data_1ca8_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 1ca8 _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 ' A' A ' 1' B ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.868 0 CA-C-O 124.786 2.231 . . . . 36.87 106.971 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 1' A ASP . . . . . . . . . . . . . 18.0 t0 -100.54 9.96 41.84 Favored 'General case' 0 C--O 1.25 1.125 0 CA-C-N 110.153 -3.203 . . . . 47.09 108.278 174.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 13.7 p -53.56 143.03 20.9 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 124.434 2.064 . . . . 25.92 111.779 -178.814 76.466 72.811 96.556 106.747 2.024 102.307 -60.122 -58.42 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 63.83 11.91 45.71 Favored Glycine 0 C--O 1.253 1.324 0 N-CA-C 120.777 3.071 . . . . 18.78 120.777 174.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 29.9 mt -111.56 107.54 16.74 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-O 116.278 -1.82 . . . . 23.82 106.294 176.133 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ARG . . . . . 0.4 ' NH1' ' OD2' ' A' ' 14' ' ' ASP . 79.0 mtm180 -76.11 132.18 74.23 Favored Pre-proline 0 N--CA 1.475 0.815 0 O-C-N 128.468 3.605 . . . . 22.28 112.555 -173.464 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -55.14 -35.73 91.42 Favored 'Trans proline' 0 C--O 1.252 1.212 0 C-N-CA 121.069 1.179 . . . . 25.08 113.633 179.56 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -95.42 -2.03 49.76 Favored 'General case' 0 C--O 1.243 0.752 0 O-C-N 118.752 -2.468 . . . . 26.92 115.454 -177.038 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -128.5 -84.6 0.58 Allowed 'General case' 0 N--CA 1.477 0.908 0 O-C-N 127.548 3.03 . . . . 26.09 107.809 -178.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.4 mp0 -51.66 -47.62 63.72 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 125.477 1.511 . . . . 24.23 113.6 -177.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.8 mmtm -64.96 -14.54 60.44 Favored 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 114.752 1.39 . . . . 38.65 114.752 -179.318 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -120.74 -2.94 9.78 Favored 'General case' 0 C--O 1.25 1.094 0 C-N-CA 126.664 1.985 . . . . 32.72 109.874 -175.741 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . 0.259 17.7 t 61.64 40.28 13.5 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 112.041 -2.345 . . . . 27.58 112.529 -176.95 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 57.6 mt -108.98 145.33 35.68 Favored 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 106.849 -1.537 . . . . 26.49 106.849 173.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 61.6 mt-10 -100.45 144.46 29.43 Favored 'General case' 0 C--O 1.257 1.473 0 CA-C-O 115.622 -2.132 . . . . 46.38 110.39 178.345 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ASP . . . . . 0.4 ' OD2' ' NH1' ' A' ' 4' ' ' ARG . 2.0 p30 -79.13 162.89 25.5 Favored 'General case' 0 N--CA 1.482 1.13 0 O-C-N 128.917 3.886 . . . . 25.45 105.299 174.562 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 14' A LYS . . . . . . . . . . . . 0.286 0.0 OUTLIER -70.05 -7.19 39.1 Favored 'General case' 0 C--O 1.247 0.943 0 CA-C-O 114.684 -2.579 . . . . 46.12 115.476 -171.325 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 14' B THR . . . . . . . . . . . . . 73.9 p -136.79 13.65 3.14 Favored 'General case' 0 C--O 1.258 1.516 0 C-N-CA 115.88 -2.328 . . . . 28.2 112.589 176.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' C GLU . . . . . . . . . . . . . 13.6 pt-20 -68.32 -28.59 67.29 Favored 'General case' 0 C--O 1.244 0.8 0 O-C-N 126.245 2.216 . . . . 25.88 109.458 -177.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' D ARG . . . . . . . . . . . . . . . -57.68 -30.47 65.49 Favored 'General case' 0 C--O 1.247 0.943 0 CA-C-N 123.091 2.678 . . . . 32.06 111.483 177.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' E GLU . . . . . . . . . . . . . 50.1 tt0 -63.21 -39.79 95.63 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 108.682 -0.858 . . . . 37.69 108.682 -179.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' F LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.74 -60.32 3.66 Favored 'General case' 0 C--N 1.312 -1.027 0 O-C-N 120.387 -1.446 . . . . 30.54 110.642 172.863 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 14' G LEU . . . . . . . . . . . . . 2.9 mm? -55.27 -36.99 66.7 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-O 122.464 1.126 . . . . 33.16 112.105 -176.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' H GLU . . . . . . . . . . . . . 73.3 mt-10 -66.66 -21.73 66.1 Favored 'General case' 0 C--N 1.322 -0.608 0 O-C-N 120.758 -1.214 . . . . 45.81 112.897 -179.478 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' I SER . . . . . . . . . . . . . 76.6 p -85.72 -18.36 33.29 Favored 'General case' 0 C--N 1.309 -1.182 0 O-C-N 123.843 0.714 . . . . 32.44 109.777 -178.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' J TYR . . . . . . . . . . . . . 5.4 m-85 . . . . . 0 C--O 1.269 2.089 0 CA-C-O 113.991 -2.909 . . . . 40.34 113.683 -177.407 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' ILE . . . . . . . . . . . . . 51.2 mm . . . . . 0 C--O 1.247 0.945 0 CA-C-O 114.3 -2.762 . . . . 26.41 105.714 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 96.1 t -109.27 129.15 64.53 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.982 0 O-C-N 126.489 2.368 . . . . 28.85 109.035 179.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 65.9 31.37 9.34 Favored 'General case' 0 C--O 1.247 0.924 0 O-C-N 126.472 2.357 . . . . 47.95 113.672 179.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' GLY . . . . . 0.415 ' N ' ' O ' ' B' ' 489' ' ' HOH . . . -98.59 -158.54 29.72 Favored Glycine 0 CA--C 1.536 1.399 0 O-C-N 126.353 2.283 . . . . 32.94 107.535 178.386 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 19.5 p -150.07 167.56 26.42 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 105.128 -2.175 . . . . 38.73 105.128 178.136 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -64.58 141.5 58.75 Favored 'General case' 0 C--N 1.312 -1.023 0 O-C-N 127.522 3.014 . . . . 37.89 107.364 -175.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' ALA . . . . . . . . . . . . . . . -77.22 153.78 33.71 Favored 'General case' 0 C--N 1.311 -1.072 1 O-C-N 129.339 4.149 . . . . 27.73 106.579 176.638 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -79.16 148.46 32.3 Favored 'General case' 0 C--O 1.248 0.977 0 O-C-N 127.485 2.99 . . . . 32.74 108.127 170.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 6.8 mm -59.27 137.72 21.32 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.824 0 O-C-N 125.53 1.769 . . . . 29.89 106.809 177.441 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.58 19.59 42.51 Favored Glycine 0 C--N 1.303 -1.258 0 C-N-CA 129.203 3.287 . . . . 24.32 115.149 -176.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' MET . . . . . . . . . . . . . 7.2 ttt -71.23 -22.66 61.97 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 116.786 -1.578 . . . . 29.92 113.772 -179.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 15.5 t -147.55 70.67 11.61 Favored Pre-proline 0 C--N 1.297 -1.676 0 CA-C-O 127.752 3.644 . . . . 24.62 108.086 -174.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -73.11 -6.08 18.32 Favored 'Trans proline' 0 N--CA 1.453 -0.89 0 O-C-N 117.927 -1.67 . . . . 19.7 114.521 -170.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' TRP . . . . . . . . . . . . . 3.4 p90 -94.63 -3.22 49.94 Favored 'General case' 0 N--CA 1.479 0.982 0 O-C-N 124.317 1.01 . . . . 20.13 108.962 175.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' GLN . . . . . 0.427 ' OE1' ' OG1' ' B' ' 139' ' ' THR . 45.8 tp60 -69.77 124.83 25.0 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 120.818 -1.176 . . . . 23.34 110.256 -179.12 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 75.9 t -117.05 147.64 20.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 C-N-CA 126.155 1.782 . . . . 22.45 111.686 179.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' MET . . . . . . . . . . . . . 51.4 ttm -108.44 124.03 49.78 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 125.7 1.6 . . . . 28.18 108.671 178.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -90.69 113.37 25.43 Favored 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 103.646 -2.724 . . . . 41.59 103.646 176.984 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' PHE . . . . . . . . . . . . . 38.1 t80 -118.73 129.01 55.03 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 113.484 -1.689 . . . . 32.65 110.527 -171.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' ARG . . . . . 0.586 ' NH1' ' OE2' ' B' ' 39' ' ' GLU . 68.1 ttt180 -85.86 126.1 33.8 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 111.282 -2.69 . . . . 40.68 108.844 179.466 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 42.1 mttt . . . . . 0 CA--C 1.554 1.096 0 N-CA-C 106.283 -1.747 . . . . 44.16 106.283 178.589 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_endo . . . . . 0 C--O 1.25 1.085 0 N-CA-C 105.466 -2.552 . . . . 44.58 105.466 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' GLN . . . . . 0.54 ' CA ' ' O ' ' B' ' 35' ' ' ARG . . . -95.96 101.67 13.37 Favored 'General case' 0 N--CA 1.495 1.777 1 CA-C-O 110.447 -4.597 . . . . 44.42 100.737 -175.714 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' GLU . . . . . 0.586 ' OE2' ' NH1' ' B' ' 35' ' ' ARG . 8.6 pt-20 -139.73 156.35 46.84 Favored 'General case' 0 C--N 1.315 -0.893 1 O-C-N 129.117 4.011 . . . . 49.75 112.045 -177.253 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 3.9 tp -73.26 113.74 10.67 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 117.77 -1.11 . . . . 34.09 109.682 177.089 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.04 -49.06 12.32 Favored 'General case' 0 C--O 1.245 0.843 0 C-N-CA 125.902 1.681 . . . . 36.27 112.652 174.107 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' CYS . . . . . . . . . . . . 0.334 12.6 m -176.67 176.03 1.6 Allowed 'General case' 0 N--CA 1.483 1.185 0 O-C-N 116.841 -3.662 . . . . 27.36 108.997 -172.684 -82.754 -160.742 -101.769 103.354 2.055 106.534 -77.348 -79.647 2 2 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' GLY . . . . . 0.589 ' CA ' ' O ' ' B' ' 564' ' ' HOH . . . -87.77 -167.32 43.37 Favored Glycine 0 CA--C 1.539 1.574 0 N-CA-C 104.379 -3.488 . . . . 22.68 104.379 171.405 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -175.95 175.15 2.0 Favored 'General case' 0 C--O 1.26 1.636 0 N-CA-C 103.128 -2.915 . . . . 20.04 103.128 179.503 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 54.8 p -140.82 148.34 40.42 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 119.053 -1.059 . . . . 24.05 109.4 179.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' LEU . . . . . 0.455 ' CD2' ' O ' ' B' ' 48' ' ' SER . 0.0 OUTLIER -94.52 121.03 35.64 Favored 'General case' 0 N--CA 1.479 0.975 0 CA-C-N 113.83 -1.532 . . . . 22.21 107.236 -176.716 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' ILE . . . . . . . . . . . . . 46.4 pt -112.06 -11.34 11.84 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.235 0 O-C-N 125.566 1.791 . . . . 25.97 110.516 -177.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' SER . . . . . 0.455 ' O ' ' CD2' ' B' ' 46' ' ' LEU . 5.3 p -159.24 -171.32 3.3 Favored 'General case' 0 C--O 1.252 1.206 0 N-CA-C 106.596 -1.631 . . . . 30.8 106.596 173.918 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 30.1 p-10 -76.5 -16.66 59.59 Favored 'General case' 0 C--O 1.25 1.113 0 O-C-N 125.459 1.725 . . . . 43.74 110.706 -178.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' ARG . . . . . 0.595 ' NH1' ' OE1' ' B' ' 86' ' ' GLU . 0.0 OUTLIER -123.24 0.67 9.01 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 115.485 -2.198 . . . . 48.97 115.059 -177.618 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' TRP . . . . . . . . . . . . . 89.5 m95 -126.92 132.26 50.92 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 122.06 2.209 . . . . 33.14 112.642 -171.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 64.2 t -115.03 141.53 31.39 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.157 1 O-C-N 129.875 4.484 . . . . 24.06 109.739 175.21 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 27.2 tp -105.83 138.01 42.74 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-O 114.656 -2.592 . . . . 23.03 108.289 177.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' THR . . . . . . . . . . . . . 5.5 t -150.31 -176.18 5.37 Favored 'General case' 0 C--N 1.316 -0.859 0 O-C-N 125.447 1.717 . . . . 22.91 111.437 174.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . -86.52 131.53 34.15 Favored 'General case' 0 C--O 1.25 1.118 0 C-N-CA 126.567 1.947 . . . . 22.32 108.129 177.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -58.89 -31.73 68.87 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-O 124.578 2.132 . . . . 21.93 111.425 -179.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' HIS . . . . . . . . . . . . . 10.1 p-80 -71.16 -18.49 62.49 Favored 'General case' 0 C--N 1.313 -1.01 0 O-C-N 119.138 -2.226 . . . . 25.83 111.184 -174.172 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' CYS . . . . . . . . . . . . . 23.3 m -61.6 -29.86 70.31 Favored 'General case' 0 C--O 1.244 0.782 0 CA-C-O 123.181 1.467 . . . . 25.44 109.425 174.694 -79.647 -77.348 -101.769 106.534 2.055 103.354 -160.742 -82.754 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 14.2 mt -102.55 -34.45 9.1 Favored 'General case' 0 C--O 1.247 0.958 0 N-CA-C 115.351 1.611 . . . . 30.36 115.351 -178.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 15.1 tp -141.45 116.7 10.05 Favored 'General case' 0 C--O 1.24 0.6 0 CA-C-N 114.319 -1.31 . . . . 28.65 109.975 -170.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' A TYR . . . . . . . . . . . . . 10.8 t80 -152.52 81.86 5.32 Favored Pre-proline 0 N--CA 1.478 0.953 0 O-C-N 128.117 3.385 . . . . 30.82 107.768 178.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' B PRO . . . . . . . . . . . . 0.335 10.7 Cg_exo -50.7 -40.27 56.2 Favored 'Trans proline' 0 C--O 1.249 1.044 0 O-C-N 127.019 3.115 . . . . 30.69 116.046 -175.972 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 60' C PRO . . . . . . . . . . . . . 16.0 Cg_exo -52.5 -30.58 44.94 Favored 'Trans proline' 0 C--O 1.256 1.413 0 C-N-CA 121.545 1.496 . . . . 33.3 113.903 175.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' D TRP . . . . . . . . . . . . . 52.5 m0 -104.08 8.71 36.53 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 109.657 -0.497 . . . . 36.56 109.657 -177.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' E ASP . . . . . . . . . . . . . 64.9 m-20 59.49 37.61 22.87 Favored 'General case' 0 C--N 1.31 -1.119 0 O-C-N 125.454 1.721 . . . . 45.3 112.354 -177.38 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' F LYS . . . . . . . . . . . . . 32.5 ttmt -103.69 113.01 26.21 Favored 'General case' 0 C--N 1.308 -1.199 0 C-N-CA 125.048 1.339 . . . . 34.59 111.61 177.014 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' G ASN . . . . . 0.652 ' ND2' ' O ' ' B' ' 453' ' ' HOH . 45.3 t30 -144.04 75.32 1.46 Allowed 'General case' 0 C--O 1.248 1.025 0 C-N-CA 125.36 1.464 . . . . 43.49 108.545 176.879 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 60' H PHE . . . . . . . . . . . . . 50.6 m-85 -74.29 143.44 45.0 Favored 'General case' 0 C--N 1.317 -0.808 0 O-C-N 124.447 1.092 . . . . 38.56 111.151 179.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' I THR . . . . . . . . . . . . . 0.9 OUTLIER -109.14 165.54 11.52 Favored 'General case' 0 C--N 1.314 -0.969 0 C-N-CA 131.49 3.916 . . . . 47.23 112.706 -179.786 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 30.3 mp0 -53.91 -45.5 71.18 Favored 'General case' 0 C--O 1.25 1.087 0 CA-C-O 123.615 1.674 . . . . 47.2 112.766 -177.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . 0.27 . . -76.12 -4.73 43.17 Favored 'General case' 0 C--O 1.246 0.905 0 N-CA-C 115.132 1.53 . . . . 39.58 115.132 -175.11 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -86.83 -21.64 26.31 Favored 'General case' 0 C--O 1.247 0.956 0 O-C-N 118.947 -2.345 . . . . 46.29 113.509 179.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -116.1 163.26 16.21 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 116.228 1.936 . . . . 43.31 116.228 -171.929 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -136.55 140.68 43.11 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 109.464 -3.516 . . . . 33.92 105.229 173.445 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -102.51 129.1 54.58 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.443 1 O-C-N 130.228 4.705 . . . . 33.08 108.808 172.363 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' ARG . . . . . . . . . . . . . 65.4 mtp180 -118.92 120.38 37.13 Favored 'General case' 0 C--N 1.309 -1.182 0 C-N-CA 125.2 1.4 . . . . 28.3 110.138 179.647 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' ILE . . . . . . . . . . . . . 1.5 mt -119.15 144.65 26.88 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 N-CA-C 116.357 1.984 . . . . 27.52 116.357 -177.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 87.93 12.5 66.04 Favored Glycine 0 CA--C 1.526 0.773 0 CA-C-N 120.921 1.691 . . . . 24.12 113.076 179.161 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' LYS . . . . . 0.462 ' NZ ' ' OE1' ' B' ' 80' ' ' GLU . 19.8 mtpp -77.41 156.5 31.12 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-O 123.974 1.845 . . . . 27.39 112.415 -178.096 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' HIS . . . . . 0.584 ' CD2' ' CG2' ' B' ' 154' ' ' VAL . 82.8 t60 -131.44 -53.42 1.02 Allowed 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 111.158 -2.747 . . . . 26.75 108.028 177.358 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' SER . . . . . 0.58 ' OG ' ' CG ' ' B' ' 75' ' ' ARG . 5.8 t -78.81 141.04 38.07 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 113.034 -1.894 . . . . 31.28 107.505 -179.463 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 68.8 ttp85 -65.63 -46.57 78.75 Favored 'General case' 0 C--O 1.258 1.51 0 N-CA-C 114.476 1.288 . . . . 34.92 114.476 176.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' THR . . . . . 0.768 ' O ' ' O ' ' B' ' 450' ' ' HOH . 77.3 p -106.83 -21.9 12.88 Favored 'General case' 0 C--O 1.246 0.893 1 N-CA-C 123.022 4.453 . . . . 32.46 123.022 -176.011 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' ARG . . . . . 0.8 ' NH1' ' CA ' ' B' ' 75' ' ' ARG . 0.0 OUTLIER -74.54 150.13 39.9 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 107.55 -1.278 . . . . 50.15 107.55 -178.855 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 50.6 t80 -88.59 109.75 20.34 Favored 'General case' 0 C--O 1.257 1.49 0 N-CA-C 101.514 -3.513 . . . . 40.62 101.514 171.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -86.55 76.64 9.54 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.91 0.884 . . . . 31.78 110.679 -169.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' A ARG . . . . . 0.815 ' O ' ' O ' ' B' ' 499' ' ' HOH . 8.4 ttp85 -46.01 125.61 6.55 Favored 'General case' 0 C--O 1.245 0.851 0 C-N-CA 129.733 3.213 . . . . 34.36 110.017 -177.449 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 1.6 m120 77.72 -4.71 2.22 Favored 'General case' 0 C--O 1.252 1.189 0 O-C-N 126.327 2.267 . . . . 35.93 114.314 -179.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 54.4 mt -114.65 -59.69 3.11 Favored 'Isoleucine or valine' 0 C--O 1.257 1.485 0 O-C-N 119.869 -1.769 . . . . 31.56 111.307 -177.236 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' GLU . . . . . 0.462 ' OE1' ' NZ ' ' B' ' 70' ' ' LYS . 9.2 pt-20 -82.47 155.76 24.44 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-O 125.117 2.389 . . . . 29.92 111.996 -179.727 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' LYS . . . . . 0.535 ' NZ ' ' O ' ' B' ' 588' ' ' HOH . 1.8 mmtt -124.81 133.9 52.95 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 113.289 -1.778 . . . . 45.13 106.376 175.729 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 3.4 mt -110.78 118.2 56.72 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.966 0 CA-C-O 113.917 -2.944 . . . . 35.51 108.79 -176.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -114.11 164.75 13.43 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 122.287 2.312 . . . . 36.31 108.931 -178.832 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' MET . . . . . . . . . . . . . . . -103.67 146.49 28.51 Favored 'General case' 0 C--O 1.249 1.067 0 N-CA-C 102.325 -3.213 . . . . 39.19 102.325 178.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' LEU . . . . . 0.465 ' CD1' ' CE ' ' B' ' 106' ' ' MET . 50.5 mt -85.63 141.3 29.89 Favored 'General case' 0 N--CA 1.473 0.675 0 O-C-N 126.671 2.482 . . . . 36.73 109.471 179.563 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' GLU . . . . . 0.595 ' OE1' ' NH1' ' B' ' 50' ' ' ARG . 52.5 tt0 -91.9 -37.15 13.06 Favored 'General case' 0 C--N 1.314 -0.952 0 O-C-N 125.673 1.858 . . . . 49.21 111.731 172.043 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' LYS . . . . . . . . . . . . . 1.2 tmtt? -162.89 145.07 10.38 Favored 'General case' 0 C--O 1.244 0.766 0 O-C-N 119.744 -1.847 . . . . 48.94 111.411 -173.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' ILE . . . . . . . . . . . . . 35.4 mt -114.21 137.08 48.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-O 123.431 1.586 . . . . 36.35 108.272 177.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' TYR . . . . . 0.404 ' CD1' ' N ' ' B' ' 89' ' ' TYR . 14.9 m-85 -125.17 118.29 25.76 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 113.011 -1.904 . . . . 47.11 109.876 175.786 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 1.1 mm -103.17 141.3 19.29 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 O-C-N 126.483 2.364 . . . . 28.78 109.424 175.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' HIS . . . . . 0.404 ' ND1' ' N ' ' B' ' 93' ' ' ARG . 44.7 t-80 -57.03 125.35 69.78 Favored Pre-proline 0 C--O 1.253 1.24 0 CA-C-N 119.609 1.095 . . . . 29.94 109.445 176.085 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_endo -55.13 -25.91 48.09 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 122.347 2.032 . . . . 32.53 111.132 -176.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' ARG . . . . . 0.404 ' N ' ' ND1' ' B' ' 91' ' ' HIS . 66.5 mtp180 -109.51 22.24 16.01 Favored 'General case' 0 C--O 1.251 1.142 0 O-C-N 125.288 1.617 . . . . 40.95 113.591 -179.053 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -54.19 130.55 38.85 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 115.908 -1.996 . . . . 24.98 106.743 176.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' ASN . . . . . . . . . . . . . 51.3 t-20 -105.98 89.16 2.99 Favored 'General case' 0 N--CA 1.488 1.455 0 CA-C-N 121.761 2.073 . . . . 29.04 114.181 177.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' TRP . . . . . . . . . . . . . 51.2 p-90 -81.91 -16.33 50.94 Favored 'General case' 0 C--O 1.256 1.396 0 C-N-CA 124.263 1.025 . . . . 29.48 112.422 -179.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 29.2 mtt-85 -76.37 -21.66 55.8 Favored 'General case' 0 C--O 1.248 0.997 0 O-C-N 125.886 1.992 . . . . 37.74 112.597 178.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' A GLU . . . . . . . . . . . . . 47.3 tt0 -134.88 -64.99 0.64 Allowed 'General case' 0 C--O 1.25 1.091 0 C-N-CA 114.073 -3.051 . . . . 42.66 114.28 -177.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' ASN . . . . . . . . . . . . . 33.3 p-10 -127.32 11.06 6.87 Favored 'General case' 0 C--O 1.242 0.707 0 CA-C-O 112.804 -3.474 . . . . 26.73 115.521 -172.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 17.2 mt 62.32 35.02 15.41 Favored 'General case' 0 C--N 1.305 -1.352 0 O-C-N 126.735 2.522 . . . . 28.16 111.469 -176.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -68.11 131.21 45.02 Favored 'General case' 0 C--O 1.248 1.005 0 N-CA-C 106.493 -1.669 . . . . 25.09 106.493 177.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 54.8 mtt85 68.06 45.81 1.26 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 127.011 2.694 . . . . 41.41 111.714 -177.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' ASP . . . . . 0.535 ' OD2' ' OG ' ' B' ' 214' ' ' SER . 46.3 t0 -77.97 77.56 4.48 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 125.511 1.524 . . . . 18.53 109.477 -176.985 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 15.4 tt -154.05 142.9 13.74 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 O-C-N 125.426 1.704 . . . . 23.93 109.965 -171.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -147.53 156.54 42.93 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 126.53 2.394 . . . . 23.47 106.971 177.412 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 31.1 mt -116.68 139.07 50.95 Favored 'General case' 0 C--O 1.251 1.148 0 O-C-N 127.25 2.844 . . . . 28.77 108.013 173.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' MET . . . . . 0.465 ' CE ' ' CD1' ' B' ' 85' ' ' LEU . 22.8 mtp -122.42 119.95 32.52 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 106.95 -1.5 . . . . 37.12 106.95 176.09 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -95.86 123.63 39.52 Favored 'General case' 0 N--CA 1.476 0.846 0 O-C-N 125.245 1.591 . . . . 43.76 109.174 178.082 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' LEU . . . . . 0.588 ' O ' ' NH1' ' B' ' 50' ' ' ARG . 66.1 mt -69.38 148.0 50.25 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 126.719 2.512 . . . . 33.96 110.461 -177.981 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' LYS . . . . . . . . . . . . . 2.2 tptm -60.61 -27.45 67.76 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 113.008 -1.906 . . . . 45.3 109.871 178.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' LYS . . . . . 0.401 ' N ' ' O ' ' B' ' 572' ' ' HOH . . . -157.44 141.28 11.47 Favored Pre-proline 0 C--N 1.321 -0.668 0 C-N-CA 125.882 1.673 . . . . 40.45 110.502 178.875 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -54.52 137.03 72.15 Favored 'Trans proline' 0 C--N 1.317 -1.083 0 O-C-N 125.291 2.206 . . . . 38.8 107.913 177.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 14.4 p -89.61 163.96 2.27 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 N-CA-C 105.444 -2.058 . . . . 38.22 105.444 177.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' ALA . . . . . . . . . . . . . . . -108.61 132.85 53.47 Favored 'General case' 0 C--N 1.32 -0.688 0 O-C-N 126.121 2.138 . . . . 35.01 107.023 -179.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 15.8 m-30 -66.82 158.83 29.46 Favored 'General case' 0 C--N 1.312 -1.055 0 O-C-N 127.25 2.844 . . . . 29.6 109.589 178.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 1.9 p -166.75 -176.7 3.59 Favored 'General case' 0 C--O 1.254 1.332 0 N-CA-C 101.875 -3.38 . . . . 26.64 101.875 -176.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' ASP . . . . . . . . . . . . . 63.5 m-20 -61.55 -22.14 64.9 Favored 'General case' 0 C--O 1.25 1.096 0 O-C-N 128.962 3.914 . . . . 34.17 110.568 179.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -112.23 -8.83 13.95 Favored 'General case' 0 C--O 1.257 1.453 0 N-CA-C 117.604 2.446 . . . . 30.05 117.604 -171.206 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' ILE . . . . . . . . . . . . . 27.4 mt -126.85 109.81 21.68 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 C-N-CA 130.052 3.341 . . . . 23.79 110.324 -177.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' HIS . . . . . . . . . . . . . 27.7 t60 -154.63 142.29 13.94 Favored Pre-proline 0 N--CA 1.486 1.373 0 CA-C-O 116.727 -1.606 . . . . 28.15 107.803 179.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -80.25 152.09 20.83 Favored 'Trans proline' 0 C--O 1.253 1.242 0 CA-C-O 125.38 2.158 . . . . 22.54 113.448 -178.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' VAL . . . . . . . . . . . . . 11.7 p -90.57 161.14 2.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 N-CA-C 104.325 -2.472 . . . . 19.77 104.325 176.91 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' CYS . . . . . . . . . . . . . 69.9 m -86.73 157.14 19.69 Favored 'General case' 0 C--O 1.243 0.723 0 O-C-N 120.843 -1.161 . . . . 21.58 110.026 173.509 -58.42 -60.122 96.556 102.307 2.024 106.747 72.811 76.466 1 1 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' LEU . . . . . . . . . . . . . 80.4 mt -100.37 136.93 19.89 Favored Pre-proline 0 N--CA 1.481 1.105 0 N-CA-C 105.178 -2.156 . . . . 25.48 105.178 170.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' PRO . . . . . 0.55 ' O ' ' NZ ' ' B' ' 235' ' ' LYS . 17.9 Cg_endo -68.45 154.09 72.55 Favored 'Trans proline' 0 N--CA 1.455 -0.771 0 O-C-N 125.024 2.065 . . . . 28.99 111.772 -175.921 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' ASP . . . . . . . . . . . . . 15.4 p-10 -103.29 158.58 16.23 Favored 'General case' 0 C--O 1.254 1.324 0 N-CA-C 103.157 -2.905 . . . . 49.63 103.157 171.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' ARG . . . . . 0.492 ' O ' ' CG ' ' B' ' 126' ' ' ARG . . . -48.22 -39.23 20.56 Favored 'General case' 0 C--O 1.242 0.669 0 O-C-N 125.054 1.471 . . . . 40.28 114.074 -178.481 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' GLU . . . . . . . . . . . . . . . -76.67 -31.98 57.64 Favored 'General case' 0 C--O 1.253 1.269 0 O-C-N 124.321 1.013 . . . . 34.17 112.65 -177.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 18.7 m -67.51 -45.72 74.98 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 116.807 -1.957 . . . . 32.94 105.789 176.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' ALA . . . . . . . . . . . . . . . -57.27 -46.7 82.82 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 125.395 1.478 . . . . 28.75 110.921 178.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 129' A ALA . . . . . . . . . . . . . . . -57.59 -48.95 77.98 Favored 'General case' 0 C--O 1.249 1.041 0 O-C-N 125.778 1.924 . . . . 31.9 111.626 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 129' B SER . . . . . . . . . . . . . 0.1 OUTLIER -81.33 -21.99 38.81 Favored 'General case' 0 C--O 1.243 0.713 0 CA-C-O 113.656 -3.069 . . . . 36.08 116.454 -177.39 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 129' C LEU . . . . . . . . . . . . . 15.9 mt -96.56 -35.45 11.08 Favored 'General case' 0 C--N 1.313 -0.982 0 O-C-N 126.639 2.462 . . . . 34.19 113.225 -175.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' LEU . . . . . 0.592 ' CD2' ' CD1' ' B' ' 162' ' ' ILE . 0.4 OUTLIER -77.54 76.08 4.08 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-O 123.155 1.455 . . . . 34.89 109.352 -176.956 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -129.39 141.36 51.07 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 116.848 -1.548 . . . . 49.7 110.561 -177.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -57.86 134.49 56.35 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 118.614 0.643 . . . . 31.14 109.632 -179.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' GLY . . . . . 0.418 ' N ' ' O ' ' B' ' 162' ' ' ILE . . . 94.28 -25.49 22.13 Favored Glycine 0 N--CA 1.468 0.802 0 C-N-CA 119.405 -1.378 . . . . 26.5 114.504 179.577 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 134' ' ' TYR . . . . . . . . . . . . . 3.8 m-30 -72.65 140.35 47.89 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 104.116 -2.55 . . . . 30.0 104.116 175.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 80.0 mttt -97.35 144.3 27.25 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 128.406 3.566 . . . . 25.92 112.68 179.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -121.14 177.53 16.38 Favored Glycine 0 CA--C 1.538 1.524 0 C-N-CA 128.291 2.853 . . . . 20.49 107.539 174.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 41.9 ttm180 -129.93 134.75 47.68 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-O 115.113 -2.375 . . . . 22.13 105.464 -172.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 138' ' ' VAL . . . . . . . . . . . . . 4.3 t -118.38 147.09 22.08 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 O-C-N 128.858 3.849 . . . . 24.21 107.601 174.908 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 139' ' ' THR . . . . . 0.427 ' OG1' ' OE1' ' B' ' 30' ' ' GLN . 23.3 p -135.94 148.65 48.6 Favored 'General case' 0 C--N 1.315 -0.921 0 O-C-N 124.618 1.199 . . . . 20.95 111.84 179.391 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 140' ' ' GLY . . . . . . . . . . . . . . . 174.8 175.55 42.39 Favored Glycine 0 CA--C 1.54 1.642 0 C-N-CA 117.564 -2.255 . . . . 20.15 109.233 175.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 141' ' ' TRP . . . . . . . . . . . . 0.251 4.6 m-90 -111.87 12.71 20.88 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-N 110.231 -2.984 . . . . 29.65 112.392 -177.311 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 142' ' ' GLY . . . . . . . . . . . . . . . -73.01 -176.87 31.78 Favored Glycine 0 CA--C 1.529 0.944 0 O-C-N 125.211 1.569 . . . . 30.5 109.406 -174.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 143' ' ' ASN . . . . . . . . . . . . . 64.9 m-20 -52.02 146.99 7.81 Favored 'General case' 0 C--O 1.244 0.814 0 CA-C-N 111.757 -2.221 . . . . 40.14 110.023 178.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 70.9 mt -91.68 -43.16 9.75 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 108.617 -3.901 . . . . 30.57 108.983 176.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 145' ' ' LYS . . . . . 0.453 ' CB ' ' N ' ' B' ' 147' ' ' THR 0.302 0.7 OUTLIER -121.98 153.48 38.48 Favored 'General case' 1 C--N 0.683 -28.404 3 O-C-N 104.817 -11.177 . . . . 48.8 111.958 177.751 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . 0.421 6.9 mt-10 -38.5 36.85 0.0 OUTLIER 'General case' 1 CA--C 1.668 5.509 2 N-CA-C 97.262 -5.088 . . . . 42.01 97.262 170.1 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' B' B ' 147' ' ' THR . . . . . 0.453 ' N ' ' CB ' ' B' ' 145' ' ' LYS . . . . . . . . 2 N--CA 1.569 5.508 0 O-C-N 117.467 -3.271 . . . . 43.55 113.473 178.894 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 151' ' ' GLN . . . . . 0.824 ' NE2' ' O ' ' B' ' 557' ' ' HOH . 8.6 mt-30 . . . . . 0 C--O 1.246 0.893 0 N-CA-C 106.023 -1.843 . . . . 52.44 106.023 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_endo -74.12 164.51 34.16 Favored 'Trans proline' 0 C--O 1.247 0.951 0 O-C-N 126.367 2.772 . . . . 35.65 108.444 -174.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 62.4 p -92.03 -29.12 16.76 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 116.609 -2.036 . . . . 33.64 108.113 175.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 154' ' ' VAL . . . . . 0.584 ' CG2' ' CD2' ' B' ' 71' ' ' HIS 0.348 0.4 OUTLIER -127.12 166.58 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 CA-C-N 113.813 -1.539 . . . . 29.17 111.051 -179.051 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' B' B ' 155' ' ' LEU . . . . . . . . . . . . . 12.5 tp -52.68 134.57 35.99 Favored 'General case' 0 C--O 1.246 0.911 0 C-N-CA 124.016 0.926 . . . . 24.77 111.551 176.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 156' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -107.71 157.03 18.44 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 106.704 -1.591 . . . . 30.16 106.704 -179.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 157' ' ' VAL . . . . . . . . . . . . . 7.3 p -135.6 146.73 29.34 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.394 0 CA-C-O 115.269 -2.3 . . . . 27.55 107.058 -178.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 158' ' ' VAL . . . . . . . . . . . . . 14.2 p -150.25 139.16 15.14 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.282 0 N-CA-C 105.283 -2.118 . . . . 24.31 105.283 170.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 159' ' ' ASN . . . . . . . . . . . . . 63.7 m-20 -96.04 126.62 41.4 Favored 'General case' 0 C--N 1.293 -1.849 0 C-N-CA 130.876 3.671 . . . . 25.97 107.934 175.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 160' ' ' LEU . . . . . . . . . . . . . 33.0 mt -137.86 143.46 40.12 Favored Pre-proline 0 C--N 1.303 -1.43 0 C-N-CA 125.337 1.455 . . . . 27.59 111.53 -174.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 161' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -85.36 138.67 6.57 Favored 'Trans proline' 0 C--O 1.245 0.853 0 O-C-N 125.298 2.209 . . . . 26.98 113.852 -179.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 162' ' ' ILE . . . . . 0.592 ' CD1' ' CD2' ' B' ' 130' ' ' LEU . 7.9 mt -70.56 136.02 26.87 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.987 0 N-CA-C 106.286 -1.746 . . . . 25.91 106.286 174.8 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 163' ' ' VAL . . . . . . . . . . . . 0.321 0.5 OUTLIER -108.87 145.78 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 CA-C-O 124.54 2.114 . . . . 28.04 110.414 179.63 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 164' ' ' GLU . . . . . 0.451 ' OE1' ' N ' ' B' ' 164' ' ' GLU . 3.2 mp0 -51.89 135.31 30.4 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 131.585 3.954 . . . . 45.97 109.384 179.462 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 165' ' ' ARG . . . . . 0.624 ' NH2' ' O ' ' B' ' 177' ' ' THR . 35.3 mtp85 -50.01 -46.86 81.91 Favored Pre-proline 0 C--N 1.308 -1.217 0 C-N-CA 128.21 2.604 . . . . 37.71 116.058 -175.71 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 166' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo -55.03 -44.28 51.19 Favored 'Trans proline' 0 C--N 1.318 -1.032 0 C-N-CA 124.892 3.728 . . . . 29.9 113.331 177.24 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 167' ' ' VAL . . . . . . . . . . . . . 96.2 t -62.14 -45.31 99.04 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 N-CA-C 107.095 -1.446 . . . . 28.64 107.095 178.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 168' ' ' CYS . . . . . . . . . . . . . 72.1 m -55.96 -54.31 46.36 Favored 'General case' 0 C--O 1.261 1.68 0 O-C-N 120.842 -1.161 . . . . 26.99 110.543 176.918 -62.817 -70.706 -85.489 103.952 2.028 107.181 -83.402 90.685 1 1 . 1 . 001 ecloud orig full ' B' B ' 169' ' ' LYS . . . . . 0.458 ' CD ' ' O ' ' B' ' 165' ' ' ARG . 1.8 mptp? -56.24 -47.27 78.83 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 123.571 1.653 . . . . 49.92 111.433 -175.733 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -74.01 -1.87 21.76 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-O 115.669 -2.11 . . . . 27.31 115.871 -177.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 71.6 p -95.78 -10.66 28.51 Favored 'General case' 0 C--N 1.313 -1.004 0 O-C-N 124.537 1.148 . . . . 25.86 108.934 -177.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 172' ' ' THR . . . . . . . . . . . . . 9.1 t -141.81 168.24 20.23 Favored 'General case' 0 C--O 1.246 0.901 0 C-N-CA 117.79 -1.564 . . . . 26.77 111.366 -174.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 13.1 mtp85 -93.72 -17.68 22.93 Favored 'General case' 0 C--N 1.321 -0.663 0 O-C-N 126.851 2.594 . . . . 45.1 107.65 175.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 174' ' ' ILE . . . . . . . . . . . . . 6.6 mm -70.2 145.98 12.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.899 0 N-CA-C 108.25 -1.019 . . . . 27.61 108.25 -178.189 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 175' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -97.22 132.09 43.32 Favored 'General case' 1 C--N 1.549 9.267 2 C-N-CA 96.053 -10.259 . . . . 35.29 109.496 -179.839 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 176' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -78.32 143.93 11.98 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 O-C-N 127.315 2.884 . . . . 32.0 111.436 -176.712 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 177' ' ' THR . . . . . 0.624 ' O ' ' NH2' ' B' ' 165' ' ' ARG . 13.5 p -120.99 164.36 16.86 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-N 114.462 -1.244 . . . . 24.38 110.405 179.187 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 178' ' ' ASP . . . . . 0.447 ' CB ' ' NH1' ' B' ' 233' ' ' ARG . 94.7 m-20 -59.26 -22.39 61.05 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 112.677 -2.056 . . . . 32.39 109.178 177.889 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 179' ' ' ASN . . . . . . . . . . . . . 48.5 m-20 -82.24 17.48 1.66 Allowed 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 116.89 -1.529 . . . . 26.46 113.125 176.401 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 180' ' ' MET . . . . . 0.473 ' O ' ' NH1' ' B' ' 165' ' ' ARG . 64.7 mtt -138.86 156.31 47.4 Favored 'General case' 0 C--N 1.313 -1.02 1 CA-C-O 111.454 -4.117 . . . . 21.9 107.649 -177.543 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 181' ' ' PHE . . . . . . . . . . . . 0.262 47.0 p90 -141.0 161.91 36.73 Favored 'General case' 0 C--N 1.297 -1.678 1 O-C-N 130.766 5.041 . . . . 22.39 101.372 169.872 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' B' B ' 182' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -125.31 156.45 38.63 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 105.654 -1.98 . . . . 25.64 105.654 177.627 90.685 -83.402 -85.489 107.181 2.028 103.952 -70.706 -62.817 2 2 . 1 . 001 ecloud orig full ' B' B ' 183' ' ' ALA . . . . . . . . . . . . . . . -147.16 150.14 34.36 Favored 'General case' 0 C--N 1.315 -0.896 0 O-C-N 126.28 2.238 . . . . 22.73 112.356 -179.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 184' ' ' GLY . . . . . . . . . . . . . . . 150.15 166.48 13.47 Favored Glycine 0 C--O 1.244 0.768 0 C-N-CA 125.938 1.732 . . . . 24.54 110.252 -178.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 184' A TYR . . . . . . . . . . . . . 65.8 m-85 -81.88 150.69 27.65 Favored 'General case' 0 C--O 1.253 1.244 0 N-CA-C 105.731 -1.951 . . . . 29.35 105.731 175.71 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 185' ' ' LYS . . . . . 0.56 ' N ' ' OE1' ' B' ' 186' B GLU . 22.4 mttp -87.32 151.7 51.49 Favored Pre-proline 0 C--O 1.256 1.404 0 CA-C-O 117.154 -1.403 . . . . 40.18 108.073 174.969 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 186' ' ' PRO . . . . . . . . . . . . . 8.7 Cg_exo -46.21 -33.82 12.57 Favored 'Trans proline' 0 C--O 1.243 0.747 0 C-N-CA 122.595 2.197 . . . . 36.91 115.957 -174.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 186' A ASP . . . . . . . . . . . . . . . -68.69 -29.44 67.89 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 111.888 -2.414 . . . . 43.93 111.92 178.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 186' B GLU . . . . . 0.56 ' OE1' ' N ' ' B' ' 185' ' ' LYS . 69.1 mt-10 -66.68 -16.78 64.46 Favored 'General case' 0 C--O 1.258 1.522 0 N-CA-C 118.479 2.77 . . . . 49.56 118.479 -172.515 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 186' C GLY . . . . . . . . . . . . . . . 53.34 34.2 47.87 Favored Glycine 0 C--O 1.253 1.307 0 CA-C-O 126.217 3.121 . . . . 48.42 116.286 176.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 186' D LYS . . . . . . . . . . . . . 17.2 mttm -144.92 133.5 22.07 Favored 'General case' 0 C--N 1.313 -0.998 1 N-CA-C 99.782 -4.155 . . . . 48.82 99.782 173.913 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 187' ' ' ARG . . . . . 0.622 ' NH2' ' O ' ' B' ' 221' ' ' ASP . 23.8 mtp85 -110.48 -176.93 3.1 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 127.162 2.789 . . . . 37.74 110.923 179.118 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . 136.43 150.02 5.79 Favored Glycine 0 C--N 1.313 -0.743 0 CA-C-N 113.437 -1.71 . . . . 25.69 111.205 173.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 189' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -175.57 162.82 2.84 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 107.101 -1.444 . . . . 27.66 107.101 179.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -80.34 172.45 13.75 Favored 'General case' 0 C--O 1.256 1.406 0 N-CA-C 101.487 -3.523 . . . . 23.99 101.487 173.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 191' ' ' CYS . . . . . . . . . . . . . 11.2 t -151.69 -172.35 4.19 Favored 'General case' 0 C--O 1.253 1.288 0 N-CA-C 104.967 -2.234 . . . . 28.1 104.967 179.256 -164.719 58.563 73.734 105.195 2.055 107.705 -174.342 -51.096 1 1 . 1 . 001 ecloud orig full ' B' B ' 192' ' ' GLU . . . . . . . . . . . . . . . -55.36 144.55 24.88 Favored 'General case' 0 C--O 1.237 0.397 0 O-C-N 127.101 2.751 . . . . 25.16 108.176 -178.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 86.01 -9.4 69.43 Favored Glycine 0 C--O 1.247 0.965 0 CA-C-O 115.303 -2.943 . . . . 25.01 114.974 178.1 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 194' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -89.39 -17.69 28.31 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 119.044 1.422 . . . . 23.86 113.957 177.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 195' ' ' SER . . . . . 1.332 ' OG ' ' C3 ' ' B' ' 248' ' ' 0KV . 51.0 m -48.69 146.45 3.11 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 125.822 1.649 . . . . 27.2 109.519 -174.835 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 196' ' ' GLY . . . . . . . . . . . . . . . 82.4 -14.23 35.94 Favored Glycine 0 N--CA 1.468 0.811 0 O-C-N 127.551 3.032 . . . . 22.34 111.185 177.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -70.98 167.54 51.27 Favored Glycine 0 C--N 1.299 -1.494 0 CA-C-N 120.716 2.258 . . . . 19.97 109.01 178.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 198' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -85.78 140.85 7.2 Favored 'Trans proline' 0 C--O 1.248 1.013 0 N-CA-C 118.862 2.601 . . . . 21.18 118.862 -179.113 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 199' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -108.59 112.54 24.95 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 100.294 -3.965 . . . . 21.03 100.294 170.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 200' ' ' VAL . . . . . . . . . . . . . 31.5 m -120.33 154.81 23.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 CA-C-N 120.493 1.497 . . . . 18.95 108.308 -169.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 201' ' ' MET . . . . . . . . . . . . . 73.6 mtp -133.11 152.84 51.93 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 116.466 -2.094 . . . . 24.09 106.379 174.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 202' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -101.14 114.28 28.09 Favored 'General case' 0 C--N 1.302 -1.498 0 CA-C-O 115.688 -2.101 . . . . 26.57 108.421 179.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 12.5 t -62.37 135.32 95.22 Favored Pre-proline 0 C--O 1.25 1.129 0 CA-C-O 125.665 2.65 . . . . 23.85 112.554 178.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 204' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_endo -83.53 -3.43 10.71 Favored 'Trans proline' 0 C--O 1.246 0.917 0 CA-C-O 116.109 -1.705 . . . . 29.77 110.118 179.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 204' A PHE . . . . . . . . . . . . . 24.3 m-85 -94.07 -41.15 9.69 Favored 'General case' 0 C--O 1.248 0.998 0 O-C-N 124.623 1.202 . . . . 34.44 111.697 -176.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 204' B ASN . . . . . 0.441 ' C ' ' ND2' ' B' ' 204' B ASN . 0.0 OUTLIER -125.17 8.1 7.91 Favored 'General case' 0 C--O 1.241 0.62 0 O-C-N 126.281 2.238 . . . . 27.36 114.485 -176.564 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . 0.358 31.8 m120 52.83 30.4 9.02 Favored 'General case' 0 C--N 1.312 -1.058 0 C-N-CA 128.231 2.612 . . . . 43.49 115.572 -179.097 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 206' ' ' ARG . . . . . . . . . . . . . 71.9 mtt-85 -98.77 155.02 17.57 Favored 'General case' 0 C--N 1.318 -0.765 0 C-N-CA 126.379 1.872 . . . . 34.69 111.325 177.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 207' ' ' TRP . . . . . . . . . . . . . 82.8 m95 -97.86 128.45 44.48 Favored 'General case' 0 N--CA 1.486 1.326 0 CA-C-O 114.957 -2.449 . . . . 20.29 106.844 179.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 53.1 m-85 -115.12 139.23 50.07 Favored 'General case' 0 C--N 1.307 -1.251 0 O-C-N 128.643 3.715 . . . . 22.07 112.063 177.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 209' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -90.31 106.86 18.78 Favored 'General case' 0 C--N 1.315 -0.908 0 O-C-N 124.888 1.367 . . . . 22.08 107.647 176.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 210' ' ' MET . . . . . . . . . . . . . 74.5 mmm -90.19 -34.68 15.73 Favored 'General case' 0 C--O 1.249 1.061 0 N-CA-C 113.113 0.783 . . . . 32.01 113.113 -179.524 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 211' ' ' GLY . . . . . . . . . . . . . . . -134.52 164.63 24.61 Favored Glycine 0 N--CA 1.47 0.915 0 N-CA-C 116.805 1.482 . . . . 20.33 116.805 -177.1 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 212' ' ' ILE . . . . . . . . . . . . . 90.7 mt -121.25 129.95 75.13 Favored 'Isoleucine or valine' 0 C--O 1.249 1.056 0 CA-C-O 116.129 -1.891 . . . . 20.42 106.418 176.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 85.0 t -52.66 117.19 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.293 0 O-C-N 125.03 1.456 . . . . 20.56 109.197 174.542 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 214' ' ' SER . . . . . 0.535 ' OG ' ' OD2' ' B' ' 102' ' ' ASP . 5.8 t -115.42 -66.84 1.04 Allowed 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 117.189 2.292 . . . . 23.71 117.189 -177.183 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 215' ' ' TRP . . . . . . . . . . . . . 62.6 p-90 -155.62 170.83 21.08 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 123.604 1.669 . . . . 25.58 110.697 -175.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 216' ' ' GLY . . . . . . . . . . . . . . . -179.33 -172.26 43.32 Favored Glycine 0 N--CA 1.478 1.496 0 N-CA-C 107.292 -2.323 . . . . 23.43 107.292 179.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 217' ' ' GLU . . . . . 0.571 ' N ' ' O ' ' B' ' 555' ' ' HOH . 21.7 mt-10 -132.08 99.06 4.6 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 115.86 -2.336 . . . . 36.15 108.826 -179.716 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 219' ' ' GLY . . . . . . . . . . . . . . . 81.73 -174.5 54.06 Favored Glycine 0 N--CA 1.494 2.559 0 N-CA-C 105.051 -3.22 . . . . 27.77 105.051 -172.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 220' ' ' CYS . . . . . . . . . . . . . 34.6 m -128.94 130.93 47.4 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 116.301 -1.809 . . . . 32.61 107.878 -177.845 -51.096 -174.342 73.734 107.705 2.055 105.195 58.563 -164.719 1 1 . 1 . 001 ecloud orig full ' B' B ' 221' ' ' ASP . . . . . 0.622 ' O ' ' NH2' ' B' ' 187' ' ' ARG . 20.2 t0 53.92 41.35 32.07 Favored 'General case' 0 C--O 1.253 1.243 0 O-C-N 125.663 1.852 . . . . 32.09 113.414 174.753 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 221' A ARG . . . . . . . . . . . . . 16.6 mmt85 -81.3 141.37 34.12 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-O 114.242 -2.79 . . . . 48.16 109.544 177.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 222' ' ' ASP . . . . . 0.421 ' OD1' ' NH2' ' B' ' 187' ' ' ARG . 35.7 m-20 -68.48 141.82 55.48 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 106.535 -1.654 . . . . 45.76 106.535 176.382 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 223' ' ' GLY . . . . . . . . . . . . . . . 73.61 9.41 78.39 Favored Glycine 0 C--O 1.247 0.959 0 O-C-N 126.848 2.592 . . . . 34.04 112.265 178.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 224' ' ' LYS . . . . . . . . . . . . . 8.8 mttt -121.71 165.79 15.27 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 107.197 -1.408 . . . . 36.81 107.197 178.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 225' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -146.73 152.07 38.22 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 123.339 1.542 . . . . 27.11 111.032 -170.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 226' ' ' GLY . . . . . . . . . . . . . . . -87.37 152.08 24.01 Favored Glycine 0 CA--C 1.545 1.928 0 N-CA-C 104.302 -3.519 . . . . 21.57 104.302 -179.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 227' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -119.44 140.26 50.72 Favored 'General case' 0 C--N 1.303 -1.419 1 O-C-N 130.871 4.513 . . . . 22.21 108.099 -178.222 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 228' ' ' TYR . . . . . . . . . . . . 0.27 90.3 m-85 -128.72 148.88 50.87 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-O 113.323 -3.227 . . . . 22.17 112.625 -175.995 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 4.3 m -69.22 142.52 54.21 Favored 'General case' 0 C--O 1.251 1.138 0 O-C-N 126.676 2.485 . . . . 21.79 108.961 171.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 230' ' ' HIS . . . . . . . . . . . . . 32.9 t-80 -88.09 94.08 9.69 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 125.744 1.618 . . . . 27.59 109.684 179.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 231' ' ' VAL . . . . . . . . . . . . . 41.9 t -57.25 -51.03 74.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 113.193 -1.821 . . . . 22.1 111.898 -171.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 232' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -54.45 -45.59 73.13 Favored 'General case' 0 C--O 1.251 1.132 0 CA-C-N 118.922 0.783 . . . . 33.36 112.274 -179.04 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 233' ' ' ARG . . . . . 0.447 ' NH1' ' CB ' ' B' ' 178' ' ' ASP . 5.8 mtp180 -60.01 -22.69 62.93 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 119.907 -1.746 . . . . 49.6 111.053 -179.855 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 234' ' ' LEU . . . . . . . . . . . . . 38.3 mt -107.64 7.29 28.49 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 114.244 1.201 . . . . 31.51 114.244 -178.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 235' ' ' LYS . . . . . 0.55 ' NZ ' ' O ' ' B' ' 124' ' ' PRO . 17.5 tttt -59.56 -35.48 74.32 Favored 'General case' 0 C--N 1.304 -1.393 0 C-N-CA 127.459 2.304 . . . . 41.8 115.252 -175.229 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 236' ' ' LYS . . . . . 0.688 ' N ' ' CE ' ' B' ' 236' ' ' LYS . 0.0 OUTLIER -53.3 -55.29 25.84 Favored 'General case' 0 C--O 1.25 1.096 0 CA-C-N 113.205 -1.816 . . . . 45.31 107.597 174.278 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 237' ' ' TRP . . . . . . . . . . . . . 64.8 t90 -60.47 -39.37 87.38 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 125.14 1.525 . . . . 29.42 110.426 178.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 238' ' ' ILE . . . . . . . . . . . . . 97.2 mt -58.59 -53.21 50.11 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.096 0 O-C-N 124.063 0.852 . . . . 30.81 110.265 178.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 239' ' ' GLN . . . . . 0.87 ' C ' ' CA ' ' B' ' 240' ' ' LYS . 11.6 mt-30 . . . . . 0 C--N 1.317 -0.843 0 CA-C-O 124.409 2.052 . . . . 47.71 112.353 179.483 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 240' ' ' LYS . . . . . 0.87 ' CA ' ' C ' ' B' ' 239' ' ' GLN . . . . . . . . 0 C--O 1.251 1.138 0 CA-C-O 116.931 -1.509 . . . . 37.58 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 241' ' ' VAL . . . . . . . . . . . . 0.345 0.4 OUTLIER -69.83 -47.66 68.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 C-N-CA 117.56 -1.656 . . . . 36.94 114.324 -176.761 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 242' ' ' ILE . . . . . 0.683 ' O ' ' N ' ' B' ' 246' ' ' GLY . 63.2 mt -56.59 -48.62 80.21 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.277 0 CA-C-O 123.322 1.534 . . . . 40.7 108.495 -176.847 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 243' ' ' ASP . . . . . . . . . . . . . . . -62.08 -55.65 26.84 Favored 'General case' 0 C--N 1.316 -0.876 0 C-N-CA 126.058 1.743 . . . . 44.86 111.09 179.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 244' ' ' GLN . . . . . . . . . . . . . . . -71.71 9.87 0.79 Allowed 'General case' 0 C--O 1.244 0.771 0 CA-C-O 114.389 -2.72 . . . . 49.26 109.318 -178.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 245' ' ' PHE . . . . . . . . . . . . . . . -171.43 4.86 0.01 OUTLIER 'General case' 0 C--O 1.257 1.488 0 C-N-CA 114.969 -2.692 . . . . 52.0 117.467 -175.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 246' ' ' GLY . . . . . 0.683 ' N ' ' O ' ' B' ' 242' ' ' ILE . . . . . . . . 0 C--O 1.267 2.202 0 CA-C-O 113.54 -3.922 . . . . 57.5 118.324 -177.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 56' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 . . . . . 0 C--O 1.242 0.663 0 CA-C-O 116.512 -1.709 . . . . 48.05 112.167 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 57' ' ' GLU . . . . . 0.636 ' OE1' ' NH1' ' B' ' 75' ' ' ARG . 29.3 tt0 -68.09 129.82 41.06 Favored 'General case' 0 C--O 1.248 1.003 0 O-C-N 126.158 2.161 . . . . 44.85 105.94 173.028 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 58' ' ' GLU . . . . . . . . . . . . . . . -53.24 156.07 2.44 Favored 'General case' 0 C--O 1.25 1.131 0 C-N-CA 124.706 1.202 . . . . 44.37 108.414 -174.636 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 59' ' ' ILE . . . . . 0.583 ' CG2' ' O ' ' C' ' 537' ' ' HOH . 1.7 pp -114.46 157.36 42.85 Favored Pre-proline 0 C--O 1.244 0.768 0 O-C-N 125.967 2.042 . . . . 46.97 108.272 179.084 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 60' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -44.48 138.52 7.57 Favored 'Trans proline' 0 C--O 1.249 1.069 0 O-C-N 127.135 3.176 . . . . 48.92 111.206 176.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 61' ' ' GLU . . . . . . . . . . . . . . . -70.87 -25.04 62.62 Favored 'General case' 0 C--O 1.247 0.952 0 CA-C-N 112.002 -2.363 . . . . 48.09 112.918 -176.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 62' ' ' GLU . . . . . . . . . . . . . . . -64.42 -26.17 68.33 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 112.838 -1.983 . . . . 52.88 106.997 179.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 63' ' ' TYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 248' ' ' 0KV . . . . . 1.332 ' C3 ' ' OG ' ' B' ' 195' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 431' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 553' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 579' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 592' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 426' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 428' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 432' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 436' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 439' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 440' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 441' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 442' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 443' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 444' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 446' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 447' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 448' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 449' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 450' ' ' HOH . . . . . 0.768 ' O ' ' O ' ' B' ' 74' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 453' ' ' HOH . . . . . 0.652 ' O ' ' ND2' ' B' ' 60' G ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 455' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 458' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 459' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 460' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 462' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 463' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 465' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 469' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 471' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 472' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 473' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 476' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 477' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 481' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 485' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 486' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 488' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 489' ' ' HOH . . . . . 0.415 ' O ' ' N ' ' B' ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 490' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 491' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 492' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 493' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 494' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 495' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 496' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 497' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 498' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 499' ' ' HOH . . . . . 0.815 ' O ' ' O ' ' B' ' 77' A ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 500' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 536' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 538' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 539' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 541' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 545' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 546' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 547' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 548' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 549' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 551' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 554' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 555' ' ' HOH . . . . . 0.571 ' O ' ' N ' ' B' ' 217' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 557' ' ' HOH . . . . . 0.824 ' O ' ' NE2' ' B' ' 151' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 562' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 563' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 564' ' ' HOH . . . . . 0.589 ' O ' ' CA ' ' B' ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 568' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 570' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 572' ' ' HOH . . . . . 0.401 ' O ' ' N ' ' B' ' 110' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 574' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 575' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 577' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 580' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 581' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 582' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 583' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 585' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 586' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 588' ' ' HOH . . . . . 0.535 ' O ' ' NZ ' ' B' ' 81' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 590' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 591' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 593' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 595' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 596' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 457' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 537' ' ' HOH . . . . . 0.583 ' O ' ' CG2' ' C' ' 59' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 556' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 565' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' B ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.868 0 CA-C-O 124.786 2.231 . . . . 36.87 106.971 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' A ASP . . . . . . . . . . . . . 18.0 t0 -100.54 9.96 41.84 Favored 'General case' 0 C--O 1.25 1.125 0 CA-C-N 110.153 -3.203 . . . . 47.09 108.278 174.235 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 13.7 p -53.56 143.03 20.9 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 124.434 2.064 . . . . 25.92 111.779 -178.814 76.466 72.811 96.556 106.747 2.024 102.307 -60.122 -58.42 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 63.83 11.91 45.71 Favored Glycine 0 C--O 1.253 1.324 0 N-CA-C 120.777 3.071 . . . . 18.78 120.777 174.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 29.9 mt -111.56 107.54 16.74 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-O 116.278 -1.82 . . . . 23.82 106.294 176.133 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 79.0 mtm180 -76.11 132.18 74.23 Favored Pre-proline 0 N--CA 1.475 0.815 0 O-C-N 128.468 3.605 . . . . 22.28 112.555 -173.464 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -55.14 -35.73 91.42 Favored 'Trans proline' 0 C--O 1.252 1.212 0 C-N-CA 121.069 1.179 . . . . 25.08 113.633 179.56 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -95.42 -2.03 49.76 Favored 'General case' 0 C--O 1.243 0.752 0 O-C-N 118.752 -2.468 . . . . 26.92 115.454 -177.038 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -128.5 -84.6 0.58 Allowed 'General case' 0 N--CA 1.477 0.908 0 O-C-N 127.548 3.03 . . . . 26.09 107.809 -178.156 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.4 mp0 -51.66 -47.62 63.72 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 125.477 1.511 . . . . 24.23 113.6 -177.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.8 mmtm -64.96 -14.54 60.44 Favored 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 114.752 1.39 . . . . 38.65 114.752 -179.318 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -120.74 -2.94 9.78 Favored 'General case' 0 C--O 1.25 1.094 0 C-N-CA 126.664 1.985 . . . . 32.72 109.874 -175.741 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . 0.259 17.7 t 61.64 40.28 13.5 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 112.041 -2.345 . . . . 27.58 112.529 -176.95 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 57.6 mt -108.98 145.33 35.68 Favored 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 106.849 -1.537 . . . . 26.49 106.849 173.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 61.6 mt-10 -100.45 144.46 29.43 Favored 'General case' 0 C--O 1.257 1.473 0 CA-C-O 115.622 -2.132 . . . . 46.38 110.39 178.345 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -79.13 162.89 25.5 Favored 'General case' 0 N--CA 1.482 1.13 0 O-C-N 128.917 3.886 . . . . 25.45 105.299 174.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' A LYS . . . . . . . . . . . . 0.286 0.0 OUTLIER -70.05 -7.19 39.1 Favored 'General case' 0 C--O 1.247 0.943 0 CA-C-O 114.684 -2.579 . . . . 46.12 115.476 -171.325 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 14' B THR . . . . . . . . . . . . . 73.9 p -136.79 13.65 3.14 Favored 'General case' 0 C--O 1.258 1.516 0 C-N-CA 115.88 -2.328 . . . . 28.2 112.589 176.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' C GLU . . . . . . . . . . . . . 13.6 pt-20 -68.32 -28.59 67.29 Favored 'General case' 0 C--O 1.244 0.8 0 O-C-N 126.245 2.216 . . . . 25.88 109.458 -177.132 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' D ARG . . . . . . . . . . . . . . . -57.68 -30.47 65.49 Favored 'General case' 0 C--O 1.247 0.943 0 CA-C-N 123.091 2.678 . . . . 32.06 111.483 177.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' E GLU . . . . . . . . . . . . . 50.1 tt0 -63.21 -39.79 95.63 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 108.682 -0.858 . . . . 37.69 108.682 -179.499 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' F LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.74 -60.32 3.66 Favored 'General case' 0 C--N 1.312 -1.027 0 O-C-N 120.387 -1.446 . . . . 30.54 110.642 172.863 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 14' G LEU . . . . . 0.466 HD22 ' N ' ' A' ' 14' G LEU . 2.9 mm? -55.27 -36.99 66.7 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-O 122.464 1.126 . . . . 33.16 112.105 -176.604 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 14' H GLU . . . . . . . . . . . . . 73.3 mt-10 -66.66 -21.73 66.1 Favored 'General case' 0 C--N 1.322 -0.608 0 O-C-N 120.758 -1.214 . . . . 45.81 112.897 -179.478 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' I SER . . . . . . . . . . . . . 76.6 p -85.72 -18.36 33.29 Favored 'General case' 0 C--N 1.309 -1.182 0 O-C-N 123.843 0.714 . . . . 32.44 109.777 -178.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' J TYR . . . . . . . . . . . . . 5.4 m-85 . . . . . 0 C--O 1.269 2.089 0 CA-C-O 113.991 -2.909 . . . . 40.34 113.683 -177.407 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 16' ' ' ILE . . . . . . . . . . . . . 51.2 mm . . . . . 0 C--O 1.247 0.945 0 CA-C-O 114.3 -2.762 . . . . 26.41 105.714 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 17' ' ' VAL . . . . . 0.463 ' O ' ' HA2' ' B' ' 188' ' ' GLY . 96.1 t -109.27 129.15 64.53 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.982 0 O-C-N 126.489 2.368 . . . . 28.85 109.035 179.063 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 65.9 31.37 9.34 Favored 'General case' 0 C--O 1.247 0.924 0 O-C-N 126.472 2.357 . . . . 47.95 113.672 179.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -98.59 -158.54 29.72 Favored Glycine 0 CA--C 1.536 1.399 0 O-C-N 126.353 2.283 . . . . 32.94 107.535 178.386 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 19.5 p -150.07 167.56 26.42 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 105.128 -2.175 . . . . 38.73 105.128 178.136 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -64.58 141.5 58.75 Favored 'General case' 0 C--N 1.312 -1.023 0 O-C-N 127.522 3.014 . . . . 37.89 107.364 -175.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' ALA . . . . . 0.455 ' O ' ' HE1' ' B' ' 71' ' ' HIS . . . -77.22 153.78 33.71 Favored 'General case' 0 C--N 1.311 -1.072 1 O-C-N 129.339 4.149 . . . . 27.73 106.579 176.638 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -79.16 148.46 32.3 Favored 'General case' 0 C--O 1.248 0.977 0 O-C-N 127.485 2.99 . . . . 32.74 108.127 170.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 6.8 mm -59.27 137.72 21.32 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.824 0 O-C-N 125.53 1.769 . . . . 29.89 106.809 177.441 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.58 19.59 42.51 Favored Glycine 0 C--N 1.303 -1.258 0 C-N-CA 129.203 3.287 . . . . 24.32 115.149 -176.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' MET . . . . . . . . . . . . . 7.2 ttt -71.23 -22.66 61.97 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 116.786 -1.578 . . . . 29.92 113.772 -179.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 15.5 t -147.55 70.67 11.61 Favored Pre-proline 0 C--N 1.297 -1.676 0 CA-C-O 127.752 3.644 . . . . 24.62 108.086 -174.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -73.11 -6.08 18.32 Favored 'Trans proline' 0 N--CA 1.453 -0.89 0 O-C-N 117.927 -1.67 . . . . 19.7 114.521 -170.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' TRP . . . . . . . . . . . . . 3.4 p90 -94.63 -3.22 49.94 Favored 'General case' 0 N--CA 1.479 0.982 0 O-C-N 124.317 1.01 . . . . 20.13 108.962 175.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' GLN . . . . . . . . . . . . . 45.8 tp60 -69.77 124.83 25.0 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 120.818 -1.176 . . . . 23.34 110.256 -179.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 75.9 t -117.05 147.64 20.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 C-N-CA 126.155 1.782 . . . . 22.45 111.686 179.706 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' MET . . . . . 0.504 ' HG3' HD13 ' B' ' 40' ' ' LEU . 51.4 ttm -108.44 124.03 49.78 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 125.7 1.6 . . . . 28.18 108.671 178.156 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 33' ' ' LEU . . . . . 0.443 ' CD2' HD22 ' B' ' 64' ' ' LEU . 0.6 OUTLIER -90.69 113.37 25.43 Favored 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 103.646 -2.724 . . . . 41.59 103.646 176.984 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 34' ' ' PHE . . . . . . . . . . . . . 38.1 t80 -118.73 129.01 55.03 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 113.484 -1.689 . . . . 32.65 110.527 -171.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' ARG . . . . . 0.646 ' HB2' HD13 ' B' ' 41' ' ' LEU . 68.1 ttt180 -85.86 126.1 33.8 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 111.282 -2.69 . . . . 40.68 108.844 179.466 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 36' ' ' LYS . . . . . 0.6 ' HG2' HD22 ' B' ' 65' ' ' LEU . 42.1 mttt . . . . . 0 CA--C 1.554 1.096 0 N-CA-C 106.283 -1.747 . . . . 44.16 106.283 178.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_endo . . . . . 0 C--O 1.25 1.085 0 N-CA-C 105.466 -2.552 . . . . 44.58 105.466 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 38' ' ' GLN . . . . . 0.54 ' CA ' ' O ' ' B' ' 35' ' ' ARG . . . -95.96 101.67 13.37 Favored 'General case' 0 N--CA 1.495 1.777 1 CA-C-O 110.447 -4.597 . . . . 44.42 100.737 -175.714 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 39' ' ' GLU . . . . . 0.515 ' OE2' ' HD3' ' B' ' 35' ' ' ARG . 8.6 pt-20 -139.73 156.35 46.84 Favored 'General case' 0 C--N 1.315 -0.893 1 O-C-N 129.117 4.011 . . . . 49.75 112.045 -177.253 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 40' ' ' LEU . . . . . 0.504 HD13 ' HG3' ' B' ' 32' ' ' MET . 3.9 tp -73.26 113.74 10.67 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 117.77 -1.11 . . . . 34.09 109.682 177.089 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 41' ' ' LEU . . . . . 0.646 HD13 ' HB2' ' B' ' 35' ' ' ARG . 0.4 OUTLIER -80.04 -49.06 12.32 Favored 'General case' 0 C--O 1.245 0.843 0 C-N-CA 125.902 1.681 . . . . 36.27 112.652 174.107 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 42' ' ' CYS . . . . . . . . . . . . 0.334 12.6 m -176.67 176.03 1.6 Allowed 'General case' 0 N--CA 1.483 1.185 0 O-C-N 116.841 -3.662 . . . . 27.36 108.997 -172.684 -82.754 -160.742 -101.769 103.354 2.055 106.534 -77.348 -79.647 2 2 . 1 . 001 ecloud build full ' B' B ' 43' ' ' GLY . . . . . 0.863 ' HA3' ' O ' ' B' ' 564' ' ' HOH . . . -87.77 -167.32 43.37 Favored Glycine 0 CA--C 1.539 1.574 0 N-CA-C 104.379 -3.488 . . . . 22.68 104.379 171.405 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -175.95 175.15 2.0 Favored 'General case' 0 C--O 1.26 1.636 0 N-CA-C 103.128 -2.915 . . . . 20.04 103.128 179.503 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 54.8 p -140.82 148.34 40.42 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 119.053 -1.059 . . . . 24.05 109.4 179.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' LEU . . . . . 0.596 HD22 ' O ' ' B' ' 48' ' ' SER . 0.0 OUTLIER -94.52 121.03 35.64 Favored 'General case' 0 N--CA 1.479 0.975 0 CA-C-N 113.83 -1.532 . . . . 22.21 107.236 -176.716 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 47' ' ' ILE . . . . . . . . . . . . . 46.4 pt -112.06 -11.34 11.84 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.235 0 O-C-N 125.566 1.791 . . . . 25.97 110.516 -177.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' SER . . . . . 0.596 ' O ' HD22 ' B' ' 46' ' ' LEU . 5.3 p -159.24 -171.32 3.3 Favored 'General case' 0 C--O 1.252 1.206 0 N-CA-C 106.596 -1.631 . . . . 30.8 106.596 173.918 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 30.1 p-10 -76.5 -16.66 59.59 Favored 'General case' 0 C--O 1.25 1.113 0 O-C-N 125.459 1.725 . . . . 43.74 110.706 -178.706 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' ARG . . . . . 0.588 ' NH1' ' O ' ' B' ' 108' ' ' LEU . 0.0 OUTLIER -123.24 0.67 9.01 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 115.485 -2.198 . . . . 48.97 115.059 -177.618 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 51' ' ' TRP . . . . . 0.48 ' HZ2' ' HA3' ' B' ' 246' ' ' GLY . 89.5 m95 -126.92 132.26 50.92 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 122.06 2.209 . . . . 33.14 112.642 -171.22 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 64.2 t -115.03 141.53 31.39 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.157 1 O-C-N 129.875 4.484 . . . . 24.06 109.739 175.21 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 27.2 tp -105.83 138.01 42.74 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-O 114.656 -2.592 . . . . 23.03 108.289 177.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' THR . . . . . . . . . . . . . 5.5 t -150.31 -176.18 5.37 Favored 'General case' 0 C--N 1.316 -0.859 0 O-C-N 125.447 1.717 . . . . 22.91 111.437 174.834 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . -86.52 131.53 34.15 Favored 'General case' 0 C--O 1.25 1.118 0 C-N-CA 126.567 1.947 . . . . 22.32 108.129 177.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -58.89 -31.73 68.87 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-O 124.578 2.132 . . . . 21.93 111.425 -179.017 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' HIS . . . . . . . . . . . . . 10.1 p-80 -71.16 -18.49 62.49 Favored 'General case' 0 C--N 1.313 -1.01 0 O-C-N 119.138 -2.226 . . . . 25.83 111.184 -174.172 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' CYS . . . . . . . . . . . . . 23.3 m -61.6 -29.86 70.31 Favored 'General case' 0 C--O 1.244 0.782 0 CA-C-O 123.181 1.467 . . . . 25.44 109.425 174.694 -79.647 -77.348 -101.769 106.534 2.055 103.354 -160.742 -82.754 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 14.2 mt -102.55 -34.45 9.1 Favored 'General case' 0 C--O 1.247 0.958 0 N-CA-C 115.351 1.611 . . . . 30.36 115.351 -178.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 15.1 tp -141.45 116.7 10.05 Favored 'General case' 0 C--O 1.24 0.6 0 CA-C-N 114.319 -1.31 . . . . 28.65 109.975 -170.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' A TYR . . . . . . . . . . . . . 10.8 t80 -152.52 81.86 5.32 Favored Pre-proline 0 N--CA 1.478 0.953 0 O-C-N 128.117 3.385 . . . . 30.82 107.768 178.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' B PRO . . . . . . . . . . . . 0.335 10.7 Cg_exo -50.7 -40.27 56.2 Favored 'Trans proline' 0 C--O 1.249 1.044 0 O-C-N 127.019 3.115 . . . . 30.69 116.046 -175.972 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 60' C PRO . . . . . . . . . . . . . 16.0 Cg_exo -52.5 -30.58 44.94 Favored 'Trans proline' 0 C--O 1.256 1.413 0 C-N-CA 121.545 1.496 . . . . 33.3 113.903 175.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' D TRP . . . . . . . . . . . . . 52.5 m0 -104.08 8.71 36.53 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 109.657 -0.497 . . . . 36.56 109.657 -177.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' E ASP . . . . . . . . . . . . . 64.9 m-20 59.49 37.61 22.87 Favored 'General case' 0 C--N 1.31 -1.119 0 O-C-N 125.454 1.721 . . . . 45.3 112.354 -177.38 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' F LYS . . . . . . . . . . . . . 32.5 ttmt -103.69 113.01 26.21 Favored 'General case' 0 C--N 1.308 -1.199 0 C-N-CA 125.048 1.339 . . . . 34.59 111.61 177.014 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' G ASN . . . . . 0.468 ' ND2' ' O ' ' B' ' 453' ' ' HOH . 45.3 t30 -144.04 75.32 1.46 Allowed 'General case' 0 C--O 1.248 1.025 0 C-N-CA 125.36 1.464 . . . . 43.49 108.545 176.879 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 60' H PHE . . . . . . . . . . . . . 50.6 m-85 -74.29 143.44 45.0 Favored 'General case' 0 C--N 1.317 -0.808 0 O-C-N 124.447 1.092 . . . . 38.56 111.151 179.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' I THR . . . . . . . . . . . . . 0.9 OUTLIER -109.14 165.54 11.52 Favored 'General case' 0 C--N 1.314 -0.969 0 C-N-CA 131.49 3.916 . . . . 47.23 112.706 -179.786 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 30.3 mp0 -53.91 -45.5 71.18 Favored 'General case' 0 C--O 1.25 1.087 0 CA-C-O 123.615 1.674 . . . . 47.2 112.766 -177.522 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' ASN . . . . . 0.454 ' O ' ' HE3' ' B' ' 36' ' ' LYS 0.27 . . -76.12 -4.73 43.17 Favored 'General case' 0 C--O 1.246 0.905 0 N-CA-C 115.132 1.53 . . . . 39.58 115.132 -175.11 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -86.83 -21.64 26.31 Favored 'General case' 0 C--O 1.247 0.956 0 O-C-N 118.947 -2.345 . . . . 46.29 113.509 179.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' LEU . . . . . 0.443 HD22 ' CD2' ' B' ' 33' ' ' LEU . 0.5 OUTLIER -116.1 163.26 16.21 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 116.228 1.936 . . . . 43.31 116.228 -171.929 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 65' ' ' LEU . . . . . 0.6 HD22 ' HG2' ' B' ' 36' ' ' LYS . 0.0 OUTLIER -136.55 140.68 43.11 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 109.464 -3.516 . . . . 33.92 105.229 173.445 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -102.51 129.1 54.58 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.443 1 O-C-N 130.228 4.705 . . . . 33.08 108.808 172.363 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 67' ' ' ARG . . . . . . . . . . . . . 65.4 mtp180 -118.92 120.38 37.13 Favored 'General case' 0 C--N 1.309 -1.182 0 C-N-CA 125.2 1.4 . . . . 28.3 110.138 179.647 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' ILE . . . . . . . . . . . . . 1.5 mt -119.15 144.65 26.88 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 N-CA-C 116.357 1.984 . . . . 27.52 116.357 -177.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 87.93 12.5 66.04 Favored Glycine 0 CA--C 1.526 0.773 0 CA-C-N 120.921 1.691 . . . . 24.12 113.076 179.161 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' LYS . . . . . 0.454 ' HE3' ' O ' ' B' ' 72' ' ' SER . 19.8 mtpp -77.41 156.5 31.12 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-O 123.974 1.845 . . . . 27.39 112.415 -178.096 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 71' ' ' HIS . . . . . 0.747 ' CD2' HG22 ' B' ' 154' ' ' VAL . 82.8 t60 -131.44 -53.42 1.02 Allowed 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 111.158 -2.747 . . . . 26.75 108.028 177.358 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 72' ' ' SER . . . . . 0.84 ' OG ' ' HG2' ' B' ' 75' ' ' ARG . 5.8 t -78.81 141.04 38.07 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 113.034 -1.894 . . . . 31.28 107.505 -179.463 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 68.8 ttp85 -65.63 -46.57 78.75 Favored 'General case' 0 C--O 1.258 1.51 0 N-CA-C 114.476 1.288 . . . . 34.92 114.476 176.105 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' THR . . . . . 0.768 ' O ' ' O ' ' B' ' 450' ' ' HOH . 77.3 p -106.83 -21.9 12.88 Favored 'General case' 0 C--O 1.246 0.893 1 N-CA-C 123.022 4.453 . . . . 32.46 123.022 -176.011 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 75' ' ' ARG . . . . . 1.074 ' HA ' ' NH1' ' B' ' 75' ' ' ARG . 0.0 OUTLIER -74.54 150.13 39.9 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 107.55 -1.278 . . . . 50.15 107.55 -178.855 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 50.6 t80 -88.59 109.75 20.34 Favored 'General case' 0 C--O 1.257 1.49 0 N-CA-C 101.514 -3.513 . . . . 40.62 101.514 171.352 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -86.55 76.64 9.54 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.91 0.884 . . . . 31.78 110.679 -169.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' A ARG . . . . . 0.815 ' O ' ' O ' ' B' ' 499' ' ' HOH . 8.4 ttp85 -46.01 125.61 6.55 Favored 'General case' 0 C--O 1.245 0.851 0 C-N-CA 129.733 3.213 . . . . 34.36 110.017 -177.449 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 78' ' ' ASN . . . . . 0.601 ' HB2' ' O ' ' B' ' 77' A ARG . 15.3 m-20 77.72 -4.71 2.22 Favored 'General case' 0 C--O 1.252 1.189 0 O-C-N 126.327 2.267 . . . . 35.93 114.314 -179.604 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 54.4 mt -114.65 -59.69 3.11 Favored 'Isoleucine or valine' 0 C--O 1.257 1.485 0 O-C-N 119.869 -1.769 . . . . 31.56 111.307 -177.236 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' GLU . . . . . 0.692 ' O ' ' HD3' ' B' ' 81' ' ' LYS . 9.2 pt-20 -82.47 155.76 24.44 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-O 125.117 2.389 . . . . 29.92 111.996 -179.727 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 81' ' ' LYS . . . . . 0.692 ' HD3' ' O ' ' B' ' 80' ' ' GLU . 1.8 mmtt -124.81 133.9 52.95 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 113.289 -1.778 . . . . 45.13 106.376 175.729 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 3.4 mt -110.78 118.2 56.72 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.966 0 CA-C-O 113.917 -2.944 . . . . 35.51 108.79 -176.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -114.11 164.75 13.43 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 122.287 2.312 . . . . 36.31 108.931 -178.832 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 84' ' ' MET . . . . . 0.426 ' O ' ' HB2' ' B' ' 109' ' ' LYS . . . -103.67 146.49 28.51 Favored 'General case' 0 C--O 1.249 1.067 0 N-CA-C 102.325 -3.213 . . . . 39.19 102.325 178.497 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 85' ' ' LEU . . . . . 0.614 HD13 ' HE2' ' B' ' 106' ' ' MET . 50.5 mt -85.63 141.3 29.89 Favored 'General case' 0 N--CA 1.473 0.675 0 O-C-N 126.671 2.482 . . . . 36.73 109.471 179.563 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 86' ' ' GLU . . . . . 0.689 ' HB3' ' HG3' ' B' ' 107' ' ' LYS . 52.5 tt0 -91.9 -37.15 13.06 Favored 'General case' 0 C--N 1.314 -0.952 0 O-C-N 125.673 1.858 . . . . 49.21 111.731 172.043 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 87' ' ' LYS . . . . . 0.478 ' HB3' ' CE1' ' B' ' 89' ' ' TYR . 1.2 tmtt? -162.89 145.07 10.38 Favored 'General case' 0 C--O 1.244 0.766 0 O-C-N 119.744 -1.847 . . . . 48.94 111.411 -173.953 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 88' ' ' ILE . . . . . . . . . . . . . 35.4 mt -114.21 137.08 48.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-O 123.431 1.586 . . . . 36.35 108.272 177.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' TYR . . . . . 0.478 ' CE1' ' HB3' ' B' ' 87' ' ' LYS . 14.9 m-85 -125.17 118.29 25.76 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 113.011 -1.904 . . . . 47.11 109.876 175.786 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 1.1 mm -103.17 141.3 19.29 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 O-C-N 126.483 2.364 . . . . 28.78 109.424 175.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' HIS . . . . . 0.541 ' ND1' ' HD2' ' B' ' 92' ' ' PRO . 44.7 t-80 -57.03 125.35 69.78 Favored Pre-proline 0 C--O 1.253 1.24 0 CA-C-N 119.609 1.095 . . . . 29.94 109.445 176.085 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 92' ' ' PRO . . . . . 0.541 ' HD2' ' ND1' ' B' ' 91' ' ' HIS . 6.2 Cg_endo -55.13 -25.91 48.09 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 122.347 2.032 . . . . 32.53 111.132 -176.821 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 93' ' ' ARG . . . . . . . . . . . . . 66.5 mtp180 -109.51 22.24 16.01 Favored 'General case' 0 C--O 1.251 1.142 0 O-C-N 125.288 1.617 . . . . 40.95 113.591 -179.053 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -54.19 130.55 38.85 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 115.908 -1.996 . . . . 24.98 106.743 176.41 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' ASN . . . . . . . . . . . . . 51.3 t-20 -105.98 89.16 2.99 Favored 'General case' 0 N--CA 1.488 1.455 0 CA-C-N 121.761 2.073 . . . . 29.04 114.181 177.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' TRP . . . . . . . . . . . . . 51.2 p-90 -81.91 -16.33 50.94 Favored 'General case' 0 C--O 1.256 1.396 0 C-N-CA 124.263 1.025 . . . . 29.48 112.422 -179.727 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 29.2 mtt-85 -76.37 -21.66 55.8 Favored 'General case' 0 C--O 1.248 0.997 0 O-C-N 125.886 1.992 . . . . 37.74 112.597 178.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' A GLU . . . . . 0.53 ' OE2' ' HD3' ' B' ' 175' ' ' ARG . 47.3 tt0 -134.88 -64.99 0.64 Allowed 'General case' 0 C--O 1.25 1.091 0 C-N-CA 114.073 -3.051 . . . . 42.66 114.28 -177.428 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 98' ' ' ASN . . . . . . . . . . . . . 33.3 p-10 -127.32 11.06 6.87 Favored 'General case' 0 C--O 1.242 0.707 0 CA-C-O 112.804 -3.474 . . . . 26.73 115.521 -172.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 17.2 mt 62.32 35.02 15.41 Favored 'General case' 0 C--N 1.305 -1.352 0 O-C-N 126.735 2.522 . . . . 28.16 111.469 -176.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -68.11 131.21 45.02 Favored 'General case' 0 C--O 1.248 1.005 0 N-CA-C 106.493 -1.669 . . . . 25.09 106.493 177.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 54.8 mtt85 68.06 45.81 1.26 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 127.011 2.694 . . . . 41.41 111.714 -177.682 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' ASP . . . . . 0.488 ' OD2' ' OG ' ' B' ' 214' ' ' SER . 46.3 t0 -77.97 77.56 4.48 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 125.511 1.524 . . . . 18.53 109.477 -176.985 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 15.4 tt -154.05 142.9 13.74 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 O-C-N 125.426 1.704 . . . . 23.93 109.965 -171.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -147.53 156.54 42.93 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 126.53 2.394 . . . . 23.47 106.971 177.412 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 31.1 mt -116.68 139.07 50.95 Favored 'General case' 0 C--O 1.251 1.148 0 O-C-N 127.25 2.844 . . . . 28.77 108.013 173.064 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 106' ' ' MET . . . . . 0.614 ' HE2' HD13 ' B' ' 85' ' ' LEU . 22.8 mtp -122.42 119.95 32.52 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 106.95 -1.5 . . . . 37.12 106.95 176.09 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 107' ' ' LYS . . . . . 0.689 ' HG3' ' HB3' ' B' ' 86' ' ' GLU . 0.4 OUTLIER -95.86 123.63 39.52 Favored 'General case' 0 N--CA 1.476 0.846 0 O-C-N 125.245 1.591 . . . . 43.76 109.174 178.082 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 108' ' ' LEU . . . . . 0.588 ' O ' ' NH1' ' B' ' 50' ' ' ARG . 66.1 mt -69.38 148.0 50.25 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 126.719 2.512 . . . . 33.96 110.461 -177.981 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 109' ' ' LYS . . . . . 0.669 ' HB3' ' O ' ' B' ' 572' ' ' HOH . 2.2 tptm -60.61 -27.45 67.76 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 113.008 -1.906 . . . . 45.3 109.871 178.487 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 110' ' ' LYS . . . . . 0.401 ' N ' ' O ' ' B' ' 572' ' ' HOH . . . -157.44 141.28 11.47 Favored Pre-proline 0 C--N 1.321 -0.668 0 C-N-CA 125.882 1.673 . . . . 40.45 110.502 178.875 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 111' ' ' PRO . . . . . 0.574 ' HD3' ' HE ' ' B' ' 50' ' ' ARG . 5.8 Cg_exo -54.52 137.03 72.15 Favored 'Trans proline' 0 C--N 1.317 -1.083 0 O-C-N 125.291 2.206 . . . . 38.8 107.913 177.376 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 14.4 p -89.61 163.96 2.27 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 N-CA-C 105.444 -2.058 . . . . 38.22 105.444 177.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 113' ' ' ALA . . . . . . . . . . . . . . . -108.61 132.85 53.47 Favored 'General case' 0 C--N 1.32 -0.688 0 O-C-N 126.121 2.138 . . . . 35.01 107.023 -179.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 15.8 m-30 -66.82 158.83 29.46 Favored 'General case' 0 C--N 1.312 -1.055 0 O-C-N 127.25 2.844 . . . . 29.6 109.589 178.536 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 1.9 p -166.75 -176.7 3.59 Favored 'General case' 0 C--O 1.254 1.332 0 N-CA-C 101.875 -3.38 . . . . 26.64 101.875 -176.086 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 116' ' ' ASP . . . . . . . . . . . . . 63.5 m-20 -61.55 -22.14 64.9 Favored 'General case' 0 C--O 1.25 1.096 0 O-C-N 128.962 3.914 . . . . 34.17 110.568 179.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 117' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -112.23 -8.83 13.95 Favored 'General case' 0 C--O 1.257 1.453 0 N-CA-C 117.604 2.446 . . . . 30.05 117.604 -171.206 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 118' ' ' ILE . . . . . . . . . . . . . 27.4 mt -126.85 109.81 21.68 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 C-N-CA 130.052 3.341 . . . . 23.79 110.324 -177.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 119' ' ' HIS . . . . . . . . . . . . . 27.7 t60 -154.63 142.29 13.94 Favored Pre-proline 0 N--CA 1.486 1.373 0 CA-C-O 116.727 -1.606 . . . . 28.15 107.803 179.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 120' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -80.25 152.09 20.83 Favored 'Trans proline' 0 C--O 1.253 1.242 0 CA-C-O 125.38 2.158 . . . . 22.54 113.448 -178.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 121' ' ' VAL . . . . . . . . . . . . . 11.7 p -90.57 161.14 2.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 N-CA-C 104.325 -2.472 . . . . 19.77 104.325 176.91 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 122' ' ' CYS . . . . . . . . . . . . . 69.9 m -86.73 157.14 19.69 Favored 'General case' 0 C--O 1.243 0.723 0 O-C-N 120.843 -1.161 . . . . 21.58 110.026 173.509 -58.42 -60.122 96.556 102.307 2.024 106.747 72.811 76.466 1 1 . 1 . 001 ecloud build full ' B' B ' 123' ' ' LEU . . . . . 0.535 HD12 ' O ' ' B' ' 503' ' ' HOH . 80.4 mt -100.37 136.93 19.89 Favored Pre-proline 0 N--CA 1.481 1.105 0 N-CA-C 105.178 -2.156 . . . . 25.48 105.178 170.774 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 124' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -68.45 154.09 72.55 Favored 'Trans proline' 0 N--CA 1.455 -0.771 0 O-C-N 125.024 2.065 . . . . 28.99 111.772 -175.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 125' ' ' ASP . . . . . . . . . . . . . 15.4 p-10 -103.29 158.58 16.23 Favored 'General case' 0 C--O 1.254 1.324 0 N-CA-C 103.157 -2.905 . . . . 49.63 103.157 171.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 126' ' ' ARG . . . . . 0.492 ' O ' ' CG ' ' B' ' 126' ' ' ARG . . . -48.22 -39.23 20.56 Favored 'General case' 0 C--O 1.242 0.669 0 O-C-N 125.054 1.471 . . . . 40.28 114.074 -178.481 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 127' ' ' GLU . . . . . . . . . . . . . . . -76.67 -31.98 57.64 Favored 'General case' 0 C--O 1.253 1.269 0 O-C-N 124.321 1.013 . . . . 34.17 112.65 -177.262 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 18.7 m -67.51 -45.72 74.98 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 116.807 -1.957 . . . . 32.94 105.789 176.067 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 129' ' ' ALA . . . . . 0.453 ' HA ' ' HE1' ' B' ' 210' ' ' MET . . . -57.27 -46.7 82.82 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 125.395 1.478 . . . . 28.75 110.921 178.689 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 129' A ALA . . . . . . . . . . . . . . . -57.59 -48.95 77.98 Favored 'General case' 0 C--O 1.249 1.041 0 O-C-N 125.778 1.924 . . . . 31.9 111.626 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 129' B SER . . . . . . . . . . . . . 0.1 OUTLIER -81.33 -21.99 38.81 Favored 'General case' 0 C--O 1.243 0.713 0 CA-C-O 113.656 -3.069 . . . . 36.08 116.454 -177.39 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 129' C LEU . . . . . . . . . . . . . 15.9 mt -96.56 -35.45 11.08 Favored 'General case' 0 C--N 1.313 -0.982 0 O-C-N 126.639 2.462 . . . . 34.19 113.225 -175.205 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 130' ' ' LEU . . . . . 0.592 ' CD2' ' CD1' ' B' ' 162' ' ' ILE . 0.4 OUTLIER -77.54 76.08 4.08 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-O 123.155 1.455 . . . . 34.89 109.352 -176.956 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -129.39 141.36 51.07 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 116.848 -1.548 . . . . 49.7 110.561 -177.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -57.86 134.49 56.35 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 118.614 0.643 . . . . 31.14 109.632 -179.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 94.28 -25.49 22.13 Favored Glycine 0 N--CA 1.468 0.802 0 C-N-CA 119.405 -1.378 . . . . 26.5 114.504 179.577 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 134' ' ' TYR . . . . . . . . . . . . . 3.8 m-30 -72.65 140.35 47.89 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 104.116 -2.55 . . . . 30.0 104.116 175.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 80.0 mttt -97.35 144.3 27.25 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 128.406 3.566 . . . . 25.92 112.68 179.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 136' ' ' GLY . . . . . 0.466 ' HA3' ' CZ ' ' B' ' 199' ' ' PHE . . . -121.14 177.53 16.38 Favored Glycine 0 CA--C 1.538 1.524 0 C-N-CA 128.291 2.853 . . . . 20.49 107.539 174.322 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 41.9 ttm180 -129.93 134.75 47.68 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-O 115.113 -2.375 . . . . 22.13 105.464 -172.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 138' ' ' VAL . . . . . . . . . . . . . 4.3 t -118.38 147.09 22.08 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 O-C-N 128.858 3.849 . . . . 24.21 107.601 174.908 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 139' ' ' THR . . . . . . . . . . . . . 23.3 p -135.94 148.65 48.6 Favored 'General case' 0 C--N 1.315 -0.921 0 O-C-N 124.618 1.199 . . . . 20.95 111.84 179.391 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 140' ' ' GLY . . . . . . . . . . . . . . . 174.8 175.55 42.39 Favored Glycine 0 CA--C 1.54 1.642 0 C-N-CA 117.564 -2.255 . . . . 20.15 109.233 175.475 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 141' ' ' TRP . . . . . . . . . . . . 0.251 4.6 m-90 -111.87 12.71 20.88 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-N 110.231 -2.984 . . . . 29.65 112.392 -177.311 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 142' ' ' GLY . . . . . . . . . . . . . . . -73.01 -176.87 31.78 Favored Glycine 0 CA--C 1.529 0.944 0 O-C-N 125.211 1.569 . . . . 30.5 109.406 -174.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 143' ' ' ASN . . . . . . . . . . . . . 64.9 m-20 -52.02 146.99 7.81 Favored 'General case' 0 C--O 1.244 0.814 0 CA-C-N 111.757 -2.221 . . . . 40.14 110.023 178.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 144' ' ' LEU . . . . . 0.493 ' H ' ' C ' ' B' ' 147' ' ' THR . 70.9 mt -91.68 -43.16 9.75 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 108.617 -3.901 . . . . 30.57 108.983 176.969 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 145' ' ' LYS . . . . . 0.539 ' HB2' ' N ' ' B' ' 147' ' ' THR 0.302 0.7 OUTLIER -121.98 153.48 38.48 Favored 'General case' 1 C--N 0.683 -28.404 3 O-C-N 104.817 -11.177 . . . . 48.8 111.958 177.751 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . 0.421 6.9 mt-10 -38.5 36.85 0.0 OUTLIER 'General case' 1 CA--C 1.668 5.509 2 N-CA-C 97.262 -5.088 . . . . 42.01 97.262 170.1 . . . . . . . . 4 2 . 1 . 001 ecloud build full ' B' B ' 147' ' ' THR . . . . . 0.539 ' N ' ' HB2' ' B' ' 145' ' ' LYS . . . . . . . . 2 N--CA 1.569 5.508 0 O-C-N 117.467 -3.271 . . . . 43.55 113.473 178.894 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 151' ' ' GLN . . . . . 0.824 ' NE2' ' O ' ' B' ' 557' ' ' HOH . 8.6 mt-30 . . . . . 0 C--O 1.246 0.893 0 N-CA-C 106.023 -1.843 . . . . 52.44 106.023 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 152' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' B' ' 151' ' ' GLN . 23.7 Cg_endo -74.12 164.51 34.16 Favored 'Trans proline' 0 C--O 1.247 0.951 0 O-C-N 126.367 2.772 . . . . 35.65 108.444 -174.241 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 62.4 p -92.03 -29.12 16.76 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 116.609 -2.036 . . . . 33.64 108.113 175.141 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 154' ' ' VAL . . . . . 0.747 HG22 ' CD2' ' B' ' 71' ' ' HIS 0.348 0.4 OUTLIER -127.12 166.58 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 CA-C-N 113.813 -1.539 . . . . 29.17 111.051 -179.051 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 155' ' ' LEU . . . . . . . . . . . . . 12.5 tp -52.68 134.57 35.99 Favored 'General case' 0 C--O 1.246 0.911 0 C-N-CA 124.016 0.926 . . . . 24.77 111.551 176.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 156' ' ' GLN . . . . . . . . . . . . . 67.6 mm-40 -107.71 157.03 18.44 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 106.704 -1.591 . . . . 30.16 106.704 -179.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 157' ' ' VAL . . . . . . . . . . . . . 7.3 p -135.6 146.73 29.34 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.394 0 CA-C-O 115.269 -2.3 . . . . 27.55 107.058 -178.119 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 158' ' ' VAL . . . . . . . . . . . . . 14.2 p -150.25 139.16 15.14 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.282 0 N-CA-C 105.283 -2.118 . . . . 24.31 105.283 170.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 159' ' ' ASN . . . . . . . . . . . . . 63.7 m-20 -96.04 126.62 41.4 Favored 'General case' 0 C--N 1.293 -1.849 0 C-N-CA 130.876 3.671 . . . . 25.97 107.934 175.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 160' ' ' LEU . . . . . . . . . . . . . 33.0 mt -137.86 143.46 40.12 Favored Pre-proline 0 C--N 1.303 -1.43 0 C-N-CA 125.337 1.455 . . . . 27.59 111.53 -174.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 161' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -85.36 138.67 6.57 Favored 'Trans proline' 0 C--O 1.245 0.853 0 O-C-N 125.298 2.209 . . . . 26.98 113.852 -179.023 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 162' ' ' ILE . . . . . 0.592 ' CD1' ' CD2' ' B' ' 130' ' ' LEU . 7.9 mt -70.56 136.02 26.87 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.987 0 N-CA-C 106.286 -1.746 . . . . 25.91 106.286 174.8 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 163' ' ' VAL . . . . . . . . . . . . 0.321 0.5 OUTLIER -108.87 145.78 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 CA-C-O 124.54 2.114 . . . . 28.04 110.414 179.63 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 164' ' ' GLU . . . . . 0.628 ' CD ' ' H ' ' B' ' 164' ' ' GLU . 3.2 mp0 -51.89 135.31 30.4 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 131.585 3.954 . . . . 45.97 109.384 179.462 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 165' ' ' ARG . . . . . 0.624 ' NH2' ' O ' ' B' ' 177' ' ' THR . 35.3 mtp85 -50.01 -46.86 81.91 Favored Pre-proline 0 C--N 1.308 -1.217 0 C-N-CA 128.21 2.604 . . . . 37.71 116.058 -175.71 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 166' ' ' PRO . . . . . 0.504 ' HD2' ' N ' ' B' ' 165' ' ' ARG . 6.6 Cg_exo -55.03 -44.28 51.19 Favored 'Trans proline' 0 C--N 1.318 -1.032 0 C-N-CA 124.892 3.728 . . . . 29.9 113.331 177.24 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 167' ' ' VAL . . . . . . . . . . . . . 96.2 t -62.14 -45.31 99.04 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 N-CA-C 107.095 -1.446 . . . . 28.64 107.095 178.025 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 168' ' ' CYS . . . . . . . . . . . . . 72.1 m -55.96 -54.31 46.36 Favored 'General case' 0 C--O 1.261 1.68 0 O-C-N 120.842 -1.161 . . . . 26.99 110.543 176.918 -62.817 -70.706 -85.489 103.952 2.028 107.181 -83.402 90.685 1 1 . 1 . 001 ecloud build full ' B' B ' 169' ' ' LYS . . . . . 0.555 ' HD3' ' O ' ' B' ' 165' ' ' ARG . 1.8 mptp? -56.24 -47.27 78.83 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 123.571 1.653 . . . . 49.92 111.433 -175.733 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -74.01 -1.87 21.76 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-O 115.669 -2.11 . . . . 27.31 115.871 -177.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 71.6 p -95.78 -10.66 28.51 Favored 'General case' 0 C--N 1.313 -1.004 0 O-C-N 124.537 1.148 . . . . 25.86 108.934 -177.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 172' ' ' THR . . . . . . . . . . . . . 9.1 t -141.81 168.24 20.23 Favored 'General case' 0 C--O 1.246 0.901 0 C-N-CA 117.79 -1.564 . . . . 26.77 111.366 -174.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 13.1 mtp85 -93.72 -17.68 22.93 Favored 'General case' 0 C--N 1.321 -0.663 0 O-C-N 126.851 2.594 . . . . 45.1 107.65 175.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 174' ' ' ILE . . . . . . . . . . . . . 6.6 mm -70.2 145.98 12.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.899 0 N-CA-C 108.25 -1.019 . . . . 27.61 108.25 -178.189 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 175' ' ' ARG . . . . . 0.6 ' O ' ' HG2' ' B' ' 175' ' ' ARG . 0.4 OUTLIER -97.22 132.09 43.32 Favored 'General case' 1 C--N 1.549 9.267 2 C-N-CA 96.053 -10.259 . . . . 35.29 109.496 -179.839 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' B' B ' 176' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -78.32 143.93 11.98 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 O-C-N 127.315 2.884 . . . . 32.0 111.436 -176.712 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 177' ' ' THR . . . . . 0.624 ' O ' ' NH2' ' B' ' 165' ' ' ARG . 13.5 p -120.99 164.36 16.86 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-N 114.462 -1.244 . . . . 24.38 110.405 179.187 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 178' ' ' ASP . . . . . 0.73 ' HB3' HH11 ' B' ' 233' ' ' ARG . 94.7 m-20 -59.26 -22.39 61.05 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 112.677 -2.056 . . . . 32.39 109.178 177.889 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 179' ' ' ASN . . . . . . . . . . . . . 48.5 m-20 -82.24 17.48 1.66 Allowed 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 116.89 -1.529 . . . . 26.46 113.125 176.401 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 180' ' ' MET . . . . . . . . . . . . . 64.7 mtt -138.86 156.31 47.4 Favored 'General case' 0 C--N 1.313 -1.02 1 CA-C-O 111.454 -4.117 . . . . 21.9 107.649 -177.543 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 181' ' ' PHE . . . . . . . . . . . . 0.262 47.0 p90 -141.0 161.91 36.73 Favored 'General case' 0 C--N 1.297 -1.678 1 O-C-N 130.766 5.041 . . . . 22.39 101.372 169.872 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' B' B ' 182' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -125.31 156.45 38.63 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 105.654 -1.98 . . . . 25.64 105.654 177.627 90.685 -83.402 -85.489 107.181 2.028 103.952 -70.706 -62.817 2 2 . 1 . 001 ecloud build full ' B' B ' 183' ' ' ALA . . . . . . . . . . . . . . . -147.16 150.14 34.36 Favored 'General case' 0 C--N 1.315 -0.896 0 O-C-N 126.28 2.238 . . . . 22.73 112.356 -179.57 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 184' ' ' GLY . . . . . . . . . . . . . . . 150.15 166.48 13.47 Favored Glycine 0 C--O 1.244 0.768 0 C-N-CA 125.938 1.732 . . . . 24.54 110.252 -178.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 184' A TYR . . . . . . . . . . . . . 65.8 m-85 -81.88 150.69 27.65 Favored 'General case' 0 C--O 1.253 1.244 0 N-CA-C 105.731 -1.951 . . . . 29.35 105.731 175.71 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 22.4 mttp -87.32 151.7 51.49 Favored Pre-proline 0 C--O 1.256 1.404 0 CA-C-O 117.154 -1.403 . . . . 40.18 108.073 174.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 186' ' ' PRO . . . . . . . . . . . . . 8.7 Cg_exo -46.21 -33.82 12.57 Favored 'Trans proline' 0 C--O 1.243 0.747 0 C-N-CA 122.595 2.197 . . . . 36.91 115.957 -174.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 186' A ASP . . . . . . . . . . . . . . . -68.69 -29.44 67.89 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 111.888 -2.414 . . . . 43.93 111.92 178.078 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 186' B GLU . . . . . . . . . . . . . 69.1 mt-10 -66.68 -16.78 64.46 Favored 'General case' 0 C--O 1.258 1.522 0 N-CA-C 118.479 2.77 . . . . 49.56 118.479 -172.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 186' C GLY . . . . . . . . . . . . . . . 53.34 34.2 47.87 Favored Glycine 0 C--O 1.253 1.307 0 CA-C-O 126.217 3.121 . . . . 48.42 116.286 176.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 186' D LYS . . . . . . . . . . . . . 17.2 mttm -144.92 133.5 22.07 Favored 'General case' 0 C--N 1.313 -0.998 1 N-CA-C 99.782 -4.155 . . . . 48.82 99.782 173.913 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 187' ' ' ARG . . . . . 0.545 ' NE ' ' OD2' ' B' ' 221' ' ' ASP . 23.8 mtp85 -110.48 -176.93 3.1 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 127.162 2.789 . . . . 37.74 110.923 179.118 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 188' ' ' GLY . . . . . 0.463 ' HA2' ' O ' ' B' ' 17' ' ' VAL . . . 136.43 150.02 5.79 Favored Glycine 0 C--N 1.313 -0.743 0 CA-C-N 113.437 -1.71 . . . . 25.69 111.205 173.526 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 189' ' ' ASP . . . . . 0.423 ' HB2' ' O ' ' B' ' 188' ' ' GLY . 46.9 t0 -175.57 162.82 2.84 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 107.101 -1.444 . . . . 27.66 107.101 179.562 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -80.34 172.45 13.75 Favored 'General case' 0 C--O 1.256 1.406 0 N-CA-C 101.487 -3.523 . . . . 23.99 101.487 173.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 191' ' ' CYS . . . . . . . . . . . . . 11.2 t -151.69 -172.35 4.19 Favored 'General case' 0 C--O 1.253 1.288 0 N-CA-C 104.967 -2.234 . . . . 28.1 104.967 179.256 -164.719 58.563 73.734 105.195 2.055 107.705 -174.342 -51.096 1 1 . 1 . 001 ecloud build full ' B' B ' 192' ' ' GLU . . . . . . . . . . . . . . . -55.36 144.55 24.88 Favored 'General case' 0 C--O 1.237 0.397 0 O-C-N 127.101 2.751 . . . . 25.16 108.176 -178.674 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 86.01 -9.4 69.43 Favored Glycine 0 C--O 1.247 0.965 0 CA-C-O 115.303 -2.943 . . . . 25.01 114.974 178.1 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 194' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -89.39 -17.69 28.31 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 119.044 1.422 . . . . 23.86 113.957 177.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 195' ' ' SER . . . . . 1.332 ' OG ' ' C3 ' ' B' ' 248' ' ' 0KV . 51.0 m -48.69 146.45 3.11 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 125.822 1.649 . . . . 27.2 109.519 -174.835 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 196' ' ' GLY . . . . . . . . . . . . . . . 82.4 -14.23 35.94 Favored Glycine 0 N--CA 1.468 0.811 0 O-C-N 127.551 3.032 . . . . 22.34 111.185 177.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -70.98 167.54 51.27 Favored Glycine 0 C--N 1.299 -1.494 0 CA-C-N 120.716 2.258 . . . . 19.97 109.01 178.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 198' ' ' PRO . . . . . 0.41 ' HB2' HG13 ' B' ' 200' ' ' VAL . 9.3 Cg_endo -85.78 140.85 7.2 Favored 'Trans proline' 0 C--O 1.248 1.013 0 N-CA-C 118.862 2.601 . . . . 21.18 118.862 -179.113 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 199' ' ' PHE . . . . . 0.466 ' CZ ' ' HA3' ' B' ' 136' ' ' GLY . 6.4 t80 -108.59 112.54 24.95 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 100.294 -3.965 . . . . 21.03 100.294 170.49 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 200' ' ' VAL . . . . . 0.41 HG13 ' HB2' ' B' ' 198' ' ' PRO . 31.5 m -120.33 154.81 23.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 CA-C-N 120.493 1.497 . . . . 18.95 108.308 -169.948 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 201' ' ' MET . . . . . . . . . . . . . 73.6 mtp -133.11 152.84 51.93 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 116.466 -2.094 . . . . 24.09 106.379 174.178 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 202' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -101.14 114.28 28.09 Favored 'General case' 0 C--N 1.302 -1.498 0 CA-C-O 115.688 -2.101 . . . . 26.57 108.421 179.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 12.5 t -62.37 135.32 95.22 Favored Pre-proline 0 C--O 1.25 1.129 0 CA-C-O 125.665 2.65 . . . . 23.85 112.554 178.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 204' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_endo -83.53 -3.43 10.71 Favored 'Trans proline' 0 C--O 1.246 0.917 0 CA-C-O 116.109 -1.705 . . . . 29.77 110.118 179.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 204' A PHE . . . . . . . . . . . . . 24.3 m-85 -94.07 -41.15 9.69 Favored 'General case' 0 C--O 1.248 0.998 0 O-C-N 124.623 1.202 . . . . 34.44 111.697 -176.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 204' B ASN . . . . . . . . . . . . . 40.3 p30 -125.17 8.1 7.91 Favored 'General case' 0 C--O 1.241 0.62 0 O-C-N 126.281 2.238 . . . . 27.36 114.485 -176.564 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . 0.358 75.7 m-80 52.83 30.4 9.02 Favored 'General case' 0 C--N 1.312 -1.058 0 C-N-CA 128.231 2.612 . . . . 43.49 115.572 -179.097 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 206' ' ' ARG . . . . . . . . . . . . . 71.9 mtt-85 -98.77 155.02 17.57 Favored 'General case' 0 C--N 1.318 -0.765 0 C-N-CA 126.379 1.872 . . . . 34.69 111.325 177.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 207' ' ' TRP . . . . . . . . . . . . . 82.8 m95 -97.86 128.45 44.48 Favored 'General case' 0 N--CA 1.486 1.326 0 CA-C-O 114.957 -2.449 . . . . 20.29 106.844 179.31 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 53.1 m-85 -115.12 139.23 50.07 Favored 'General case' 0 C--N 1.307 -1.251 0 O-C-N 128.643 3.715 . . . . 22.07 112.063 177.188 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 209' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -90.31 106.86 18.78 Favored 'General case' 0 C--N 1.315 -0.908 0 O-C-N 124.888 1.367 . . . . 22.08 107.647 176.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 210' ' ' MET . . . . . 0.453 ' HE1' ' HA ' ' B' ' 129' ' ' ALA . 74.5 mmm -90.19 -34.68 15.73 Favored 'General case' 0 C--O 1.249 1.061 0 N-CA-C 113.113 0.783 . . . . 32.01 113.113 -179.524 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 211' ' ' GLY . . . . . 0.421 ' HA2' ' O ' ' B' ' 229' ' ' THR . . . -134.52 164.63 24.61 Favored Glycine 0 N--CA 1.47 0.915 0 N-CA-C 116.805 1.482 . . . . 20.33 116.805 -177.1 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 212' ' ' ILE . . . . . . . . . . . . . 90.7 mt -121.25 129.95 75.13 Favored 'Isoleucine or valine' 0 C--O 1.249 1.056 0 CA-C-O 116.129 -1.891 . . . . 20.42 106.418 176.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 85.0 t -52.66 117.19 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.293 0 O-C-N 125.03 1.456 . . . . 20.56 109.197 174.542 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 214' ' ' SER . . . . . 0.488 ' OG ' ' OD2' ' B' ' 102' ' ' ASP . 5.8 t -115.42 -66.84 1.04 Allowed 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 117.189 2.292 . . . . 23.71 117.189 -177.183 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 215' ' ' TRP . . . . . 0.545 ' CE3' ' H9 ' ' B' ' 248' ' ' 0KV . 62.6 p-90 -155.62 170.83 21.08 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 123.604 1.669 . . . . 25.58 110.697 -175.225 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 216' ' ' GLY . . . . . . . . . . . . . . . -179.33 -172.26 43.32 Favored Glycine 0 N--CA 1.478 1.496 0 N-CA-C 107.292 -2.323 . . . . 23.43 107.292 179.141 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 217' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -132.08 99.06 4.6 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 115.86 -2.336 . . . . 36.15 108.826 -179.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 219' ' ' GLY . . . . . . . . . . . . . . . 81.73 -174.5 54.06 Favored Glycine 0 N--CA 1.494 2.559 0 N-CA-C 105.051 -3.22 . . . . 27.77 105.051 -172.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 220' ' ' CYS . . . . . . . . . . . . . 34.6 m -128.94 130.93 47.4 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 116.301 -1.809 . . . . 32.61 107.878 -177.845 -51.096 -174.342 73.734 107.705 2.055 105.195 58.563 -164.719 1 1 . 1 . 001 ecloud build full ' B' B ' 221' ' ' ASP . . . . . 0.545 ' OD2' ' NE ' ' B' ' 187' ' ' ARG . 20.2 t0 53.92 41.35 32.07 Favored 'General case' 0 C--O 1.253 1.243 0 O-C-N 125.663 1.852 . . . . 32.09 113.414 174.753 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 221' A ARG . . . . . . . . . . . . . 16.6 mmt85 -81.3 141.37 34.12 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-O 114.242 -2.79 . . . . 48.16 109.544 177.119 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 222' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -68.48 141.82 55.48 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 106.535 -1.654 . . . . 45.76 106.535 176.382 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 223' ' ' GLY . . . . . . . . . . . . . . . 73.61 9.41 78.39 Favored Glycine 0 C--O 1.247 0.959 0 O-C-N 126.848 2.592 . . . . 34.04 112.265 178.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 224' ' ' LYS . . . . . . . . . . . . . 8.8 mttt -121.71 165.79 15.27 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 107.197 -1.408 . . . . 36.81 107.197 178.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 225' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -146.73 152.07 38.22 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 123.339 1.542 . . . . 27.11 111.032 -170.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 226' ' ' GLY . . . . . . . . . . . . . . . -87.37 152.08 24.01 Favored Glycine 0 CA--C 1.545 1.928 0 N-CA-C 104.302 -3.519 . . . . 21.57 104.302 -179.472 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 227' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -119.44 140.26 50.72 Favored 'General case' 0 C--N 1.303 -1.419 1 O-C-N 130.871 4.513 . . . . 22.21 108.099 -178.222 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 228' ' ' TYR . . . . . . . . . . . . 0.27 90.3 m-85 -128.72 148.88 50.87 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-O 113.323 -3.227 . . . . 22.17 112.625 -175.995 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 229' ' ' THR . . . . . 0.421 ' O ' ' HA2' ' B' ' 211' ' ' GLY . 4.3 m -69.22 142.52 54.21 Favored 'General case' 0 C--O 1.251 1.138 0 O-C-N 126.676 2.485 . . . . 21.79 108.961 171.297 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 230' ' ' HIS . . . . . 0.448 ' ND1' ' HG3' ' B' ' 233' ' ' ARG . 32.9 t-80 -88.09 94.08 9.69 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 125.744 1.618 . . . . 27.59 109.684 179.955 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 231' ' ' VAL . . . . . . . . . . . . . 41.9 t -57.25 -51.03 74.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 113.193 -1.821 . . . . 22.1 111.898 -171.509 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 232' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -54.45 -45.59 73.13 Favored 'General case' 0 C--O 1.251 1.132 0 CA-C-N 118.922 0.783 . . . . 33.36 112.274 -179.04 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 233' ' ' ARG . . . . . 0.73 HH11 ' HB3' ' B' ' 178' ' ' ASP . 5.8 mtp180 -60.01 -22.69 62.93 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 119.907 -1.746 . . . . 49.6 111.053 -179.855 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 234' ' ' LEU . . . . . . . . . . . . . 38.3 mt -107.64 7.29 28.49 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 114.244 1.201 . . . . 31.51 114.244 -178.026 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 235' ' ' LYS . . . . . 0.496 ' HE2' ' NE2' ' B' ' 239' ' ' GLN . 17.5 tttt -59.56 -35.48 74.32 Favored 'General case' 0 C--N 1.304 -1.393 0 C-N-CA 127.459 2.304 . . . . 41.8 115.252 -175.229 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 236' ' ' LYS . . . . . 1.154 ' H ' ' HE3' ' B' ' 236' ' ' LYS . 0.0 OUTLIER -53.3 -55.29 25.84 Favored 'General case' 0 C--O 1.25 1.096 0 CA-C-N 113.205 -1.816 . . . . 45.31 107.597 174.278 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 237' ' ' TRP . . . . . 0.568 ' H ' ' HG2' ' B' ' 236' ' ' LYS . 64.8 t90 -60.47 -39.37 87.38 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 125.14 1.525 . . . . 29.42 110.426 178.837 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 238' ' ' ILE . . . . . . . . . . . . . 97.2 mt -58.59 -53.21 50.11 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.096 0 O-C-N 124.063 0.852 . . . . 30.81 110.265 178.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 239' ' ' GLN . . . . . 0.87 ' C ' ' CA ' ' B' ' 240' ' ' LYS . 60.2 mt-30 . . . . . 0 C--N 1.317 -0.843 0 CA-C-O 124.409 2.052 . . . . 47.71 112.353 179.483 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 240' ' ' LYS . . . . . 0.87 ' CA ' ' C ' ' B' ' 239' ' ' GLN . . . . . . . . 0 C--O 1.251 1.138 0 CA-C-O 116.931 -1.509 . . . . 37.58 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 241' ' ' VAL . . . . . . . . . . . . 0.345 0.4 OUTLIER -69.83 -47.66 68.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 C-N-CA 117.56 -1.656 . . . . 36.94 114.324 -176.761 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 242' ' ' ILE . . . . . 0.677 ' O ' ' N ' ' B' ' 246' ' ' GLY . 63.2 mt -56.59 -48.62 80.21 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.277 0 CA-C-O 123.322 1.534 . . . . 40.7 108.495 -176.847 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 243' ' ' ASP . . . . . . . . . . . . . . . -62.08 -55.65 26.84 Favored 'General case' 0 C--N 1.316 -0.876 0 C-N-CA 126.058 1.743 . . . . 44.86 111.09 179.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 244' ' ' GLN . . . . . . . . . . . . . . . -71.71 9.87 0.79 Allowed 'General case' 0 C--O 1.244 0.771 0 CA-C-O 114.389 -2.72 . . . . 49.26 109.318 -178.079 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 245' ' ' PHE . . . . . . . . . . . . . . . -171.43 4.86 0.01 OUTLIER 'General case' 0 C--O 1.257 1.488 0 C-N-CA 114.969 -2.692 . . . . 52.0 117.467 -175.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 246' ' ' GLY . . . . . 0.677 ' N ' ' O ' ' B' ' 242' ' ' ILE . . . . . . . . 0 C--O 1.267 2.202 0 CA-C-O 113.54 -3.922 . . . . 57.5 118.324 -177.245 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 56' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 . . . . . 0 C--O 1.242 0.663 0 CA-C-O 116.512 -1.709 . . . . 48.05 112.167 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 57' ' ' GLU . . . . . 0.693 ' CB ' HH12 ' B' ' 75' ' ' ARG . 29.3 tt0 -68.09 129.82 41.06 Favored 'General case' 0 C--O 1.248 1.003 0 O-C-N 126.158 2.161 . . . . 44.85 105.94 173.028 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 58' ' ' GLU . . . . . . . . . . . . . . . -53.24 156.07 2.44 Favored 'General case' 0 C--O 1.25 1.131 0 C-N-CA 124.706 1.202 . . . . 44.37 108.414 -174.636 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 59' ' ' ILE . . . . . 0.688 HG23 ' O ' ' C' ' 537' ' ' HOH . 1.7 pp -114.46 157.36 42.85 Favored Pre-proline 0 C--O 1.244 0.768 0 O-C-N 125.967 2.042 . . . . 46.97 108.272 179.084 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 60' ' ' PRO . . . . . 0.892 ' HG2' ' HE2' ' C' ' 63' ' ' TYS . 12.1 Cg_exo -44.48 138.52 7.57 Favored 'Trans proline' 0 C--O 1.249 1.069 0 O-C-N 127.135 3.176 . . . . 48.92 111.206 176.491 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 61' ' ' GLU . . . . . . . . . . . . . . . -70.87 -25.04 62.62 Favored 'General case' 0 C--O 1.247 0.952 0 CA-C-N 112.002 -2.363 . . . . 48.09 112.918 -176.286 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 62' ' ' GLU . . . . . . . . . . . . . . . -64.42 -26.17 68.33 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 112.838 -1.983 . . . . 52.88 106.997 179.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 63' ' ' TYS . . . . . 0.892 ' HE2' ' HG2' ' C' ' 60' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 1' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 2' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 248' ' ' 0KV . . . . . 1.332 ' C3 ' ' OG ' ' B' ' 195' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 431' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 553' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 579' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 592' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 426' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 428' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 432' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 436' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 439' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 440' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 441' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 442' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 443' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 444' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 446' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 447' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 448' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 449' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 450' ' ' HOH . . . . . 0.768 ' O ' ' O ' ' B' ' 74' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 453' ' ' HOH . . . . . 0.468 ' O ' ' ND2' ' B' ' 60' G ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 455' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 458' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 459' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 460' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 462' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 463' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 465' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 469' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 471' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 472' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 473' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 476' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 477' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 481' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 485' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 486' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 488' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 489' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 490' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 491' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 492' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 493' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 494' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 495' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 496' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 497' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 498' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 499' ' ' HOH . . . . . 0.815 ' O ' ' O ' ' B' ' 77' A ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 500' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 503' ' ' HOH . . . . . 0.535 ' O ' HD12 ' B' ' 123' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 536' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 538' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 539' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 541' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 545' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 546' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 547' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 548' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 549' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 551' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 554' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 555' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 557' ' ' HOH . . . . . 0.824 ' O ' ' NE2' ' B' ' 151' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 562' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 563' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 564' ' ' HOH . . . . . 0.863 ' O ' ' HA3' ' B' ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 568' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 570' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 572' ' ' HOH . . . . . 0.669 ' O ' ' HB3' ' B' ' 109' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 574' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 575' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 577' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 580' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 581' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 582' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 583' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 585' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 586' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 588' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 590' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 591' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 593' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 595' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 596' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 457' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 537' ' ' HOH . . . . . 0.688 ' O ' HG23 ' C' ' 59' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 556' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 565' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' B ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.868 0 CA-C-O 124.786 2.231 . . . . 36.87 106.971 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' A ASP . . . . . . . . . . . . . 18.0 t0 -100.54 9.96 41.84 Favored 'General case' 0 C--O 1.25 1.125 0 CA-C-N 110.153 -3.203 . . . . 47.09 108.278 174.235 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 13.7 p -53.56 143.03 20.9 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 124.434 2.064 . . . . 25.92 111.779 -178.814 76.466 72.811 96.556 106.747 2.024 102.307 -60.122 -58.42 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 63.83 11.91 45.71 Favored Glycine 0 C--O 1.253 1.324 0 N-CA-C 120.777 3.071 . . . . 18.78 120.777 174.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 29.9 mt -111.56 107.54 16.74 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-O 116.278 -1.82 . . . . 23.82 106.294 176.133 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 79.0 mtm180 -76.11 132.18 74.23 Favored Pre-proline 0 N--CA 1.475 0.815 0 O-C-N 128.468 3.605 . . . . 22.28 112.555 -173.464 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -55.14 -35.73 91.42 Favored 'Trans proline' 0 C--O 1.252 1.212 0 C-N-CA 121.069 1.179 . . . . 25.08 113.633 179.56 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -95.42 -2.03 49.76 Favored 'General case' 0 C--O 1.243 0.752 0 O-C-N 118.752 -2.468 . . . . 26.92 115.454 -177.038 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -128.5 -84.6 0.58 Allowed 'General case' 0 N--CA 1.477 0.908 0 O-C-N 127.548 3.03 . . . . 26.09 107.809 -178.156 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.4 mp0 -51.66 -47.62 63.72 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 125.477 1.511 . . . . 24.23 113.6 -177.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.8 mmtm -64.96 -14.54 60.44 Favored 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 114.752 1.39 . . . . 38.65 114.752 -179.318 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -120.74 -2.94 9.78 Favored 'General case' 0 C--O 1.25 1.094 0 C-N-CA 126.664 1.985 . . . . 32.72 109.874 -175.741 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . 0.259 17.7 t 61.64 40.28 13.5 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 112.041 -2.345 . . . . 27.58 112.529 -176.95 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 57.6 mt -108.98 145.33 35.68 Favored 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 106.849 -1.537 . . . . 26.49 106.849 173.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 61.6 mt-10 -100.45 144.46 29.43 Favored 'General case' 0 C--O 1.257 1.473 0 CA-C-O 115.622 -2.132 . . . . 46.38 110.39 178.345 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -79.13 162.89 25.5 Favored 'General case' 0 N--CA 1.482 1.13 0 O-C-N 128.917 3.886 . . . . 25.45 105.299 174.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' A LYS . . . . . . . . . . . . 0.286 0.0 OUTLIER -70.05 -7.19 39.1 Favored 'General case' 0 C--O 1.247 0.943 0 CA-C-O 114.684 -2.579 . . . . 46.12 115.476 -171.325 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 14' B THR . . . . . . . . . . . . . 73.9 p -136.79 13.65 3.14 Favored 'General case' 0 C--O 1.258 1.516 0 C-N-CA 115.88 -2.328 . . . . 28.2 112.589 176.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' C GLU . . . . . . . . . . . . . 13.6 pt-20 -68.32 -28.59 67.29 Favored 'General case' 0 C--O 1.244 0.8 0 O-C-N 126.245 2.216 . . . . 25.88 109.458 -177.132 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' D ARG . . . . . . . . . . . . . . . -57.68 -30.47 65.49 Favored 'General case' 0 C--O 1.247 0.943 0 CA-C-N 123.091 2.678 . . . . 32.06 111.483 177.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' E GLU . . . . . . . . . . . . . 50.1 tt0 -63.21 -39.79 95.63 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 108.682 -0.858 . . . . 37.69 108.682 -179.499 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' F LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.74 -60.32 3.66 Favored 'General case' 0 C--N 1.312 -1.027 0 O-C-N 120.387 -1.446 . . . . 30.54 110.642 172.863 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' G LEU . . . . . 0.466 HD22 ' N ' ' A' ' 14' G LEU . 2.9 mm? -55.27 -36.99 66.7 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-O 122.464 1.126 . . . . 33.16 112.105 -176.604 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' H GLU . . . . . . . . . . . . . 73.3 mt-10 -66.66 -21.73 66.1 Favored 'General case' 0 C--N 1.322 -0.608 0 O-C-N 120.758 -1.214 . . . . 45.81 112.897 -179.478 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' I SER . . . . . . . . . . . . . 76.6 p -85.72 -18.36 33.29 Favored 'General case' 0 C--N 1.309 -1.182 0 O-C-N 123.843 0.714 . . . . 32.44 109.777 -178.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' J TYR . . . . . . . . . . . . . 5.4 m-85 . . . . . 0 C--O 1.269 2.089 0 CA-C-O 113.991 -2.909 . . . . 40.34 113.683 -177.407 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' ILE . . . . . . . . . . . . . 51.2 mm . . . . . 0 C--O 1.247 0.945 0 CA-C-O 114.3 -2.762 . . . . 26.41 105.714 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.463 ' O ' ' HA2' ' B' ' 188' ' ' GLY . 96.1 t -109.27 129.15 64.53 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.982 0 O-C-N 126.489 2.368 . . . . 28.85 109.035 179.063 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 65.9 31.37 9.34 Favored 'General case' 0 C--O 1.247 0.924 0 O-C-N 126.472 2.357 . . . . 47.95 113.672 179.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -98.59 -158.54 29.72 Favored Glycine 0 CA--C 1.536 1.399 0 O-C-N 126.353 2.283 . . . . 32.94 107.535 178.386 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 19.5 p -150.07 167.56 26.42 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 105.128 -2.175 . . . . 38.73 105.128 178.136 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -64.58 141.5 58.75 Favored 'General case' 0 C--N 1.312 -1.023 0 O-C-N 127.522 3.014 . . . . 37.89 107.364 -175.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' ALA . . . . . 0.455 ' O ' ' HE1' ' B' ' 71' ' ' HIS . . . -77.22 153.78 33.71 Favored 'General case' 0 C--N 1.311 -1.072 1 O-C-N 129.339 4.149 . . . . 27.73 106.579 176.638 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -79.16 148.46 32.3 Favored 'General case' 0 C--O 1.248 0.977 0 O-C-N 127.485 2.99 . . . . 32.74 108.127 170.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 6.8 mm -59.27 137.72 21.32 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.824 0 O-C-N 125.53 1.769 . . . . 29.89 106.809 177.441 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.58 19.59 42.51 Favored Glycine 0 C--N 1.303 -1.258 0 C-N-CA 129.203 3.287 . . . . 24.32 115.149 -176.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' MET . . . . . . . . . . . . . 7.2 ttt -71.23 -22.66 61.97 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 116.786 -1.578 . . . . 29.92 113.772 -179.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 15.5 t -147.55 70.67 11.61 Favored Pre-proline 0 C--N 1.297 -1.676 0 CA-C-O 127.752 3.644 . . . . 24.62 108.086 -174.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -73.11 -6.08 18.32 Favored 'Trans proline' 0 N--CA 1.453 -0.89 0 O-C-N 117.927 -1.67 . . . . 19.7 114.521 -170.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' TRP . . . . . . . . . . . . . 3.4 p90 -94.63 -3.22 49.94 Favored 'General case' 0 N--CA 1.479 0.982 0 O-C-N 124.317 1.01 . . . . 20.13 108.962 175.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' GLN . . . . . . . . . . . . . 45.8 tp60 -69.77 124.83 25.0 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 120.818 -1.176 . . . . 23.34 110.256 -179.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 75.9 t -117.05 147.64 20.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 C-N-CA 126.155 1.782 . . . . 22.45 111.686 179.706 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' MET . . . . . 0.504 ' HG3' HD13 ' B' ' 40' ' ' LEU . 51.4 ttm -108.44 124.03 49.78 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 125.7 1.6 . . . . 28.18 108.671 178.156 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.443 ' CD2' HD22 ' B' ' 64' ' ' LEU . 0.6 OUTLIER -90.69 113.37 25.43 Favored 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 103.646 -2.724 . . . . 41.59 103.646 176.984 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' PHE . . . . . . . . . . . . . 38.1 t80 -118.73 129.01 55.03 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 113.484 -1.689 . . . . 32.65 110.527 -171.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' ARG . . . . . 0.646 ' HB2' HD13 ' B' ' 41' ' ' LEU . 68.1 ttt180 -85.86 126.1 33.8 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 111.282 -2.69 . . . . 40.68 108.844 179.466 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' LYS . . . . . 0.6 ' HG2' HD22 ' B' ' 65' ' ' LEU . 42.1 mttt . . . . . 0 CA--C 1.554 1.096 0 N-CA-C 106.283 -1.747 . . . . 44.16 106.283 178.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_endo . . . . . 0 C--O 1.25 1.085 0 N-CA-C 105.466 -2.552 . . . . 44.58 105.466 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' GLN . . . . . 0.54 ' CA ' ' O ' ' B' ' 35' ' ' ARG . . . -95.96 101.67 13.37 Favored 'General case' 0 N--CA 1.495 1.777 1 CA-C-O 110.447 -4.597 . . . . 44.42 100.737 -175.714 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.515 ' OE2' ' HD3' ' B' ' 35' ' ' ARG . 8.6 pt-20 -139.73 156.35 46.84 Favored 'General case' 0 C--N 1.315 -0.893 1 O-C-N 129.117 4.011 . . . . 49.75 112.045 -177.253 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.504 HD13 ' HG3' ' B' ' 32' ' ' MET . 3.9 tp -73.26 113.74 10.67 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 117.77 -1.11 . . . . 34.09 109.682 177.089 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' LEU . . . . . 0.646 HD13 ' HB2' ' B' ' 35' ' ' ARG . 0.4 OUTLIER -80.04 -49.06 12.32 Favored 'General case' 0 C--O 1.245 0.843 0 C-N-CA 125.902 1.681 . . . . 36.27 112.652 174.107 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' CYS . . . . . . . . . . . . 0.334 12.6 m -176.67 176.03 1.6 Allowed 'General case' 0 N--CA 1.483 1.185 0 O-C-N 116.841 -3.662 . . . . 27.36 108.997 -172.684 -82.754 -160.742 -101.769 103.354 2.055 106.534 -77.348 -79.647 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' GLY . . . . . 0.863 ' HA3' ' O ' ' B' ' 564' ' ' HOH . . . -87.77 -167.32 43.37 Favored Glycine 0 CA--C 1.539 1.574 0 N-CA-C 104.379 -3.488 . . . . 22.68 104.379 171.405 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -175.95 175.15 2.0 Favored 'General case' 0 C--O 1.26 1.636 0 N-CA-C 103.128 -2.915 . . . . 20.04 103.128 179.503 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 54.8 p -140.82 148.34 40.42 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 119.053 -1.059 . . . . 24.05 109.4 179.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' LEU . . . . . 0.596 HD22 ' O ' ' B' ' 48' ' ' SER . 0.0 OUTLIER -94.52 121.03 35.64 Favored 'General case' 0 N--CA 1.479 0.975 0 CA-C-N 113.83 -1.532 . . . . 22.21 107.236 -176.716 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' ILE . . . . . . . . . . . . . 46.4 pt -112.06 -11.34 11.84 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.235 0 O-C-N 125.566 1.791 . . . . 25.97 110.516 -177.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' SER . . . . . 0.596 ' O ' HD22 ' B' ' 46' ' ' LEU . 5.3 p -159.24 -171.32 3.3 Favored 'General case' 0 C--O 1.252 1.206 0 N-CA-C 106.596 -1.631 . . . . 30.8 106.596 173.918 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 30.1 p-10 -76.5 -16.66 59.59 Favored 'General case' 0 C--O 1.25 1.113 0 O-C-N 125.459 1.725 . . . . 43.74 110.706 -178.706 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' ARG . . . . . 0.588 ' NH1' ' O ' ' B' ' 108' ' ' LEU . 0.0 OUTLIER -123.24 0.67 9.01 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 115.485 -2.198 . . . . 48.97 115.059 -177.618 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' TRP . . . . . 0.48 ' HZ2' ' HA3' ' B' ' 246' ' ' GLY . 89.5 m95 -126.92 132.26 50.92 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 122.06 2.209 . . . . 33.14 112.642 -171.22 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 64.2 t -115.03 141.53 31.39 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.157 1 O-C-N 129.875 4.484 . . . . 24.06 109.739 175.21 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 27.2 tp -105.83 138.01 42.74 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-O 114.656 -2.592 . . . . 23.03 108.289 177.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' THR . . . . . . . . . . . . . 5.5 t -150.31 -176.18 5.37 Favored 'General case' 0 C--N 1.316 -0.859 0 O-C-N 125.447 1.717 . . . . 22.91 111.437 174.834 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . -86.52 131.53 34.15 Favored 'General case' 0 C--O 1.25 1.118 0 C-N-CA 126.567 1.947 . . . . 22.32 108.129 177.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -58.89 -31.73 68.87 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-O 124.578 2.132 . . . . 21.93 111.425 -179.017 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' HIS . . . . . . . . . . . . . 10.1 p-80 -71.16 -18.49 62.49 Favored 'General case' 0 C--N 1.313 -1.01 0 O-C-N 119.138 -2.226 . . . . 25.83 111.184 -174.172 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' CYS . . . . . . . . . . . . . 23.3 m -61.6 -29.86 70.31 Favored 'General case' 0 C--O 1.244 0.782 0 CA-C-O 123.181 1.467 . . . . 25.44 109.425 174.694 -79.647 -77.348 -101.769 106.534 2.055 103.354 -160.742 -82.754 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 14.2 mt -102.55 -34.45 9.1 Favored 'General case' 0 C--O 1.247 0.958 0 N-CA-C 115.351 1.611 . . . . 30.36 115.351 -178.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 15.1 tp -141.45 116.7 10.05 Favored 'General case' 0 C--O 1.24 0.6 0 CA-C-N 114.319 -1.31 . . . . 28.65 109.975 -170.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' A TYR . . . . . . . . . . . . . 10.8 t80 -152.52 81.86 5.32 Favored Pre-proline 0 N--CA 1.478 0.953 0 O-C-N 128.117 3.385 . . . . 30.82 107.768 178.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' B PRO . . . . . . . . . . . . 0.335 10.7 Cg_exo -50.7 -40.27 56.2 Favored 'Trans proline' 0 C--O 1.249 1.044 0 O-C-N 127.019 3.115 . . . . 30.69 116.046 -175.972 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 60' C PRO . . . . . . . . . . . . . 16.0 Cg_exo -52.5 -30.58 44.94 Favored 'Trans proline' 0 C--O 1.256 1.413 0 C-N-CA 121.545 1.496 . . . . 33.3 113.903 175.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' D TRP . . . . . . . . . . . . . 52.5 m0 -104.08 8.71 36.53 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 109.657 -0.497 . . . . 36.56 109.657 -177.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' E ASP . . . . . . . . . . . . . 64.9 m-20 59.49 37.61 22.87 Favored 'General case' 0 C--N 1.31 -1.119 0 O-C-N 125.454 1.721 . . . . 45.3 112.354 -177.38 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' F LYS . . . . . . . . . . . . . 32.5 ttmt -103.69 113.01 26.21 Favored 'General case' 0 C--N 1.308 -1.199 0 C-N-CA 125.048 1.339 . . . . 34.59 111.61 177.014 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' G ASN . . . . . 0.468 ' ND2' ' O ' ' B' ' 453' ' ' HOH . 45.3 t30 -144.04 75.32 1.46 Allowed 'General case' 0 C--O 1.248 1.025 0 C-N-CA 125.36 1.464 . . . . 43.49 108.545 176.879 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 60' H PHE . . . . . . . . . . . . . 50.6 m-85 -74.29 143.44 45.0 Favored 'General case' 0 C--N 1.317 -0.808 0 O-C-N 124.447 1.092 . . . . 38.56 111.151 179.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' I THR . . . . . . . . . . . . . 0.9 OUTLIER -109.14 165.54 11.52 Favored 'General case' 0 C--N 1.314 -0.969 0 C-N-CA 131.49 3.916 . . . . 47.23 112.706 -179.786 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 30.3 mp0 -53.91 -45.5 71.18 Favored 'General case' 0 C--O 1.25 1.087 0 CA-C-O 123.615 1.674 . . . . 47.2 112.766 -177.522 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' ASN . . . . . 0.454 ' O ' ' HE3' ' B' ' 36' ' ' LYS 0.27 . . -76.12 -4.73 43.17 Favored 'General case' 0 C--O 1.246 0.905 0 N-CA-C 115.132 1.53 . . . . 39.58 115.132 -175.11 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -86.83 -21.64 26.31 Favored 'General case' 0 C--O 1.247 0.956 0 O-C-N 118.947 -2.345 . . . . 46.29 113.509 179.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' LEU . . . . . 0.443 HD22 ' CD2' ' B' ' 33' ' ' LEU . 0.5 OUTLIER -116.1 163.26 16.21 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 116.228 1.936 . . . . 43.31 116.228 -171.929 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.6 HD22 ' HG2' ' B' ' 36' ' ' LYS . 0.0 OUTLIER -136.55 140.68 43.11 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 109.464 -3.516 . . . . 33.92 105.229 173.445 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -102.51 129.1 54.58 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.443 1 O-C-N 130.228 4.705 . . . . 33.08 108.808 172.363 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' ARG . . . . . . . . . . . . . 65.4 mtp180 -118.92 120.38 37.13 Favored 'General case' 0 C--N 1.309 -1.182 0 C-N-CA 125.2 1.4 . . . . 28.3 110.138 179.647 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' ILE . . . . . . . . . . . . . 1.5 mt -119.15 144.65 26.88 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 N-CA-C 116.357 1.984 . . . . 27.52 116.357 -177.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 87.93 12.5 66.04 Favored Glycine 0 CA--C 1.526 0.773 0 CA-C-N 120.921 1.691 . . . . 24.12 113.076 179.161 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' LYS . . . . . 0.454 ' HE3' ' O ' ' B' ' 72' ' ' SER . 19.8 mtpp -77.41 156.5 31.12 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-O 123.974 1.845 . . . . 27.39 112.415 -178.096 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' HIS . . . . . 0.747 ' CD2' HG22 ' B' ' 154' ' ' VAL . 82.8 t60 -131.44 -53.42 1.02 Allowed 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 111.158 -2.747 . . . . 26.75 108.028 177.358 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' SER . . . . . 0.84 ' OG ' ' HG2' ' B' ' 75' ' ' ARG . 5.8 t -78.81 141.04 38.07 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 113.034 -1.894 . . . . 31.28 107.505 -179.463 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 68.8 ttp85 -65.63 -46.57 78.75 Favored 'General case' 0 C--O 1.258 1.51 0 N-CA-C 114.476 1.288 . . . . 34.92 114.476 176.105 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' THR . . . . . 0.768 ' O ' ' O ' ' B' ' 450' ' ' HOH . 77.3 p -106.83 -21.9 12.88 Favored 'General case' 0 C--O 1.246 0.893 1 N-CA-C 123.022 4.453 . . . . 32.46 123.022 -176.011 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' ARG . . . . . 1.074 ' HA ' ' NH1' ' B' ' 75' ' ' ARG . 0.0 OUTLIER -74.54 150.13 39.9 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 107.55 -1.278 . . . . 50.15 107.55 -178.855 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 50.6 t80 -88.59 109.75 20.34 Favored 'General case' 0 C--O 1.257 1.49 0 N-CA-C 101.514 -3.513 . . . . 40.62 101.514 171.352 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -86.55 76.64 9.54 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.91 0.884 . . . . 31.78 110.679 -169.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' A ARG . . . . . 0.815 ' O ' ' O ' ' B' ' 499' ' ' HOH . 8.4 ttp85 -46.01 125.61 6.55 Favored 'General case' 0 C--O 1.245 0.851 0 C-N-CA 129.733 3.213 . . . . 34.36 110.017 -177.449 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' ASN . . . . . 0.601 ' HB2' ' O ' ' B' ' 77' A ARG . 1.6 m120 77.72 -4.71 2.22 Favored 'General case' 0 C--O 1.252 1.189 0 O-C-N 126.327 2.267 . . . . 35.93 114.314 -179.604 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 54.4 mt -114.65 -59.69 3.11 Favored 'Isoleucine or valine' 0 C--O 1.257 1.485 0 O-C-N 119.869 -1.769 . . . . 31.56 111.307 -177.236 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' GLU . . . . . 0.692 ' O ' ' HD3' ' B' ' 81' ' ' LYS . 9.2 pt-20 -82.47 155.76 24.44 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-O 125.117 2.389 . . . . 29.92 111.996 -179.727 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' LYS . . . . . 0.692 ' HD3' ' O ' ' B' ' 80' ' ' GLU . 1.8 mmtt -124.81 133.9 52.95 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 113.289 -1.778 . . . . 45.13 106.376 175.729 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 3.4 mt -110.78 118.2 56.72 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.966 0 CA-C-O 113.917 -2.944 . . . . 35.51 108.79 -176.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -114.11 164.75 13.43 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 122.287 2.312 . . . . 36.31 108.931 -178.832 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' MET . . . . . 0.426 ' O ' ' HB2' ' B' ' 109' ' ' LYS . . . -103.67 146.49 28.51 Favored 'General case' 0 C--O 1.249 1.067 0 N-CA-C 102.325 -3.213 . . . . 39.19 102.325 178.497 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' LEU . . . . . 0.614 HD13 ' HE2' ' B' ' 106' ' ' MET . 50.5 mt -85.63 141.3 29.89 Favored 'General case' 0 N--CA 1.473 0.675 0 O-C-N 126.671 2.482 . . . . 36.73 109.471 179.563 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' GLU . . . . . 0.689 ' HB3' ' HG3' ' B' ' 107' ' ' LYS . 52.5 tt0 -91.9 -37.15 13.06 Favored 'General case' 0 C--N 1.314 -0.952 0 O-C-N 125.673 1.858 . . . . 49.21 111.731 172.043 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.478 ' HB3' ' CE1' ' B' ' 89' ' ' TYR . 1.2 tmtt? -162.89 145.07 10.38 Favored 'General case' 0 C--O 1.244 0.766 0 O-C-N 119.744 -1.847 . . . . 48.94 111.411 -173.953 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' ILE . . . . . . . . . . . . . 35.4 mt -114.21 137.08 48.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-O 123.431 1.586 . . . . 36.35 108.272 177.068 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' TYR . . . . . 0.478 ' CE1' ' HB3' ' B' ' 87' ' ' LYS . 14.9 m-85 -125.17 118.29 25.76 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 113.011 -1.904 . . . . 47.11 109.876 175.786 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 1.1 mm -103.17 141.3 19.29 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 O-C-N 126.483 2.364 . . . . 28.78 109.424 175.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' HIS . . . . . 0.541 ' ND1' ' HD2' ' B' ' 92' ' ' PRO . 44.7 t-80 -57.03 125.35 69.78 Favored Pre-proline 0 C--O 1.253 1.24 0 CA-C-N 119.609 1.095 . . . . 29.94 109.445 176.085 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' PRO . . . . . 0.541 ' HD2' ' ND1' ' B' ' 91' ' ' HIS . 6.2 Cg_endo -55.13 -25.91 48.09 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 122.347 2.032 . . . . 32.53 111.132 -176.821 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' ARG . . . . . . . . . . . . . 66.5 mtp180 -109.51 22.24 16.01 Favored 'General case' 0 C--O 1.251 1.142 0 O-C-N 125.288 1.617 . . . . 40.95 113.591 -179.053 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -54.19 130.55 38.85 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 115.908 -1.996 . . . . 24.98 106.743 176.41 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' ASN . . . . . . . . . . . . . 51.3 t-20 -105.98 89.16 2.99 Favored 'General case' 0 N--CA 1.488 1.455 0 CA-C-N 121.761 2.073 . . . . 29.04 114.181 177.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' TRP . . . . . . . . . . . . . 51.2 p-90 -81.91 -16.33 50.94 Favored 'General case' 0 C--O 1.256 1.396 0 C-N-CA 124.263 1.025 . . . . 29.48 112.422 -179.727 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 29.2 mtt-85 -76.37 -21.66 55.8 Favored 'General case' 0 C--O 1.248 0.997 0 O-C-N 125.886 1.992 . . . . 37.74 112.597 178.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' A GLU . . . . . 0.53 ' OE2' ' HD3' ' B' ' 175' ' ' ARG . 47.3 tt0 -134.88 -64.99 0.64 Allowed 'General case' 0 C--O 1.25 1.091 0 C-N-CA 114.073 -3.051 . . . . 42.66 114.28 -177.428 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' ASN . . . . . . . . . . . . . 33.3 p-10 -127.32 11.06 6.87 Favored 'General case' 0 C--O 1.242 0.707 0 CA-C-O 112.804 -3.474 . . . . 26.73 115.521 -172.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 17.2 mt 62.32 35.02 15.41 Favored 'General case' 0 C--N 1.305 -1.352 0 O-C-N 126.735 2.522 . . . . 28.16 111.469 -176.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -68.11 131.21 45.02 Favored 'General case' 0 C--O 1.248 1.005 0 N-CA-C 106.493 -1.669 . . . . 25.09 106.493 177.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 54.8 mtt85 68.06 45.81 1.26 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 127.011 2.694 . . . . 41.41 111.714 -177.682 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' ASP . . . . . 0.488 ' OD2' ' OG ' ' B' ' 214' ' ' SER . 46.3 t0 -77.97 77.56 4.48 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 125.511 1.524 . . . . 18.53 109.477 -176.985 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 15.4 tt -154.05 142.9 13.74 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 O-C-N 125.426 1.704 . . . . 23.93 109.965 -171.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -147.53 156.54 42.93 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 126.53 2.394 . . . . 23.47 106.971 177.412 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 31.1 mt -116.68 139.07 50.95 Favored 'General case' 0 C--O 1.251 1.148 0 O-C-N 127.25 2.844 . . . . 28.77 108.013 173.064 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' MET . . . . . 0.614 ' HE2' HD13 ' B' ' 85' ' ' LEU . 22.8 mtp -122.42 119.95 32.52 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 106.95 -1.5 . . . . 37.12 106.95 176.09 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' LYS . . . . . 0.689 ' HG3' ' HB3' ' B' ' 86' ' ' GLU . 0.4 OUTLIER -95.86 123.63 39.52 Favored 'General case' 0 N--CA 1.476 0.846 0 O-C-N 125.245 1.591 . . . . 43.76 109.174 178.082 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' LEU . . . . . 0.588 ' O ' ' NH1' ' B' ' 50' ' ' ARG . 66.1 mt -69.38 148.0 50.25 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 126.719 2.512 . . . . 33.96 110.461 -177.981 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' LYS . . . . . 0.669 ' HB3' ' O ' ' B' ' 572' ' ' HOH . 2.2 tptm -60.61 -27.45 67.76 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 113.008 -1.906 . . . . 45.3 109.871 178.487 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' LYS . . . . . 0.401 ' N ' ' O ' ' B' ' 572' ' ' HOH . . . -157.44 141.28 11.47 Favored Pre-proline 0 C--N 1.321 -0.668 0 C-N-CA 125.882 1.673 . . . . 40.45 110.502 178.875 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' PRO . . . . . 0.574 ' HD3' ' HE ' ' B' ' 50' ' ' ARG . 5.8 Cg_exo -54.52 137.03 72.15 Favored 'Trans proline' 0 C--N 1.317 -1.083 0 O-C-N 125.291 2.206 . . . . 38.8 107.913 177.376 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 14.4 p -89.61 163.96 2.27 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 N-CA-C 105.444 -2.058 . . . . 38.22 105.444 177.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' ALA . . . . . . . . . . . . . . . -108.61 132.85 53.47 Favored 'General case' 0 C--N 1.32 -0.688 0 O-C-N 126.121 2.138 . . . . 35.01 107.023 -179.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 15.8 m-30 -66.82 158.83 29.46 Favored 'General case' 0 C--N 1.312 -1.055 0 O-C-N 127.25 2.844 . . . . 29.6 109.589 178.536 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 1.9 p -166.75 -176.7 3.59 Favored 'General case' 0 C--O 1.254 1.332 0 N-CA-C 101.875 -3.38 . . . . 26.64 101.875 -176.086 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' ASP . . . . . . . . . . . . . 63.5 m-20 -61.55 -22.14 64.9 Favored 'General case' 0 C--O 1.25 1.096 0 O-C-N 128.962 3.914 . . . . 34.17 110.568 179.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -112.23 -8.83 13.95 Favored 'General case' 0 C--O 1.257 1.453 0 N-CA-C 117.604 2.446 . . . . 30.05 117.604 -171.206 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' ILE . . . . . . . . . . . . . 27.4 mt -126.85 109.81 21.68 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 C-N-CA 130.052 3.341 . . . . 23.79 110.324 -177.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' HIS . . . . . . . . . . . . . 27.7 t60 -154.63 142.29 13.94 Favored Pre-proline 0 N--CA 1.486 1.373 0 CA-C-O 116.727 -1.606 . . . . 28.15 107.803 179.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -80.25 152.09 20.83 Favored 'Trans proline' 0 C--O 1.253 1.242 0 CA-C-O 125.38 2.158 . . . . 22.54 113.448 -178.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' VAL . . . . . . . . . . . . . 11.7 p -90.57 161.14 2.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 N-CA-C 104.325 -2.472 . . . . 19.77 104.325 176.91 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' CYS . . . . . . . . . . . . . 69.9 m -86.73 157.14 19.69 Favored 'General case' 0 C--O 1.243 0.723 0 O-C-N 120.843 -1.161 . . . . 21.58 110.026 173.509 -58.42 -60.122 96.556 102.307 2.024 106.747 72.811 76.466 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' LEU . . . . . 0.535 HD12 ' O ' ' B' ' 503' ' ' HOH . 80.4 mt -100.37 136.93 19.89 Favored Pre-proline 0 N--CA 1.481 1.105 0 N-CA-C 105.178 -2.156 . . . . 25.48 105.178 170.774 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -68.45 154.09 72.55 Favored 'Trans proline' 0 N--CA 1.455 -0.771 0 O-C-N 125.024 2.065 . . . . 28.99 111.772 -175.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' ASP . . . . . . . . . . . . . 15.4 p-10 -103.29 158.58 16.23 Favored 'General case' 0 C--O 1.254 1.324 0 N-CA-C 103.157 -2.905 . . . . 49.63 103.157 171.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' ARG . . . . . 0.492 ' O ' ' CG ' ' B' ' 126' ' ' ARG . . . -48.22 -39.23 20.56 Favored 'General case' 0 C--O 1.242 0.669 0 O-C-N 125.054 1.471 . . . . 40.28 114.074 -178.481 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' GLU . . . . . . . . . . . . . . . -76.67 -31.98 57.64 Favored 'General case' 0 C--O 1.253 1.269 0 O-C-N 124.321 1.013 . . . . 34.17 112.65 -177.262 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 18.7 m -67.51 -45.72 74.98 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 116.807 -1.957 . . . . 32.94 105.789 176.067 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' ALA . . . . . 0.453 ' HA ' ' HE1' ' B' ' 210' ' ' MET . . . -57.27 -46.7 82.82 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 125.395 1.478 . . . . 28.75 110.921 178.689 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 129' A ALA . . . . . . . . . . . . . . . -57.59 -48.95 77.98 Favored 'General case' 0 C--O 1.249 1.041 0 O-C-N 125.778 1.924 . . . . 31.9 111.626 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 129' B SER . . . . . . . . . . . . . 0.1 OUTLIER -81.33 -21.99 38.81 Favored 'General case' 0 C--O 1.243 0.713 0 CA-C-O 113.656 -3.069 . . . . 36.08 116.454 -177.39 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 129' C LEU . . . . . . . . . . . . . 15.9 mt -96.56 -35.45 11.08 Favored 'General case' 0 C--N 1.313 -0.982 0 O-C-N 126.639 2.462 . . . . 34.19 113.225 -175.205 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' LEU . . . . . 0.592 ' CD2' ' CD1' ' B' ' 162' ' ' ILE . 0.4 OUTLIER -77.54 76.08 4.08 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-O 123.155 1.455 . . . . 34.89 109.352 -176.956 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -129.39 141.36 51.07 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 116.848 -1.548 . . . . 49.7 110.561 -177.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -57.86 134.49 56.35 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 118.614 0.643 . . . . 31.14 109.632 -179.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 94.28 -25.49 22.13 Favored Glycine 0 N--CA 1.468 0.802 0 C-N-CA 119.405 -1.378 . . . . 26.5 114.504 179.577 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 134' ' ' TYR . . . . . . . . . . . . . 3.8 m-30 -72.65 140.35 47.89 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 104.116 -2.55 . . . . 30.0 104.116 175.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 80.0 mttt -97.35 144.3 27.25 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 128.406 3.566 . . . . 25.92 112.68 179.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 136' ' ' GLY . . . . . 0.466 ' HA3' ' CZ ' ' B' ' 199' ' ' PHE . . . -121.14 177.53 16.38 Favored Glycine 0 CA--C 1.538 1.524 0 C-N-CA 128.291 2.853 . . . . 20.49 107.539 174.322 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 41.9 ttm180 -129.93 134.75 47.68 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-O 115.113 -2.375 . . . . 22.13 105.464 -172.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 138' ' ' VAL . . . . . . . . . . . . . 4.3 t -118.38 147.09 22.08 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 O-C-N 128.858 3.849 . . . . 24.21 107.601 174.908 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 139' ' ' THR . . . . . . . . . . . . . 23.3 p -135.94 148.65 48.6 Favored 'General case' 0 C--N 1.315 -0.921 0 O-C-N 124.618 1.199 . . . . 20.95 111.84 179.391 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 140' ' ' GLY . . . . . . . . . . . . . . . 174.8 175.55 42.39 Favored Glycine 0 CA--C 1.54 1.642 0 C-N-CA 117.564 -2.255 . . . . 20.15 109.233 175.475 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 141' ' ' TRP . . . . . . . . . . . . 0.251 4.6 m-90 -111.87 12.71 20.88 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-N 110.231 -2.984 . . . . 29.65 112.392 -177.311 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 142' ' ' GLY . . . . . . . . . . . . . . . -73.01 -176.87 31.78 Favored Glycine 0 CA--C 1.529 0.944 0 O-C-N 125.211 1.569 . . . . 30.5 109.406 -174.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 143' ' ' ASN . . . . . . . . . . . . . 64.9 m-20 -52.02 146.99 7.81 Favored 'General case' 0 C--O 1.244 0.814 0 CA-C-N 111.757 -2.221 . . . . 40.14 110.023 178.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 144' ' ' LEU . . . . . 0.493 ' H ' ' C ' ' B' ' 147' ' ' THR . 70.9 mt -91.68 -43.16 9.75 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 108.617 -3.901 . . . . 30.57 108.983 176.969 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 145' ' ' LYS . . . . . 0.539 ' HB2' ' N ' ' B' ' 147' ' ' THR 0.302 0.7 OUTLIER -121.98 153.48 38.48 Favored 'General case' 1 C--N 0.683 -28.404 3 O-C-N 104.817 -11.177 . . . . 48.8 111.958 177.751 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . 0.421 6.9 mt-10 -38.5 36.85 0.0 OUTLIER 'General case' 1 CA--C 1.668 5.509 2 N-CA-C 97.262 -5.088 . . . . 42.01 97.262 170.1 . . . . . . . . 4 2 . 1 . 001 ecloud nobuild full ' B' B ' 147' ' ' THR . . . . . 0.539 ' N ' ' HB2' ' B' ' 145' ' ' LYS . . . . . . . . 2 N--CA 1.569 5.508 0 O-C-N 117.467 -3.271 . . . . 43.55 113.473 178.894 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 151' ' ' GLN . . . . . 0.824 ' NE2' ' O ' ' B' ' 557' ' ' HOH . 8.6 mt-30 . . . . . 0 C--O 1.246 0.893 0 N-CA-C 106.023 -1.843 . . . . 52.44 106.023 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 152' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' B' ' 151' ' ' GLN . 23.7 Cg_endo -74.12 164.51 34.16 Favored 'Trans proline' 0 C--O 1.247 0.951 0 O-C-N 126.367 2.772 . . . . 35.65 108.444 -174.241 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 62.4 p -92.03 -29.12 16.76 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 116.609 -2.036 . . . . 33.64 108.113 175.141 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 154' ' ' VAL . . . . . 0.747 HG22 ' CD2' ' B' ' 71' ' ' HIS 0.348 0.4 OUTLIER -127.12 166.58 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 CA-C-N 113.813 -1.539 . . . . 29.17 111.051 -179.051 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 155' ' ' LEU . . . . . . . . . . . . . 12.5 tp -52.68 134.57 35.99 Favored 'General case' 0 C--O 1.246 0.911 0 C-N-CA 124.016 0.926 . . . . 24.77 111.551 176.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 156' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -107.71 157.03 18.44 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 106.704 -1.591 . . . . 30.16 106.704 -179.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 157' ' ' VAL . . . . . . . . . . . . . 7.3 p -135.6 146.73 29.34 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.394 0 CA-C-O 115.269 -2.3 . . . . 27.55 107.058 -178.119 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 158' ' ' VAL . . . . . . . . . . . . . 14.2 p -150.25 139.16 15.14 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.282 0 N-CA-C 105.283 -2.118 . . . . 24.31 105.283 170.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 159' ' ' ASN . . . . . . . . . . . . . 63.7 m-20 -96.04 126.62 41.4 Favored 'General case' 0 C--N 1.293 -1.849 0 C-N-CA 130.876 3.671 . . . . 25.97 107.934 175.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 160' ' ' LEU . . . . . . . . . . . . . 33.0 mt -137.86 143.46 40.12 Favored Pre-proline 0 C--N 1.303 -1.43 0 C-N-CA 125.337 1.455 . . . . 27.59 111.53 -174.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 161' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -85.36 138.67 6.57 Favored 'Trans proline' 0 C--O 1.245 0.853 0 O-C-N 125.298 2.209 . . . . 26.98 113.852 -179.023 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 162' ' ' ILE . . . . . 0.592 ' CD1' ' CD2' ' B' ' 130' ' ' LEU . 7.9 mt -70.56 136.02 26.87 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.987 0 N-CA-C 106.286 -1.746 . . . . 25.91 106.286 174.8 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 163' ' ' VAL . . . . . . . . . . . . 0.321 0.5 OUTLIER -108.87 145.78 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 CA-C-O 124.54 2.114 . . . . 28.04 110.414 179.63 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 164' ' ' GLU . . . . . 0.628 ' CD ' ' H ' ' B' ' 164' ' ' GLU . 3.2 mp0 -51.89 135.31 30.4 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 131.585 3.954 . . . . 45.97 109.384 179.462 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 165' ' ' ARG . . . . . 0.624 ' NH2' ' O ' ' B' ' 177' ' ' THR . 35.3 mtp85 -50.01 -46.86 81.91 Favored Pre-proline 0 C--N 1.308 -1.217 0 C-N-CA 128.21 2.604 . . . . 37.71 116.058 -175.71 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 166' ' ' PRO . . . . . 0.504 ' HD2' ' N ' ' B' ' 165' ' ' ARG . 6.6 Cg_exo -55.03 -44.28 51.19 Favored 'Trans proline' 0 C--N 1.318 -1.032 0 C-N-CA 124.892 3.728 . . . . 29.9 113.331 177.24 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 167' ' ' VAL . . . . . . . . . . . . . 96.2 t -62.14 -45.31 99.04 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 N-CA-C 107.095 -1.446 . . . . 28.64 107.095 178.025 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 168' ' ' CYS . . . . . . . . . . . . . 72.1 m -55.96 -54.31 46.36 Favored 'General case' 0 C--O 1.261 1.68 0 O-C-N 120.842 -1.161 . . . . 26.99 110.543 176.918 -62.817 -70.706 -85.489 103.952 2.028 107.181 -83.402 90.685 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 169' ' ' LYS . . . . . 0.555 ' HD3' ' O ' ' B' ' 165' ' ' ARG . 1.8 mptp? -56.24 -47.27 78.83 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 123.571 1.653 . . . . 49.92 111.433 -175.733 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -74.01 -1.87 21.76 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-O 115.669 -2.11 . . . . 27.31 115.871 -177.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 71.6 p -95.78 -10.66 28.51 Favored 'General case' 0 C--N 1.313 -1.004 0 O-C-N 124.537 1.148 . . . . 25.86 108.934 -177.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 172' ' ' THR . . . . . . . . . . . . . 9.1 t -141.81 168.24 20.23 Favored 'General case' 0 C--O 1.246 0.901 0 C-N-CA 117.79 -1.564 . . . . 26.77 111.366 -174.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 13.1 mtp85 -93.72 -17.68 22.93 Favored 'General case' 0 C--N 1.321 -0.663 0 O-C-N 126.851 2.594 . . . . 45.1 107.65 175.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 174' ' ' ILE . . . . . . . . . . . . . 6.6 mm -70.2 145.98 12.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.899 0 N-CA-C 108.25 -1.019 . . . . 27.61 108.25 -178.189 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 175' ' ' ARG . . . . . 0.6 ' O ' ' HG2' ' B' ' 175' ' ' ARG . 0.4 OUTLIER -97.22 132.09 43.32 Favored 'General case' 1 C--N 1.549 9.267 2 C-N-CA 96.053 -10.259 . . . . 35.29 109.496 -179.839 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' B' B ' 176' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -78.32 143.93 11.98 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 O-C-N 127.315 2.884 . . . . 32.0 111.436 -176.712 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 177' ' ' THR . . . . . 0.624 ' O ' ' NH2' ' B' ' 165' ' ' ARG . 13.5 p -120.99 164.36 16.86 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-N 114.462 -1.244 . . . . 24.38 110.405 179.187 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 178' ' ' ASP . . . . . 0.73 ' HB3' HH11 ' B' ' 233' ' ' ARG . 94.7 m-20 -59.26 -22.39 61.05 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 112.677 -2.056 . . . . 32.39 109.178 177.889 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 179' ' ' ASN . . . . . . . . . . . . . 48.5 m-20 -82.24 17.48 1.66 Allowed 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 116.89 -1.529 . . . . 26.46 113.125 176.401 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 180' ' ' MET . . . . . . . . . . . . . 64.7 mtt -138.86 156.31 47.4 Favored 'General case' 0 C--N 1.313 -1.02 1 CA-C-O 111.454 -4.117 . . . . 21.9 107.649 -177.543 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 181' ' ' PHE . . . . . . . . . . . . 0.262 47.0 p90 -141.0 161.91 36.73 Favored 'General case' 0 C--N 1.297 -1.678 1 O-C-N 130.766 5.041 . . . . 22.39 101.372 169.872 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' B' B ' 182' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -125.31 156.45 38.63 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 105.654 -1.98 . . . . 25.64 105.654 177.627 90.685 -83.402 -85.489 107.181 2.028 103.952 -70.706 -62.817 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 183' ' ' ALA . . . . . . . . . . . . . . . -147.16 150.14 34.36 Favored 'General case' 0 C--N 1.315 -0.896 0 O-C-N 126.28 2.238 . . . . 22.73 112.356 -179.57 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 184' ' ' GLY . . . . . . . . . . . . . . . 150.15 166.48 13.47 Favored Glycine 0 C--O 1.244 0.768 0 C-N-CA 125.938 1.732 . . . . 24.54 110.252 -178.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 184' A TYR . . . . . . . . . . . . . 65.8 m-85 -81.88 150.69 27.65 Favored 'General case' 0 C--O 1.253 1.244 0 N-CA-C 105.731 -1.951 . . . . 29.35 105.731 175.71 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 22.4 mttp -87.32 151.7 51.49 Favored Pre-proline 0 C--O 1.256 1.404 0 CA-C-O 117.154 -1.403 . . . . 40.18 108.073 174.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 186' ' ' PRO . . . . . . . . . . . . . 8.7 Cg_exo -46.21 -33.82 12.57 Favored 'Trans proline' 0 C--O 1.243 0.747 0 C-N-CA 122.595 2.197 . . . . 36.91 115.957 -174.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 186' A ASP . . . . . . . . . . . . . . . -68.69 -29.44 67.89 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 111.888 -2.414 . . . . 43.93 111.92 178.078 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 186' B GLU . . . . . . . . . . . . . 69.1 mt-10 -66.68 -16.78 64.46 Favored 'General case' 0 C--O 1.258 1.522 0 N-CA-C 118.479 2.77 . . . . 49.56 118.479 -172.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 186' C GLY . . . . . . . . . . . . . . . 53.34 34.2 47.87 Favored Glycine 0 C--O 1.253 1.307 0 CA-C-O 126.217 3.121 . . . . 48.42 116.286 176.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 186' D LYS . . . . . . . . . . . . . 17.2 mttm -144.92 133.5 22.07 Favored 'General case' 0 C--N 1.313 -0.998 1 N-CA-C 99.782 -4.155 . . . . 48.82 99.782 173.913 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 187' ' ' ARG . . . . . 0.545 ' NE ' ' OD2' ' B' ' 221' ' ' ASP . 23.8 mtp85 -110.48 -176.93 3.1 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 127.162 2.789 . . . . 37.74 110.923 179.118 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 188' ' ' GLY . . . . . 0.463 ' HA2' ' O ' ' B' ' 17' ' ' VAL . . . 136.43 150.02 5.79 Favored Glycine 0 C--N 1.313 -0.743 0 CA-C-N 113.437 -1.71 . . . . 25.69 111.205 173.526 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 189' ' ' ASP . . . . . 0.423 ' HB2' ' O ' ' B' ' 188' ' ' GLY . 46.9 t0 -175.57 162.82 2.84 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 107.101 -1.444 . . . . 27.66 107.101 179.562 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -80.34 172.45 13.75 Favored 'General case' 0 C--O 1.256 1.406 0 N-CA-C 101.487 -3.523 . . . . 23.99 101.487 173.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 191' ' ' CYS . . . . . . . . . . . . . 11.2 t -151.69 -172.35 4.19 Favored 'General case' 0 C--O 1.253 1.288 0 N-CA-C 104.967 -2.234 . . . . 28.1 104.967 179.256 -164.719 58.563 73.734 105.195 2.055 107.705 -174.342 -51.096 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 192' ' ' GLU . . . . . . . . . . . . . . . -55.36 144.55 24.88 Favored 'General case' 0 C--O 1.237 0.397 0 O-C-N 127.101 2.751 . . . . 25.16 108.176 -178.674 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 86.01 -9.4 69.43 Favored Glycine 0 C--O 1.247 0.965 0 CA-C-O 115.303 -2.943 . . . . 25.01 114.974 178.1 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 194' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -89.39 -17.69 28.31 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 119.044 1.422 . . . . 23.86 113.957 177.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 195' ' ' SER . . . . . 1.332 ' OG ' ' C3 ' ' B' ' 248' ' ' 0KV . 51.0 m -48.69 146.45 3.11 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 125.822 1.649 . . . . 27.2 109.519 -174.835 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 196' ' ' GLY . . . . . . . . . . . . . . . 82.4 -14.23 35.94 Favored Glycine 0 N--CA 1.468 0.811 0 O-C-N 127.551 3.032 . . . . 22.34 111.185 177.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -70.98 167.54 51.27 Favored Glycine 0 C--N 1.299 -1.494 0 CA-C-N 120.716 2.258 . . . . 19.97 109.01 178.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 198' ' ' PRO . . . . . 0.41 ' HB2' HG13 ' B' ' 200' ' ' VAL . 9.3 Cg_endo -85.78 140.85 7.2 Favored 'Trans proline' 0 C--O 1.248 1.013 0 N-CA-C 118.862 2.601 . . . . 21.18 118.862 -179.113 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 199' ' ' PHE . . . . . 0.466 ' CZ ' ' HA3' ' B' ' 136' ' ' GLY . 6.4 t80 -108.59 112.54 24.95 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 100.294 -3.965 . . . . 21.03 100.294 170.49 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 200' ' ' VAL . . . . . 0.41 HG13 ' HB2' ' B' ' 198' ' ' PRO . 31.5 m -120.33 154.81 23.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 CA-C-N 120.493 1.497 . . . . 18.95 108.308 -169.948 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 201' ' ' MET . . . . . . . . . . . . . 73.6 mtp -133.11 152.84 51.93 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 116.466 -2.094 . . . . 24.09 106.379 174.178 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 202' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -101.14 114.28 28.09 Favored 'General case' 0 C--N 1.302 -1.498 0 CA-C-O 115.688 -2.101 . . . . 26.57 108.421 179.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 12.5 t -62.37 135.32 95.22 Favored Pre-proline 0 C--O 1.25 1.129 0 CA-C-O 125.665 2.65 . . . . 23.85 112.554 178.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 204' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_endo -83.53 -3.43 10.71 Favored 'Trans proline' 0 C--O 1.246 0.917 0 CA-C-O 116.109 -1.705 . . . . 29.77 110.118 179.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 204' A PHE . . . . . . . . . . . . . 24.3 m-85 -94.07 -41.15 9.69 Favored 'General case' 0 C--O 1.248 0.998 0 O-C-N 124.623 1.202 . . . . 34.44 111.697 -176.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 204' B ASN . . . . . 0.553 HD22 ' C ' ' B' ' 204' B ASN . 0.0 OUTLIER -125.17 8.1 7.91 Favored 'General case' 0 C--O 1.241 0.62 0 O-C-N 126.281 2.238 . . . . 27.36 114.485 -176.564 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . 0.358 31.8 m120 52.83 30.4 9.02 Favored 'General case' 0 C--N 1.312 -1.058 0 C-N-CA 128.231 2.612 . . . . 43.49 115.572 -179.097 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 206' ' ' ARG . . . . . . . . . . . . . 71.9 mtt-85 -98.77 155.02 17.57 Favored 'General case' 0 C--N 1.318 -0.765 0 C-N-CA 126.379 1.872 . . . . 34.69 111.325 177.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 207' ' ' TRP . . . . . . . . . . . . . 82.8 m95 -97.86 128.45 44.48 Favored 'General case' 0 N--CA 1.486 1.326 0 CA-C-O 114.957 -2.449 . . . . 20.29 106.844 179.31 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 53.1 m-85 -115.12 139.23 50.07 Favored 'General case' 0 C--N 1.307 -1.251 0 O-C-N 128.643 3.715 . . . . 22.07 112.063 177.188 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 209' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -90.31 106.86 18.78 Favored 'General case' 0 C--N 1.315 -0.908 0 O-C-N 124.888 1.367 . . . . 22.08 107.647 176.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 210' ' ' MET . . . . . 0.453 ' HE1' ' HA ' ' B' ' 129' ' ' ALA . 74.5 mmm -90.19 -34.68 15.73 Favored 'General case' 0 C--O 1.249 1.061 0 N-CA-C 113.113 0.783 . . . . 32.01 113.113 -179.524 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 211' ' ' GLY . . . . . 0.421 ' HA2' ' O ' ' B' ' 229' ' ' THR . . . -134.52 164.63 24.61 Favored Glycine 0 N--CA 1.47 0.915 0 N-CA-C 116.805 1.482 . . . . 20.33 116.805 -177.1 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 212' ' ' ILE . . . . . . . . . . . . . 90.7 mt -121.25 129.95 75.13 Favored 'Isoleucine or valine' 0 C--O 1.249 1.056 0 CA-C-O 116.129 -1.891 . . . . 20.42 106.418 176.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 85.0 t -52.66 117.19 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.293 0 O-C-N 125.03 1.456 . . . . 20.56 109.197 174.542 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 214' ' ' SER . . . . . 0.488 ' OG ' ' OD2' ' B' ' 102' ' ' ASP . 5.8 t -115.42 -66.84 1.04 Allowed 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 117.189 2.292 . . . . 23.71 117.189 -177.183 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 215' ' ' TRP . . . . . 0.545 ' CE3' ' H9 ' ' B' ' 248' ' ' 0KV . 62.6 p-90 -155.62 170.83 21.08 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 123.604 1.669 . . . . 25.58 110.697 -175.225 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 216' ' ' GLY . . . . . . . . . . . . . . . -179.33 -172.26 43.32 Favored Glycine 0 N--CA 1.478 1.496 0 N-CA-C 107.292 -2.323 . . . . 23.43 107.292 179.141 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 217' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -132.08 99.06 4.6 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 115.86 -2.336 . . . . 36.15 108.826 -179.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 219' ' ' GLY . . . . . . . . . . . . . . . 81.73 -174.5 54.06 Favored Glycine 0 N--CA 1.494 2.559 0 N-CA-C 105.051 -3.22 . . . . 27.77 105.051 -172.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 220' ' ' CYS . . . . . . . . . . . . . 34.6 m -128.94 130.93 47.4 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 116.301 -1.809 . . . . 32.61 107.878 -177.845 -51.096 -174.342 73.734 107.705 2.055 105.195 58.563 -164.719 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 221' ' ' ASP . . . . . 0.545 ' OD2' ' NE ' ' B' ' 187' ' ' ARG . 20.2 t0 53.92 41.35 32.07 Favored 'General case' 0 C--O 1.253 1.243 0 O-C-N 125.663 1.852 . . . . 32.09 113.414 174.753 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 221' A ARG . . . . . . . . . . . . . 16.6 mmt85 -81.3 141.37 34.12 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-O 114.242 -2.79 . . . . 48.16 109.544 177.119 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 222' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -68.48 141.82 55.48 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 106.535 -1.654 . . . . 45.76 106.535 176.382 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 223' ' ' GLY . . . . . . . . . . . . . . . 73.61 9.41 78.39 Favored Glycine 0 C--O 1.247 0.959 0 O-C-N 126.848 2.592 . . . . 34.04 112.265 178.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 224' ' ' LYS . . . . . . . . . . . . . 8.8 mttt -121.71 165.79 15.27 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 107.197 -1.408 . . . . 36.81 107.197 178.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 225' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -146.73 152.07 38.22 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 123.339 1.542 . . . . 27.11 111.032 -170.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 226' ' ' GLY . . . . . . . . . . . . . . . -87.37 152.08 24.01 Favored Glycine 0 CA--C 1.545 1.928 0 N-CA-C 104.302 -3.519 . . . . 21.57 104.302 -179.472 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 227' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -119.44 140.26 50.72 Favored 'General case' 0 C--N 1.303 -1.419 1 O-C-N 130.871 4.513 . . . . 22.21 108.099 -178.222 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 228' ' ' TYR . . . . . . . . . . . . 0.27 90.3 m-85 -128.72 148.88 50.87 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-O 113.323 -3.227 . . . . 22.17 112.625 -175.995 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 229' ' ' THR . . . . . 0.421 ' O ' ' HA2' ' B' ' 211' ' ' GLY . 4.3 m -69.22 142.52 54.21 Favored 'General case' 0 C--O 1.251 1.138 0 O-C-N 126.676 2.485 . . . . 21.79 108.961 171.297 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 230' ' ' HIS . . . . . 0.448 ' ND1' ' HG3' ' B' ' 233' ' ' ARG . 32.9 t-80 -88.09 94.08 9.69 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 125.744 1.618 . . . . 27.59 109.684 179.955 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 231' ' ' VAL . . . . . . . . . . . . . 41.9 t -57.25 -51.03 74.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 113.193 -1.821 . . . . 22.1 111.898 -171.509 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 232' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -54.45 -45.59 73.13 Favored 'General case' 0 C--O 1.251 1.132 0 CA-C-N 118.922 0.783 . . . . 33.36 112.274 -179.04 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 233' ' ' ARG . . . . . 0.73 HH11 ' HB3' ' B' ' 178' ' ' ASP . 5.8 mtp180 -60.01 -22.69 62.93 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 119.907 -1.746 . . . . 49.6 111.053 -179.855 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 234' ' ' LEU . . . . . . . . . . . . . 38.3 mt -107.64 7.29 28.49 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 114.244 1.201 . . . . 31.51 114.244 -178.026 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 235' ' ' LYS . . . . . . . . . . . . . 17.5 tttt -59.56 -35.48 74.32 Favored 'General case' 0 C--N 1.304 -1.393 0 C-N-CA 127.459 2.304 . . . . 41.8 115.252 -175.229 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 236' ' ' LYS . . . . . 1.154 ' H ' ' HE3' ' B' ' 236' ' ' LYS . 0.0 OUTLIER -53.3 -55.29 25.84 Favored 'General case' 0 C--O 1.25 1.096 0 CA-C-N 113.205 -1.816 . . . . 45.31 107.597 174.278 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 237' ' ' TRP . . . . . 0.568 ' H ' ' HG2' ' B' ' 236' ' ' LYS . 64.8 t90 -60.47 -39.37 87.38 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 125.14 1.525 . . . . 29.42 110.426 178.837 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 238' ' ' ILE . . . . . . . . . . . . . 97.2 mt -58.59 -53.21 50.11 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.096 0 O-C-N 124.063 0.852 . . . . 30.81 110.265 178.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 239' ' ' GLN . . . . . 0.87 ' C ' ' CA ' ' B' ' 240' ' ' LYS . 11.6 mt-30 . . . . . 0 C--N 1.317 -0.843 0 CA-C-O 124.409 2.052 . . . . 47.71 112.353 179.483 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 240' ' ' LYS . . . . . 0.87 ' CA ' ' C ' ' B' ' 239' ' ' GLN . . . . . . . . 0 C--O 1.251 1.138 0 CA-C-O 116.931 -1.509 . . . . 37.58 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 241' ' ' VAL . . . . . . . . . . . . 0.345 0.4 OUTLIER -69.83 -47.66 68.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 C-N-CA 117.56 -1.656 . . . . 36.94 114.324 -176.761 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 242' ' ' ILE . . . . . 0.677 ' O ' ' N ' ' B' ' 246' ' ' GLY . 63.2 mt -56.59 -48.62 80.21 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.277 0 CA-C-O 123.322 1.534 . . . . 40.7 108.495 -176.847 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 243' ' ' ASP . . . . . . . . . . . . . . . -62.08 -55.65 26.84 Favored 'General case' 0 C--N 1.316 -0.876 0 C-N-CA 126.058 1.743 . . . . 44.86 111.09 179.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 244' ' ' GLN . . . . . . . . . . . . . . . -71.71 9.87 0.79 Allowed 'General case' 0 C--O 1.244 0.771 0 CA-C-O 114.389 -2.72 . . . . 49.26 109.318 -178.079 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 245' ' ' PHE . . . . . . . . . . . . . . . -171.43 4.86 0.01 OUTLIER 'General case' 0 C--O 1.257 1.488 0 C-N-CA 114.969 -2.692 . . . . 52.0 117.467 -175.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 246' ' ' GLY . . . . . 0.677 ' N ' ' O ' ' B' ' 242' ' ' ILE . . . . . . . . 0 C--O 1.267 2.202 0 CA-C-O 113.54 -3.922 . . . . 57.5 118.324 -177.245 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 56' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 . . . . . 0 C--O 1.242 0.663 0 CA-C-O 116.512 -1.709 . . . . 48.05 112.167 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 57' ' ' GLU . . . . . 0.693 ' CB ' HH12 ' B' ' 75' ' ' ARG . 29.3 tt0 -68.09 129.82 41.06 Favored 'General case' 0 C--O 1.248 1.003 0 O-C-N 126.158 2.161 . . . . 44.85 105.94 173.028 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 58' ' ' GLU . . . . . . . . . . . . . . . -53.24 156.07 2.44 Favored 'General case' 0 C--O 1.25 1.131 0 C-N-CA 124.706 1.202 . . . . 44.37 108.414 -174.636 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 59' ' ' ILE . . . . . 0.688 HG23 ' O ' ' C' ' 537' ' ' HOH . 1.7 pp -114.46 157.36 42.85 Favored Pre-proline 0 C--O 1.244 0.768 0 O-C-N 125.967 2.042 . . . . 46.97 108.272 179.084 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 60' ' ' PRO . . . . . 0.892 ' HG2' ' HE2' ' C' ' 63' ' ' TYS . 12.1 Cg_exo -44.48 138.52 7.57 Favored 'Trans proline' 0 C--O 1.249 1.069 0 O-C-N 127.135 3.176 . . . . 48.92 111.206 176.491 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 61' ' ' GLU . . . . . . . . . . . . . . . -70.87 -25.04 62.62 Favored 'General case' 0 C--O 1.247 0.952 0 CA-C-N 112.002 -2.363 . . . . 48.09 112.918 -176.286 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 62' ' ' GLU . . . . . . . . . . . . . . . -64.42 -26.17 68.33 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 112.838 -1.983 . . . . 52.88 106.997 179.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 63' ' ' TYS . . . . . 0.892 ' HE2' ' HG2' ' C' ' 60' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 248' ' ' 0KV . . . . . 1.332 ' C3 ' ' OG ' ' B' ' 195' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 431' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 553' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 579' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 592' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 426' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 428' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 432' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 436' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 439' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 440' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 441' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 442' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 443' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 444' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 446' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 447' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 448' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 449' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 450' ' ' HOH . . . . . 0.768 ' O ' ' O ' ' B' ' 74' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 453' ' ' HOH . . . . . 0.468 ' O ' ' ND2' ' B' ' 60' G ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 455' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 458' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 459' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 460' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 462' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 463' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 465' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 469' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 471' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 472' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 473' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 476' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 477' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 481' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 485' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 486' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 488' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 489' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 490' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 491' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 492' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 493' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 494' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 495' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 496' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 497' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 498' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 499' ' ' HOH . . . . . 0.815 ' O ' ' O ' ' B' ' 77' A ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 500' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 503' ' ' HOH . . . . . 0.535 ' O ' HD12 ' B' ' 123' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 536' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 538' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 539' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 541' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 545' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 546' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 547' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 548' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 549' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 551' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 554' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 555' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 557' ' ' HOH . . . . . 0.824 ' O ' ' NE2' ' B' ' 151' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 562' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 563' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 564' ' ' HOH . . . . . 0.863 ' O ' ' HA3' ' B' ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 568' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 570' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 572' ' ' HOH . . . . . 0.669 ' O ' ' HB3' ' B' ' 109' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 574' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 575' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 577' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 580' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 581' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 582' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 583' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 585' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 586' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 588' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 590' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 591' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 593' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 595' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 596' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 457' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 537' ' ' HOH . . . . . 0.688 ' O ' HG23 ' C' ' 59' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 556' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 565' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_