SER . . . . . . . . . . . . . 53.9 p -84.89 -7.94 58.97 Favored 'General case' 0 N--CA 1.473 0.705 1 O-C-N 129.349 4.156 . . . . 30.39 112.302 -177.78 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 14' J TYR . . . . . . . . . . . . . 8.7 m-30 -91.1 56.85 3.28 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 102.904 -2.999 . . . . 37.84 102.904 -178.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' K ILE . . . . . . . . . . . . 0.355 0.0 OUTLIER . . . . . 0 C--O 1.28 2.706 0 C-N-CA 129.785 3.234 . . . . 50.0 114.358 -169.934 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 16' ' ' ILE . . . . . . . . . . . . . 36.0 mm . . . . . 0 C--O 1.246 0.906 0 CA-C-O 113.255 -3.259 . . . . 23.91 105.493 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 17' ' ' VAL . . . . . 0.419 ' O ' ' CB ' ' H' ' 18' ' ' GLU . 85.0 t -110.52 128.79 66.57 Favored 'Isoleucine or valine' 0 C--O 1.244 0.799 0 O-C-N 128.695 3.747 . . . . 28.59 110.061 -179.656 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 18' ' ' GLU . . . . . 0.419 ' CB ' ' O ' ' H' ' 17' ' ' VAL . 30.3 mm-40 67.44 24.52 8.79 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-O 111.96 -3.876 . . . . 48.22 109.314 175.343 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 19' ' ' GLY . . . . . . . . . . . . . . . -94.73 -142.72 12.94 Favored Glycine 0 CA--C 1.54 1.622 0 O-C-N 126.395 2.309 . . . . 31.5 110.33 178.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 20' ' ' SER . . . . . . . . . . . . . 17.4 p -167.45 158.48 11.57 Favored 'General case' 0 C--O 1.248 0.976 0 N-CA-C 106.504 -1.665 . . . . 39.6 106.504 179.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 21' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -57.85 142.22 46.59 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 115.014 -0.994 . . . . 41.57 108.723 -177.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 22' ' ' ALA . . . . . . . . . . . . 0.308 . . -77.49 164.47 25.39 Favored 'General case' 0 C--N 1.295 -1.8 0 N-CA-C 104.16 -2.533 . . . . 29.68 104.16 178.28 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 23' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -85.73 167.03 15.64 Favored 'General case' 0 C--N 1.306 -1.296 0 C-N-CA 128.274 2.63 . . . . 37.05 104.552 170.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 24' ' ' ILE . . . . . . . . . . . . . 2.4 mm -81.49 143.6 11.94 Favored 'Isoleucine or valine' 0 C--O 1.259 1.571 0 N-CA-C 102.492 -3.151 . . . . 26.25 102.492 -174.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.81 17.51 58.19 Favored Glycine 0 C--N 1.286 -2.228 1 CA-C-O 110.655 -5.525 . . . . 22.66 113.306 -174.804 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 26' ' ' MET . . . . . . . . . . . . . 3.7 ttt -70.75 -32.93 70.26 Favored 'General case' 0 C--O 1.277 2.522 1 CA-C-N 124.895 4.347 . . . . 24.51 113.07 175.487 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 27' ' ' SER . . . . . . . . . . . . . 1.3 m -134.2 78.86 57.4 Favored Pre-proline 0 N--CA 1.485 1.296 0 C-N-CA 124.531 1.132 . . . . 27.53 109.168 179.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 28' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -73.01 -7.95 21.46 Favored 'Trans proline' 0 C--N 1.308 -1.559 0 O-C-N 124.614 1.849 . . . . 18.26 113.43 -176.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 29' ' ' TRP . . . . . . . . . . . . . 2.7 p90 -98.0 -0.85 43.93 Favored 'General case' 0 C--O 1.273 2.335 0 CA-C-O 116.462 -1.733 . . . . 17.83 111.081 178.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 30' ' ' GLN . . . . . 0.413 ' OE1' ' OG1' ' H' ' 139' ' ' THR . 64.0 tp60 -72.9 119.0 16.53 Favored 'General case' 0 C--O 1.256 1.435 0 O-C-N 126.678 2.486 . . . . 23.61 113.532 178.745 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 31' ' ' VAL . . . . . . . . . . . . . 76.2 t -109.85 151.8 12.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 C-N-CA 125.492 1.517 . . . . 22.82 110.652 -174.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 32' ' ' MET . . . . . . . . . . . . . 15.6 ttm -112.66 121.95 46.25 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 105.578 -2.008 . . . . 29.07 105.578 179.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -83.56 122.04 28.04 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 105.237 -2.134 . . . . 34.35 105.237 175.618 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 34' ' ' PHE . . . . . 0.471 ' N ' ' O ' ' H' ' 65' ' ' LEU . 61.4 t80 -122.82 125.78 46.12 Favored 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 117.297 -1.761 . . . . 30.9 111.684 -172.048 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 35' ' ' ARG . . . . . 0.553 ' NH1' ' OE2' ' H' ' 39' ' ' GLU . 48.1 ttt180 -77.92 133.45 38.07 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 117.101 -1.839 . . . . 40.66 109.856 176.976 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 36' ' ' LYS . . . . . . . . . . . . . 14.0 mttt -66.32 -36.08 82.01 Favored 'General case' 0 C--O 1.261 1.689 0 N-CA-C 114.47 1.285 . . . . 45.66 114.47 178.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 36' A SER . . . . . . . . . . . . . 0.2 OUTLIER -159.85 105.06 1.43 Allowed Pre-proline 0 N--CA 1.491 1.58 0 CA-C-O 114.942 -2.456 . . . . 50.0 112.615 -171.841 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 37' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_endo -66.79 157.99 81.53 Favored 'Cis proline' 0 C--N 1.308 -1.579 0 O-C-N 124.995 2.05 . . . . 42.69 111.429 1.374 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 38' ' ' GLN . . . . . 0.422 ' O ' ' CB ' ' H' ' 39' ' ' GLU . 87.9 mt-30 -69.25 132.22 46.13 Favored 'General case' 0 C--O 1.258 1.521 0 N-CA-C 103.797 -2.668 . . . . 46.99 103.797 179.794 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 39' ' ' GLU . . . . . 0.553 ' OE2' ' NH1' ' H' ' 35' ' ' ARG . 10.1 pt-20 -178.71 147.23 0.37 Allowed 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 115.322 -2.551 . . . . 44.11 111.948 178.71 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 40' ' ' LEU . . . . . . . . . . . . . 3.1 tp -70.44 109.53 4.83 Favored 'General case' 0 C--O 1.244 0.764 0 O-C-N 127.295 2.872 . . . . 35.91 111.158 -179.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 41' ' ' LEU . . . . . 0.62 ' CD2' ' CD2' ' H' ' 64' ' ' LEU . 0.2 OUTLIER -69.06 -60.22 2.51 Favored 'General case' 0 C--O 1.256 1.443 0 O-C-N 128.627 3.704 . . . . 29.73 110.847 174.767 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 42' ' ' CYS . . . . . . . . . . . . . 91.2 m -159.27 -168.01 2.21 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 105.479 -2.045 . . . . 23.74 105.479 -179.555 -68.342 -177.225 -109.635 103.349 2.019 102.872 -87.366 -76.33 1 1 . 1 . 001 ecloud orig full ' H' H ' 43' ' ' GLY . . . . . . . . . . . . . . . -100.77 176.87 27.64 Favored Glycine 0 C--O 1.269 2.337 0 CA-C-O 126.143 3.079 . . . . 20.94 106.957 170.174 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 44' ' ' ALA . . . . . . . . . . . . . . . -170.35 -173.39 1.45 Allowed 'General case' 0 N--CA 1.504 2.237 0 C-N-CA 115.289 -2.565 . . . . 18.8 105.312 179.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 45' ' ' SER . . . . . . . . . . . . . 36.9 p -146.31 151.87 38.22 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 125.651 1.844 . . . . 21.97 115.48 172.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 46' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -90.84 116.79 28.95 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 127.147 2.179 . . . . 21.58 111.331 179.224 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 47' ' ' ILE . . . . . . . . . . . . 0.26 3.2 pt -110.25 -22.1 5.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-O 115.265 -2.302 . . . . 27.98 110.486 -176.538 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 48' ' ' SER . . . . . . . . . . . . . 60.1 p -154.95 174.67 14.82 Favored 'General case' 0 C--O 1.264 1.841 0 O-C-N 124.975 1.422 . . . . 30.99 107.167 175.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 49' ' ' ASP . . . . . 0.522 ' OD2' ' CB ' ' H' ' 111' ' ' PRO . 18.4 p-10 -76.16 17.13 0.37 Allowed 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 117.078 -1.849 . . . . 40.43 114.266 -177.452 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 50' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -148.66 -5.84 0.41 Allowed 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 113.837 -2.982 . . . . 50.0 109.937 -179.55 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 51' ' ' TRP . . . . . 0.99 ' CE3' ' O ' ' H' ' 548' ' ' HOH . 92.9 m95 -125.05 133.11 53.06 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 127.601 3.063 . . . . 31.73 111.38 -176.887 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 52' ' ' VAL . . . . . . . . . . . . . 69.0 t -117.49 135.61 57.34 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 CA-C-N 112.206 -2.27 . . . . 25.65 109.368 178.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 53' ' ' LEU . . . . . . . . . . . . . 16.9 tp -101.39 129.34 47.39 Favored 'General case' 0 C--O 1.248 0.976 0 O-C-N 120.6 -1.312 . . . . 20.93 108.512 177.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 54' ' ' THR . . . . . . . . . . . . . 1.3 t -137.22 -172.07 3.11 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-O 117.265 -1.35 . . . . 22.64 109.357 175.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 55' ' ' ALA . . . . . . . . . . . . . . . -93.39 129.12 39.64 Favored 'General case' 0 C--O 1.267 1.976 1 C-N-CA 132.234 4.214 . . . . 20.6 106.625 174.01 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 56' ' ' ALA . . . . . . . . . . . . . . . -62.17 -33.32 74.3 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-N 120.789 1.631 . . . . 20.11 111.331 -179.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 57' ' ' HIS . . . . . 0.439 ' NE2' ' N1X' ' H' ' 372' ' ' 00N . 2.0 p-80 -63.66 -12.8 36.94 Favored 'General case' 0 C--O 1.261 1.702 1 O-C-N 115.123 -4.736 . . . . 20.14 114.598 -178.244 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 58' ' ' CYS . . . . . . . . . . . . . 51.2 m -73.66 -30.04 62.68 Favored 'General case' 0 C--O 1.253 1.27 0 CA-C-O 115.883 -2.008 . . . . 23.99 109.968 179.343 -76.33 -87.366 -109.635 102.872 2.019 103.349 -177.225 -68.342 1 1 . 1 . 001 ecloud orig full ' H' H ' 59' ' ' LEU . . . . . . . . . . . . . 37.1 mt -99.53 -37.63 9.09 Favored 'General case' 0 C--O 1.218 -0.58 0 O-C-N 126.995 2.684 . . . . 29.64 112.296 176.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' ' ' LEU . . . . . . . . . . . . . 49.8 tp -132.61 116.46 16.7 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 120.875 1.67 . . . . 27.7 114.505 -178.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' A TYR . . . . . . . . . . . . . 14.1 t80 -155.85 85.52 3.27 Favored Pre-proline 0 N--CA 1.476 0.851 0 CA-C-O 125.101 2.381 . . . . 26.02 108.513 -179.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' B PRO . . . . . 0.406 ' N ' ' CD ' ' H' ' 60' C PRO . 8.1 Cg_exo -54.67 -37.16 91.34 Favored 'Trans proline' 0 N--CA 1.482 0.848 0 CA-C-N 111.686 -1.934 . . . . 27.48 116.7 -178.008 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 60' C PRO . . . . . 0.406 ' CD ' ' N ' ' H' ' 60' B PRO . 16.1 Cg_exo -56.5 -31.75 87.21 Favored 'Trans proline' 0 C--N 1.305 -1.717 0 O-C-N 116.603 -2.367 . . . . 31.82 114.022 177.919 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 60' D TRP . . . . . . . . . . . . . 43.9 m0 -102.3 4.86 39.57 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 115.228 -2.32 . . . . 31.15 107.667 -179.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' E ASP . . . . . 0.447 ' OD2' ' O ' ' H' ' 425' ' ' HOH . 35.7 m-20 62.69 39.27 11.33 Favored 'General case' 0 C--O 1.25 1.089 0 O-C-N 128.781 3.801 . . . . 49.7 111.103 -178.624 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 60' F LYS . . . . . . . . . . . . . 12.0 tttt -106.31 117.2 33.41 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 107.21 -1.404 . . . . 44.29 107.21 176.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' G ASN . . . . . 0.532 ' ND2' ' O ' ' H' ' 441' ' ' HOH . 49.0 t-20 -145.63 74.25 1.38 Allowed 'General case' 0 C--O 1.253 1.281 0 C-N-CA 125.659 1.583 . . . . 37.47 112.784 176.955 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 60' H PHE . . . . . . . . . . . . . 58.6 m-85 -78.47 150.47 32.97 Favored 'General case' 0 C--O 1.244 0.777 0 CA-C-N 120.511 1.505 . . . . 34.81 113.204 -178.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' I THR . . . . . . . . . . . . . 0.4 OUTLIER -117.54 162.86 17.3 Favored 'General case' 0 C--O 1.243 0.739 1 CA-C-N 108.171 -4.104 . . . . 43.03 110.666 179.23 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 61' ' ' GLU . . . . . . . . . . . . . 59.3 mp0 -52.25 -47.74 65.61 Favored 'General case' 0 C--O 1.259 1.604 0 CA-C-O 123.482 1.611 . . . . 47.46 112.693 -177.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 62' ' ' ASN . . . . . . . . . . . . 0.266 41.9 m-20 -52.94 -35.64 58.82 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-O 124.351 2.024 . . . . 50.0 112.525 178.428 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 63' ' ' ASP . . . . . . . . . . . . . 91.5 m-20 -67.83 -19.73 65.09 Favored 'General case' 0 C--O 1.244 0.795 0 CA-C-N 111.756 -2.475 . . . . 50.0 114.552 -170.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 64' ' ' LEU . . . . . 0.62 ' CD2' ' CD2' ' H' ' 41' ' ' LEU . 24.3 mt -125.64 161.03 28.17 Favored 'General case' 0 CA--C 1.518 -0.253 1 O-C-N 129.9 4.5 . . . . 46.08 118.972 -172.442 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 65' ' ' LEU . . . . . 0.471 ' O ' ' N ' ' H' ' 34' ' ' PHE . 0.2 OUTLIER -135.67 132.85 37.5 Favored 'General case' 0 C--N 1.308 -1.202 1 C-N-CA 132.272 4.229 . . . . 33.89 111.959 174.731 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' H' H ' 66' ' ' VAL . . . . . . . . . . . . 0.264 1.4 t -106.67 128.58 61.23 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.084 0 CA-C-N 110.603 -2.999 . . . . 33.36 108.627 -179.682 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 67' ' ' ARG . . . . . . . . . . . . . 67.3 mtp180 -127.96 115.0 17.86 Favored 'General case' 0 C--O 1.271 2.189 1 O-C-N 115.949 -4.219 . . . . 27.22 111.763 -177.263 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 68' ' ' ILE . . . . . . . . . . . . . 1.9 mt -106.07 144.86 14.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 111.362 -2.653 . . . . 24.67 113.063 -176.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 69' ' ' GLY . . . . . . . . . . . . . . . 87.22 13.33 66.18 Favored Glycine 0 CA--C 1.522 0.488 0 C-N-CA 127.972 2.701 . . . . 25.18 113.242 173.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 70' ' ' LYS . . . . . . . . . . . . . 5.7 mtpp -80.82 154.4 27.15 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 115.073 1.509 . . . . 28.59 115.073 -175.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 71' ' ' HIS . . . . . . . . . . . . . 84.5 t60 -126.23 -49.76 1.56 Allowed 'General case' 0 C--O 1.242 0.678 0 CA-C-N 110.05 -3.25 . . . . 28.12 107.317 175.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 72' ' ' SER . . . . . . . . . . . . . 22.8 t -81.33 129.35 34.58 Favored 'General case' 0 C--O 1.254 1.307 0 O-C-N 118.609 -2.557 . . . . 30.44 108.156 -176.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 73' ' ' ARG . . . . . 0.575 ' NH2' ' O ' ' H' ' 443' ' ' HOH . 55.2 ttp85 -63.02 -45.87 90.27 Favored 'General case' 0 N--CA 1.485 1.32 1 O-C-N 129.934 4.521 . . . . 37.48 115.004 175.911 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 74' ' ' THR . . . . . 0.675 ' O ' ' O ' ' H' ' 482' ' ' HOH . 25.9 p -112.26 -20.17 11.96 Favored 'General case' 0 N--CA 1.486 1.374 0 N-CA-C 120.494 3.516 . . . . 34.34 120.494 -177.334 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 75' ' ' ARG . . . . . 1.133 ' NH1' ' CG ' ' H' ' 75' ' ' ARG . 0.0 OUTLIER -70.42 151.2 45.44 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 115.313 -2.28 . . . . 45.1 109.968 175.168 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 76' ' ' TYR . . . . . . . . . . . . . 33.8 t80 -87.25 101.06 13.17 Favored 'General case' 0 C--N 1.312 -1.047 0 O-C-N 128.085 3.365 . . . . 40.84 105.262 171.124 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 77' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -73.68 85.1 1.62 Allowed 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 129.103 2.961 . . . . 34.59 115.13 -177.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 77' A ARG . . . . . . . . . . . . . 3.9 ttp85 -62.93 122.28 15.62 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 131.418 3.887 . . . . 33.33 108.743 -175.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 78' ' ' ASN . . . . . . . . . . . . . 2.1 m120 83.57 -7.66 1.11 Allowed 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 112.909 -1.95 . . . . 36.13 113.337 -178.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 79' ' ' ILE . . . . . . . . . . . . . 51.2 mt -109.66 -51.39 6.61 Favored 'Isoleucine or valine' 0 C--O 1.252 1.237 0 O-C-N 119.077 -2.264 . . . . 32.69 115.594 178.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 80' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -92.87 135.71 33.89 Favored 'General case' 0 CA--C 1.485 -1.534 0 CA-C-O 115.711 -2.09 . . . . 29.69 114.821 -171.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.85 133.8 46.04 Favored 'General case' 0 C--O 1.253 1.282 0 CA-C-N 120.691 1.587 . . . . 38.2 106.863 176.432 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 82' ' ' ILE . . . . . . . . . . . . . 53.3 mt -108.46 124.68 65.05 Favored 'Isoleucine or valine' 0 C--O 1.246 0.912 0 CA-C-O 113.793 -3.003 . . . . 33.0 106.961 179.17 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 83' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -125.24 176.49 6.71 Favored 'General case' 0 C--N 1.318 -0.767 0 O-C-N 126.387 2.304 . . . . 34.98 110.113 176.598 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 84' ' ' MET . . . . . . . . . . . . . 21.4 mtt -114.96 150.54 35.6 Favored 'General case' 0 C--N 1.307 -1.272 1 CA-C-N 108.1 -4.136 . . . . 50.0 109.837 -178.1 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 85' ' ' LEU . . . . . 0.773 ' CD1' ' CE ' ' H' ' 106' ' ' MET . 0.6 OUTLIER -92.63 139.33 30.68 Favored 'General case' 0 C--O 1.245 0.847 0 N-CA-C 106.465 -1.68 . . . . 38.44 106.465 -179.133 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 86' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -95.64 -19.74 19.49 Favored 'General case' 0 C--O 1.258 1.509 1 O-C-N 130.408 4.818 . . . . 50.0 105.866 174.59 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 87' ' ' LYS . . . . . . . . . . . . 0.354 0.3 OUTLIER -178.64 153.5 0.69 Allowed 'General case' 0 N--CA 1.483 1.213 0 O-C-N 119.803 -1.81 . . . . 46.72 113.708 -177.954 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 88' ' ' ILE . . . . . . . . . . . . . 96.3 mt -121.14 132.54 70.3 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 C-N-CA 124.916 1.286 . . . . 36.55 112.241 176.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 89' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -122.0 112.39 18.22 Favored 'General case' 0 C--N 1.287 -2.137 0 C-N-CA 129.135 2.974 . . . . 38.81 110.706 177.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 90' ' ' ILE . . . . . . . . . . . . . 32.3 mm -93.58 144.81 8.75 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.797 0 C-N-CA 127.94 2.496 . . . . 26.35 107.543 177.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 91' ' ' HIS . . . . . . . . . . . . . 14.8 t-80 -66.53 123.57 86.03 Favored Pre-proline 0 N--CA 1.501 2.08 0 CA-C-O 126.706 3.146 . . . . 28.21 107.673 175.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 92' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_endo -46.89 -38.0 22.65 Favored 'Trans proline' 0 CA--C 1.544 1.015 0 O-C-N 117.715 -1.781 . . . . 31.16 111.611 -178.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 93' ' ' ARG . . . . . . . . . . . . . 14.9 mtp180 -103.65 34.4 2.99 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 116.658 2.095 . . . . 39.44 116.658 179.08 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 94' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -73.28 135.69 44.47 Favored 'General case' 0 N--CA 1.494 1.748 0 N-CA-C 103.067 -2.938 . . . . 24.03 103.067 -179.325 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 95' ' ' ASN . . . . . . . . . . . . . 53.7 t-20 -106.24 85.62 2.22 Favored 'General case' 0 C--N 1.288 -2.075 0 C-N-CA 126.284 1.834 . . . . 25.51 109.456 -176.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 96' ' ' TRP . . . . . . . . . . . . . 54.5 p-90 -79.07 -22.03 45.92 Favored 'General case' 0 C--O 1.26 1.609 0 CA-C-O 114.436 -2.697 . . . . 27.96 108.573 178.278 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 97' ' ' ARG . . . . . . . . . . . . . 92.8 mtt-85 -70.94 -37.08 72.84 Favored 'General case' 0 C--O 1.254 1.34 1 O-C-N 130.554 4.909 . . . . 40.71 117.626 -179.839 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 97' A GLU . . . . . 0.481 ' OE2' ' NE ' ' H' ' 175' ' ' ARG . 41.3 tt0 -118.4 -62.43 1.54 Allowed 'General case' 0 C--O 1.264 1.832 0 CA-C-N 123.869 3.031 . . . . 35.7 111.057 -179.142 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 98' ' ' ASN . . . . . . . . . . . . . 38.2 p30 -129.71 6.49 5.15 Favored 'General case' 0 C--O 1.254 1.33 0 CA-C-O 113.229 -3.272 . . . . 25.88 118.806 -173.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 99' ' ' LEU . . . . . . . . . . . . . 6.0 mt 80.02 35.62 0.14 Allowed 'General case' 0 C--N 1.293 -1.87 0 CA-C-N 123.893 3.042 . . . . 25.08 107.495 179.815 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 100' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -76.82 132.85 39.42 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 128.027 3.329 . . . . 24.0 105.458 -176.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 101' ' ' ARG . . . . . . . . . . . . . 56.5 mtt85 69.63 38.58 1.69 Allowed 'General case' 0 N--CA 1.476 0.865 0 O-C-N 127.465 2.978 . . . . 38.08 112.77 -178.154 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 102' ' ' ASP . . . . . 0.428 ' OD2' ' ND1' ' H' ' 57' ' ' HIS . 39.5 t0 -74.89 76.83 2.15 Favored 'General case' 0 N--CA 1.482 1.163 0 CA-C-N 114.549 -1.205 . . . . 19.27 112.116 -178.376 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 103' ' ' ILE . . . . . . . . . . . . . 8.6 tt -151.76 145.43 16.02 Favored 'Isoleucine or valine' 0 C--O 1.261 1.677 0 C-N-CA 128.794 2.838 . . . . 21.35 109.193 -174.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 104' ' ' ALA . . . . . . . . . . . . . . . -152.5 159.39 43.32 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 126.149 2.156 . . . . 24.06 106.961 179.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 105' ' ' LEU . . . . . . . . . . . . . 17.0 mt -128.06 151.33 49.3 Favored 'General case' 0 C--O 1.258 1.508 0 N-CA-C 106.976 -1.49 . . . . 29.15 106.976 176.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 106' ' ' MET . . . . . 0.894 ' C ' ' O ' ' H' ' 548' ' ' HOH . 26.1 mtp -138.16 111.25 7.84 Favored 'General case' 0 C--O 1.258 1.545 0 O-C-N 127.208 2.818 . . . . 35.49 107.868 -178.991 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 107' ' ' LYS . . . . . 0.539 ' NZ ' ' CA ' ' H' ' 246' ' ' GLY . 1.8 ttmt -79.7 126.32 30.78 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 127.511 3.007 . . . . 46.44 108.244 178.226 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 108' ' ' LEU . . . . . . . . . . . . . 10.7 mt -67.82 151.25 47.48 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-O 114.201 -2.809 . . . . 31.1 110.79 179.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.92 -36.5 82.39 Favored 'General case' 0 C--O 1.257 1.461 0 O-C-N 125.396 1.685 . . . . 47.42 107.183 174.241 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 110' ' ' LYS . . . . . . . . . . . . . 6.0 ptpt -143.69 152.93 57.35 Favored Pre-proline 0 N--CA 1.501 2.113 0 C-N-CA 114.663 -2.815 . . . . 46.05 107.58 -179.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 111' ' ' PRO . . . . . 0.522 ' CB ' ' OD2' ' H' ' 49' ' ' ASP . 1.5 Cg_endo -64.37 146.83 90.44 Favored 'Trans proline' 0 C--N 1.308 -1.56 0 O-C-N 125.848 2.499 . . . . 35.61 110.9 -174.896 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 112' ' ' VAL . . . . . . . . . . . . . 12.5 p -99.94 140.72 18.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 N-CA-C 103.219 -2.882 . . . . 34.2 103.219 -178.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 113' ' ' ALA . . . . . . . . . . . . . . . -87.59 138.64 31.29 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 100.695 -3.817 . . . . 31.78 100.695 178.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 114' ' ' PHE . . . . . . . . . . . . . 16.5 m-30 -78.08 166.83 22.32 Favored 'General case' 0 C--N 1.288 -2.078 1 O-C-N 129.839 4.462 . . . . 28.9 105.756 -177.294 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 115' ' ' SER . . . . . . . . . . . . . 1.1 p -170.86 -173.59 1.37 Allowed 'General case' 0 N--CA 1.487 1.416 0 O-C-N 126.504 2.378 . . . . 27.42 104.638 -174.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 116' ' ' ASP . . . . . 0.694 ' OD1' ' O ' ' H' ' 421' ' ' HOH . 51.7 m-20 -65.56 -24.95 67.21 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-N 123.469 2.849 . . . . 32.95 112.219 177.618 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 117' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -102.67 -12.69 17.5 Favored 'General case' 0 C--N 1.312 -1.059 0 N-CA-C 115.843 1.794 . . . . 37.15 115.843 -174.333 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 118' ' ' ILE . . . . . . . . . . . . . 6.6 mt -129.18 115.37 35.63 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.71 1 C-N-CA 131.792 4.037 . . . . 27.94 110.689 -175.264 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 119' ' ' HIS . . . . . . . . . . . . . 18.2 t60 -158.54 148.3 15.15 Favored Pre-proline 0 N--CA 1.483 1.204 0 O-C-N 128.946 3.904 . . . . 28.32 108.335 179.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 120' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -82.14 152.47 16.28 Favored 'Trans proline' 0 C--N 1.323 -0.804 0 C-N-CA 123.778 2.985 . . . . 24.99 114.741 177.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 121' ' ' VAL . . . . . . . . . . . . . 7.2 p -96.06 160.22 2.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 CA-C-N 112.181 -2.281 . . . . 17.71 107.257 177.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 122' ' ' CYS . . . . . . . . . . . . . 79.5 m -93.14 147.12 23.14 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 123.244 1.497 . . . . 20.66 112.196 177.308 -60.52 -57.875 101.901 103.964 2.012 103.597 72.874 75.452 1 1 . 1 . 001 ecloud orig full ' H' H ' 123' ' ' LEU . . . . . . . . . . . . . 52.7 mt -96.67 141.61 23.34 Favored Pre-proline 0 N--CA 1.488 1.456 0 N-CA-C 102.839 -3.023 . . . . 22.5 102.839 176.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 124' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -78.18 154.8 29.02 Favored 'Trans proline' 0 N--CA 1.444 -1.405 0 CA-C-O 126.242 2.518 . . . . 25.89 110.692 -174.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 125' ' ' ASP . . . . . 0.509 ' OD1' ' OG1' ' H' ' 128' ' ' THR . 17.4 p-10 -96.65 154.53 17.23 Favored 'General case' 0 C--N 1.299 -1.622 1 CA-C-O 128.908 4.194 . . . . 38.06 101.431 170.88 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 126' ' ' ARG . . . . . 0.719 ' N ' ' O ' ' H' ' 503' ' ' HOH . 57.9 ttt85 -45.65 -41.23 10.06 Favored 'General case' 0 CA--C 1.509 -0.628 1 CA-C-N 106.473 -4.876 . . . . 50.0 113.637 -179.912 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 127' ' ' GLU . . . . . 0.557 ' OE1' ' CB ' ' H' ' 126' ' ' ARG . 0.0 OUTLIER -83.17 -36.58 24.6 Favored 'General case' 0 C--O 1.275 2.416 0 CA-C-O 125.591 2.615 . . . . 50.0 114.379 -178.164 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 128' ' ' THR . . . . . 0.509 ' OG1' ' OD1' ' H' ' 125' ' ' ASP . 48.1 m -62.26 -40.69 97.05 Favored 'General case' 0 N--CA 1.484 1.25 1 O-C-N 115.972 -4.205 . . . . 32.03 103.435 176.431 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 129' ' ' ALA . . . . . . . . . . . . . . . -63.36 -38.38 90.94 Favored 'General case' 0 CA--C 1.5 -0.955 0 CA-C-O 126.028 2.823 . . . . 29.42 109.582 -176.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 129' A ALA . . . . . . . . . . . . . . . -68.21 -44.04 76.68 Favored 'General case' 0 CA--C 1.493 -1.216 0 CA-C-N 111.268 -2.696 . . . . 30.08 108.991 -176.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 129' B SER . . . . . . . . . . . . . 0.3 OUTLIER -76.14 -21.55 56.47 Favored 'General case' 0 C--O 1.256 1.401 0 CA-C-O 111.859 -3.924 . . . . 28.42 117.238 -178.286 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 129' C LEU . . . . . . . . . . . . . 47.4 mt -107.72 -29.44 9.12 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 126.98 2.675 . . . . 38.94 113.459 -171.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 130' ' ' LEU . . . . . 0.407 ' CD2' ' CD1' ' H' ' 162' ' ' ILE . 0.1 OUTLIER -73.06 77.22 1.22 Allowed 'General case' 0 N--CA 1.489 1.481 0 O-C-N 128.753 3.783 . . . . 32.45 110.5 179.374 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 131' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -135.47 139.87 44.39 Favored 'General case' 0 C--N 1.306 -1.321 0 C-N-CA 130.495 3.518 . . . . 50.0 116.815 -177.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 132' ' ' ALA . . . . . . . . . . . . . . . -58.99 126.31 27.19 Favored 'General case' 0 C--O 1.257 1.477 0 CA-C-O 114.177 -2.821 . . . . 30.14 108.196 -175.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 133' ' ' GLY . . . . . . . . . . . . . . . 104.48 -35.71 4.87 Favored Glycine 0 C--O 1.26 1.733 0 C-N-CA 115.372 -3.299 . . . . 24.49 115.06 -173.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 134' ' ' TYR . . . . . 0.524 ' CD1' ' N ' ' H' ' 134' ' ' TYR . 3.5 m-30 -68.93 141.33 55.02 Favored 'General case' 0 C--N 1.309 -1.158 0 O-C-N 118.848 -2.56 . . . . 33.43 108.769 175.019 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 135' ' ' LYS . . . . . . . . . . . . . 10.7 mttt -89.11 146.48 24.78 Favored 'General case' 0 CA--C 1.506 -0.748 0 CA-C-N 112.354 -2.203 . . . . 20.87 115.271 174.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 136' ' ' GLY . . . . . . . . . . . . . . . -131.17 -171.82 12.97 Favored Glycine 0 N--CA 1.507 3.373 0 N-CA-C 106.532 -2.627 . . . . 18.86 106.532 169.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 137' ' ' ARG . . . . . 0.462 ' NH1' ' OD2' ' L' ' 14' ' ' ASP . 37.2 ttm180 -136.32 139.5 42.65 Favored 'General case' 0 C--N 1.288 -2.087 0 O-C-N 116.425 -3.985 . . . . 20.76 107.109 -176.707 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 138' ' ' VAL . . . . . . . . . . . . . 2.5 t -115.43 144.49 22.9 Favored 'Isoleucine or valine' 0 C--O 1.248 0.993 1 O-C-N 130.809 5.068 . . . . 25.64 109.125 176.205 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 139' ' ' THR . . . . . 0.413 ' OG1' ' OE1' ' H' ' 30' ' ' GLN . 38.2 p -140.39 153.76 46.47 Favored 'General case' 0 N--CA 1.503 2.182 0 N-CA-C 107.002 -1.481 . . . . 20.25 107.002 177.576 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 140' ' ' GLY . . . . . . . . . . . . . . . 172.51 168.73 34.28 Favored Glycine 0 C--O 1.19 -2.627 0 N-CA-C 107.938 -2.065 . . . . 21.08 107.938 178.534 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 141' ' ' TRP . . . . . . . . . . . . . 3.9 m-90 -97.75 19.66 13.29 Favored 'General case' 0 N--CA 1.443 -0.819 0 C-N-CA 129.189 2.996 . . . . 24.28 114.187 174.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 142' ' ' GLY . . . . . . . . . . . . . . . -76.64 169.92 54.96 Favored Glycine 0 N--CA 1.438 -1.179 0 C-N-CA 128.146 2.784 . . . . 28.65 113.165 -174.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 143' ' ' ASN . . . . . 0.81 ' ND2' ' O ' ' H' ' 520' ' ' HOH . 76.5 m-20 -50.42 152.85 1.73 Allowed 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 124.948 2.308 . . . . 39.43 108.07 -179.786 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 144' ' ' LEU . . . . . . . . . . . . . 72.9 mt -102.51 -13.45 17.21 Favored 'General case' 0 CA--C 1.511 -0.537 1 CA-C-N 106.81 -4.723 . . . . 35.32 110.88 -175.179 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 145' ' ' LYS . . . . . . . . . . . . 0.285 1.4 ttpp -150.27 139.44 21.19 Favored 'General case' 0 N--CA 1.486 1.372 1 O-C-N 129.44 4.212 . . . . 50.0 105.402 -169.877 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' H' H ' 146' ' ' GLU . . . . . 0.479 ' OE1' ' NE ' ' H' ' 221' A ARG . 36.7 tt0 . . . . . 0 C--O 1.252 1.231 0 O-C-N 126.801 2.563 . . . . 47.61 108.89 -178.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 150' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.931 0 N-CA-C 106.782 -2.527 . . . . 45.3 106.782 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 151' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -109.54 151.18 42.06 Favored Pre-proline 0 C--O 1.275 2.417 0 N-CA-C 106.309 -1.738 . . . . 50.0 106.309 174.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 152' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -82.51 173.08 10.87 Favored 'Trans proline' 0 C--O 1.256 1.389 0 O-C-N 126.037 2.599 . . . . 35.98 108.619 -179.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 153' ' ' SER . . . . . . . . . . . . . 78.1 p -93.99 -23.68 17.94 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 105.674 -1.973 . . . . 41.14 105.674 173.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 154' ' ' VAL . . . . . . . . . . . . 0.374 0.4 OUTLIER -131.69 167.87 25.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 CA-C-O 115.768 -2.063 . . . . 29.85 111.659 -176.108 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 155' ' ' LEU . . . . . . . . . . . . . 17.5 tp -60.44 128.56 37.27 Favored 'General case' 0 C--O 1.251 1.169 0 C-N-CA 126.428 1.891 . . . . 24.27 109.514 177.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 156' ' ' GLN . . . . . 0.41 ' O ' ' CG2' ' H' ' 157' ' ' VAL . 3.8 mm100 -98.45 161.66 13.57 Favored 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 126.26 1.824 . . . . 22.47 110.952 179.679 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 157' ' ' VAL . . . . . 0.41 ' CG2' ' O ' ' H' ' 156' ' ' GLN . 46.3 t -144.92 151.41 15.39 Favored 'Isoleucine or valine' 0 C--O 1.248 1.002 0 O-C-N 119.68 -1.888 . . . . 25.99 106.54 -177.788 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 158' ' ' VAL . . . . . . . . . . . . . 10.5 p -153.58 138.41 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 CA-C-O 113.879 -2.963 . . . . 19.01 104.671 174.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 159' ' ' ASN . . . . . . . . . . . . . 75.0 m-20 -96.42 127.05 42.05 Favored 'General case' 0 C--O 1.252 1.236 0 C-N-CA 127.553 2.341 . . . . 22.42 108.119 172.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 160' ' ' LEU . . . . . . . . . . . . . 16.9 mt -134.43 151.82 76.86 Favored Pre-proline 0 C--O 1.275 2.445 0 O-C-N 116.863 -3.648 . . . . 26.83 106.701 -176.606 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 161' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -87.4 142.35 6.08 Favored 'Trans proline' 0 C--O 1.268 2.025 0 O-C-N 126.337 2.756 . . . . 22.23 113.214 -179.417 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 162' ' ' ILE . . . . . 0.407 ' CD1' ' CD2' ' H' ' 130' ' ' LEU . 33.5 mt -65.63 141.02 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.833 0 O-C-N 118.16 -2.837 . . . . 20.18 108.218 171.9 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 163' ' ' VAL . . . . . . . . . . . . . 61.3 t -115.77 138.88 44.78 Favored 'Isoleucine or valine' 0 C--O 1.269 2.097 0 C-N-CA 127.828 2.451 . . . . 23.25 109.518 -177.542 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 164' ' ' GLU . . . . . 0.492 ' OE1' ' CG2' ' H' ' 167' ' ' VAL . 1.9 mp0 -53.06 138.56 30.59 Favored 'General case' 0 C--O 1.266 1.934 0 CA-C-O 125.314 2.483 . . . . 50.0 112.849 -179.88 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 165' ' ' ARG . . . . . 0.654 ' NH1' ' O ' ' H' ' 180' ' ' MET . 2.4 mtp180 -48.41 -39.33 28.79 Favored Pre-proline 0 C--N 1.296 -1.75 1 O-C-N 116.075 -4.141 . . . . 50.0 116.775 -176.068 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 166' ' ' PRO . . . . . 0.458 ' CD ' ' N ' ' H' ' 165' ' ' ARG . 1.4 Cg_endo -68.99 -43.49 3.27 Favored 'Trans proline' 0 C--O 1.255 1.349 0 C-N-CA 122.805 2.337 . . . . 26.08 110.006 -174.108 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 167' ' ' VAL . . . . . 0.492 ' CG2' ' OE1' ' H' ' 164' ' ' GLU . 59.0 t -60.67 -43.72 95.53 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.918 1 CA-C-N 107.914 -4.221 . . . . 24.45 106.508 178.339 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 168' ' ' CYS . . . . . . . . . . . . . 92.6 m -58.56 -62.76 1.61 Allowed 'General case' 0 C--O 1.246 0.904 0 O-C-N 120.27 -1.519 . . . . 24.12 107.067 178.794 -70.063 -62.894 -88.101 106.536 2.009 105.13 -76.683 83.506 1 1 . 1 . 001 ecloud orig full ' H' H ' 169' ' ' LYS . . . . . 0.729 ' NZ ' ' CB ' ' H' ' 169' ' ' LYS . 0.0 OUTLIER -48.14 -40.99 25.5 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 115.559 1.689 . . . . 45.22 115.559 178.965 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 170' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -79.72 9.05 5.54 Favored 'General case' 0 C--O 1.279 2.622 0 CA-C-N 123.613 2.915 . . . . 29.21 117.824 -176.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 171' ' ' SER . . . . . . . . . . . . . 53.4 p -103.06 -6.26 22.49 Favored 'General case' 0 C--O 1.251 1.176 0 O-C-N 128.202 3.439 . . . . 21.65 109.895 -175.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 172' ' ' THR . . . . . . . . . . . . 0.337 3.2 t -151.35 171.86 16.82 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 118.028 -2.92 . . . . 22.89 109.687 -177.581 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 173' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 -98.16 -11.23 23.01 Favored 'General case' 0 C--N 1.309 -1.158 0 C-N-CA 126.945 2.098 . . . . 45.24 110.018 175.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 174' ' ' ILE . . . . . . . . . . . . . 10.5 mm -72.83 139.26 19.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 O-C-N 125.989 2.056 . . . . 25.8 106.188 -179.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 175' ' ' ARG . . . . . 0.481 ' NE ' ' OE2' ' H' ' 97' A GLU . 57.1 ttp85 -72.12 116.04 12.06 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-N 113.189 -1.823 . . . . 28.94 111.924 174.064 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 176' ' ' ILE . . . . . . . . . . . . 0.256 23.5 mm -80.5 145.14 9.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 118.014 -2.929 . . . . 30.03 109.879 172.01 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 177' ' ' THR . . . . . . . . . . . . . 6.6 p -126.3 173.36 9.37 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 127.974 2.509 . . . . 26.89 107.656 179.04 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 178' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -72.33 -9.24 58.24 Favored 'General case' 0 C--N 1.281 -2.388 0 C-N-CA 128.553 2.741 . . . . 34.44 112.372 177.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 179' ' ' ASN . . . . . . . . . . . . . 68.7 m-20 -91.21 17.86 7.7 Favored 'General case' 0 C--N 1.301 -1.543 1 CA-C-O 110.66 -4.495 . . . . 24.67 109.103 175.282 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 180' ' ' MET . . . . . 0.654 ' O ' ' NH1' ' H' ' 165' ' ' ARG . 26.3 mtt -143.74 151.68 40.32 Favored 'General case' 0 C--N 1.301 -1.522 1 CA-C-O 110.91 -4.376 . . . . 22.04 104.86 -178.353 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 181' ' ' PHE . . . . . . . . . . . . . 22.4 p90 -139.13 147.72 42.3 Favored 'General case' 0 C--N 1.308 -1.204 1 O-C-N 129.761 4.413 . . . . 19.59 103.754 176.707 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 182' ' ' CYS . . . . . . . . . . . . . 2.8 p -110.3 160.53 16.46 Favored 'General case' 0 N--CA 1.5 2.027 0 CA-C-N 122.877 2.58 . . . . 22.54 109.132 174.112 83.506 -76.683 -88.101 105.13 2.009 106.536 -62.894 -70.063 1 1 . 1 . 001 ecloud orig full ' H' H ' 183' ' ' ALA . . . . . . . . . . . . . . . -148.43 143.76 26.99 Favored 'General case' 0 C--N 1.306 -1.294 0 O-C-N 119.302 -2.124 . . . . 23.97 109.596 -177.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 184' ' ' GLY . . . . . . . . . . . . . . . 152.15 163.27 11.43 Favored Glycine 0 N--CA 1.478 1.489 0 O-C-N 116.716 -3.74 . . . . 24.24 106.529 -178.607 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 184' A TYR . . . . . . . . . . . . 0.295 47.2 m-85 -82.35 158.76 23.25 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 123.929 0.892 . . . . 31.75 111.179 176.699 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 185' ' ' LYS . . . . . . . . . . . . . 3.9 mmtp -87.6 147.76 42.4 Favored Pre-proline 0 C--O 1.252 1.198 0 N-CA-C 107.731 -1.211 . . . . 39.2 107.731 172.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 186' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -48.74 -37.84 36.1 Favored 'Trans proline' 0 C--O 1.235 0.349 0 O-C-N 126.945 3.076 . . . . 42.24 107.571 -176.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 186' A ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.77 -50.43 72.39 Favored 'General case' 0 C--N 1.309 -1.188 1 O-C-N 129.144 4.028 . . . . 50.0 111.471 179.176 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 186' B GLU . . . . . . . . . . . . . 30.7 mt-10 -59.98 -20.32 57.05 Favored 'General case' 0 C--O 1.257 1.457 0 O-C-N 124.47 1.106 . . . . 45.17 108.104 -173.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 186' C GLY . . . . . . . . . . . . . . . 31.02 88.3 0.01 OUTLIER Glycine 0 N--CA 1.482 1.72 1 O-C-N 129.334 4.146 . . . . 44.06 111.238 -179.809 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 186' D LYS . . . . . . . . . . . . . 8.1 ttmm -170.53 135.02 1.15 Allowed 'General case' 0 C--O 1.25 1.112 2 C-N-CA 135.343 5.457 . . . . 44.25 98.527 178.351 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 187' ' ' ARG . . . . . 0.557 ' NH2' ' O ' ' H' ' 221' ' ' ASP . 38.7 mtp85 -120.69 176.14 5.67 Favored 'General case' 0 C--N 1.295 -1.8 0 CA-C-N 124.826 3.467 . . . . 42.97 119.404 -173.957 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 188' ' ' GLY . . . . . . . . . . . . . . . 138.33 152.04 5.93 Favored Glycine 0 C--O 1.249 1.088 0 CA-C-O 116.017 -2.546 . . . . 28.37 108.321 175.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 189' ' ' ASP . . . . . 0.7 ' OD2' ' NH2' ' H' ' 372' ' ' 00N . 48.6 t0 -168.38 165.95 12.57 Favored 'General case' 0 C--O 1.262 1.711 0 O-C-N 128.266 2.98 . . . . 26.15 103.205 -178.798 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 190' ' ' ALA . . . . . . . . . . . . . . . -79.78 177.07 9.16 Favored 'General case' 0 C--O 1.254 1.296 0 N-CA-C 102.152 -3.277 . . . . 20.76 102.152 169.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 191' ' ' CYS . . . . . . . . . . . . . 14.4 t -153.58 -171.7 3.99 Favored 'General case' 0 N--CA 1.507 2.399 0 N-CA-C 101.218 -3.623 . . . . 28.84 101.218 176.643 -166.566 47.613 92.248 108.196 2.021 106.168 -170.847 -56.304 1 1 . 1 . 001 ecloud orig full ' H' H ' 192' ' ' GLU . . . . . . . . . . . . . 25.8 mp0 -61.32 141.44 57.58 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-O 117.905 -1.045 . . . . 37.37 108.767 178.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 193' ' ' GLY . . . . . . . . . . . . . . . 89.35 -12.94 65.05 Favored Glycine 0 C--N 1.307 -1.081 1 CA-C-O 109.6 -6.111 . . . . 22.57 109.182 -178.774 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 194' ' ' ASP . . . . . 0.485 ' O ' ' C ' ' H' ' 195' ' ' SER . 76.4 m-20 -75.58 -21.67 57.64 Favored 'General case' 0 C--O 1.267 1.981 1 CA-C-N 124.323 4.062 . . . . 23.36 116.313 169.079 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 195' ' ' SER . . . . . 1.29 ' OG ' ' C ' ' H' ' 372' ' ' 00N . 4.1 m -34.07 142.22 0.04 OUTLIER 'General case' 0 N--CA 1.433 -1.298 0 CA-C-O 113.587 -3.101 . . . . 19.91 111.235 -179.983 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 196' ' ' GLY . . . . . . . . . . . . . . . 81.57 -14.3 30.72 Favored Glycine 0 C--O 1.243 0.683 0 O-C-N 129.041 3.963 . . . . 15.15 110.651 170.003 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 197' ' ' GLY . . . . . . . . . . . . . . . -72.32 165.6 54.17 Favored Glycine 0 C--O 1.256 1.5 0 CA-C-O 124.586 2.215 . . . . 21.56 110.481 176.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 198' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_endo -84.1 145.5 11.08 Favored 'Trans proline' 0 C--O 1.249 1.043 0 N-CA-C 117.63 2.127 . . . . 20.08 117.63 -177.146 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 199' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -113.13 108.82 17.83 Favored 'General case' 0 N--CA 1.501 2.087 0 CA-C-N 110.533 -3.03 . . . . 18.74 103.725 168.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 200' ' ' VAL . . . . . . . . . . . . . 32.7 m -118.59 156.36 20.49 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.955 0 CA-C-O 125.521 2.581 . . . . 22.83 112.068 -173.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 201' ' ' MET . . . . . . . . . . . . . 60.6 mtp -129.25 158.84 37.91 Favored 'General case' 0 C--O 1.207 -1.159 0 CA-C-N 111.532 -2.576 . . . . 21.79 108.028 171.381 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 202' ' ' LYS . . . . . . . . . . . . . 44.9 tttt -105.14 117.25 33.54 Favored 'General case' 0 C--O 1.262 1.745 0 CA-C-O 116.596 -1.668 . . . . 19.02 110.157 172.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 203' ' ' SER . . . . . . . . . . . . . 43.3 t -61.0 129.11 90.15 Favored Pre-proline 0 N--CA 1.497 1.886 0 O-C-N 126.445 2.341 . . . . 25.22 113.823 174.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 204' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_endo -77.52 -6.67 16.42 Favored 'Trans proline' 0 C--N 1.315 -1.203 0 C-N-CA 121.688 1.592 . . . . 22.72 111.097 178.209 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 204' A PHE . . . . . . . . . . . . . 42.1 m-85 -89.62 -50.36 6.13 Favored 'General case' 0 C--O 1.241 0.605 0 O-C-N 118.704 -2.498 . . . . 27.49 114.699 -176.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 204' B ASN . . . . . . . . . . . . . 0.0 OUTLIER -120.84 3.9 10.54 Favored 'General case' 0 C--O 1.265 1.892 0 O-C-N 128.468 3.605 . . . . 24.27 114.138 -174.509 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 205' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 66.09 13.68 9.23 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 113.708 -3.044 . . . . 41.34 117.328 178.17 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 206' ' ' ARG . . . . . . . . . . . . . 40.0 mtt180 -91.16 167.58 12.24 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 128.122 3.389 . . . . 26.43 111.983 -177.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 207' ' ' TRP . . . . . . . . . . . . . 78.2 m95 -103.08 135.92 43.85 Favored 'General case' 0 CA--C 1.508 -0.653 0 O-C-N 127.2 2.813 . . . . 18.18 103.475 -179.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 208' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -122.94 142.74 50.48 Favored 'General case' 0 N--CA 1.523 3.198 1 O-C-N 129.328 4.143 . . . . 21.71 110.799 178.442 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 209' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -85.36 123.91 31.37 Favored 'General case' 0 N--CA 1.495 1.814 0 C-N-CA 115.317 -2.553 . . . . 18.08 108.645 173.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 210' ' ' MET . . . . . . . . . . . . . 24.7 mmm -102.15 -22.13 14.27 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 114.939 1.459 . . . . 30.49 114.939 175.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 211' ' ' GLY . . . . . . . . . . . . . . . -148.21 164.23 28.95 Favored Glycine 0 C--N 1.35 1.352 0 O-C-N 120.817 -1.177 . . . . 18.61 113.295 -177.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 212' ' ' ILE . . . . . . . . . . . . . 54.3 mt -122.94 126.56 73.94 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.896 1 CA-C-O 110.976 -4.345 . . . . 19.67 106.441 177.675 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 213' ' ' VAL . . . . . . . . . . . . . 24.4 t -52.4 126.62 8.45 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.466 0 CA-C-N 121.685 2.039 . . . . 19.56 106.649 179.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 214' ' ' SER . . . . . . . . . . . . . 9.2 t -121.27 -61.9 1.49 Allowed 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 113.952 -3.099 . . . . 20.57 113.903 -175.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 215' ' ' TRP . . . . . . . . . . . . . 65.6 p-90 -158.56 165.15 35.19 Favored 'General case' 0 CA--C 1.494 -1.211 0 CA-C-O 125.568 2.604 . . . . 22.65 116.397 -176.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 216' ' ' GLY . . . . . 0.609 ' O ' ' N3 ' ' H' ' 372' ' ' 00N . . . -164.91 -174.21 34.38 Favored Glycine 0 N--CA 1.49 2.269 0 CA-C-N 108.877 -3.783 . . . . 20.83 107.556 172.93 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 217' ' ' GLU . . . . . 0.576 ' OE1' ' NZ ' ' H' ' 224' ' ' LYS . 38.7 mt-10 -132.53 101.37 5.29 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 110.719 -2.74 . . . . 34.15 104.983 -179.47 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 219' ' ' GLY . . . . . . . . . . . . . . . 81.93 -156.33 36.1 Favored Glycine 0 N--CA 1.495 2.619 0 C-N-CA 114.598 -3.667 . . . . 26.06 105.376 -172.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 220' ' ' CYS . . . . . . . . . . . . . 61.4 m -158.69 126.64 5.13 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 109.623 -3.288 . . . . 29.17 109.978 -177.378 -56.304 -170.847 92.248 106.168 2.021 108.196 47.613 -166.566 1 1 . 1 . 001 ecloud orig full ' H' H ' 221' ' ' ASP . . . . . 0.557 ' O ' ' NH2' ' H' ' 187' ' ' ARG 0.3 27.9 t70 55.58 22.15 5.01 Favored 'General case' 0 C--O 1.26 1.643 0 CA-C-N 112.269 -2.241 . . . . 33.9 111.034 177.794 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 221' A ARG . . . . . 0.479 ' NE ' ' OE1' ' H' ' 146' ' ' GLU . 0.8 OUTLIER -66.28 152.67 44.44 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 107.601 -1.259 . . . . 47.81 107.601 173.444 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 222' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -77.67 144.88 37.02 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 119.126 -2.234 . . . . 50.0 109.954 179.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 223' ' ' GLY . . . . . . . . . . . . . . . 68.46 10.08 59.52 Favored Glycine 0 C--O 1.251 1.157 0 N-CA-C 109.369 -1.492 . . . . 36.04 109.369 177.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 224' ' ' LYS . . . . . 0.576 ' NZ ' ' OE1' ' H' ' 217' ' ' GLU . 6.3 mmtt -116.37 167.04 11.39 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 105.38 -2.082 . . . . 32.77 105.38 174.187 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 225' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -147.15 155.13 41.88 Favored 'General case' 0 C--O 1.255 1.361 0 C-N-CA 128.38 2.672 . . . . 26.0 113.452 -176.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 226' ' ' GLY . . . . . . . . . . . . . . . -84.22 151.97 27.64 Favored Glycine 0 CA--C 1.538 1.508 0 CA-C-O 115.643 -2.754 . . . . 16.89 106.947 177.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 227' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -117.02 138.77 51.36 Favored 'General case' 0 C--O 1.254 1.292 1 O-C-N 130.724 4.426 . . . . 20.74 108.656 -179.876 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 228' ' ' TYR . . . . . . . . . . . . 0.278 72.2 m-85 -131.16 145.17 51.85 Favored 'General case' 0 N--CA 1.485 1.28 1 CA-C-O 110.235 -4.697 . . . . 22.48 109.521 -176.128 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' H' H ' 229' ' ' THR . . . . . . . . . . . . . 4.8 m -60.88 135.97 57.94 Favored 'General case' 0 C--O 1.276 2.455 0 O-C-N 128.9 3.875 . . . . 21.02 113.997 168.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 230' ' ' HIS . . . . . . . . . . . . . 21.6 t-80 -83.48 112.85 20.34 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 128.246 3.466 . . . . 24.47 108.344 177.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 231' ' ' VAL . . . . . . . . . . . . . 31.5 t -78.74 -40.85 23.94 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 O-C-N 127.82 3.2 . . . . 21.33 106.23 -166.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 232' ' ' PHE . . . . . . . . . . . . 0.286 32.0 t80 -57.33 -47.75 80.74 Favored 'General case' 0 C--N 1.294 -1.835 0 CA-C-O 123.442 1.591 . . . . 31.24 111.307 -177.393 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 233' ' ' ARG . . . . . . . . . . . . . 4.8 mmt180 -53.59 -33.43 54.86 Favored 'General case' 0 C--O 1.244 0.784 0 O-C-N 117.821 -3.049 . . . . 45.79 112.065 175.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 234' ' ' LEU . . . . . . . . . . . . . 8.2 mt -98.59 12.1 36.35 Favored 'General case' 0 C--O 1.24 0.554 0 O-C-N 119.935 -1.728 . . . . 30.22 111.96 -178.412 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 235' ' ' LYS . . . . . . . . . . . . . 13.2 tttt -64.35 -27.6 69.13 Favored 'General case' 0 C--O 1.255 1.348 0 O-C-N 118.96 -2.338 . . . . 44.17 114.647 -174.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 236' ' ' LYS . . . . . 0.467 ' CE ' ' O ' ' H' ' 465' ' ' HOH . 18.9 mmtt -66.58 -48.34 69.9 Favored 'General case' 0 C--O 1.239 0.515 0 CA-C-O 114.33 -2.748 . . . . 49.08 105.034 -179.711 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 237' ' ' TRP . . . . . 0.403 ' O ' ' CG1' ' H' ' 241' ' ' VAL . 74.0 t90 -56.25 -47.27 78.85 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 128.76 3.787 . . . . 30.25 110.939 178.132 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 238' ' ' ILE . . . . . . . . . . . . . 71.7 mt -50.39 -54.53 8.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 O-C-N 119.471 -2.018 . . . . 30.97 111.041 -177.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 239' ' ' GLN . . . . . 0.457 ' O ' ' C ' ' H' ' 240' ' ' LYS . 4.6 tt0 -49.44 -63.46 1.1 Allowed 'General case' 0 C--N 1.296 -1.755 2 CA-C-O 129.528 4.49 . . . . 50.0 107.849 -179.773 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 240' ' ' LYS . . . . . 0.457 ' C ' ' O ' ' H' ' 239' ' ' GLN . 25.0 tttp -45.04 -52.98 8.37 Favored 'General case' 0 C--N 1.311 -1.094 0 O-C-N 117.272 -3.392 . . . . 49.1 109.842 178.512 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 241' ' ' VAL . . . . . 0.403 ' CG1' ' O ' ' H' ' 237' ' ' TRP 0.379 0.4 OUTLIER -70.39 -35.78 63.79 Favored 'Isoleucine or valine' 0 C--O 1.255 1.377 0 C-N-CA 117.927 -1.509 . . . . 37.72 114.171 -176.021 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' H' H ' 242' ' ' ILE . . . . . . . . . . . . . 26.8 mt -71.3 -14.63 17.96 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.126 0 CA-C-O 116.357 -1.782 . . . . 40.98 109.453 179.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 243' ' ' ASP . . . . . . . . . . . . 0.473 0.0 OUTLIER -96.52 -27.04 15.04 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 116.048 -2.261 . . . . 50.0 114.899 179.563 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 244' ' ' GLN . . . . . 0.641 ' CG ' ' CD2' ' H' ' 245' ' ' PHE . 1.0 OUTLIER -87.78 -35.35 17.91 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 117.261 -3.399 . . . . 50.0 112.898 179.612 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 245' ' ' PHE . . . . . 0.745 ' CE2' ' O ' ' H' ' 448' ' ' HOH . 90.6 m-85 -109.29 3.73 21.94 Favored 'General case' 0 C--O 1.264 1.855 0 N-CA-C 117.695 2.48 . . . . 50.0 117.695 -173.696 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 246' ' ' GLY . . . . . 0.539 ' CA ' ' NZ ' ' H' ' 107' ' ' LYS . . . . . . . . 0 C--O 1.272 2.476 2 CA-C-O 106.243 -7.976 . . . . 50.0 109.096 178.301 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' I' I ' 355' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.484 1.264 0 CA-C-O 124.417 2.055 . . . . 50.0 105.66 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 356' ' ' PHE . . . . . . . . . . . . . 55.8 m-85 -66.31 124.25 22.19 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 112.38 -2.191 . . . . 47.65 109.094 -174.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 357' ' ' GLU . . . . . 0.435 ' CG ' ' N ' ' I' ' 358' ' ' GLU . 15.4 tt0 -75.29 144.78 42.3 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 127.469 3.509 . . . . 45.42 106.711 172.329 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' I' I ' 358' ' ' GLU . . . . . 0.435 ' N ' ' CG ' ' I' ' 357' ' ' GLU . 0.0 OUTLIER -59.09 149.98 26.35 Favored 'General case' 0 C--O 1.266 1.926 0 O-C-N 116.657 -3.777 . . . . 50.0 111.448 -176.898 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' I' I ' 359' ' ' ILE . . . . . . . . . . . . . 3.9 pt -114.61 158.47 40.13 Favored Pre-proline 0 C--O 1.256 1.399 0 CA-C-O 115.688 -2.101 . . . . 47.07 110.135 179.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 360' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -58.16 134.85 64.6 Favored 'Trans proline' 0 C--O 1.255 1.339 0 C-N-CA 123.049 2.499 . . . . 47.79 113.358 178.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 361' ' ' GLU . . . . . . . . . . . . . . . -53.39 -25.24 14.82 Favored 'General case' 0 C--O 1.26 1.619 0 N-CA-C 118.658 2.836 . . . . 48.4 118.658 -176.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 362' ' ' GLU . . . . . 0.438 ' OE1' ' N ' ' I' ' 362' ' ' GLU 0.271 3.0 pm0 -67.54 -5.53 15.68 Favored 'General case' 0 C--O 1.244 0.772 0 CA-C-O 114.739 -2.553 . . . . 50.0 107.317 -177.226 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' I' I ' 363' ' ' TYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 364' ' ' LEU . . . . . 0.801 ' C ' ' O ' ' I' ' 538' ' ' HOH . 1.6 mm? . . . . . 0 N--CA 1.48 1.043 0 CA-C-O 114.309 -2.758 . . . . 47.21 105.359 176.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 650' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 651' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 372' ' ' 00N . . . . . 1.29 ' C ' ' OG ' ' H' ' 195' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 423' ' ' HOH . . . . . 0.617 ' O ' ' NZ ' ' L' ' 10' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 447' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 478' ' ' HOH . . . . . 0.673 ' O ' ' CA ' ' L' ' 1' A ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 484' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 493' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 514' ' ' HOH . . . . . 0.497 ' O ' ' NZ ' ' L' ' 14' A LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 401' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 421' ' ' HOH . . . . . 0.694 ' O ' ' OD1' ' H' ' 116' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 422' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 425' ' ' HOH . . . . . 0.447 ' O ' ' OD2' ' H' ' 60' E ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 ' 429' ' ' 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 . . . . . 0.503 ' O ' ' NH1' ' H' ' 73' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 440' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 441' ' ' HOH . . . . . 0.532 ' O ' ' ND2' ' H' ' 60' G ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 442' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 443' ' ' HOH . . . . . 0.575 ' O ' ' NH2' ' H' ' 73' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 ' 448' ' ' HOH . . . . . 0.745 ' O ' ' CE2' ' H' ' 245' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 449' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 450' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 453' ' ' HOH . . . . . 0.436 ' O ' ' CD ' ' H' ' 175' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 ' 463' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 464' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 465' ' ' HOH . . . . . 0.467 ' O ' ' CE ' ' H' ' 236' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 ' 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 ' 473' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 475' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 476' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 477' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 480' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 481' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 482' ' ' HOH . . . . . 0.675 ' O ' ' O ' ' H' ' 74' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 483' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 485' ' ' 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 ' 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 ' 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 0 . 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 ' 503' ' ' HOH . . . . . 0.719 ' O ' ' N ' ' H' ' 126' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 520' ' ' HOH . . . . . 0.81 ' O ' ' ND2' ' H' ' 143' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 536' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 537' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 539' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 540' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 541' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 542' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 543' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 544' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 546' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 548' ' ' HOH . . . . . 0.99 ' O ' ' CE3' ' H' ' 51' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 549' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 550' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 551' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 552' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 553' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 554' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 556' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 557' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 558' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 559' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 560' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 561' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 454' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 474' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 479' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 488' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 492' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 538' ' ' HOH . . . . . 0.801 ' O ' ' C ' ' I' ' 364' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 1' B ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.755 0 CA-C-O 125.476 2.56 . . . . 46.33 111.922 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 1' A ASP . . . . . 0.673 ' CA ' ' O ' ' L' ' 478' ' ' HOH . 12.8 t0 -100.77 21.56 13.35 Favored 'General case' 0 C--O 1.258 1.523 0 CA-C-N 108.712 -3.858 . . . . 50.0 107.406 171.27 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 1' ' ' CYS . . . . . 0.462 ' O ' ' HD3' ' H' ' 206' ' ' ARG . 14.3 p -57.13 148.31 22.32 Favored 'General case' 0 CA--C 1.534 0.346 1 CA-C-O 130.174 4.797 . . . . 26.47 114.667 -178.786 75.452 72.874 101.901 103.597 2.012 103.964 -57.875 -60.52 3 3 . 1 . 001 ecloud build full ' L' L ' 2' ' ' GLY . . . . . . . . . . . . . . . 56.54 23.51 43.17 Favored Glycine 0 C--O 1.256 1.48 0 CA-C-O 113.509 -3.939 . . . . 19.12 113.874 174.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 3' ' ' LEU . . . . . . . . . . . . . 85.4 mt -115.27 102.52 9.95 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-O 113.86 -2.971 . . . . 19.36 105.969 175.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 4' ' ' ARG . . . . . 0.506 ' HB2' ' OE1' ' L' ' 8' ' ' GLU . 76.1 mtm180 -65.04 131.09 95.09 Favored Pre-proline 0 N--CA 1.488 1.455 0 O-C-N 129.01 3.944 . . . . 20.2 115.337 -171.764 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 5' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -58.79 -27.32 83.48 Favored 'Trans proline' 0 C--O 1.269 2.063 0 CA-C-O 113.403 -2.832 . . . . 26.57 112.658 177.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 6' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -100.97 -1.65 33.86 Favored 'General case' 0 C--O 1.252 1.209 1 O-C-N 113.12 -5.988 . . . . 24.05 112.644 -178.097 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' L' L ' 7' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -125.0 -84.03 0.64 Allowed 'General case' 0 N--CA 1.503 2.179 0 C-N-CA 115.895 -2.322 . . . . 26.02 108.955 -172.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 8' ' ' GLU . . . . . 0.506 ' OE1' ' HB2' ' L' ' 4' ' ' ARG . 20.1 mp0 -55.77 -51.39 67.56 Favored 'General case' 0 C--N 1.306 -1.306 0 C-N-CA 128.249 2.62 . . . . 22.2 110.705 -176.947 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 9' ' ' LYS . . . . . 0.539 ' HE2' ' OD2' ' L' ' 1' A ASP . 4.1 mmtp -60.21 -16.01 29.43 Favored 'General case' 0 C--N 1.328 -0.355 0 O-C-N 126.428 2.33 . . . . 32.13 113.069 179.377 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 10' ' ' LYS . . . . . . . . . . . . . 17.7 mtpt -116.76 2.31 12.88 Favored 'General case' 0 C--O 1.261 1.666 0 O-C-N 119.35 -2.094 . . . . 32.07 109.498 -179.645 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 11' ' ' SER . . . . . . . . . . . . . 4.0 t 59.59 38.35 22.23 Favored 'General case' 0 C--O 1.258 1.549 0 N-CA-C 115.771 1.767 . . . . 24.9 115.771 -176.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 12' ' ' LEU . . . . . . . . . . . . . 86.0 mt -109.38 145.26 36.38 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 105.626 -1.99 . . . . 28.25 105.626 175.28 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 13' ' ' GLU . . . . . . . . . . . . 0.364 69.8 mt-10 -106.18 143.44 34.3 Favored 'General case' 0 C--O 1.279 2.621 0 CA-C-O 113.931 -2.938 . . . . 42.62 110.029 176.825 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -74.04 156.79 37.12 Favored 'General case' 0 C--O 1.258 1.55 0 O-C-N 128.289 3.493 . . . . 24.09 105.174 171.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 14' A LYS . . . . . 0.722 ' HG2' ' OE2' ' H' ' 23' ' ' GLU 0.273 0.0 OUTLIER -68.28 -6.53 24.4 Favored 'General case' 0 C--O 1.254 1.325 0 CA-C-O 112.336 -3.697 . . . . 50.0 116.12 -172.333 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' L' L ' 14' B THR . . . . . . . . . . . . . 51.6 p -130.56 4.12 4.63 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-N 124.764 3.438 . . . . 26.63 109.026 175.536 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 14' C GLU . . . . . 0.432 ' O ' ' HB2' ' L' ' 14' F LEU . 12.7 pt-20 -61.27 -31.61 71.42 Favored 'General case' 0 C--O 1.257 1.481 0 O-C-N 126.536 2.397 . . . . 28.98 111.769 -176.74 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' D ARG . . . . . 0.786 ' NH1' ' OE2' ' L' ' 14' H GLU . 0.0 OUTLIER -61.1 -27.4 68.34 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 116.67 -2.012 . . . . 50.0 114.631 177.785 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' L' L ' 14' E GLU . . . . . . . . . . . . . 14.3 tt0 -61.07 -49.89 75.53 Favored 'General case' 0 C--N 1.308 -1.237 0 C-N-CA 127.314 2.245 . . . . 38.4 106.261 -179.216 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 14' F LEU . . . . . 0.432 ' HB2' ' O ' ' L' ' 14' C GLU . 2.7 mp -49.73 -68.02 0.21 Allowed 'General case' 0 C--O 1.242 0.668 0 CA-C-O 116.887 -1.53 . . . . 28.78 112.008 170.508 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' G LEU . . . . . . . . . . . . . 3.7 mm? -56.48 -33.31 65.83 Favored 'General case' 0 C--N 1.306 -1.325 0 CA-C-O 124.367 2.032 . . . . 33.16 113.678 -170.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 14' H GLU . . . . . 0.786 ' OE2' ' NH1' ' L' ' 14' D ARG . 61.8 mt-10 -67.49 -26.14 66.21 Favored 'General case' 0 C--N 1.291 -1.939 0 CA-C-O 113.057 -3.354 . . . . 33.87 110.652 178.981 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' I SER . . . . . . . . . . . . . 53.9 p -84.89 -7.94 58.97 Favored 'General case' 0 N--CA 1.473 0.705 1 O-C-N 129.349 4.156 . . . . 30.39 112.302 -177.78 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' J TYR . . . . . 0.425 ' HE2' ' O ' ' H' ' 202' ' ' LYS . 8.7 m-30 -91.1 56.85 3.28 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 102.904 -2.999 . . . . 37.84 102.904 -178.805 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' K ILE . . . . . . . . . . . . 0.355 0.0 OUTLIER . . . . . 0 C--O 1.28 2.706 0 C-N-CA 129.785 3.234 . . . . 50.0 114.358 -169.934 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 16' ' ' ILE . . . . . 0.516 HD13 ' OD2' ' H' ' 194' ' ' ASP . 36.0 mm . . . . . 0 C--O 1.246 0.906 0 CA-C-O 113.255 -3.259 . . . . 23.91 105.493 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 17' ' ' VAL . . . . . 0.697 ' O ' ' HB2' ' H' ' 18' ' ' GLU . 85.0 t -110.52 128.79 66.57 Favored 'Isoleucine or valine' 0 C--O 1.244 0.799 0 O-C-N 128.695 3.747 . . . . 28.59 110.061 -179.656 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 18' ' ' GLU . . . . . 0.835 ' HG3' ' HB2' ' H' ' 187' ' ' ARG . 30.3 mm-40 67.44 24.52 8.79 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-O 111.96 -3.876 . . . . 48.22 109.314 175.343 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 19' ' ' GLY . . . . . . . . . . . . . . . -94.73 -142.72 12.94 Favored Glycine 0 CA--C 1.54 1.622 0 O-C-N 126.395 2.309 . . . . 31.5 110.33 178.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 20' ' ' SER . . . . . . . . . . . . . 17.4 p -167.45 158.48 11.57 Favored 'General case' 0 C--O 1.248 0.976 0 N-CA-C 106.504 -1.665 . . . . 39.6 106.504 179.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 21' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -57.85 142.22 46.59 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 115.014 -0.994 . . . . 41.57 108.723 -177.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 22' ' ' ALA . . . . . . . . . . . . 0.308 . . -77.49 164.47 25.39 Favored 'General case' 0 C--N 1.295 -1.8 0 N-CA-C 104.16 -2.533 . . . . 29.68 104.16 178.28 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 23' ' ' GLU . . . . . 0.722 ' OE2' ' HG2' ' L' ' 14' A LYS . 47.8 mt-10 -85.73 167.03 15.64 Favored 'General case' 0 C--N 1.306 -1.296 0 C-N-CA 128.274 2.63 . . . . 37.05 104.552 170.702 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 24' ' ' ILE . . . . . . . . . . . . . 2.4 mm -81.49 143.6 11.94 Favored 'Isoleucine or valine' 0 C--O 1.259 1.571 0 N-CA-C 102.492 -3.151 . . . . 26.25 102.492 -174.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.81 17.51 58.19 Favored Glycine 0 C--N 1.286 -2.228 1 CA-C-O 110.655 -5.525 . . . . 22.66 113.306 -174.804 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 26' ' ' MET . . . . . . . . . . . . . 3.7 ttt -70.75 -32.93 70.26 Favored 'General case' 0 C--O 1.277 2.522 1 CA-C-N 124.895 4.347 . . . . 24.51 113.07 175.487 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 27' ' ' SER . . . . . . . . . . . . . 1.3 m -134.2 78.86 57.4 Favored Pre-proline 0 N--CA 1.485 1.296 0 C-N-CA 124.531 1.132 . . . . 27.53 109.168 179.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 28' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -73.01 -7.95 21.46 Favored 'Trans proline' 0 C--N 1.308 -1.559 0 O-C-N 124.614 1.849 . . . . 18.26 113.43 -176.096 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 29' ' ' TRP . . . . . . . . . . . . . 2.7 p90 -98.0 -0.85 43.93 Favored 'General case' 0 C--O 1.273 2.335 0 CA-C-O 116.462 -1.733 . . . . 17.83 111.081 178.383 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 30' ' ' GLN . . . . . . . . . . . . . 64.0 tp60 -72.9 119.0 16.53 Favored 'General case' 0 C--O 1.256 1.435 0 O-C-N 126.678 2.486 . . . . 23.61 113.532 178.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 31' ' ' VAL . . . . . . . . . . . . . 76.2 t -109.85 151.8 12.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 C-N-CA 125.492 1.517 . . . . 22.82 110.652 -174.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 32' ' ' MET . . . . . . . . . . . . . 15.6 ttm -112.66 121.95 46.25 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 105.578 -2.008 . . . . 29.07 105.578 179.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -83.56 122.04 28.04 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 105.237 -2.134 . . . . 34.35 105.237 175.618 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 34' ' ' PHE . . . . . 0.646 ' CZ ' ' HB3' ' H' ' 38' ' ' GLN . 61.4 t80 -122.82 125.78 46.12 Favored 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 117.297 -1.761 . . . . 30.9 111.684 -172.048 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 35' ' ' ARG . . . . . 0.553 ' NH1' ' OE2' ' H' ' 39' ' ' GLU . 48.1 ttt180 -77.92 133.45 38.07 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 117.101 -1.839 . . . . 40.66 109.856 176.976 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 36' ' ' LYS . . . . . 0.409 ' HG2' HD12 ' I' ' 364' ' ' LEU . 14.0 mttt -66.32 -36.08 82.01 Favored 'General case' 0 C--O 1.261 1.689 0 N-CA-C 114.47 1.285 . . . . 45.66 114.47 178.101 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 36' A SER . . . . . . . . . . . . . 0.2 OUTLIER -159.85 105.06 1.43 Allowed Pre-proline 0 N--CA 1.491 1.58 0 CA-C-O 114.942 -2.456 . . . . 50.0 112.615 -171.841 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 37' ' ' PRO . . . . . 0.449 ' O ' ' HG2' ' H' ' 39' ' ' GLU . 5.8 Cg_endo -66.79 157.99 81.53 Favored 'Cis proline' 0 C--N 1.308 -1.579 0 O-C-N 124.995 2.05 . . . . 42.69 111.429 1.374 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 38' ' ' GLN . . . . . 0.646 ' HB3' ' CZ ' ' H' ' 34' ' ' PHE . 87.9 mt-30 -69.25 132.22 46.13 Favored 'General case' 0 C--O 1.258 1.521 0 N-CA-C 103.797 -2.668 . . . . 46.99 103.797 179.794 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 39' ' ' GLU . . . . . 0.553 ' OE2' ' NH1' ' H' ' 35' ' ' ARG . 10.1 pt-20 -178.71 147.23 0.37 Allowed 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 115.322 -2.551 . . . . 44.11 111.948 178.71 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 40' ' ' LEU . . . . . . . . . . . . . 3.1 tp -70.44 109.53 4.83 Favored 'General case' 0 C--O 1.244 0.764 0 O-C-N 127.295 2.872 . . . . 35.91 111.158 -179.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 41' ' ' LEU . . . . . 0.62 ' CD2' ' CD2' ' H' ' 64' ' ' LEU . 0.2 OUTLIER -69.06 -60.22 2.51 Favored 'General case' 0 C--O 1.256 1.443 0 O-C-N 128.627 3.704 . . . . 29.73 110.847 174.767 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 42' ' ' CYS . . . . . 0.569 ' HB3' ' O ' ' H' ' 195' ' ' SER . 91.2 m -159.27 -168.01 2.21 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 105.479 -2.045 . . . . 23.74 105.479 -179.555 -68.342 -177.225 -109.635 103.349 2.019 102.872 -87.366 -76.33 2 2 . 1 . 001 ecloud build full ' H' H ' 43' ' ' GLY . . . . . 0.428 ' O ' ' HB2' ' H' ' 44' ' ' ALA . . . -100.77 176.87 27.64 Favored Glycine 0 C--O 1.269 2.337 0 CA-C-O 126.143 3.079 . . . . 20.94 106.957 170.174 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 44' ' ' ALA . . . . . 0.428 ' HB2' ' O ' ' H' ' 43' ' ' GLY . . . -170.35 -173.39 1.45 Allowed 'General case' 0 N--CA 1.504 2.237 0 C-N-CA 115.289 -2.565 . . . . 18.8 105.312 179.925 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 45' ' ' SER . . . . . . . . . . . . . 36.9 p -146.31 151.87 38.22 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 125.651 1.844 . . . . 21.97 115.48 172.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 46' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -90.84 116.79 28.95 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 127.147 2.179 . . . . 21.58 111.331 179.224 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 47' ' ' ILE . . . . . . . . . . . . 0.26 3.2 pt -110.25 -22.1 5.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-O 115.265 -2.302 . . . . 27.98 110.486 -176.538 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 48' ' ' SER . . . . . . . . . . . . . 60.1 p -154.95 174.67 14.82 Favored 'General case' 0 C--O 1.264 1.841 0 O-C-N 124.975 1.422 . . . . 30.99 107.167 175.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 49' ' ' ASP . . . . . 0.677 ' OD2' ' HB3' ' H' ' 111' ' ' PRO . 18.4 p-10 -76.16 17.13 0.37 Allowed 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 117.078 -1.849 . . . . 40.43 114.266 -177.452 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 50' ' ' ARG . . . . . 0.878 ' HE ' ' HE2' ' H' ' 107' ' ' LYS . 0.5 OUTLIER -148.66 -5.84 0.41 Allowed 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 113.837 -2.982 . . . . 50.0 109.937 -179.55 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 51' ' ' TRP . . . . . 0.99 ' CE3' ' O ' ' H' ' 548' ' ' HOH . 92.9 m95 -125.05 133.11 53.06 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 127.601 3.063 . . . . 31.73 111.38 -176.887 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 52' ' ' VAL . . . . . . . . . . . . . 69.0 t -117.49 135.61 57.34 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 CA-C-N 112.206 -2.27 . . . . 25.65 109.368 178.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 53' ' ' LEU . . . . . . . . . . . . . 16.9 tp -101.39 129.34 47.39 Favored 'General case' 0 C--O 1.248 0.976 0 O-C-N 120.6 -1.312 . . . . 20.93 108.512 177.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 54' ' ' THR . . . . . 0.464 HG23 ' O ' ' H' ' 55' ' ' ALA . 1.3 t -137.22 -172.07 3.11 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-O 117.265 -1.35 . . . . 22.64 109.357 175.509 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 55' ' ' ALA . . . . . 0.464 ' O ' HG23 ' H' ' 54' ' ' THR . . . -93.39 129.12 39.64 Favored 'General case' 0 C--O 1.267 1.976 1 C-N-CA 132.234 4.214 . . . . 20.6 106.625 174.01 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 56' ' ' ALA . . . . . 0.471 ' HB2' ' O ' ' H' ' 103' ' ' ILE . . . -62.17 -33.32 74.3 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-N 120.789 1.631 . . . . 20.11 111.331 -179.561 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 57' ' ' HIS . . . . . 0.439 ' NE2' ' N1X' ' H' ' 372' ' ' 00N . 2.0 p-80 -63.66 -12.8 36.94 Favored 'General case' 0 C--O 1.261 1.702 1 O-C-N 115.123 -4.736 . . . . 20.14 114.598 -178.244 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 58' ' ' CYS . . . . . 0.441 ' O ' ' HE2' ' H' ' 60' F LYS . 51.2 m -73.66 -30.04 62.68 Favored 'General case' 0 C--O 1.253 1.27 0 CA-C-O 115.883 -2.008 . . . . 23.99 109.968 179.343 -76.33 -87.366 -109.635 102.872 2.019 103.349 -177.225 -68.342 2 2 . 1 . 001 ecloud build full ' H' H ' 59' ' ' LEU . . . . . 0.631 HD13 HG21 ' H' ' 88' ' ' ILE . 37.1 mt -99.53 -37.63 9.09 Favored 'General case' 0 C--O 1.218 -0.58 0 O-C-N 126.995 2.684 . . . . 29.64 112.296 176.991 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 60' ' ' LEU . . . . . . . . . . . . . 49.8 tp -132.61 116.46 16.7 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 120.875 1.67 . . . . 27.7 114.505 -178.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' A TYR . . . . . . . . . . . . . 14.1 t80 -155.85 85.52 3.27 Favored Pre-proline 0 N--CA 1.476 0.851 0 CA-C-O 125.101 2.381 . . . . 26.02 108.513 -179.506 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' B PRO . . . . . 0.406 ' N ' ' CD ' ' H' ' 60' C PRO . 8.1 Cg_exo -54.67 -37.16 91.34 Favored 'Trans proline' 0 N--CA 1.482 0.848 0 CA-C-N 111.686 -1.934 . . . . 27.48 116.7 -178.008 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 60' C PRO . . . . . 0.406 ' CD ' ' N ' ' H' ' 60' B PRO . 16.1 Cg_exo -56.5 -31.75 87.21 Favored 'Trans proline' 0 C--N 1.305 -1.717 0 O-C-N 116.603 -2.367 . . . . 31.82 114.022 177.919 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 60' D TRP . . . . . . . . . . . . . 43.9 m0 -102.3 4.86 39.57 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 115.228 -2.32 . . . . 31.15 107.667 -179.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' E ASP . . . . . 0.447 ' OD2' ' O ' ' H' ' 425' ' ' HOH . 35.7 m-20 62.69 39.27 11.33 Favored 'General case' 0 C--O 1.25 1.089 0 O-C-N 128.781 3.801 . . . . 49.7 111.103 -178.624 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 60' F LYS . . . . . 0.441 ' HE2' ' O ' ' H' ' 58' ' ' CYS . 12.0 tttt -106.31 117.2 33.41 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 107.21 -1.404 . . . . 44.29 107.21 176.912 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 60' G ASN . . . . . 0.437 ' ND2' ' O ' ' H' ' 441' ' ' HOH . 49.0 t-20 -145.63 74.25 1.38 Allowed 'General case' 0 C--O 1.253 1.281 0 C-N-CA 125.659 1.583 . . . . 37.47 112.784 176.955 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 60' H PHE . . . . . . . . . . . . . 58.6 m-85 -78.47 150.47 32.97 Favored 'General case' 0 C--O 1.244 0.777 0 CA-C-N 120.511 1.505 . . . . 34.81 113.204 -178.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' I THR . . . . . 0.632 ' O ' ' HB2' ' H' ' 63' ' ' ASP . 0.4 OUTLIER -117.54 162.86 17.3 Favored 'General case' 0 C--O 1.243 0.739 1 CA-C-N 108.171 -4.104 . . . . 43.03 110.666 179.23 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' H' H ' 61' ' ' GLU . . . . . . . . . . . . . 59.3 mp0 -52.25 -47.74 65.61 Favored 'General case' 0 C--O 1.259 1.604 0 CA-C-O 123.482 1.611 . . . . 47.46 112.693 -177.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 62' ' ' ASN . . . . . . . . . . . . 0.266 41.9 m-20 -52.94 -35.64 58.82 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-O 124.351 2.024 . . . . 50.0 112.525 178.428 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 63' ' ' ASP . . . . . 0.632 ' HB2' ' O ' ' H' ' 60' I THR . 91.5 m-20 -67.83 -19.73 65.09 Favored 'General case' 0 C--O 1.244 0.795 0 CA-C-N 111.756 -2.475 . . . . 50.0 114.552 -170.578 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 64' ' ' LEU . . . . . 0.62 ' CD2' ' CD2' ' H' ' 41' ' ' LEU . 24.3 mt -125.64 161.03 28.17 Favored 'General case' 0 CA--C 1.518 -0.253 1 O-C-N 129.9 4.5 . . . . 46.08 118.972 -172.442 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 65' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -135.67 132.85 37.5 Favored 'General case' 0 C--N 1.308 -1.202 1 C-N-CA 132.272 4.229 . . . . 33.89 111.959 174.731 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 66' ' ' VAL . . . . . . . . . . . . 0.264 1.4 t -106.67 128.58 61.23 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.084 0 CA-C-N 110.603 -2.999 . . . . 33.36 108.627 -179.682 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 67' ' ' ARG . . . . . 0.44 ' HG2' HG12 ' H' ' 82' ' ' ILE . 67.3 mtp180 -127.96 115.0 17.86 Favored 'General case' 0 C--O 1.271 2.189 1 O-C-N 115.949 -4.219 . . . . 27.22 111.763 -177.263 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 68' ' ' ILE . . . . . . . . . . . . . 1.9 mt -106.07 144.86 14.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 111.362 -2.653 . . . . 24.67 113.063 -176.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 69' ' ' GLY . . . . . . . . . . . . . . . 87.22 13.33 66.18 Favored Glycine 0 CA--C 1.522 0.488 0 C-N-CA 127.972 2.701 . . . . 25.18 113.242 173.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 70' ' ' LYS . . . . . . . . . . . . . 5.7 mtpp -80.82 154.4 27.15 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 115.073 1.509 . . . . 28.59 115.073 -175.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 71' ' ' HIS . . . . . 0.501 ' CD2' HG22 ' H' ' 154' ' ' VAL . 84.5 t60 -126.23 -49.76 1.56 Allowed 'General case' 0 C--O 1.242 0.678 0 CA-C-N 110.05 -3.25 . . . . 28.12 107.317 175.48 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 72' ' ' SER . . . . . . . . . . . . . 22.8 t -81.33 129.35 34.58 Favored 'General case' 0 C--O 1.254 1.307 0 O-C-N 118.609 -2.557 . . . . 30.44 108.156 -176.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 73' ' ' ARG . . . . . 0.575 ' NH2' ' O ' ' H' ' 443' ' ' HOH . 55.2 ttp85 -63.02 -45.87 90.27 Favored 'General case' 0 N--CA 1.485 1.32 1 O-C-N 129.934 4.521 . . . . 37.48 115.004 175.911 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 74' ' ' THR . . . . . 0.675 ' O ' ' O ' ' H' ' 482' ' ' HOH . 25.9 p -112.26 -20.17 11.96 Favored 'General case' 0 N--CA 1.486 1.374 0 N-CA-C 120.494 3.516 . . . . 34.34 120.494 -177.334 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 75' ' ' ARG . . . . . 1.152 ' NH1' ' HG3' ' H' ' 75' ' ' ARG . 0.0 OUTLIER -70.42 151.2 45.44 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 115.313 -2.28 . . . . 45.1 109.968 175.168 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 76' ' ' TYR . . . . . . . . . . . . . 33.8 t80 -87.25 101.06 13.17 Favored 'General case' 0 C--N 1.312 -1.047 0 O-C-N 128.085 3.365 . . . . 40.84 105.262 171.124 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 77' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -73.68 85.1 1.62 Allowed 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 129.103 2.961 . . . . 34.59 115.13 -177.973 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 77' A ARG . . . . . 0.603 ' O ' ' HB2' ' H' ' 78' ' ' ASN . 3.9 ttp85 -62.93 122.28 15.62 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 131.418 3.887 . . . . 33.33 108.743 -175.95 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 78' ' ' ASN . . . . . 0.603 ' HB2' ' O ' ' H' ' 77' A ARG . 13.4 m-20 83.57 -7.66 1.11 Allowed 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 112.909 -1.95 . . . . 36.13 113.337 -178.596 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 79' ' ' ILE . . . . . . . . . . . . . 51.2 mt -109.66 -51.39 6.61 Favored 'Isoleucine or valine' 0 C--O 1.252 1.237 0 O-C-N 119.077 -2.264 . . . . 32.69 115.594 178.088 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 80' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -92.87 135.71 33.89 Favored 'General case' 0 CA--C 1.485 -1.534 0 CA-C-O 115.711 -2.09 . . . . 29.69 114.821 -171.836 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.85 133.8 46.04 Favored 'General case' 0 C--O 1.253 1.282 0 CA-C-N 120.691 1.587 . . . . 38.2 106.863 176.432 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 82' ' ' ILE . . . . . 0.44 HG12 ' HG2' ' H' ' 67' ' ' ARG . 53.3 mt -108.46 124.68 65.05 Favored 'Isoleucine or valine' 0 C--O 1.246 0.912 0 CA-C-O 113.793 -3.003 . . . . 33.0 106.961 179.17 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 83' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -125.24 176.49 6.71 Favored 'General case' 0 C--N 1.318 -0.767 0 O-C-N 126.387 2.304 . . . . 34.98 110.113 176.598 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 84' ' ' MET . . . . . . . . . . . . . 21.4 mtt -114.96 150.54 35.6 Favored 'General case' 0 C--N 1.307 -1.272 1 CA-C-N 108.1 -4.136 . . . . 50.0 109.837 -178.1 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 85' ' ' LEU . . . . . 0.779 HD11 ' HE1' ' H' ' 106' ' ' MET . 0.6 OUTLIER -92.63 139.33 30.68 Favored 'General case' 0 C--O 1.245 0.847 0 N-CA-C 106.465 -1.68 . . . . 38.44 106.465 -179.133 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 86' ' ' GLU . . . . . 0.678 ' OE2' ' HD3' ' H' ' 107' ' ' LYS . 7.0 tt0 -95.64 -19.74 19.49 Favored 'General case' 0 C--O 1.258 1.509 1 O-C-N 130.408 4.818 . . . . 50.0 105.866 174.59 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 87' ' ' LYS . . . . . . . . . . . . 0.354 0.3 OUTLIER -178.64 153.5 0.69 Allowed 'General case' 0 N--CA 1.483 1.213 0 O-C-N 119.803 -1.81 . . . . 46.72 113.708 -177.954 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 88' ' ' ILE . . . . . 0.631 HG21 HD13 ' H' ' 59' ' ' LEU . 96.3 mt -121.14 132.54 70.3 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 C-N-CA 124.916 1.286 . . . . 36.55 112.241 176.255 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 89' ' ' TYR . . . . . 0.505 ' OH ' ' HB3' ' H' ' 245' ' ' PHE . 24.8 m-85 -122.0 112.39 18.22 Favored 'General case' 0 C--N 1.287 -2.137 0 C-N-CA 129.135 2.974 . . . . 38.81 110.706 177.243 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 90' ' ' ILE . . . . . 0.46 HG23 ' HB1' ' H' ' 56' ' ' ALA . 32.3 mm -93.58 144.81 8.75 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.797 0 C-N-CA 127.94 2.496 . . . . 26.35 107.543 177.357 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 91' ' ' HIS . . . . . 0.613 ' CG ' ' HD2' ' H' ' 92' ' ' PRO . 14.8 t-80 -66.53 123.57 86.03 Favored Pre-proline 0 N--CA 1.501 2.08 0 CA-C-O 126.706 3.146 . . . . 28.21 107.673 175.068 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 92' ' ' PRO . . . . . 0.613 ' HD2' ' CG ' ' H' ' 91' ' ' HIS . 16.4 Cg_endo -46.89 -38.0 22.65 Favored 'Trans proline' 0 CA--C 1.544 1.015 0 O-C-N 117.715 -1.781 . . . . 31.16 111.611 -178.982 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 93' ' ' ARG . . . . . . . . . . . . . 14.9 mtp180 -103.65 34.4 2.99 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 116.658 2.095 . . . . 39.44 116.658 179.08 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 94' ' ' TYR . . . . . 0.436 ' HA ' ' HB2' ' H' ' 101' ' ' ARG . 0.3 OUTLIER -73.28 135.69 44.47 Favored 'General case' 0 N--CA 1.494 1.748 0 N-CA-C 103.067 -2.938 . . . . 24.03 103.067 -179.325 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 95' ' ' ASN . . . . . . . . . . . . . 53.7 t-20 -106.24 85.62 2.22 Favored 'General case' 0 C--N 1.288 -2.075 0 C-N-CA 126.284 1.834 . . . . 25.51 109.456 -176.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 96' ' ' TRP . . . . . 0.423 ' HB3' ' CZ ' ' H' ' 94' ' ' TYR . 54.5 p-90 -79.07 -22.03 45.92 Favored 'General case' 0 C--O 1.26 1.609 0 CA-C-O 114.436 -2.697 . . . . 27.96 108.573 178.278 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 97' ' ' ARG . . . . . . . . . . . . . 92.8 mtt-85 -70.94 -37.08 72.84 Favored 'General case' 0 C--O 1.254 1.34 1 O-C-N 130.554 4.909 . . . . 40.71 117.626 -179.839 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 97' A GLU . . . . . . . . . . . . . 41.3 tt0 -118.4 -62.43 1.54 Allowed 'General case' 0 C--O 1.264 1.832 0 CA-C-N 123.869 3.031 . . . . 35.7 111.057 -179.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 98' ' ' ASN . . . . . . . . . . . . . 38.2 p30 -129.71 6.49 5.15 Favored 'General case' 0 C--O 1.254 1.33 0 CA-C-O 113.229 -3.272 . . . . 25.88 118.806 -173.016 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 99' ' ' LEU . . . . . . . . . . . . . 6.0 mt 80.02 35.62 0.14 Allowed 'General case' 0 C--N 1.293 -1.87 0 CA-C-N 123.893 3.042 . . . . 25.08 107.495 179.815 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 100' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -76.82 132.85 39.42 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 128.027 3.329 . . . . 24.0 105.458 -176.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 101' ' ' ARG . . . . . 0.436 ' HB2' ' HA ' ' H' ' 94' ' ' TYR . 56.5 mtt85 69.63 38.58 1.69 Allowed 'General case' 0 N--CA 1.476 0.865 0 O-C-N 127.465 2.978 . . . . 38.08 112.77 -178.154 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 102' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -74.89 76.83 2.15 Favored 'General case' 0 N--CA 1.482 1.163 0 CA-C-N 114.549 -1.205 . . . . 19.27 112.116 -178.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 103' ' ' ILE . . . . . 0.471 ' O ' ' HB2' ' H' ' 56' ' ' ALA . 8.6 tt -151.76 145.43 16.02 Favored 'Isoleucine or valine' 0 C--O 1.261 1.677 0 C-N-CA 128.794 2.838 . . . . 21.35 109.193 -174.528 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 104' ' ' ALA . . . . . . . . . . . . . . . -152.5 159.39 43.32 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 126.149 2.156 . . . . 24.06 106.961 179.718 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 105' ' ' LEU . . . . . . . . . . . . . 17.0 mt -128.06 151.33 49.3 Favored 'General case' 0 C--O 1.258 1.508 0 N-CA-C 106.976 -1.49 . . . . 29.15 106.976 176.063 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 106' ' ' MET . . . . . 0.894 ' C ' ' O ' ' H' ' 548' ' ' HOH . 26.1 mtp -138.16 111.25 7.84 Favored 'General case' 0 C--O 1.258 1.545 0 O-C-N 127.208 2.818 . . . . 35.49 107.868 -178.991 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 107' ' ' LYS . . . . . 0.982 ' NZ ' ' HA3' ' H' ' 246' ' ' GLY . 1.8 ttmt -79.7 126.32 30.78 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 127.511 3.007 . . . . 46.44 108.244 178.226 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 108' ' ' LEU . . . . . . . . . . . . . 10.7 mt -67.82 151.25 47.48 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-O 114.201 -2.809 . . . . 31.1 110.79 179.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.92 -36.5 82.39 Favored 'General case' 0 C--O 1.257 1.461 0 O-C-N 125.396 1.685 . . . . 47.42 107.183 174.241 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 110' ' ' LYS . . . . . . . . . . . . . 6.0 ptpt -143.69 152.93 57.35 Favored Pre-proline 0 N--CA 1.501 2.113 0 C-N-CA 114.663 -2.815 . . . . 46.05 107.58 -179.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 111' ' ' PRO . . . . . 0.677 ' HB3' ' OD2' ' H' ' 49' ' ' ASP . 1.5 Cg_endo -64.37 146.83 90.44 Favored 'Trans proline' 0 C--N 1.308 -1.56 0 O-C-N 125.848 2.499 . . . . 35.61 110.9 -174.896 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 112' ' ' VAL . . . . . 0.425 ' O ' ' HB2' ' H' ' 49' ' ' ASP . 12.5 p -99.94 140.72 18.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 N-CA-C 103.219 -2.882 . . . . 34.2 103.219 -178.796 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 113' ' ' ALA . . . . . . . . . . . . . . . -87.59 138.64 31.29 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 100.695 -3.817 . . . . 31.78 100.695 178.344 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 114' ' ' PHE . . . . . 0.609 ' CZ ' ' HB3' ' H' ' 49' ' ' ASP . 16.5 m-30 -78.08 166.83 22.32 Favored 'General case' 0 C--N 1.288 -2.078 1 O-C-N 129.839 4.462 . . . . 28.9 105.756 -177.294 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 115' ' ' SER . . . . . . . . . . . . . 1.1 p -170.86 -173.59 1.37 Allowed 'General case' 0 N--CA 1.487 1.416 0 O-C-N 126.504 2.378 . . . . 27.42 104.638 -174.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 116' ' ' ASP . . . . . 0.694 ' OD1' ' O ' ' H' ' 421' ' ' HOH . 51.7 m-20 -65.56 -24.95 67.21 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-N 123.469 2.849 . . . . 32.95 112.219 177.618 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 117' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -102.67 -12.69 17.5 Favored 'General case' 0 C--N 1.312 -1.059 0 N-CA-C 115.843 1.794 . . . . 37.15 115.843 -174.333 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 118' ' ' ILE . . . . . . . . . . . . . 6.6 mt -129.18 115.37 35.63 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.71 1 C-N-CA 131.792 4.037 . . . . 27.94 110.689 -175.264 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 119' ' ' HIS . . . . . . . . . . . . . 18.2 t60 -158.54 148.3 15.15 Favored Pre-proline 0 N--CA 1.483 1.204 0 O-C-N 128.946 3.904 . . . . 28.32 108.335 179.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 120' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -82.14 152.47 16.28 Favored 'Trans proline' 0 C--N 1.323 -0.804 0 C-N-CA 123.778 2.985 . . . . 24.99 114.741 177.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 121' ' ' VAL . . . . . . . . . . . . . 7.2 p -96.06 160.22 2.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 CA-C-N 112.181 -2.281 . . . . 17.71 107.257 177.255 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 122' ' ' CYS . . . . . . . . . . . . . 79.5 m -93.14 147.12 23.14 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 123.244 1.497 . . . . 20.66 112.196 177.308 -60.52 -57.875 101.901 103.964 2.012 103.597 72.874 75.452 1 1 . 1 . 001 ecloud build full ' H' H ' 123' ' ' LEU . . . . . . . . . . . . . 52.7 mt -96.67 141.61 23.34 Favored Pre-proline 0 N--CA 1.488 1.456 0 N-CA-C 102.839 -3.023 . . . . 22.5 102.839 176.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 124' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -78.18 154.8 29.02 Favored 'Trans proline' 0 N--CA 1.444 -1.405 0 CA-C-O 126.242 2.518 . . . . 25.89 110.692 -174.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 125' ' ' ASP . . . . . 0.49 ' OD1' ' CB ' ' H' ' 128' ' ' THR . 17.4 p-10 -96.65 154.53 17.23 Favored 'General case' 0 C--N 1.299 -1.622 1 CA-C-O 128.908 4.194 . . . . 38.06 101.431 170.88 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 126' ' ' ARG . . . . . 0.899 ' HB3' ' OE1' ' H' ' 127' ' ' GLU . 57.9 ttt85 -45.65 -41.23 10.06 Favored 'General case' 0 CA--C 1.509 -0.628 1 CA-C-N 106.473 -4.876 . . . . 50.0 113.637 -179.912 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 127' ' ' GLU . . . . . 0.899 ' OE1' ' HB3' ' H' ' 126' ' ' ARG . 0.0 OUTLIER -83.17 -36.58 24.6 Favored 'General case' 0 C--O 1.275 2.416 0 CA-C-O 125.591 2.615 . . . . 50.0 114.379 -178.164 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 128' ' ' THR . . . . . 0.49 ' CB ' ' OD1' ' H' ' 125' ' ' ASP . 48.1 m -62.26 -40.69 97.05 Favored 'General case' 0 N--CA 1.484 1.25 1 O-C-N 115.972 -4.205 . . . . 32.03 103.435 176.431 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 129' ' ' ALA . . . . . . . . . . . . . . . -63.36 -38.38 90.94 Favored 'General case' 0 CA--C 1.5 -0.955 0 CA-C-O 126.028 2.823 . . . . 29.42 109.582 -176.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 129' A ALA . . . . . . . . . . . . . . . -68.21 -44.04 76.68 Favored 'General case' 0 CA--C 1.493 -1.216 0 CA-C-N 111.268 -2.696 . . . . 30.08 108.991 -176.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 129' B SER . . . . . . . . . . . . . 0.3 OUTLIER -76.14 -21.55 56.47 Favored 'General case' 0 C--O 1.256 1.401 0 CA-C-O 111.859 -3.924 . . . . 28.42 117.238 -178.286 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 129' C LEU . . . . . . . . . . . . . 47.4 mt -107.72 -29.44 9.12 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 126.98 2.675 . . . . 38.94 113.459 -171.781 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 130' ' ' LEU . . . . . 0.555 HD22 HD13 ' H' ' 162' ' ' ILE . 0.1 OUTLIER -73.06 77.22 1.22 Allowed 'General case' 0 N--CA 1.489 1.481 0 O-C-N 128.753 3.783 . . . . 32.45 110.5 179.374 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 131' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -135.47 139.87 44.39 Favored 'General case' 0 C--N 1.306 -1.321 0 C-N-CA 130.495 3.518 . . . . 50.0 116.815 -177.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 132' ' ' ALA . . . . . 0.45 ' HB1' ' HG3' ' H' ' 164' ' ' GLU . . . -58.99 126.31 27.19 Favored 'General case' 0 C--O 1.257 1.477 0 CA-C-O 114.177 -2.821 . . . . 30.14 108.196 -175.697 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 133' ' ' GLY . . . . . . . . . . . . . . . 104.48 -35.71 4.87 Favored Glycine 0 C--O 1.26 1.733 0 C-N-CA 115.372 -3.299 . . . . 24.49 115.06 -173.582 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 134' ' ' TYR . . . . . 0.537 ' HD1' ' N ' ' H' ' 134' ' ' TYR . 3.5 m-30 -68.93 141.33 55.02 Favored 'General case' 0 C--N 1.309 -1.158 0 O-C-N 118.848 -2.56 . . . . 33.43 108.769 175.019 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 135' ' ' LYS . . . . . . . . . . . . . 10.7 mttt -89.11 146.48 24.78 Favored 'General case' 0 CA--C 1.506 -0.748 0 CA-C-N 112.354 -2.203 . . . . 20.87 115.271 174.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 136' ' ' GLY . . . . . . . . . . . . . . . -131.17 -171.82 12.97 Favored Glycine 0 N--CA 1.507 3.373 0 N-CA-C 106.532 -2.627 . . . . 18.86 106.532 169.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 137' ' ' ARG . . . . . . . . . . . . . 37.2 ttm180 -136.32 139.5 42.65 Favored 'General case' 0 C--N 1.288 -2.087 0 O-C-N 116.425 -3.985 . . . . 20.76 107.109 -176.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 138' ' ' VAL . . . . . . . . . . . . . 2.5 t -115.43 144.49 22.9 Favored 'Isoleucine or valine' 0 C--O 1.248 0.993 1 O-C-N 130.809 5.068 . . . . 25.64 109.125 176.205 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 139' ' ' THR . . . . . 1.083 HG22 HG22 ' H' ' 157' ' ' VAL . 38.2 p -140.39 153.76 46.47 Favored 'General case' 0 N--CA 1.503 2.182 0 N-CA-C 107.002 -1.481 . . . . 20.25 107.002 177.576 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 140' ' ' GLY . . . . . . . . . . . . . . . 172.51 168.73 34.28 Favored Glycine 0 C--O 1.19 -2.627 0 N-CA-C 107.938 -2.065 . . . . 21.08 107.938 178.534 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 141' ' ' TRP . . . . . . . . . . . . . 3.9 m-90 -97.75 19.66 13.29 Favored 'General case' 0 N--CA 1.443 -0.819 0 C-N-CA 129.189 2.996 . . . . 24.28 114.187 174.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 142' ' ' GLY . . . . . . . . . . . . . . . -76.64 169.92 54.96 Favored Glycine 0 N--CA 1.438 -1.179 0 C-N-CA 128.146 2.784 . . . . 28.65 113.165 -174.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 143' ' ' ASN . . . . . 0.614 ' ND2' ' O ' ' H' ' 520' ' ' HOH . 76.5 m-20 -50.42 152.85 1.73 Allowed 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 124.948 2.308 . . . . 39.43 108.07 -179.786 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 144' ' ' LEU . . . . . . . . . . . . . 72.9 mt -102.51 -13.45 17.21 Favored 'General case' 0 CA--C 1.511 -0.537 1 CA-C-N 106.81 -4.723 . . . . 35.32 110.88 -175.179 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 145' ' ' LYS . . . . . . . . . . . . 0.285 1.4 ttpp -150.27 139.44 21.19 Favored 'General case' 0 N--CA 1.486 1.372 1 O-C-N 129.44 4.212 . . . . 50.0 105.402 -169.877 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' H' H ' 146' ' ' GLU . . . . . 0.469 ' OE1' ' NE ' ' H' ' 221' A ARG . 36.7 tt0 . . . . . 0 C--O 1.252 1.231 0 O-C-N 126.801 2.563 . . . . 47.61 108.89 -178.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 150' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.931 0 N-CA-C 106.782 -2.527 . . . . 45.3 106.782 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 151' ' ' GLN . . . . . 0.428 ' HA ' ' HD3' ' H' ' 152' ' ' PRO . 1.2 mt-30 -109.54 151.18 42.06 Favored Pre-proline 0 C--O 1.275 2.417 0 N-CA-C 106.309 -1.738 . . . . 50.0 106.309 174.788 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 152' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' H' ' 151' ' ' GLN . 10.6 Cg_endo -82.51 173.08 10.87 Favored 'Trans proline' 0 C--O 1.256 1.389 0 O-C-N 126.037 2.599 . . . . 35.98 108.619 -179.974 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 153' ' ' SER . . . . . 0.785 ' HB3' ' O ' ' H' ' 442' ' ' HOH . 78.1 p -93.99 -23.68 17.94 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 105.674 -1.973 . . . . 41.14 105.674 173.843 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 154' ' ' VAL . . . . . 0.501 HG22 ' CD2' ' H' ' 71' ' ' HIS 0.374 0.4 OUTLIER -131.69 167.87 25.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 CA-C-O 115.768 -2.063 . . . . 29.85 111.659 -176.108 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' H' H ' 155' ' ' LEU . . . . . . . . . . . . . 17.5 tp -60.44 128.56 37.27 Favored 'General case' 0 C--O 1.251 1.169 0 C-N-CA 126.428 1.891 . . . . 24.27 109.514 177.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 156' ' ' GLN . . . . . 0.502 ' C ' HG23 ' H' ' 157' ' ' VAL . 26.8 mm-40 -98.45 161.66 13.57 Favored 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 126.26 1.824 . . . . 22.47 110.952 179.679 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 157' ' ' VAL . . . . . 1.083 HG22 HG22 ' H' ' 139' ' ' THR . 46.3 t -144.92 151.41 15.39 Favored 'Isoleucine or valine' 0 C--O 1.248 1.002 0 O-C-N 119.68 -1.888 . . . . 25.99 106.54 -177.788 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 158' ' ' VAL . . . . . . . . . . . . . 10.5 p -153.58 138.41 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 CA-C-O 113.879 -2.963 . . . . 19.01 104.671 174.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 159' ' ' ASN . . . . . . . . . . . . . 75.0 m-20 -96.42 127.05 42.05 Favored 'General case' 0 C--O 1.252 1.236 0 C-N-CA 127.553 2.341 . . . . 22.42 108.119 172.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 160' ' ' LEU . . . . . . . . . . . . . 16.9 mt -134.43 151.82 76.86 Favored Pre-proline 0 C--O 1.275 2.445 0 O-C-N 116.863 -3.648 . . . . 26.83 106.701 -176.606 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 161' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -87.4 142.35 6.08 Favored 'Trans proline' 0 C--O 1.268 2.025 0 O-C-N 126.337 2.756 . . . . 22.23 113.214 -179.417 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 162' ' ' ILE . . . . . 0.555 HD13 HD22 ' H' ' 130' ' ' LEU . 33.5 mt -65.63 141.02 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.833 0 O-C-N 118.16 -2.837 . . . . 20.18 108.218 171.9 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 163' ' ' VAL . . . . . . . . . . . . . 61.3 t -115.77 138.88 44.78 Favored 'Isoleucine or valine' 0 C--O 1.269 2.097 0 C-N-CA 127.828 2.451 . . . . 23.25 109.518 -177.542 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 164' ' ' GLU . . . . . 0.887 ' OE1' HG21 ' H' ' 167' ' ' VAL . 1.9 mp0 -53.06 138.56 30.59 Favored 'General case' 0 C--O 1.266 1.934 0 CA-C-O 125.314 2.483 . . . . 50.0 112.849 -179.88 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 165' ' ' ARG . . . . . 0.654 ' NH1' ' O ' ' H' ' 180' ' ' MET . 2.4 mtp180 -48.41 -39.33 28.79 Favored Pre-proline 0 C--N 1.296 -1.75 1 O-C-N 116.075 -4.141 . . . . 50.0 116.775 -176.068 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 166' ' ' PRO . . . . . 0.458 ' CD ' ' N ' ' H' ' 165' ' ' ARG . 1.4 Cg_endo -68.99 -43.49 3.27 Favored 'Trans proline' 0 C--O 1.255 1.349 0 C-N-CA 122.805 2.337 . . . . 26.08 110.006 -174.108 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 167' ' ' VAL . . . . . 0.887 HG21 ' OE1' ' H' ' 164' ' ' GLU . 59.0 t -60.67 -43.72 95.53 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.918 1 CA-C-N 107.914 -4.221 . . . . 24.45 106.508 178.339 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 168' ' ' CYS . . . . . . . . . . . . . 92.6 m -58.56 -62.76 1.61 Allowed 'General case' 0 C--O 1.246 0.904 0 O-C-N 120.27 -1.519 . . . . 24.12 107.067 178.794 -70.063 -62.894 -88.101 106.536 2.009 105.13 -76.683 83.506 1 1 . 1 . 001 ecloud build full ' H' H ' 169' ' ' LYS . . . . . 0.779 ' NZ ' ' HB3' ' H' ' 169' ' ' LYS . 0.0 OUTLIER -48.14 -40.99 25.5 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 115.559 1.689 . . . . 45.22 115.559 178.965 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 170' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -79.72 9.05 5.54 Favored 'General case' 0 C--O 1.279 2.622 0 CA-C-N 123.613 2.915 . . . . 29.21 117.824 -176.825 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 171' ' ' SER . . . . . . . . . . . . . 53.4 p -103.06 -6.26 22.49 Favored 'General case' 0 C--O 1.251 1.176 0 O-C-N 128.202 3.439 . . . . 21.65 109.895 -175.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 172' ' ' THR . . . . . . . . . . . . 0.337 3.2 t -151.35 171.86 16.82 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 118.028 -2.92 . . . . 22.89 109.687 -177.581 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 173' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' H' ' 173' ' ' ARG . 6.2 mtp180 -98.16 -11.23 23.01 Favored 'General case' 0 C--N 1.309 -1.158 0 C-N-CA 126.945 2.098 . . . . 45.24 110.018 175.218 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 174' ' ' ILE . . . . . . . . . . . . . 10.5 mm -72.83 139.26 19.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 O-C-N 125.989 2.056 . . . . 25.8 106.188 -179.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 175' ' ' ARG . . . . . 0.704 ' HD2' ' O ' ' H' ' 453' ' ' HOH . 57.1 ttp85 -72.12 116.04 12.06 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-N 113.189 -1.823 . . . . 28.94 111.924 174.064 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 176' ' ' ILE . . . . . 0.513 HD12 ' CE2' ' H' ' 227' ' ' PHE 0.256 23.5 mm -80.5 145.14 9.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 118.014 -2.929 . . . . 30.03 109.879 172.01 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 177' ' ' THR . . . . . . . . . . . . . 6.6 p -126.3 173.36 9.37 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 127.974 2.509 . . . . 26.89 107.656 179.04 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 178' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -72.33 -9.24 58.24 Favored 'General case' 0 C--N 1.281 -2.388 0 C-N-CA 128.553 2.741 . . . . 34.44 112.372 177.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 179' ' ' ASN . . . . . . . . . . . . . 68.7 m-20 -91.21 17.86 7.7 Favored 'General case' 0 C--N 1.301 -1.543 1 CA-C-O 110.66 -4.495 . . . . 24.67 109.103 175.282 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 180' ' ' MET . . . . . 0.654 ' O ' ' NH1' ' H' ' 165' ' ' ARG . 26.3 mtt -143.74 151.68 40.32 Favored 'General case' 0 C--N 1.301 -1.522 1 CA-C-O 110.91 -4.376 . . . . 22.04 104.86 -178.353 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 181' ' ' PHE . . . . . . . . . . . . . 22.4 p90 -139.13 147.72 42.3 Favored 'General case' 0 C--N 1.308 -1.204 1 O-C-N 129.761 4.413 . . . . 19.59 103.754 176.707 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 182' ' ' CYS . . . . . . . . . . . . . 2.8 p -110.3 160.53 16.46 Favored 'General case' 0 N--CA 1.5 2.027 0 CA-C-N 122.877 2.58 . . . . 22.54 109.132 174.112 83.506 -76.683 -88.101 105.13 2.009 106.536 -62.894 -70.063 1 1 . 1 . 001 ecloud build full ' H' H ' 183' ' ' ALA . . . . . . . . . . . . . . . -148.43 143.76 26.99 Favored 'General case' 0 C--N 1.306 -1.294 0 O-C-N 119.302 -2.124 . . . . 23.97 109.596 -177.119 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 184' ' ' GLY . . . . . . . . . . . . . . . 152.15 163.27 11.43 Favored Glycine 0 N--CA 1.478 1.489 0 O-C-N 116.716 -3.74 . . . . 24.24 106.529 -178.607 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 184' A TYR . . . . . . . . . . . . 0.295 47.2 m-85 -82.35 158.76 23.25 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 123.929 0.892 . . . . 31.75 111.179 176.699 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 185' ' ' LYS . . . . . 0.497 ' HD3' ' OH ' ' H' ' 225' ' ' TYR . 3.9 mmtp -87.6 147.76 42.4 Favored Pre-proline 0 C--O 1.252 1.198 0 N-CA-C 107.731 -1.211 . . . . 39.2 107.731 172.57 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 186' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -48.74 -37.84 36.1 Favored 'Trans proline' 0 C--O 1.235 0.349 0 O-C-N 126.945 3.076 . . . . 42.24 107.571 -176.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 186' A ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.77 -50.43 72.39 Favored 'General case' 0 C--N 1.309 -1.188 1 O-C-N 129.144 4.028 . . . . 50.0 111.471 179.176 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 186' B GLU . . . . . . . . . . . . . 30.7 mt-10 -59.98 -20.32 57.05 Favored 'General case' 0 C--O 1.257 1.457 0 O-C-N 124.47 1.106 . . . . 45.17 108.104 -173.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 186' C GLY . . . . . . . . . . . . . . . 31.02 88.3 0.01 OUTLIER Glycine 0 N--CA 1.482 1.72 1 O-C-N 129.334 4.146 . . . . 44.06 111.238 -179.809 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 186' D LYS . . . . . . . . . . . . . 8.1 ttmm -170.53 135.02 1.15 Allowed 'General case' 0 C--O 1.25 1.112 2 C-N-CA 135.343 5.457 . . . . 44.25 98.527 178.351 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 187' ' ' ARG . . . . . 0.835 ' HB2' ' HG3' ' H' ' 18' ' ' GLU . 38.7 mtp85 -120.69 176.14 5.67 Favored 'General case' 0 C--N 1.295 -1.8 0 CA-C-N 124.826 3.467 . . . . 42.97 119.404 -173.957 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 188' ' ' GLY . . . . . 0.497 ' HA2' ' O ' ' H' ' 17' ' ' VAL . . . 138.33 152.04 5.93 Favored Glycine 0 C--O 1.249 1.088 0 CA-C-O 116.017 -2.546 . . . . 28.37 108.321 175.415 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 189' ' ' ASP . . . . . 0.684 ' OD2' ' NH2' ' H' ' 372' ' ' 00N . 48.6 t0 -168.38 165.95 12.57 Favored 'General case' 0 C--O 1.262 1.711 0 O-C-N 128.266 2.98 . . . . 26.15 103.205 -178.798 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 190' ' ' ALA . . . . . . . . . . . . . . . -79.78 177.07 9.16 Favored 'General case' 0 C--O 1.254 1.296 0 N-CA-C 102.152 -3.277 . . . . 20.76 102.152 169.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 191' ' ' CYS . . . . . . . . . . . . . 14.4 t -153.58 -171.7 3.99 Favored 'General case' 0 N--CA 1.507 2.399 0 N-CA-C 101.218 -3.623 . . . . 28.84 101.218 176.643 -166.566 47.613 92.248 108.196 2.021 106.168 -170.847 -56.304 1 1 . 1 . 001 ecloud build full ' H' H ' 192' ' ' GLU . . . . . . . . . . . . . 25.8 mp0 -61.32 141.44 57.58 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-O 117.905 -1.045 . . . . 37.37 108.767 178.082 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 193' ' ' GLY . . . . . . . . . . . . . . . 89.35 -12.94 65.05 Favored Glycine 0 C--N 1.307 -1.081 1 CA-C-O 109.6 -6.111 . . . . 22.57 109.182 -178.774 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 194' ' ' ASP . . . . . 0.516 ' OD2' HD13 ' H' ' 16' ' ' ILE . 76.4 m-20 -75.58 -21.67 57.64 Favored 'General case' 0 C--O 1.267 1.981 1 CA-C-N 124.323 4.062 . . . . 23.36 116.313 169.079 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 195' ' ' SER . . . . . 1.29 ' OG ' ' C ' ' H' ' 372' ' ' 00N . 4.1 m -34.07 142.22 0.04 OUTLIER 'General case' 0 N--CA 1.433 -1.298 0 CA-C-O 113.587 -3.101 . . . . 19.91 111.235 -179.983 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 196' ' ' GLY . . . . . . . . . . . . . . . 81.57 -14.3 30.72 Favored Glycine 0 C--O 1.243 0.683 0 O-C-N 129.041 3.963 . . . . 15.15 110.651 170.003 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 197' ' ' GLY . . . . . . . . . . . . . . . -72.32 165.6 54.17 Favored Glycine 0 C--O 1.256 1.5 0 CA-C-O 124.586 2.215 . . . . 21.56 110.481 176.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 198' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_endo -84.1 145.5 11.08 Favored 'Trans proline' 0 C--O 1.249 1.043 0 N-CA-C 117.63 2.127 . . . . 20.08 117.63 -177.146 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 199' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -113.13 108.82 17.83 Favored 'General case' 0 N--CA 1.501 2.087 0 CA-C-N 110.533 -3.03 . . . . 18.74 103.725 168.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 200' ' ' VAL . . . . . 0.423 HG12 ' HA ' ' H' ' 209' ' ' GLN . 32.7 m -118.59 156.36 20.49 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.955 0 CA-C-O 125.521 2.581 . . . . 22.83 112.068 -173.255 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 201' ' ' MET . . . . . . . . . . . . . 60.6 mtp -129.25 158.84 37.91 Favored 'General case' 0 C--O 1.207 -1.159 0 CA-C-N 111.532 -2.576 . . . . 21.79 108.028 171.381 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 202' ' ' LYS . . . . . 0.425 ' O ' ' HE2' ' L' ' 14' J TYR . 44.9 tttt -105.14 117.25 33.54 Favored 'General case' 0 C--O 1.262 1.745 0 CA-C-O 116.596 -1.668 . . . . 19.02 110.157 172.309 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 203' ' ' SER . . . . . . . . . . . . . 43.3 t -61.0 129.11 90.15 Favored Pre-proline 0 N--CA 1.497 1.886 0 O-C-N 126.445 2.341 . . . . 25.22 113.823 174.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 204' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_endo -77.52 -6.67 16.42 Favored 'Trans proline' 0 C--N 1.315 -1.203 0 C-N-CA 121.688 1.592 . . . . 22.72 111.097 178.209 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 204' A PHE . . . . . . . . . . . . . 42.1 m-85 -89.62 -50.36 6.13 Favored 'General case' 0 C--O 1.241 0.605 0 O-C-N 118.704 -2.498 . . . . 27.49 114.699 -176.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 204' B ASN . . . . . . . . . . . . . 48.0 p-10 -120.84 3.9 10.54 Favored 'General case' 0 C--O 1.265 1.892 0 O-C-N 128.468 3.605 . . . . 24.27 114.138 -174.509 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 205' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 66.09 13.68 9.23 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 113.708 -3.044 . . . . 41.34 117.328 178.17 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 206' ' ' ARG . . . . . 0.462 ' HD3' ' O ' ' L' ' 1' ' ' CYS . 40.0 mtt180 -91.16 167.58 12.24 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 128.122 3.389 . . . . 26.43 111.983 -177.712 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 207' ' ' TRP . . . . . . . . . . . . . 78.2 m95 -103.08 135.92 43.85 Favored 'General case' 0 CA--C 1.508 -0.653 0 O-C-N 127.2 2.813 . . . . 18.18 103.475 -179.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 208' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -122.94 142.74 50.48 Favored 'General case' 0 N--CA 1.523 3.198 1 O-C-N 129.328 4.143 . . . . 21.71 110.799 178.442 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 209' ' ' GLN . . . . . 0.423 ' HA ' HG12 ' H' ' 200' ' ' VAL . 41.0 tt0 -85.36 123.91 31.37 Favored 'General case' 0 N--CA 1.495 1.814 0 C-N-CA 115.317 -2.553 . . . . 18.08 108.645 173.443 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 210' ' ' MET . . . . . . . . . . . . . 24.7 mmm -102.15 -22.13 14.27 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 114.939 1.459 . . . . 30.49 114.939 175.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 211' ' ' GLY . . . . . 0.482 ' HA2' ' O ' ' H' ' 229' ' ' THR . . . -148.21 164.23 28.95 Favored Glycine 0 C--N 1.35 1.352 0 O-C-N 120.817 -1.177 . . . . 18.61 113.295 -177.105 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 212' ' ' ILE . . . . . . . . . . . . . 54.3 mt -122.94 126.56 73.94 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.896 1 CA-C-O 110.976 -4.345 . . . . 19.67 106.441 177.675 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 213' ' ' VAL . . . . . . . . . . . . . 24.4 t -52.4 126.62 8.45 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.466 0 CA-C-N 121.685 2.039 . . . . 19.56 106.649 179.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 214' ' ' SER . . . . . . . . . . . . . 9.2 t -121.27 -61.9 1.49 Allowed 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 113.952 -3.099 . . . . 20.57 113.903 -175.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 215' ' ' TRP . . . . . . . . . . . . . 65.6 p-90 -158.56 165.15 35.19 Favored 'General case' 0 CA--C 1.494 -1.211 0 CA-C-O 125.568 2.604 . . . . 22.65 116.397 -176.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 216' ' ' GLY . . . . . 0.526 ' O ' ' N3 ' ' H' ' 372' ' ' 00N . . . -164.91 -174.21 34.38 Favored Glycine 0 N--CA 1.49 2.269 0 CA-C-N 108.877 -3.783 . . . . 20.83 107.556 172.93 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 217' ' ' GLU . . . . . 0.558 ' OE1' ' NZ ' ' H' ' 224' ' ' LYS . 38.7 mt-10 -132.53 101.37 5.29 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 110.719 -2.74 . . . . 34.15 104.983 -179.47 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 219' ' ' GLY . . . . . . . . . . . . . . . 81.93 -156.33 36.1 Favored Glycine 0 N--CA 1.495 2.619 0 C-N-CA 114.598 -3.667 . . . . 26.06 105.376 -172.026 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 220' ' ' CYS . . . . . . . . . . . . . 61.4 m -158.69 126.64 5.13 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 109.623 -3.288 . . . . 29.17 109.978 -177.378 -56.304 -170.847 92.248 106.168 2.021 108.196 47.613 -166.566 1 1 . 1 . 001 ecloud build full ' H' H ' 221' ' ' ASP . . . . . 0.516 ' O ' ' NH2' ' H' ' 187' ' ' ARG 0.3 27.9 t70 55.58 22.15 5.01 Favored 'General case' 0 C--O 1.26 1.643 0 CA-C-N 112.269 -2.241 . . . . 33.9 111.034 177.794 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 221' A ARG . . . . . 0.469 ' NE ' ' OE1' ' H' ' 146' ' ' GLU . 0.8 OUTLIER -66.28 152.67 44.44 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 107.601 -1.259 . . . . 47.81 107.601 173.444 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 222' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -77.67 144.88 37.02 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 119.126 -2.234 . . . . 50.0 109.954 179.468 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 223' ' ' GLY . . . . . . . . . . . . . . . 68.46 10.08 59.52 Favored Glycine 0 C--O 1.251 1.157 0 N-CA-C 109.369 -1.492 . . . . 36.04 109.369 177.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 224' ' ' LYS . . . . . 0.558 ' NZ ' ' OE1' ' H' ' 217' ' ' GLU . 6.3 mmtt -116.37 167.04 11.39 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 105.38 -2.082 . . . . 32.77 105.38 174.187 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 225' ' ' TYR . . . . . 0.497 ' OH ' ' HD3' ' H' ' 185' ' ' LYS . 18.2 m-85 -147.15 155.13 41.88 Favored 'General case' 0 C--O 1.255 1.361 0 C-N-CA 128.38 2.672 . . . . 26.0 113.452 -176.264 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 226' ' ' GLY . . . . . . . . . . . . . . . -84.22 151.97 27.64 Favored Glycine 0 CA--C 1.538 1.508 0 CA-C-O 115.643 -2.754 . . . . 16.89 106.947 177.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 227' ' ' PHE . . . . . 0.513 ' CE2' HD12 ' H' ' 176' ' ' ILE . 30.0 m-85 -117.02 138.77 51.36 Favored 'General case' 0 C--O 1.254 1.292 1 O-C-N 130.724 4.426 . . . . 20.74 108.656 -179.876 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 228' ' ' TYR . . . . . . . . . . . . 0.278 72.2 m-85 -131.16 145.17 51.85 Favored 'General case' 0 N--CA 1.485 1.28 1 CA-C-O 110.235 -4.697 . . . . 22.48 109.521 -176.128 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' H' H ' 229' ' ' THR . . . . . 0.482 ' O ' ' HA2' ' H' ' 211' ' ' GLY . 4.8 m -60.88 135.97 57.94 Favored 'General case' 0 C--O 1.276 2.455 0 O-C-N 128.9 3.875 . . . . 21.02 113.997 168.433 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 230' ' ' HIS . . . . . 0.402 ' NE2' HD12 ' H' ' 130' ' ' LEU . 21.6 t-80 -83.48 112.85 20.34 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 128.246 3.466 . . . . 24.47 108.344 177.662 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 231' ' ' VAL . . . . . . . . . . . . . 31.5 t -78.74 -40.85 23.94 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 O-C-N 127.82 3.2 . . . . 21.33 106.23 -166.436 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 232' ' ' PHE . . . . . . . . . . . . 0.286 32.0 t80 -57.33 -47.75 80.74 Favored 'General case' 0 C--N 1.294 -1.835 0 CA-C-O 123.442 1.591 . . . . 31.24 111.307 -177.393 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 233' ' ' ARG . . . . . . . . . . . . . 4.8 mmt180 -53.59 -33.43 54.86 Favored 'General case' 0 C--O 1.244 0.784 0 O-C-N 117.821 -3.049 . . . . 45.79 112.065 175.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 234' ' ' LEU . . . . . . . . . . . . . 8.2 mt -98.59 12.1 36.35 Favored 'General case' 0 C--O 1.24 0.554 0 O-C-N 119.935 -1.728 . . . . 30.22 111.96 -178.412 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 235' ' ' LYS . . . . . 0.454 ' O ' ' HB2' ' H' ' 239' ' ' GLN . 13.2 tttt -64.35 -27.6 69.13 Favored 'General case' 0 C--O 1.255 1.348 0 O-C-N 118.96 -2.338 . . . . 44.17 114.647 -174.215 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 236' ' ' LYS . . . . . 0.777 ' HE2' ' O ' ' H' ' 465' ' ' HOH . 18.9 mmtt -66.58 -48.34 69.9 Favored 'General case' 0 C--O 1.239 0.515 0 CA-C-O 114.33 -2.748 . . . . 49.08 105.034 -179.711 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 237' ' ' TRP . . . . . 0.403 ' O ' ' CG1' ' H' ' 241' ' ' VAL . 74.0 t90 -56.25 -47.27 78.85 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 128.76 3.787 . . . . 30.25 110.939 178.132 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 238' ' ' ILE . . . . . . . . . . . . . 71.7 mt -50.39 -54.53 8.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 O-C-N 119.471 -2.018 . . . . 30.97 111.041 -177.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 239' ' ' GLN . . . . . 0.457 ' O ' ' C ' ' H' ' 240' ' ' LYS . 4.6 tt0 -49.44 -63.46 1.1 Allowed 'General case' 0 C--N 1.296 -1.755 2 CA-C-O 129.528 4.49 . . . . 50.0 107.849 -179.773 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 240' ' ' LYS . . . . . 0.457 ' C ' ' O ' ' H' ' 239' ' ' GLN . 25.0 tttp -45.04 -52.98 8.37 Favored 'General case' 0 C--N 1.311 -1.094 0 O-C-N 117.272 -3.392 . . . . 49.1 109.842 178.512 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 241' ' ' VAL . . . . . 0.403 ' CG1' ' O ' ' H' ' 237' ' ' TRP 0.379 0.4 OUTLIER -70.39 -35.78 63.79 Favored 'Isoleucine or valine' 0 C--O 1.255 1.377 0 C-N-CA 117.927 -1.509 . . . . 37.72 114.171 -176.021 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' H' H ' 242' ' ' ILE . . . . . . . . . . . . . 26.8 mt -71.3 -14.63 17.96 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.126 0 CA-C-O 116.357 -1.782 . . . . 40.98 109.453 179.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 243' ' ' ASP . . . . . . . . . . . . 0.473 0.0 OUTLIER -96.52 -27.04 15.04 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 116.048 -2.261 . . . . 50.0 114.899 179.563 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 244' ' ' GLN . . . . . 1.079 ' HG2' ' CD2' ' H' ' 245' ' ' PHE . 1.0 OUTLIER -87.78 -35.35 17.91 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 117.261 -3.399 . . . . 50.0 112.898 179.612 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 245' ' ' PHE . . . . . 1.079 ' CD2' ' HG2' ' H' ' 244' ' ' GLN . 90.6 m-85 -109.29 3.73 21.94 Favored 'General case' 0 C--O 1.264 1.855 0 N-CA-C 117.695 2.48 . . . . 50.0 117.695 -173.696 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 246' ' ' GLY . . . . . 0.982 ' HA3' ' NZ ' ' H' ' 107' ' ' LYS . . . . . . . . 0 C--O 1.272 2.476 2 CA-C-O 106.243 -7.976 . . . . 50.0 109.096 178.301 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 355' ' ' ASP . . . . . 0.443 ' HB3' HG21 ' H' ' 74' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.484 1.264 0 CA-C-O 124.417 2.055 . . . . 50.0 105.66 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 356' ' ' PHE . . . . . 0.522 ' HA ' ' HB ' ' H' ' 74' ' ' THR . 55.8 m-85 -66.31 124.25 22.19 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 112.38 -2.191 . . . . 47.65 109.094 -174.674 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 357' ' ' GLU . . . . . 0.575 ' HG2' ' N ' ' I' ' 358' ' ' GLU . 15.4 tt0 -75.29 144.78 42.3 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 127.469 3.509 . . . . 45.42 106.711 172.329 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 358' ' ' GLU . . . . . 0.769 ' HG3' ' O ' ' I' ' 488' ' ' HOH . 0.0 OUTLIER -59.09 149.98 26.35 Favored 'General case' 0 C--O 1.266 1.926 0 O-C-N 116.657 -3.777 . . . . 50.0 111.448 -176.898 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' I' I ' 359' ' ' ILE . . . . . . . . . . . . . 3.9 pt -114.61 158.47 40.13 Favored Pre-proline 0 C--O 1.256 1.399 0 CA-C-O 115.688 -2.101 . . . . 47.07 110.135 179.353 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 360' ' ' PRO . . . . . 0.562 ' HB2' ' OE2' ' I' ' 362' ' ' GLU . 1.7 Cg_endo -58.16 134.85 64.6 Favored 'Trans proline' 0 C--O 1.255 1.339 0 C-N-CA 123.049 2.499 . . . . 47.79 113.358 178.0 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 361' ' ' GLU . . . . . . . . . . . . . . . -53.39 -25.24 14.82 Favored 'General case' 0 C--O 1.26 1.619 0 N-CA-C 118.658 2.836 . . . . 48.4 118.658 -176.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 362' ' ' GLU . . . . . 0.562 ' OE2' ' HB2' ' I' ' 360' ' ' PRO 0.271 3.0 pm0 -67.54 -5.53 15.68 Favored 'General case' 0 C--O 1.244 0.772 0 CA-C-O 114.739 -2.553 . . . . 50.0 107.317 -177.226 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' I' I ' 363' ' ' TYS . . . . . 0.417 ' HE2' ' HG2' ' I' ' 360' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 364' ' ' LEU . . . . . 0.801 ' C ' ' O ' ' I' ' 538' ' ' HOH . 1.6 mm? . . . . . 0 N--CA 1.48 1.043 0 CA-C-O 114.309 -2.758 . . . . 47.21 105.359 176.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 650' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 651' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 372' ' ' 00N . . . . . 1.29 ' C ' ' OG ' ' H' ' 195' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 447' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 478' ' ' HOH . . . . . 0.673 ' O ' ' CA ' ' L' ' 1' A ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 484' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 493' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 514' ' ' HOH . . . . . 0.497 ' O ' ' NZ ' ' L' ' 14' A LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 401' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 421' ' ' HOH . . . . . 0.694 ' O ' ' OD1' ' H' ' 116' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 422' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 425' ' ' HOH . . . . . 0.447 ' O ' ' OD2' ' H' ' 60' E ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 431' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 432' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 435' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 436' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 438' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 439' ' ' HOH . . . . . 0.438 ' O ' ' NH1' ' H' ' 73' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 440' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 441' ' ' HOH . . . . . 0.437 ' O ' ' ND2' ' H' ' 60' G ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 442' ' ' HOH . . . . . 0.785 ' O ' ' HB3' ' H' ' 153' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 443' ' ' HOH . . . . . 0.575 ' O ' ' NH2' ' H' ' 73' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 ' 448' ' ' HOH . . . . . 0.911 ' O ' ' HE2' ' H' ' 245' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 449' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 450' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 453' ' ' HOH . . . . . 0.704 ' O ' ' HD2' ' H' ' 175' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 ' 463' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 464' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 465' ' ' HOH . . . . . 0.777 ' O ' ' HE2' ' H' ' 236' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 ' 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 ' 473' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 475' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 476' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 477' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 480' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 481' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 482' ' ' HOH . . . . . 0.675 ' O ' ' O ' ' H' ' 74' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 483' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 485' ' ' 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 ' 489' ' ' HOH . . . . . 0.628 ' O ' ' HA ' ' H' ' 18' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 ' 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 0 . 1 . 001 ecloud build full ' H' H ' 499' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 500' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 503' ' ' HOH . . . . . 0.704 ' O ' ' HB2' ' H' ' 126' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 510' ' ' 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 ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 520' ' ' HOH . . . . . 0.614 ' O ' ' ND2' ' H' ' 143' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 536' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 537' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 539' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 540' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 541' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 542' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 543' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 544' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 546' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 548' ' ' HOH . . . . . 0.99 ' O ' ' CE3' ' H' ' 51' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 549' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 550' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 551' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 552' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 553' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 554' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 556' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 557' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 558' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 559' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 560' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 561' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 454' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 474' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 479' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 488' ' ' HOH . . . . . 0.769 ' O ' ' HG3' ' I' ' 358' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 492' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 538' ' ' HOH . . . . . 0.801 ' O ' ' C ' ' I' ' 364' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 1' B ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.755 0 CA-C-O 125.476 2.56 . . . . 46.33 111.922 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 1' A ASP . . . . . 0.673 ' CA ' ' O ' ' L' ' 478' ' ' HOH . 12.8 t0 -100.77 21.56 13.35 Favored 'General case' 0 C--O 1.258 1.523 0 CA-C-N 108.712 -3.858 . . . . 50.0 107.406 171.27 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 1' ' ' CYS . . . . . 0.462 ' O ' ' HD3' ' H' ' 206' ' ' ARG . 14.3 p -57.13 148.31 22.32 Favored 'General case' 0 CA--C 1.534 0.346 1 CA-C-O 130.174 4.797 . . . . 26.47 114.667 -178.786 75.452 72.874 101.901 103.597 2.012 103.964 -57.875 -60.52 3 3 . 1 . 001 ecloud nobuild full ' L' L ' 2' ' ' GLY . . . . . . . . . . . . . . . 56.54 23.51 43.17 Favored Glycine 0 C--O 1.256 1.48 0 CA-C-O 113.509 -3.939 . . . . 19.12 113.874 174.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 3' ' ' LEU . . . . . . . . . . . . . 85.4 mt -115.27 102.52 9.95 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-O 113.86 -2.971 . . . . 19.36 105.969 175.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 4' ' ' ARG . . . . . 0.506 ' HB2' ' OE1' ' L' ' 8' ' ' GLU . 76.1 mtm180 -65.04 131.09 95.09 Favored Pre-proline 0 N--CA 1.488 1.455 0 O-C-N 129.01 3.944 . . . . 20.2 115.337 -171.764 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 5' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -58.79 -27.32 83.48 Favored 'Trans proline' 0 C--O 1.269 2.063 0 CA-C-O 113.403 -2.832 . . . . 26.57 112.658 177.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 6' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -100.97 -1.65 33.86 Favored 'General case' 0 C--O 1.252 1.209 1 O-C-N 113.12 -5.988 . . . . 24.05 112.644 -178.097 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' L' L ' 7' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -125.0 -84.03 0.64 Allowed 'General case' 0 N--CA 1.503 2.179 0 C-N-CA 115.895 -2.322 . . . . 26.02 108.955 -172.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 8' ' ' GLU . . . . . 0.506 ' OE1' ' HB2' ' L' ' 4' ' ' ARG . 20.1 mp0 -55.77 -51.39 67.56 Favored 'General case' 0 C--N 1.306 -1.306 0 C-N-CA 128.249 2.62 . . . . 22.2 110.705 -176.947 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 9' ' ' LYS . . . . . 0.539 ' HE2' ' OD2' ' L' ' 1' A ASP . 4.1 mmtp -60.21 -16.01 29.43 Favored 'General case' 0 C--N 1.328 -0.355 0 O-C-N 126.428 2.33 . . . . 32.13 113.069 179.377 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 10' ' ' LYS . . . . . . . . . . . . . 17.7 mtpt -116.76 2.31 12.88 Favored 'General case' 0 C--O 1.261 1.666 0 O-C-N 119.35 -2.094 . . . . 32.07 109.498 -179.645 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 11' ' ' SER . . . . . . . . . . . . . 4.0 t 59.59 38.35 22.23 Favored 'General case' 0 C--O 1.258 1.549 0 N-CA-C 115.771 1.767 . . . . 24.9 115.771 -176.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 12' ' ' LEU . . . . . . . . . . . . . 86.0 mt -109.38 145.26 36.38 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 105.626 -1.99 . . . . 28.25 105.626 175.28 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 13' ' ' GLU . . . . . . . . . . . . 0.364 69.8 mt-10 -106.18 143.44 34.3 Favored 'General case' 0 C--O 1.279 2.621 0 CA-C-O 113.931 -2.938 . . . . 42.62 110.029 176.825 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -74.04 156.79 37.12 Favored 'General case' 0 C--O 1.258 1.55 0 O-C-N 128.289 3.493 . . . . 24.09 105.174 171.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 14' A LYS . . . . . 0.722 ' HG2' ' OE2' ' H' ' 23' ' ' GLU 0.273 0.0 OUTLIER -68.28 -6.53 24.4 Favored 'General case' 0 C--O 1.254 1.325 0 CA-C-O 112.336 -3.697 . . . . 50.0 116.12 -172.333 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' L' L ' 14' B THR . . . . . . . . . . . . . 51.6 p -130.56 4.12 4.63 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-N 124.764 3.438 . . . . 26.63 109.026 175.536 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 14' C GLU . . . . . 0.432 ' O ' ' HB2' ' L' ' 14' F LEU . 12.7 pt-20 -61.27 -31.61 71.42 Favored 'General case' 0 C--O 1.257 1.481 0 O-C-N 126.536 2.397 . . . . 28.98 111.769 -176.74 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' D ARG . . . . . 0.786 ' NH1' ' OE2' ' L' ' 14' H GLU . 0.0 OUTLIER -61.1 -27.4 68.34 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 116.67 -2.012 . . . . 50.0 114.631 177.785 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' L' L ' 14' E GLU . . . . . . . . . . . . . 14.3 tt0 -61.07 -49.89 75.53 Favored 'General case' 0 C--N 1.308 -1.237 0 C-N-CA 127.314 2.245 . . . . 38.4 106.261 -179.216 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 14' F LEU . . . . . 0.432 ' HB2' ' O ' ' L' ' 14' C GLU . 2.7 mp -49.73 -68.02 0.21 Allowed 'General case' 0 C--O 1.242 0.668 0 CA-C-O 116.887 -1.53 . . . . 28.78 112.008 170.508 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' G LEU . . . . . . . . . . . . . 3.7 mm? -56.48 -33.31 65.83 Favored 'General case' 0 C--N 1.306 -1.325 0 CA-C-O 124.367 2.032 . . . . 33.16 113.678 -170.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 14' H GLU . . . . . 0.786 ' OE2' ' NH1' ' L' ' 14' D ARG . 61.8 mt-10 -67.49 -26.14 66.21 Favored 'General case' 0 C--N 1.291 -1.939 0 CA-C-O 113.057 -3.354 . . . . 33.87 110.652 178.981 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' I SER . . . . . . . . . . . . . 53.9 p -84.89 -7.94 58.97 Favored 'General case' 0 N--CA 1.473 0.705 1 O-C-N 129.349 4.156 . . . . 30.39 112.302 -177.78 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' J TYR . . . . . 0.425 ' HE2' ' O ' ' H' ' 202' ' ' LYS . 8.7 m-30 -91.1 56.85 3.28 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 102.904 -2.999 . . . . 37.84 102.904 -178.805 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' K ILE . . . . . . . . . . . . 0.355 0.0 OUTLIER . . . . . 0 C--O 1.28 2.706 0 C-N-CA 129.785 3.234 . . . . 50.0 114.358 -169.934 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 16' ' ' ILE . . . . . 0.516 HD13 ' OD2' ' H' ' 194' ' ' ASP . 36.0 mm . . . . . 0 C--O 1.246 0.906 0 CA-C-O 113.255 -3.259 . . . . 23.91 105.493 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 17' ' ' VAL . . . . . 0.697 ' O ' ' HB2' ' H' ' 18' ' ' GLU . 85.0 t -110.52 128.79 66.57 Favored 'Isoleucine or valine' 0 C--O 1.244 0.799 0 O-C-N 128.695 3.747 . . . . 28.59 110.061 -179.656 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 18' ' ' GLU . . . . . 0.835 ' HG3' ' HB2' ' H' ' 187' ' ' ARG . 30.3 mm-40 67.44 24.52 8.79 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-O 111.96 -3.876 . . . . 48.22 109.314 175.343 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 19' ' ' GLY . . . . . . . . . . . . . . . -94.73 -142.72 12.94 Favored Glycine 0 CA--C 1.54 1.622 0 O-C-N 126.395 2.309 . . . . 31.5 110.33 178.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 20' ' ' SER . . . . . . . . . . . . . 17.4 p -167.45 158.48 11.57 Favored 'General case' 0 C--O 1.248 0.976 0 N-CA-C 106.504 -1.665 . . . . 39.6 106.504 179.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 21' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -57.85 142.22 46.59 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 115.014 -0.994 . . . . 41.57 108.723 -177.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 22' ' ' ALA . . . . . . . . . . . . 0.308 . . -77.49 164.47 25.39 Favored 'General case' 0 C--N 1.295 -1.8 0 N-CA-C 104.16 -2.533 . . . . 29.68 104.16 178.28 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 23' ' ' GLU . . . . . 0.722 ' OE2' ' HG2' ' L' ' 14' A LYS . 47.8 mt-10 -85.73 167.03 15.64 Favored 'General case' 0 C--N 1.306 -1.296 0 C-N-CA 128.274 2.63 . . . . 37.05 104.552 170.702 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 24' ' ' ILE . . . . . . . . . . . . . 2.4 mm -81.49 143.6 11.94 Favored 'Isoleucine or valine' 0 C--O 1.259 1.571 0 N-CA-C 102.492 -3.151 . . . . 26.25 102.492 -174.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.81 17.51 58.19 Favored Glycine 0 C--N 1.286 -2.228 1 CA-C-O 110.655 -5.525 . . . . 22.66 113.306 -174.804 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 26' ' ' MET . . . . . . . . . . . . . 3.7 ttt -70.75 -32.93 70.26 Favored 'General case' 0 C--O 1.277 2.522 1 CA-C-N 124.895 4.347 . . . . 24.51 113.07 175.487 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 27' ' ' SER . . . . . . . . . . . . . 1.3 m -134.2 78.86 57.4 Favored Pre-proline 0 N--CA 1.485 1.296 0 C-N-CA 124.531 1.132 . . . . 27.53 109.168 179.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 28' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -73.01 -7.95 21.46 Favored 'Trans proline' 0 C--N 1.308 -1.559 0 O-C-N 124.614 1.849 . . . . 18.26 113.43 -176.096 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 29' ' ' TRP . . . . . . . . . . . . . 2.7 p90 -98.0 -0.85 43.93 Favored 'General case' 0 C--O 1.273 2.335 0 CA-C-O 116.462 -1.733 . . . . 17.83 111.081 178.383 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 30' ' ' GLN . . . . . . . . . . . . . 64.0 tp60 -72.9 119.0 16.53 Favored 'General case' 0 C--O 1.256 1.435 0 O-C-N 126.678 2.486 . . . . 23.61 113.532 178.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 31' ' ' VAL . . . . . . . . . . . . . 76.2 t -109.85 151.8 12.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 C-N-CA 125.492 1.517 . . . . 22.82 110.652 -174.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 32' ' ' MET . . . . . . . . . . . . . 15.6 ttm -112.66 121.95 46.25 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 105.578 -2.008 . . . . 29.07 105.578 179.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -83.56 122.04 28.04 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 105.237 -2.134 . . . . 34.35 105.237 175.618 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 34' ' ' PHE . . . . . 0.646 ' CZ ' ' HB3' ' H' ' 38' ' ' GLN . 61.4 t80 -122.82 125.78 46.12 Favored 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 117.297 -1.761 . . . . 30.9 111.684 -172.048 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 35' ' ' ARG . . . . . 0.553 ' NH1' ' OE2' ' H' ' 39' ' ' GLU . 48.1 ttt180 -77.92 133.45 38.07 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 117.101 -1.839 . . . . 40.66 109.856 176.976 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 36' ' ' LYS . . . . . 0.409 ' HG2' HD12 ' I' ' 364' ' ' LEU . 14.0 mttt -66.32 -36.08 82.01 Favored 'General case' 0 C--O 1.261 1.689 0 N-CA-C 114.47 1.285 . . . . 45.66 114.47 178.101 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 36' A SER . . . . . . . . . . . . . 0.2 OUTLIER -159.85 105.06 1.43 Allowed Pre-proline 0 N--CA 1.491 1.58 0 CA-C-O 114.942 -2.456 . . . . 50.0 112.615 -171.841 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 37' ' ' PRO . . . . . 0.449 ' O ' ' HG2' ' H' ' 39' ' ' GLU . 5.8 Cg_endo -66.79 157.99 81.53 Favored 'Cis proline' 0 C--N 1.308 -1.579 0 O-C-N 124.995 2.05 . . . . 42.69 111.429 1.374 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 38' ' ' GLN . . . . . 0.646 ' HB3' ' CZ ' ' H' ' 34' ' ' PHE . 87.9 mt-30 -69.25 132.22 46.13 Favored 'General case' 0 C--O 1.258 1.521 0 N-CA-C 103.797 -2.668 . . . . 46.99 103.797 179.794 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 39' ' ' GLU . . . . . 0.553 ' OE2' ' NH1' ' H' ' 35' ' ' ARG . 10.1 pt-20 -178.71 147.23 0.37 Allowed 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 115.322 -2.551 . . . . 44.11 111.948 178.71 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 40' ' ' LEU . . . . . . . . . . . . . 3.1 tp -70.44 109.53 4.83 Favored 'General case' 0 C--O 1.244 0.764 0 O-C-N 127.295 2.872 . . . . 35.91 111.158 -179.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 41' ' ' LEU . . . . . 0.62 ' CD2' ' CD2' ' H' ' 64' ' ' LEU . 0.2 OUTLIER -69.06 -60.22 2.51 Favored 'General case' 0 C--O 1.256 1.443 0 O-C-N 128.627 3.704 . . . . 29.73 110.847 174.767 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 42' ' ' CYS . . . . . 0.569 ' HB3' ' O ' ' H' ' 195' ' ' SER . 91.2 m -159.27 -168.01 2.21 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 105.479 -2.045 . . . . 23.74 105.479 -179.555 -68.342 -177.225 -109.635 103.349 2.019 102.872 -87.366 -76.33 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 43' ' ' GLY . . . . . 0.428 ' O ' ' HB2' ' H' ' 44' ' ' ALA . . . -100.77 176.87 27.64 Favored Glycine 0 C--O 1.269 2.337 0 CA-C-O 126.143 3.079 . . . . 20.94 106.957 170.174 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 44' ' ' ALA . . . . . 0.428 ' HB2' ' O ' ' H' ' 43' ' ' GLY . . . -170.35 -173.39 1.45 Allowed 'General case' 0 N--CA 1.504 2.237 0 C-N-CA 115.289 -2.565 . . . . 18.8 105.312 179.925 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 45' ' ' SER . . . . . . . . . . . . . 36.9 p -146.31 151.87 38.22 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 125.651 1.844 . . . . 21.97 115.48 172.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 46' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -90.84 116.79 28.95 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 127.147 2.179 . . . . 21.58 111.331 179.224 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 47' ' ' ILE . . . . . . . . . . . . 0.26 3.2 pt -110.25 -22.1 5.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-O 115.265 -2.302 . . . . 27.98 110.486 -176.538 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 48' ' ' SER . . . . . . . . . . . . . 60.1 p -154.95 174.67 14.82 Favored 'General case' 0 C--O 1.264 1.841 0 O-C-N 124.975 1.422 . . . . 30.99 107.167 175.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 49' ' ' ASP . . . . . 0.677 ' OD2' ' HB3' ' H' ' 111' ' ' PRO . 18.4 p-10 -76.16 17.13 0.37 Allowed 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 117.078 -1.849 . . . . 40.43 114.266 -177.452 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 50' ' ' ARG . . . . . 0.878 ' HE ' ' HE2' ' H' ' 107' ' ' LYS . 0.5 OUTLIER -148.66 -5.84 0.41 Allowed 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 113.837 -2.982 . . . . 50.0 109.937 -179.55 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 51' ' ' TRP . . . . . 0.99 ' CE3' ' O ' ' H' ' 548' ' ' HOH . 92.9 m95 -125.05 133.11 53.06 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 127.601 3.063 . . . . 31.73 111.38 -176.887 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 52' ' ' VAL . . . . . . . . . . . . . 69.0 t -117.49 135.61 57.34 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 CA-C-N 112.206 -2.27 . . . . 25.65 109.368 178.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 53' ' ' LEU . . . . . . . . . . . . . 16.9 tp -101.39 129.34 47.39 Favored 'General case' 0 C--O 1.248 0.976 0 O-C-N 120.6 -1.312 . . . . 20.93 108.512 177.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 54' ' ' THR . . . . . 0.464 HG23 ' O ' ' H' ' 55' ' ' ALA . 1.3 t -137.22 -172.07 3.11 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-O 117.265 -1.35 . . . . 22.64 109.357 175.509 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 55' ' ' ALA . . . . . 0.464 ' O ' HG23 ' H' ' 54' ' ' THR . . . -93.39 129.12 39.64 Favored 'General case' 0 C--O 1.267 1.976 1 C-N-CA 132.234 4.214 . . . . 20.6 106.625 174.01 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 56' ' ' ALA . . . . . 0.471 ' HB2' ' O ' ' H' ' 103' ' ' ILE . . . -62.17 -33.32 74.3 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-N 120.789 1.631 . . . . 20.11 111.331 -179.561 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 57' ' ' HIS . . . . . 0.439 ' NE2' ' N1X' ' H' ' 372' ' ' 00N . 2.0 p-80 -63.66 -12.8 36.94 Favored 'General case' 0 C--O 1.261 1.702 1 O-C-N 115.123 -4.736 . . . . 20.14 114.598 -178.244 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 58' ' ' CYS . . . . . 0.441 ' O ' ' HE2' ' H' ' 60' F LYS . 51.2 m -73.66 -30.04 62.68 Favored 'General case' 0 C--O 1.253 1.27 0 CA-C-O 115.883 -2.008 . . . . 23.99 109.968 179.343 -76.33 -87.366 -109.635 102.872 2.019 103.349 -177.225 -68.342 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 59' ' ' LEU . . . . . 0.631 HD13 HG21 ' H' ' 88' ' ' ILE . 37.1 mt -99.53 -37.63 9.09 Favored 'General case' 0 C--O 1.218 -0.58 0 O-C-N 126.995 2.684 . . . . 29.64 112.296 176.991 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 60' ' ' LEU . . . . . . . . . . . . . 49.8 tp -132.61 116.46 16.7 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 120.875 1.67 . . . . 27.7 114.505 -178.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' A TYR . . . . . . . . . . . . . 14.1 t80 -155.85 85.52 3.27 Favored Pre-proline 0 N--CA 1.476 0.851 0 CA-C-O 125.101 2.381 . . . . 26.02 108.513 -179.506 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' B PRO . . . . . 0.406 ' N ' ' CD ' ' H' ' 60' C PRO . 8.1 Cg_exo -54.67 -37.16 91.34 Favored 'Trans proline' 0 N--CA 1.482 0.848 0 CA-C-N 111.686 -1.934 . . . . 27.48 116.7 -178.008 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 60' C PRO . . . . . 0.406 ' CD ' ' N ' ' H' ' 60' B PRO . 16.1 Cg_exo -56.5 -31.75 87.21 Favored 'Trans proline' 0 C--N 1.305 -1.717 0 O-C-N 116.603 -2.367 . . . . 31.82 114.022 177.919 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 60' D TRP . . . . . . . . . . . . . 43.9 m0 -102.3 4.86 39.57 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 115.228 -2.32 . . . . 31.15 107.667 -179.066 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' E ASP . . . . . 0.447 ' OD2' ' O ' ' H' ' 425' ' ' HOH . 35.7 m-20 62.69 39.27 11.33 Favored 'General case' 0 C--O 1.25 1.089 0 O-C-N 128.781 3.801 . . . . 49.7 111.103 -178.624 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 60' F LYS . . . . . 0.441 ' HE2' ' O ' ' H' ' 58' ' ' CYS . 12.0 tttt -106.31 117.2 33.41 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 107.21 -1.404 . . . . 44.29 107.21 176.912 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 60' G ASN . . . . . 0.437 ' ND2' ' O ' ' H' ' 441' ' ' HOH . 49.0 t-20 -145.63 74.25 1.38 Allowed 'General case' 0 C--O 1.253 1.281 0 C-N-CA 125.659 1.583 . . . . 37.47 112.784 176.955 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 60' H PHE . . . . . . . . . . . . . 58.6 m-85 -78.47 150.47 32.97 Favored 'General case' 0 C--O 1.244 0.777 0 CA-C-N 120.511 1.505 . . . . 34.81 113.204 -178.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' I THR . . . . . 0.632 ' O ' ' HB2' ' H' ' 63' ' ' ASP . 0.4 OUTLIER -117.54 162.86 17.3 Favored 'General case' 0 C--O 1.243 0.739 1 CA-C-N 108.171 -4.104 . . . . 43.03 110.666 179.23 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' H' H ' 61' ' ' GLU . . . . . . . . . . . . . 59.3 mp0 -52.25 -47.74 65.61 Favored 'General case' 0 C--O 1.259 1.604 0 CA-C-O 123.482 1.611 . . . . 47.46 112.693 -177.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 62' ' ' ASN . . . . . . . . . . . . 0.266 41.9 m-20 -52.94 -35.64 58.82 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-O 124.351 2.024 . . . . 50.0 112.525 178.428 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 63' ' ' ASP . . . . . 0.632 ' HB2' ' O ' ' H' ' 60' I THR . 91.5 m-20 -67.83 -19.73 65.09 Favored 'General case' 0 C--O 1.244 0.795 0 CA-C-N 111.756 -2.475 . . . . 50.0 114.552 -170.578 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 64' ' ' LEU . . . . . 0.62 ' CD2' ' CD2' ' H' ' 41' ' ' LEU . 24.3 mt -125.64 161.03 28.17 Favored 'General case' 0 CA--C 1.518 -0.253 1 O-C-N 129.9 4.5 . . . . 46.08 118.972 -172.442 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 65' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -135.67 132.85 37.5 Favored 'General case' 0 C--N 1.308 -1.202 1 C-N-CA 132.272 4.229 . . . . 33.89 111.959 174.731 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 66' ' ' VAL . . . . . . . . . . . . 0.264 1.4 t -106.67 128.58 61.23 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.084 0 CA-C-N 110.603 -2.999 . . . . 33.36 108.627 -179.682 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 67' ' ' ARG . . . . . 0.44 ' HG2' HG12 ' H' ' 82' ' ' ILE . 67.3 mtp180 -127.96 115.0 17.86 Favored 'General case' 0 C--O 1.271 2.189 1 O-C-N 115.949 -4.219 . . . . 27.22 111.763 -177.263 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 68' ' ' ILE . . . . . . . . . . . . . 1.9 mt -106.07 144.86 14.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 111.362 -2.653 . . . . 24.67 113.063 -176.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 69' ' ' GLY . . . . . . . . . . . . . . . 87.22 13.33 66.18 Favored Glycine 0 CA--C 1.522 0.488 0 C-N-CA 127.972 2.701 . . . . 25.18 113.242 173.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 70' ' ' LYS . . . . . . . . . . . . . 5.7 mtpp -80.82 154.4 27.15 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 115.073 1.509 . . . . 28.59 115.073 -175.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 71' ' ' HIS . . . . . 0.501 ' CD2' HG22 ' H' ' 154' ' ' VAL . 84.5 t60 -126.23 -49.76 1.56 Allowed 'General case' 0 C--O 1.242 0.678 0 CA-C-N 110.05 -3.25 . . . . 28.12 107.317 175.48 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 72' ' ' SER . . . . . . . . . . . . . 22.8 t -81.33 129.35 34.58 Favored 'General case' 0 C--O 1.254 1.307 0 O-C-N 118.609 -2.557 . . . . 30.44 108.156 -176.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 73' ' ' ARG . . . . . 0.575 ' NH2' ' O ' ' H' ' 443' ' ' HOH . 55.2 ttp85 -63.02 -45.87 90.27 Favored 'General case' 0 N--CA 1.485 1.32 1 O-C-N 129.934 4.521 . . . . 37.48 115.004 175.911 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 74' ' ' THR . . . . . 0.675 ' O ' ' O ' ' H' ' 482' ' ' HOH . 25.9 p -112.26 -20.17 11.96 Favored 'General case' 0 N--CA 1.486 1.374 0 N-CA-C 120.494 3.516 . . . . 34.34 120.494 -177.334 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 75' ' ' ARG . . . . . 1.152 ' NH1' ' HG3' ' H' ' 75' ' ' ARG . 0.0 OUTLIER -70.42 151.2 45.44 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 115.313 -2.28 . . . . 45.1 109.968 175.168 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 76' ' ' TYR . . . . . . . . . . . . . 33.8 t80 -87.25 101.06 13.17 Favored 'General case' 0 C--N 1.312 -1.047 0 O-C-N 128.085 3.365 . . . . 40.84 105.262 171.124 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 77' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -73.68 85.1 1.62 Allowed 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 129.103 2.961 . . . . 34.59 115.13 -177.973 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 77' A ARG . . . . . 0.603 ' O ' ' HB2' ' H' ' 78' ' ' ASN . 3.9 ttp85 -62.93 122.28 15.62 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 131.418 3.887 . . . . 33.33 108.743 -175.95 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 78' ' ' ASN . . . . . 0.603 ' HB2' ' O ' ' H' ' 77' A ARG . 2.1 m120 83.57 -7.66 1.11 Allowed 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 112.909 -1.95 . . . . 36.13 113.337 -178.596 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 79' ' ' ILE . . . . . . . . . . . . . 51.2 mt -109.66 -51.39 6.61 Favored 'Isoleucine or valine' 0 C--O 1.252 1.237 0 O-C-N 119.077 -2.264 . . . . 32.69 115.594 178.088 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 80' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -92.87 135.71 33.89 Favored 'General case' 0 CA--C 1.485 -1.534 0 CA-C-O 115.711 -2.09 . . . . 29.69 114.821 -171.836 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.85 133.8 46.04 Favored 'General case' 0 C--O 1.253 1.282 0 CA-C-N 120.691 1.587 . . . . 38.2 106.863 176.432 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 82' ' ' ILE . . . . . 0.44 HG12 ' HG2' ' H' ' 67' ' ' ARG . 53.3 mt -108.46 124.68 65.05 Favored 'Isoleucine or valine' 0 C--O 1.246 0.912 0 CA-C-O 113.793 -3.003 . . . . 33.0 106.961 179.17 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 83' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -125.24 176.49 6.71 Favored 'General case' 0 C--N 1.318 -0.767 0 O-C-N 126.387 2.304 . . . . 34.98 110.113 176.598 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 84' ' ' MET . . . . . . . . . . . . . 21.4 mtt -114.96 150.54 35.6 Favored 'General case' 0 C--N 1.307 -1.272 1 CA-C-N 108.1 -4.136 . . . . 50.0 109.837 -178.1 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 85' ' ' LEU . . . . . 0.779 HD11 ' HE1' ' H' ' 106' ' ' MET . 0.6 OUTLIER -92.63 139.33 30.68 Favored 'General case' 0 C--O 1.245 0.847 0 N-CA-C 106.465 -1.68 . . . . 38.44 106.465 -179.133 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 86' ' ' GLU . . . . . 0.678 ' OE2' ' HD3' ' H' ' 107' ' ' LYS . 7.0 tt0 -95.64 -19.74 19.49 Favored 'General case' 0 C--O 1.258 1.509 1 O-C-N 130.408 4.818 . . . . 50.0 105.866 174.59 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 87' ' ' LYS . . . . . . . . . . . . 0.354 0.3 OUTLIER -178.64 153.5 0.69 Allowed 'General case' 0 N--CA 1.483 1.213 0 O-C-N 119.803 -1.81 . . . . 46.72 113.708 -177.954 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 88' ' ' ILE . . . . . 0.631 HG21 HD13 ' H' ' 59' ' ' LEU . 96.3 mt -121.14 132.54 70.3 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 C-N-CA 124.916 1.286 . . . . 36.55 112.241 176.255 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 89' ' ' TYR . . . . . 0.505 ' OH ' ' HB3' ' H' ' 245' ' ' PHE . 24.8 m-85 -122.0 112.39 18.22 Favored 'General case' 0 C--N 1.287 -2.137 0 C-N-CA 129.135 2.974 . . . . 38.81 110.706 177.243 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 90' ' ' ILE . . . . . 0.46 HG23 ' HB1' ' H' ' 56' ' ' ALA . 32.3 mm -93.58 144.81 8.75 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.797 0 C-N-CA 127.94 2.496 . . . . 26.35 107.543 177.357 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 91' ' ' HIS . . . . . 0.613 ' CG ' ' HD2' ' H' ' 92' ' ' PRO . 14.8 t-80 -66.53 123.57 86.03 Favored Pre-proline 0 N--CA 1.501 2.08 0 CA-C-O 126.706 3.146 . . . . 28.21 107.673 175.068 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 92' ' ' PRO . . . . . 0.613 ' HD2' ' CG ' ' H' ' 91' ' ' HIS . 16.4 Cg_endo -46.89 -38.0 22.65 Favored 'Trans proline' 0 CA--C 1.544 1.015 0 O-C-N 117.715 -1.781 . . . . 31.16 111.611 -178.982 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 93' ' ' ARG . . . . . . . . . . . . . 14.9 mtp180 -103.65 34.4 2.99 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 116.658 2.095 . . . . 39.44 116.658 179.08 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 94' ' ' TYR . . . . . 0.436 ' HA ' ' HB2' ' H' ' 101' ' ' ARG . 0.3 OUTLIER -73.28 135.69 44.47 Favored 'General case' 0 N--CA 1.494 1.748 0 N-CA-C 103.067 -2.938 . . . . 24.03 103.067 -179.325 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 95' ' ' ASN . . . . . . . . . . . . . 53.7 t-20 -106.24 85.62 2.22 Favored 'General case' 0 C--N 1.288 -2.075 0 C-N-CA 126.284 1.834 . . . . 25.51 109.456 -176.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 96' ' ' TRP . . . . . 0.423 ' HB3' ' CZ ' ' H' ' 94' ' ' TYR . 54.5 p-90 -79.07 -22.03 45.92 Favored 'General case' 0 C--O 1.26 1.609 0 CA-C-O 114.436 -2.697 . . . . 27.96 108.573 178.278 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 97' ' ' ARG . . . . . . . . . . . . . 92.8 mtt-85 -70.94 -37.08 72.84 Favored 'General case' 0 C--O 1.254 1.34 1 O-C-N 130.554 4.909 . . . . 40.71 117.626 -179.839 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 97' A GLU . . . . . . . . . . . . . 41.3 tt0 -118.4 -62.43 1.54 Allowed 'General case' 0 C--O 1.264 1.832 0 CA-C-N 123.869 3.031 . . . . 35.7 111.057 -179.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 98' ' ' ASN . . . . . . . . . . . . . 38.2 p30 -129.71 6.49 5.15 Favored 'General case' 0 C--O 1.254 1.33 0 CA-C-O 113.229 -3.272 . . . . 25.88 118.806 -173.016 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 99' ' ' LEU . . . . . . . . . . . . . 6.0 mt 80.02 35.62 0.14 Allowed 'General case' 0 C--N 1.293 -1.87 0 CA-C-N 123.893 3.042 . . . . 25.08 107.495 179.815 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 100' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -76.82 132.85 39.42 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 128.027 3.329 . . . . 24.0 105.458 -176.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 101' ' ' ARG . . . . . 0.436 ' HB2' ' HA ' ' H' ' 94' ' ' TYR . 56.5 mtt85 69.63 38.58 1.69 Allowed 'General case' 0 N--CA 1.476 0.865 0 O-C-N 127.465 2.978 . . . . 38.08 112.77 -178.154 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 102' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -74.89 76.83 2.15 Favored 'General case' 0 N--CA 1.482 1.163 0 CA-C-N 114.549 -1.205 . . . . 19.27 112.116 -178.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 103' ' ' ILE . . . . . 0.471 ' O ' ' HB2' ' H' ' 56' ' ' ALA . 8.6 tt -151.76 145.43 16.02 Favored 'Isoleucine or valine' 0 C--O 1.261 1.677 0 C-N-CA 128.794 2.838 . . . . 21.35 109.193 -174.528 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 104' ' ' ALA . . . . . . . . . . . . . . . -152.5 159.39 43.32 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 126.149 2.156 . . . . 24.06 106.961 179.718 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 105' ' ' LEU . . . . . . . . . . . . . 17.0 mt -128.06 151.33 49.3 Favored 'General case' 0 C--O 1.258 1.508 0 N-CA-C 106.976 -1.49 . . . . 29.15 106.976 176.063 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 106' ' ' MET . . . . . 0.894 ' C ' ' O ' ' H' ' 548' ' ' HOH . 26.1 mtp -138.16 111.25 7.84 Favored 'General case' 0 C--O 1.258 1.545 0 O-C-N 127.208 2.818 . . . . 35.49 107.868 -178.991 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 107' ' ' LYS . . . . . 0.982 ' NZ ' ' HA3' ' H' ' 246' ' ' GLY . 1.8 ttmt -79.7 126.32 30.78 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 127.511 3.007 . . . . 46.44 108.244 178.226 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 108' ' ' LEU . . . . . . . . . . . . . 10.7 mt -67.82 151.25 47.48 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-O 114.201 -2.809 . . . . 31.1 110.79 179.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.92 -36.5 82.39 Favored 'General case' 0 C--O 1.257 1.461 0 O-C-N 125.396 1.685 . . . . 47.42 107.183 174.241 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 110' ' ' LYS . . . . . . . . . . . . . 6.0 ptpt -143.69 152.93 57.35 Favored Pre-proline 0 N--CA 1.501 2.113 0 C-N-CA 114.663 -2.815 . . . . 46.05 107.58 -179.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 111' ' ' PRO . . . . . 0.677 ' HB3' ' OD2' ' H' ' 49' ' ' ASP . 1.5 Cg_endo -64.37 146.83 90.44 Favored 'Trans proline' 0 C--N 1.308 -1.56 0 O-C-N 125.848 2.499 . . . . 35.61 110.9 -174.896 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 112' ' ' VAL . . . . . 0.425 ' O ' ' HB2' ' H' ' 49' ' ' ASP . 12.5 p -99.94 140.72 18.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 N-CA-C 103.219 -2.882 . . . . 34.2 103.219 -178.796 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 113' ' ' ALA . . . . . . . . . . . . . . . -87.59 138.64 31.29 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 100.695 -3.817 . . . . 31.78 100.695 178.344 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 114' ' ' PHE . . . . . 0.609 ' CZ ' ' HB3' ' H' ' 49' ' ' ASP . 16.5 m-30 -78.08 166.83 22.32 Favored 'General case' 0 C--N 1.288 -2.078 1 O-C-N 129.839 4.462 . . . . 28.9 105.756 -177.294 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 115' ' ' SER . . . . . . . . . . . . . 1.1 p -170.86 -173.59 1.37 Allowed 'General case' 0 N--CA 1.487 1.416 0 O-C-N 126.504 2.378 . . . . 27.42 104.638 -174.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 116' ' ' ASP . . . . . 0.694 ' OD1' ' O ' ' H' ' 421' ' ' HOH . 51.7 m-20 -65.56 -24.95 67.21 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-N 123.469 2.849 . . . . 32.95 112.219 177.618 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 117' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -102.67 -12.69 17.5 Favored 'General case' 0 C--N 1.312 -1.059 0 N-CA-C 115.843 1.794 . . . . 37.15 115.843 -174.333 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 118' ' ' ILE . . . . . . . . . . . . . 6.6 mt -129.18 115.37 35.63 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.71 1 C-N-CA 131.792 4.037 . . . . 27.94 110.689 -175.264 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 119' ' ' HIS . . . . . . . . . . . . . 18.2 t60 -158.54 148.3 15.15 Favored Pre-proline 0 N--CA 1.483 1.204 0 O-C-N 128.946 3.904 . . . . 28.32 108.335 179.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 120' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -82.14 152.47 16.28 Favored 'Trans proline' 0 C--N 1.323 -0.804 0 C-N-CA 123.778 2.985 . . . . 24.99 114.741 177.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 121' ' ' VAL . . . . . . . . . . . . . 7.2 p -96.06 160.22 2.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 CA-C-N 112.181 -2.281 . . . . 17.71 107.257 177.255 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 122' ' ' CYS . . . . . . . . . . . . . 79.5 m -93.14 147.12 23.14 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 123.244 1.497 . . . . 20.66 112.196 177.308 -60.52 -57.875 101.901 103.964 2.012 103.597 72.874 75.452 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 123' ' ' LEU . . . . . . . . . . . . . 52.7 mt -96.67 141.61 23.34 Favored Pre-proline 0 N--CA 1.488 1.456 0 N-CA-C 102.839 -3.023 . . . . 22.5 102.839 176.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 124' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -78.18 154.8 29.02 Favored 'Trans proline' 0 N--CA 1.444 -1.405 0 CA-C-O 126.242 2.518 . . . . 25.89 110.692 -174.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 125' ' ' ASP . . . . . 0.49 ' OD1' ' CB ' ' H' ' 128' ' ' THR . 17.4 p-10 -96.65 154.53 17.23 Favored 'General case' 0 C--N 1.299 -1.622 1 CA-C-O 128.908 4.194 . . . . 38.06 101.431 170.88 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 126' ' ' ARG . . . . . 0.899 ' HB3' ' OE1' ' H' ' 127' ' ' GLU . 57.9 ttt85 -45.65 -41.23 10.06 Favored 'General case' 0 CA--C 1.509 -0.628 1 CA-C-N 106.473 -4.876 . . . . 50.0 113.637 -179.912 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 127' ' ' GLU . . . . . 0.899 ' OE1' ' HB3' ' H' ' 126' ' ' ARG . 0.0 OUTLIER -83.17 -36.58 24.6 Favored 'General case' 0 C--O 1.275 2.416 0 CA-C-O 125.591 2.615 . . . . 50.0 114.379 -178.164 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 128' ' ' THR . . . . . 0.49 ' CB ' ' OD1' ' H' ' 125' ' ' ASP . 48.1 m -62.26 -40.69 97.05 Favored 'General case' 0 N--CA 1.484 1.25 1 O-C-N 115.972 -4.205 . . . . 32.03 103.435 176.431 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 129' ' ' ALA . . . . . . . . . . . . . . . -63.36 -38.38 90.94 Favored 'General case' 0 CA--C 1.5 -0.955 0 CA-C-O 126.028 2.823 . . . . 29.42 109.582 -176.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 129' A ALA . . . . . . . . . . . . . . . -68.21 -44.04 76.68 Favored 'General case' 0 CA--C 1.493 -1.216 0 CA-C-N 111.268 -2.696 . . . . 30.08 108.991 -176.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 129' B SER . . . . . . . . . . . . . 0.3 OUTLIER -76.14 -21.55 56.47 Favored 'General case' 0 C--O 1.256 1.401 0 CA-C-O 111.859 -3.924 . . . . 28.42 117.238 -178.286 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 129' C LEU . . . . . . . . . . . . . 47.4 mt -107.72 -29.44 9.12 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 126.98 2.675 . . . . 38.94 113.459 -171.781 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 130' ' ' LEU . . . . . 0.555 HD22 HD13 ' H' ' 162' ' ' ILE . 0.1 OUTLIER -73.06 77.22 1.22 Allowed 'General case' 0 N--CA 1.489 1.481 0 O-C-N 128.753 3.783 . . . . 32.45 110.5 179.374 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 131' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -135.47 139.87 44.39 Favored 'General case' 0 C--N 1.306 -1.321 0 C-N-CA 130.495 3.518 . . . . 50.0 116.815 -177.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 132' ' ' ALA . . . . . 0.45 ' HB1' ' HG3' ' H' ' 164' ' ' GLU . . . -58.99 126.31 27.19 Favored 'General case' 0 C--O 1.257 1.477 0 CA-C-O 114.177 -2.821 . . . . 30.14 108.196 -175.697 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 133' ' ' GLY . . . . . . . . . . . . . . . 104.48 -35.71 4.87 Favored Glycine 0 C--O 1.26 1.733 0 C-N-CA 115.372 -3.299 . . . . 24.49 115.06 -173.582 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 134' ' ' TYR . . . . . 0.537 ' HD1' ' N ' ' H' ' 134' ' ' TYR . 3.5 m-30 -68.93 141.33 55.02 Favored 'General case' 0 C--N 1.309 -1.158 0 O-C-N 118.848 -2.56 . . . . 33.43 108.769 175.019 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 135' ' ' LYS . . . . . . . . . . . . . 10.7 mttt -89.11 146.48 24.78 Favored 'General case' 0 CA--C 1.506 -0.748 0 CA-C-N 112.354 -2.203 . . . . 20.87 115.271 174.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 136' ' ' GLY . . . . . . . . . . . . . . . -131.17 -171.82 12.97 Favored Glycine 0 N--CA 1.507 3.373 0 N-CA-C 106.532 -2.627 . . . . 18.86 106.532 169.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 137' ' ' ARG . . . . . . . . . . . . . 37.2 ttm180 -136.32 139.5 42.65 Favored 'General case' 0 C--N 1.288 -2.087 0 O-C-N 116.425 -3.985 . . . . 20.76 107.109 -176.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 138' ' ' VAL . . . . . . . . . . . . . 2.5 t -115.43 144.49 22.9 Favored 'Isoleucine or valine' 0 C--O 1.248 0.993 1 O-C-N 130.809 5.068 . . . . 25.64 109.125 176.205 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 139' ' ' THR . . . . . 1.083 HG22 HG22 ' H' ' 157' ' ' VAL . 38.2 p -140.39 153.76 46.47 Favored 'General case' 0 N--CA 1.503 2.182 0 N-CA-C 107.002 -1.481 . . . . 20.25 107.002 177.576 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 140' ' ' GLY . . . . . . . . . . . . . . . 172.51 168.73 34.28 Favored Glycine 0 C--O 1.19 -2.627 0 N-CA-C 107.938 -2.065 . . . . 21.08 107.938 178.534 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 141' ' ' TRP . . . . . . . . . . . . . 3.9 m-90 -97.75 19.66 13.29 Favored 'General case' 0 N--CA 1.443 -0.819 0 C-N-CA 129.189 2.996 . . . . 24.28 114.187 174.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 142' ' ' GLY . . . . . . . . . . . . . . . -76.64 169.92 54.96 Favored Glycine 0 N--CA 1.438 -1.179 0 C-N-CA 128.146 2.784 . . . . 28.65 113.165 -174.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 143' ' ' ASN . . . . . 0.614 ' ND2' ' O ' ' H' ' 520' ' ' HOH . 76.5 m-20 -50.42 152.85 1.73 Allowed 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 124.948 2.308 . . . . 39.43 108.07 -179.786 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 144' ' ' LEU . . . . . . . . . . . . . 72.9 mt -102.51 -13.45 17.21 Favored 'General case' 0 CA--C 1.511 -0.537 1 CA-C-N 106.81 -4.723 . . . . 35.32 110.88 -175.179 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 145' ' ' LYS . . . . . . . . . . . . 0.285 1.4 ttpp -150.27 139.44 21.19 Favored 'General case' 0 N--CA 1.486 1.372 1 O-C-N 129.44 4.212 . . . . 50.0 105.402 -169.877 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' H' H ' 146' ' ' GLU . . . . . 0.469 ' OE1' ' NE ' ' H' ' 221' A ARG . 36.7 tt0 . . . . . 0 C--O 1.252 1.231 0 O-C-N 126.801 2.563 . . . . 47.61 108.89 -178.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 150' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.931 0 N-CA-C 106.782 -2.527 . . . . 45.3 106.782 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 151' ' ' GLN . . . . . 0.428 ' HA ' ' HD3' ' H' ' 152' ' ' PRO . 1.2 mt-30 -109.54 151.18 42.06 Favored Pre-proline 0 C--O 1.275 2.417 0 N-CA-C 106.309 -1.738 . . . . 50.0 106.309 174.788 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 152' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' H' ' 151' ' ' GLN . 10.6 Cg_endo -82.51 173.08 10.87 Favored 'Trans proline' 0 C--O 1.256 1.389 0 O-C-N 126.037 2.599 . . . . 35.98 108.619 -179.974 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 153' ' ' SER . . . . . 0.785 ' HB3' ' O ' ' H' ' 442' ' ' HOH . 78.1 p -93.99 -23.68 17.94 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 105.674 -1.973 . . . . 41.14 105.674 173.843 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 154' ' ' VAL . . . . . 0.501 HG22 ' CD2' ' H' ' 71' ' ' HIS 0.374 0.4 OUTLIER -131.69 167.87 25.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 CA-C-O 115.768 -2.063 . . . . 29.85 111.659 -176.108 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' H' H ' 155' ' ' LEU . . . . . . . . . . . . . 17.5 tp -60.44 128.56 37.27 Favored 'General case' 0 C--O 1.251 1.169 0 C-N-CA 126.428 1.891 . . . . 24.27 109.514 177.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 156' ' ' GLN . . . . . 0.502 ' C ' HG23 ' H' ' 157' ' ' VAL . 3.8 mm100 -98.45 161.66 13.57 Favored 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 126.26 1.824 . . . . 22.47 110.952 179.679 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 157' ' ' VAL . . . . . 1.083 HG22 HG22 ' H' ' 139' ' ' THR . 46.3 t -144.92 151.41 15.39 Favored 'Isoleucine or valine' 0 C--O 1.248 1.002 0 O-C-N 119.68 -1.888 . . . . 25.99 106.54 -177.788 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 158' ' ' VAL . . . . . . . . . . . . . 10.5 p -153.58 138.41 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 CA-C-O 113.879 -2.963 . . . . 19.01 104.671 174.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 159' ' ' ASN . . . . . . . . . . . . . 75.0 m-20 -96.42 127.05 42.05 Favored 'General case' 0 C--O 1.252 1.236 0 C-N-CA 127.553 2.341 . . . . 22.42 108.119 172.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 160' ' ' LEU . . . . . . . . . . . . . 16.9 mt -134.43 151.82 76.86 Favored Pre-proline 0 C--O 1.275 2.445 0 O-C-N 116.863 -3.648 . . . . 26.83 106.701 -176.606 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 161' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -87.4 142.35 6.08 Favored 'Trans proline' 0 C--O 1.268 2.025 0 O-C-N 126.337 2.756 . . . . 22.23 113.214 -179.417 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 162' ' ' ILE . . . . . 0.555 HD13 HD22 ' H' ' 130' ' ' LEU . 33.5 mt -65.63 141.02 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.833 0 O-C-N 118.16 -2.837 . . . . 20.18 108.218 171.9 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 163' ' ' VAL . . . . . . . . . . . . . 61.3 t -115.77 138.88 44.78 Favored 'Isoleucine or valine' 0 C--O 1.269 2.097 0 C-N-CA 127.828 2.451 . . . . 23.25 109.518 -177.542 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 164' ' ' GLU . . . . . 0.887 ' OE1' HG21 ' H' ' 167' ' ' VAL . 1.9 mp0 -53.06 138.56 30.59 Favored 'General case' 0 C--O 1.266 1.934 0 CA-C-O 125.314 2.483 . . . . 50.0 112.849 -179.88 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 165' ' ' ARG . . . . . 0.654 ' NH1' ' O ' ' H' ' 180' ' ' MET . 2.4 mtp180 -48.41 -39.33 28.79 Favored Pre-proline 0 C--N 1.296 -1.75 1 O-C-N 116.075 -4.141 . . . . 50.0 116.775 -176.068 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 166' ' ' PRO . . . . . 0.458 ' CD ' ' N ' ' H' ' 165' ' ' ARG . 1.4 Cg_endo -68.99 -43.49 3.27 Favored 'Trans proline' 0 C--O 1.255 1.349 0 C-N-CA 122.805 2.337 . . . . 26.08 110.006 -174.108 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 167' ' ' VAL . . . . . 0.887 HG21 ' OE1' ' H' ' 164' ' ' GLU . 59.0 t -60.67 -43.72 95.53 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.918 1 CA-C-N 107.914 -4.221 . . . . 24.45 106.508 178.339 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 168' ' ' CYS . . . . . . . . . . . . . 92.6 m -58.56 -62.76 1.61 Allowed 'General case' 0 C--O 1.246 0.904 0 O-C-N 120.27 -1.519 . . . . 24.12 107.067 178.794 -70.063 -62.894 -88.101 106.536 2.009 105.13 -76.683 83.506 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 169' ' ' LYS . . . . . 0.779 ' NZ ' ' HB3' ' H' ' 169' ' ' LYS . 0.0 OUTLIER -48.14 -40.99 25.5 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 115.559 1.689 . . . . 45.22 115.559 178.965 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 170' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -79.72 9.05 5.54 Favored 'General case' 0 C--O 1.279 2.622 0 CA-C-N 123.613 2.915 . . . . 29.21 117.824 -176.825 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 171' ' ' SER . . . . . . . . . . . . . 53.4 p -103.06 -6.26 22.49 Favored 'General case' 0 C--O 1.251 1.176 0 O-C-N 128.202 3.439 . . . . 21.65 109.895 -175.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 172' ' ' THR . . . . . . . . . . . . 0.337 3.2 t -151.35 171.86 16.82 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 118.028 -2.92 . . . . 22.89 109.687 -177.581 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 173' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' H' ' 173' ' ' ARG . 6.2 mtp180 -98.16 -11.23 23.01 Favored 'General case' 0 C--N 1.309 -1.158 0 C-N-CA 126.945 2.098 . . . . 45.24 110.018 175.218 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 174' ' ' ILE . . . . . . . . . . . . . 10.5 mm -72.83 139.26 19.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 O-C-N 125.989 2.056 . . . . 25.8 106.188 -179.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 175' ' ' ARG . . . . . 0.704 ' HD2' ' O ' ' H' ' 453' ' ' HOH . 57.1 ttp85 -72.12 116.04 12.06 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-N 113.189 -1.823 . . . . 28.94 111.924 174.064 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 176' ' ' ILE . . . . . 0.513 HD12 ' CE2' ' H' ' 227' ' ' PHE 0.256 23.5 mm -80.5 145.14 9.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 118.014 -2.929 . . . . 30.03 109.879 172.01 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 177' ' ' THR . . . . . . . . . . . . . 6.6 p -126.3 173.36 9.37 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 127.974 2.509 . . . . 26.89 107.656 179.04 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 178' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -72.33 -9.24 58.24 Favored 'General case' 0 C--N 1.281 -2.388 0 C-N-CA 128.553 2.741 . . . . 34.44 112.372 177.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 179' ' ' ASN . . . . . . . . . . . . . 68.7 m-20 -91.21 17.86 7.7 Favored 'General case' 0 C--N 1.301 -1.543 1 CA-C-O 110.66 -4.495 . . . . 24.67 109.103 175.282 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 180' ' ' MET . . . . . 0.654 ' O ' ' NH1' ' H' ' 165' ' ' ARG . 26.3 mtt -143.74 151.68 40.32 Favored 'General case' 0 C--N 1.301 -1.522 1 CA-C-O 110.91 -4.376 . . . . 22.04 104.86 -178.353 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 181' ' ' PHE . . . . . . . . . . . . . 22.4 p90 -139.13 147.72 42.3 Favored 'General case' 0 C--N 1.308 -1.204 1 O-C-N 129.761 4.413 . . . . 19.59 103.754 176.707 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 182' ' ' CYS . . . . . . . . . . . . . 2.8 p -110.3 160.53 16.46 Favored 'General case' 0 N--CA 1.5 2.027 0 CA-C-N 122.877 2.58 . . . . 22.54 109.132 174.112 83.506 -76.683 -88.101 105.13 2.009 106.536 -62.894 -70.063 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 183' ' ' ALA . . . . . . . . . . . . . . . -148.43 143.76 26.99 Favored 'General case' 0 C--N 1.306 -1.294 0 O-C-N 119.302 -2.124 . . . . 23.97 109.596 -177.119 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 184' ' ' GLY . . . . . . . . . . . . . . . 152.15 163.27 11.43 Favored Glycine 0 N--CA 1.478 1.489 0 O-C-N 116.716 -3.74 . . . . 24.24 106.529 -178.607 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 184' A TYR . . . . . . . . . . . . 0.295 47.2 m-85 -82.35 158.76 23.25 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 123.929 0.892 . . . . 31.75 111.179 176.699 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 185' ' ' LYS . . . . . 0.497 ' HD3' ' OH ' ' H' ' 225' ' ' TYR . 3.9 mmtp -87.6 147.76 42.4 Favored Pre-proline 0 C--O 1.252 1.198 0 N-CA-C 107.731 -1.211 . . . . 39.2 107.731 172.57 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 186' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -48.74 -37.84 36.1 Favored 'Trans proline' 0 C--O 1.235 0.349 0 O-C-N 126.945 3.076 . . . . 42.24 107.571 -176.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 186' A ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.77 -50.43 72.39 Favored 'General case' 0 C--N 1.309 -1.188 1 O-C-N 129.144 4.028 . . . . 50.0 111.471 179.176 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 186' B GLU . . . . . . . . . . . . . 30.7 mt-10 -59.98 -20.32 57.05 Favored 'General case' 0 C--O 1.257 1.457 0 O-C-N 124.47 1.106 . . . . 45.17 108.104 -173.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 186' C GLY . . . . . . . . . . . . . . . 31.02 88.3 0.01 OUTLIER Glycine 0 N--CA 1.482 1.72 1 O-C-N 129.334 4.146 . . . . 44.06 111.238 -179.809 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 186' D LYS . . . . . . . . . . . . . 8.1 ttmm -170.53 135.02 1.15 Allowed 'General case' 0 C--O 1.25 1.112 2 C-N-CA 135.343 5.457 . . . . 44.25 98.527 178.351 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 187' ' ' ARG . . . . . 0.835 ' HB2' ' HG3' ' H' ' 18' ' ' GLU . 38.7 mtp85 -120.69 176.14 5.67 Favored 'General case' 0 C--N 1.295 -1.8 0 CA-C-N 124.826 3.467 . . . . 42.97 119.404 -173.957 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 188' ' ' GLY . . . . . 0.497 ' HA2' ' O ' ' H' ' 17' ' ' VAL . . . 138.33 152.04 5.93 Favored Glycine 0 C--O 1.249 1.088 0 CA-C-O 116.017 -2.546 . . . . 28.37 108.321 175.415 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 189' ' ' ASP . . . . . 0.684 ' OD2' ' NH2' ' H' ' 372' ' ' 00N . 48.6 t0 -168.38 165.95 12.57 Favored 'General case' 0 C--O 1.262 1.711 0 O-C-N 128.266 2.98 . . . . 26.15 103.205 -178.798 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 190' ' ' ALA . . . . . . . . . . . . . . . -79.78 177.07 9.16 Favored 'General case' 0 C--O 1.254 1.296 0 N-CA-C 102.152 -3.277 . . . . 20.76 102.152 169.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 191' ' ' CYS . . . . . . . . . . . . . 14.4 t -153.58 -171.7 3.99 Favored 'General case' 0 N--CA 1.507 2.399 0 N-CA-C 101.218 -3.623 . . . . 28.84 101.218 176.643 -166.566 47.613 92.248 108.196 2.021 106.168 -170.847 -56.304 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 192' ' ' GLU . . . . . . . . . . . . . 25.8 mp0 -61.32 141.44 57.58 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-O 117.905 -1.045 . . . . 37.37 108.767 178.082 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 193' ' ' GLY . . . . . . . . . . . . . . . 89.35 -12.94 65.05 Favored Glycine 0 C--N 1.307 -1.081 1 CA-C-O 109.6 -6.111 . . . . 22.57 109.182 -178.774 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 194' ' ' ASP . . . . . 0.516 ' OD2' HD13 ' H' ' 16' ' ' ILE . 76.4 m-20 -75.58 -21.67 57.64 Favored 'General case' 0 C--O 1.267 1.981 1 CA-C-N 124.323 4.062 . . . . 23.36 116.313 169.079 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 195' ' ' SER . . . . . 1.29 ' OG ' ' C ' ' H' ' 372' ' ' 00N . 4.1 m -34.07 142.22 0.04 OUTLIER 'General case' 0 N--CA 1.433 -1.298 0 CA-C-O 113.587 -3.101 . . . . 19.91 111.235 -179.983 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 196' ' ' GLY . . . . . . . . . . . . . . . 81.57 -14.3 30.72 Favored Glycine 0 C--O 1.243 0.683 0 O-C-N 129.041 3.963 . . . . 15.15 110.651 170.003 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 197' ' ' GLY . . . . . . . . . . . . . . . -72.32 165.6 54.17 Favored Glycine 0 C--O 1.256 1.5 0 CA-C-O 124.586 2.215 . . . . 21.56 110.481 176.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 198' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_endo -84.1 145.5 11.08 Favored 'Trans proline' 0 C--O 1.249 1.043 0 N-CA-C 117.63 2.127 . . . . 20.08 117.63 -177.146 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 199' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -113.13 108.82 17.83 Favored 'General case' 0 N--CA 1.501 2.087 0 CA-C-N 110.533 -3.03 . . . . 18.74 103.725 168.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 200' ' ' VAL . . . . . 0.423 HG12 ' HA ' ' H' ' 209' ' ' GLN . 32.7 m -118.59 156.36 20.49 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.955 0 CA-C-O 125.521 2.581 . . . . 22.83 112.068 -173.255 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 201' ' ' MET . . . . . . . . . . . . . 60.6 mtp -129.25 158.84 37.91 Favored 'General case' 0 C--O 1.207 -1.159 0 CA-C-N 111.532 -2.576 . . . . 21.79 108.028 171.381 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 202' ' ' LYS . . . . . 0.425 ' O ' ' HE2' ' L' ' 14' J TYR . 44.9 tttt -105.14 117.25 33.54 Favored 'General case' 0 C--O 1.262 1.745 0 CA-C-O 116.596 -1.668 . . . . 19.02 110.157 172.309 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 203' ' ' SER . . . . . . . . . . . . . 43.3 t -61.0 129.11 90.15 Favored Pre-proline 0 N--CA 1.497 1.886 0 O-C-N 126.445 2.341 . . . . 25.22 113.823 174.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 204' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_endo -77.52 -6.67 16.42 Favored 'Trans proline' 0 C--N 1.315 -1.203 0 C-N-CA 121.688 1.592 . . . . 22.72 111.097 178.209 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 204' A PHE . . . . . . . . . . . . . 42.1 m-85 -89.62 -50.36 6.13 Favored 'General case' 0 C--O 1.241 0.605 0 O-C-N 118.704 -2.498 . . . . 27.49 114.699 -176.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 204' B ASN . . . . . 0.481 ' C ' HD22 ' H' ' 204' B ASN . 0.0 OUTLIER -120.84 3.9 10.54 Favored 'General case' 0 C--O 1.265 1.892 0 O-C-N 128.468 3.605 . . . . 24.27 114.138 -174.509 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 205' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 66.09 13.68 9.23 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 113.708 -3.044 . . . . 41.34 117.328 178.17 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 206' ' ' ARG . . . . . 0.462 ' HD3' ' O ' ' L' ' 1' ' ' CYS . 40.0 mtt180 -91.16 167.58 12.24 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 128.122 3.389 . . . . 26.43 111.983 -177.712 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 207' ' ' TRP . . . . . . . . . . . . . 78.2 m95 -103.08 135.92 43.85 Favored 'General case' 0 CA--C 1.508 -0.653 0 O-C-N 127.2 2.813 . . . . 18.18 103.475 -179.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 208' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -122.94 142.74 50.48 Favored 'General case' 0 N--CA 1.523 3.198 1 O-C-N 129.328 4.143 . . . . 21.71 110.799 178.442 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 209' ' ' GLN . . . . . 0.423 ' HA ' HG12 ' H' ' 200' ' ' VAL . 41.0 tt0 -85.36 123.91 31.37 Favored 'General case' 0 N--CA 1.495 1.814 0 C-N-CA 115.317 -2.553 . . . . 18.08 108.645 173.443 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 210' ' ' MET . . . . . . . . . . . . . 24.7 mmm -102.15 -22.13 14.27 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 114.939 1.459 . . . . 30.49 114.939 175.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 211' ' ' GLY . . . . . 0.482 ' HA2' ' O ' ' H' ' 229' ' ' THR . . . -148.21 164.23 28.95 Favored Glycine 0 C--N 1.35 1.352 0 O-C-N 120.817 -1.177 . . . . 18.61 113.295 -177.105 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 212' ' ' ILE . . . . . . . . . . . . . 54.3 mt -122.94 126.56 73.94 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.896 1 CA-C-O 110.976 -4.345 . . . . 19.67 106.441 177.675 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 213' ' ' VAL . . . . . . . . . . . . . 24.4 t -52.4 126.62 8.45 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.466 0 CA-C-N 121.685 2.039 . . . . 19.56 106.649 179.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 214' ' ' SER . . . . . . . . . . . . . 9.2 t -121.27 -61.9 1.49 Allowed 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 113.952 -3.099 . . . . 20.57 113.903 -175.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 215' ' ' TRP . . . . . . . . . . . . . 65.6 p-90 -158.56 165.15 35.19 Favored 'General case' 0 CA--C 1.494 -1.211 0 CA-C-O 125.568 2.604 . . . . 22.65 116.397 -176.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 216' ' ' GLY . . . . . 0.526 ' O ' ' N3 ' ' H' ' 372' ' ' 00N . . . -164.91 -174.21 34.38 Favored Glycine 0 N--CA 1.49 2.269 0 CA-C-N 108.877 -3.783 . . . . 20.83 107.556 172.93 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 217' ' ' GLU . . . . . 0.558 ' OE1' ' NZ ' ' H' ' 224' ' ' LYS . 38.7 mt-10 -132.53 101.37 5.29 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 110.719 -2.74 . . . . 34.15 104.983 -179.47 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 219' ' ' GLY . . . . . . . . . . . . . . . 81.93 -156.33 36.1 Favored Glycine 0 N--CA 1.495 2.619 0 C-N-CA 114.598 -3.667 . . . . 26.06 105.376 -172.026 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 220' ' ' CYS . . . . . . . . . . . . . 61.4 m -158.69 126.64 5.13 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 109.623 -3.288 . . . . 29.17 109.978 -177.378 -56.304 -170.847 92.248 106.168 2.021 108.196 47.613 -166.566 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 221' ' ' ASP . . . . . 0.516 ' O ' ' NH2' ' H' ' 187' ' ' ARG 0.3 27.9 t70 55.58 22.15 5.01 Favored 'General case' 0 C--O 1.26 1.643 0 CA-C-N 112.269 -2.241 . . . . 33.9 111.034 177.794 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 221' A ARG . . . . . 0.469 ' NE ' ' OE1' ' H' ' 146' ' ' GLU . 0.8 OUTLIER -66.28 152.67 44.44 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 107.601 -1.259 . . . . 47.81 107.601 173.444 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 222' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -77.67 144.88 37.02 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 119.126 -2.234 . . . . 50.0 109.954 179.468 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 223' ' ' GLY . . . . . . . . . . . . . . . 68.46 10.08 59.52 Favored Glycine 0 C--O 1.251 1.157 0 N-CA-C 109.369 -1.492 . . . . 36.04 109.369 177.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 224' ' ' LYS . . . . . 0.558 ' NZ ' ' OE1' ' H' ' 217' ' ' GLU . 6.3 mmtt -116.37 167.04 11.39 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 105.38 -2.082 . . . . 32.77 105.38 174.187 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 225' ' ' TYR . . . . . 0.497 ' OH ' ' HD3' ' H' ' 185' ' ' LYS . 18.2 m-85 -147.15 155.13 41.88 Favored 'General case' 0 C--O 1.255 1.361 0 C-N-CA 128.38 2.672 . . . . 26.0 113.452 -176.264 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 226' ' ' GLY . . . . . . . . . . . . . . . -84.22 151.97 27.64 Favored Glycine 0 CA--C 1.538 1.508 0 CA-C-O 115.643 -2.754 . . . . 16.89 106.947 177.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 227' ' ' PHE . . . . . 0.513 ' CE2' HD12 ' H' ' 176' ' ' ILE . 30.0 m-85 -117.02 138.77 51.36 Favored 'General case' 0 C--O 1.254 1.292 1 O-C-N 130.724 4.426 . . . . 20.74 108.656 -179.876 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 228' ' ' TYR . . . . . . . . . . . . 0.278 72.2 m-85 -131.16 145.17 51.85 Favored 'General case' 0 N--CA 1.485 1.28 1 CA-C-O 110.235 -4.697 . . . . 22.48 109.521 -176.128 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' H' H ' 229' ' ' THR . . . . . 0.482 ' O ' ' HA2' ' H' ' 211' ' ' GLY . 4.8 m -60.88 135.97 57.94 Favored 'General case' 0 C--O 1.276 2.455 0 O-C-N 128.9 3.875 . . . . 21.02 113.997 168.433 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 230' ' ' HIS . . . . . 0.402 ' NE2' HD12 ' H' ' 130' ' ' LEU . 21.6 t-80 -83.48 112.85 20.34 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 128.246 3.466 . . . . 24.47 108.344 177.662 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 231' ' ' VAL . . . . . . . . . . . . . 31.5 t -78.74 -40.85 23.94 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 O-C-N 127.82 3.2 . . . . 21.33 106.23 -166.436 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 232' ' ' PHE . . . . . . . . . . . . 0.286 32.0 t80 -57.33 -47.75 80.74 Favored 'General case' 0 C--N 1.294 -1.835 0 CA-C-O 123.442 1.591 . . . . 31.24 111.307 -177.393 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 233' ' ' ARG . . . . . . . . . . . . . 4.8 mmt180 -53.59 -33.43 54.86 Favored 'General case' 0 C--O 1.244 0.784 0 O-C-N 117.821 -3.049 . . . . 45.79 112.065 175.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 234' ' ' LEU . . . . . . . . . . . . . 8.2 mt -98.59 12.1 36.35 Favored 'General case' 0 C--O 1.24 0.554 0 O-C-N 119.935 -1.728 . . . . 30.22 111.96 -178.412 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 235' ' ' LYS . . . . . 0.454 ' O ' ' HB2' ' H' ' 239' ' ' GLN . 13.2 tttt -64.35 -27.6 69.13 Favored 'General case' 0 C--O 1.255 1.348 0 O-C-N 118.96 -2.338 . . . . 44.17 114.647 -174.215 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 236' ' ' LYS . . . . . 0.777 ' HE2' ' O ' ' H' ' 465' ' ' HOH . 18.9 mmtt -66.58 -48.34 69.9 Favored 'General case' 0 C--O 1.239 0.515 0 CA-C-O 114.33 -2.748 . . . . 49.08 105.034 -179.711 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 237' ' ' TRP . . . . . 0.403 ' O ' ' CG1' ' H' ' 241' ' ' VAL . 74.0 t90 -56.25 -47.27 78.85 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 128.76 3.787 . . . . 30.25 110.939 178.132 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 238' ' ' ILE . . . . . . . . . . . . . 71.7 mt -50.39 -54.53 8.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 O-C-N 119.471 -2.018 . . . . 30.97 111.041 -177.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 239' ' ' GLN . . . . . 0.457 ' O ' ' C ' ' H' ' 240' ' ' LYS . 4.6 tt0 -49.44 -63.46 1.1 Allowed 'General case' 0 C--N 1.296 -1.755 2 CA-C-O 129.528 4.49 . . . . 50.0 107.849 -179.773 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 240' ' ' LYS . . . . . 0.457 ' C ' ' O ' ' H' ' 239' ' ' GLN . 25.0 tttp -45.04 -52.98 8.37 Favored 'General case' 0 C--N 1.311 -1.094 0 O-C-N 117.272 -3.392 . . . . 49.1 109.842 178.512 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 241' ' ' VAL . . . . . 0.403 ' CG1' ' O ' ' H' ' 237' ' ' TRP 0.379 0.4 OUTLIER -70.39 -35.78 63.79 Favored 'Isoleucine or valine' 0 C--O 1.255 1.377 0 C-N-CA 117.927 -1.509 . . . . 37.72 114.171 -176.021 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' H' H ' 242' ' ' ILE . . . . . . . . . . . . . 26.8 mt -71.3 -14.63 17.96 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.126 0 CA-C-O 116.357 -1.782 . . . . 40.98 109.453 179.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 243' ' ' ASP . . . . . . . . . . . . 0.473 0.0 OUTLIER -96.52 -27.04 15.04 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 116.048 -2.261 . . . . 50.0 114.899 179.563 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 244' ' ' GLN . . . . . 1.079 ' HG2' ' CD2' ' H' ' 245' ' ' PHE . 1.0 OUTLIER -87.78 -35.35 17.91 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 117.261 -3.399 . . . . 50.0 112.898 179.612 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 245' ' ' PHE . . . . . 1.079 ' CD2' ' HG2' ' H' ' 244' ' ' GLN . 90.6 m-85 -109.29 3.73 21.94 Favored 'General case' 0 C--O 1.264 1.855 0 N-CA-C 117.695 2.48 . . . . 50.0 117.695 -173.696 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 246' ' ' GLY . . . . . 0.982 ' HA3' ' NZ ' ' H' ' 107' ' ' LYS . . . . . . . . 0 C--O 1.272 2.476 2 CA-C-O 106.243 -7.976 . . . . 50.0 109.096 178.301 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 355' ' ' ASP . . . . . 0.443 ' HB3' HG21 ' H' ' 74' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.484 1.264 0 CA-C-O 124.417 2.055 . . . . 50.0 105.66 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 356' ' ' PHE . . . . . 0.522 ' HA ' ' HB ' ' H' ' 74' ' ' THR . 55.8 m-85 -66.31 124.25 22.19 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 112.38 -2.191 . . . . 47.65 109.094 -174.674 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 357' ' ' GLU . . . . . 0.575 ' HG2' ' N ' ' I' ' 358' ' ' GLU . 15.4 tt0 -75.29 144.78 42.3 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 127.469 3.509 . . . . 45.42 106.711 172.329 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 358' ' ' GLU . . . . . 0.769 ' HG3' ' O ' ' I' ' 488' ' ' HOH . 0.0 OUTLIER -59.09 149.98 26.35 Favored 'General case' 0 C--O 1.266 1.926 0 O-C-N 116.657 -3.777 . . . . 50.0 111.448 -176.898 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' I' I ' 359' ' ' ILE . . . . . . . . . . . . . 3.9 pt -114.61 158.47 40.13 Favored Pre-proline 0 C--O 1.256 1.399 0 CA-C-O 115.688 -2.101 . . . . 47.07 110.135 179.353 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 360' ' ' PRO . . . . . 0.562 ' HB2' ' OE2' ' I' ' 362' ' ' GLU . 1.7 Cg_endo -58.16 134.85 64.6 Favored 'Trans proline' 0 C--O 1.255 1.339 0 C-N-CA 123.049 2.499 . . . . 47.79 113.358 178.0 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 361' ' ' GLU . . . . . . . . . . . . . . . -53.39 -25.24 14.82 Favored 'General case' 0 C--O 1.26 1.619 0 N-CA-C 118.658 2.836 . . . . 48.4 118.658 -176.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 362' ' ' GLU . . . . . 0.562 ' OE2' ' HB2' ' I' ' 360' ' ' PRO 0.271 3.0 pm0 -67.54 -5.53 15.68 Favored 'General case' 0 C--O 1.244 0.772 0 CA-C-O 114.739 -2.553 . . . . 50.0 107.317 -177.226 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' I' I ' 363' ' ' TYS . . . . . 0.417 ' HE2' ' HG2' ' I' ' 360' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 364' ' ' LEU . . . . . 0.801 ' C ' ' O ' ' I' ' 538' ' ' HOH . 1.6 mm? . . . . . 0 N--CA 1.48 1.043 0 CA-C-O 114.309 -2.758 . . . . 47.21 105.359 176.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 650' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 651' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 372' ' ' 00N . . . . . 1.29 ' C ' ' OG ' ' H' ' 195' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 447' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 478' ' ' HOH . . . . . 0.673 ' O ' ' CA ' ' L' ' 1' A ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 484' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 493' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 514' ' ' HOH . . . . . 0.497 ' O ' ' NZ ' ' L' ' 14' A LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 401' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 421' ' ' HOH . . . . . 0.694 ' O ' ' OD1' ' H' ' 116' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 422' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 425' ' ' HOH . . . . . 0.447 ' O ' ' OD2' ' H' ' 60' E ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 431' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 432' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 435' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 436' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 438' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 439' ' ' HOH . . . . . 0.438 ' O ' ' NH1' ' H' ' 73' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 440' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 441' ' ' HOH . . . . . 0.437 ' O ' ' ND2' ' H' ' 60' G ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 442' ' ' HOH . . . . . 0.785 ' O ' ' HB3' ' H' ' 153' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 443' ' ' HOH . . . . . 0.575 ' O ' ' NH2' ' H' ' 73' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 ' 448' ' ' HOH . . . . . 0.911 ' O ' ' HE2' ' H' ' 245' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 449' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 450' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 453' ' ' HOH . . . . . 0.704 ' O ' ' HD2' ' H' ' 175' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 ' 463' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 464' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 465' ' ' HOH . . . . . 0.777 ' O ' ' HE2' ' H' ' 236' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 ' 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 ' 473' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 475' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 476' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 477' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 480' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 481' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 482' ' ' HOH . . . . . 0.675 ' O ' ' O ' ' H' ' 74' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 483' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 485' ' ' 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 ' 489' ' ' HOH . . . . . 0.628 ' O ' ' HA ' ' H' ' 18' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 ' 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 0 . 1 . 001 ecloud nobuild full ' H' H ' 499' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 500' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 503' ' ' HOH . . . . . 0.704 ' O ' ' HB2' ' H' ' 126' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 510' ' ' 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 ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 520' ' ' HOH . . . . . 0.614 ' O ' ' ND2' ' H' ' 143' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 536' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 537' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 539' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 540' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 541' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 542' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 543' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 544' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 546' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 548' ' ' HOH . . . . . 0.99 ' O ' ' CE3' ' H' ' 51' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 549' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 550' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 551' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 552' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 553' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 554' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 556' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 557' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 558' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 559' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 560' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 561' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 454' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 474' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 479' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 488' ' ' HOH . . . . . 0.769 ' O ' ' HG3' ' I' ' 358' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 492' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 538' ' ' HOH . . . . . 0.801 ' O ' ' C ' ' I' ' 364' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_