data_6yjn_residue ############################ # Computer software used # ############################ 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 6yjn _Structure_validation_residue.Date_analyzed 2020-06-05 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 ' 7' ' ' PRO . . . . . 0.423 ' C ' ' N ' ' A' ' 9' ' ' SER . 3.5 Cg_exo . . . . . 0 CA--C 1.529 0.226 0 CA-C-O 120.733 0.222 . . . . 181.44 111.993 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . . . 52.63 7.09 0.06 Allowed 'General case' 0 C--N 1.343 0.301 0 C-N-CA 125.221 1.409 . . . . 174.49 109.958 -172.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' SER . . . . . 0.423 ' N ' ' C ' ' A' ' 7' ' ' PRO . . . -55.24 -16.72 3.53 Favored 'General case' 0 N--CA 1.453 -0.308 0 O-C-N 124.184 0.927 . . . . 151.07 110.111 -172.929 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . . . 71.31 -51.41 0.69 Allowed 'General case' 0 C--N 1.347 0.457 0 C-N-CA 125.831 1.652 . . . . 115.08 109.353 -176.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . . . -124.47 28.96 6.45 Favored 'General case' 0 C--N 1.344 0.343 0 C-N-CA 123.684 0.794 . . . . 94.04 110.022 -176.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . . . -45.55 -54.42 7.59 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 125.332 1.453 . . . . 102.59 110.533 175.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -39.75 -41.42 1.1 Allowed 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.032 -0.985 . . . . 110.04 109.183 178.732 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 20.6 m-20 -79.79 -37.08 36.04 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 114.66 -1.154 . . . . 100.08 110.295 -168.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -70.7 -26.64 63.51 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 124.238 0.961 . . . . 106.58 110.324 173.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ASP . . . . . 0.402 ' C ' ' N ' ' A' ' 18' ' ' TRP . 14.4 m-20 -73.67 -56.08 5.46 Favored 'General case' 0 C--N 1.343 0.323 0 N-CA-C 109.601 -0.518 . . . . 134.89 109.601 176.426 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.49 -15.26 1.6 Allowed 'General case' 0 C--N 1.349 0.553 0 CA-C-O 121.922 0.868 . . . . 101.18 108.723 -179.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' TRP . . . . . 0.402 ' N ' ' C ' ' A' ' 16' ' ' ASP . 54.2 t-105 -81.95 -58.74 2.84 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 114.403 -1.271 . . . . 130.61 111.91 178.585 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -56.31 -36.8 47.73 Favored 'Isoleucine or valine' 0 C--N 1.353 0.741 0 N-CA-C 107.265 -1.383 . . . . 96.49 107.265 175.55 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . . . -52.46 -50.29 62.94 Favored 'General case' 0 N--CA 1.452 -0.355 0 O-C-N 124.347 1.029 . . . . 96.52 109.537 173.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.6 -49.43 63.11 Favored 'General case' 0 C--N 1.345 0.401 0 CA-C-O 119.523 -0.275 . . . . 136.62 110.316 -179.674 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . . . -53.14 -39.59 63.64 Favored 'General case' 0 C--N 1.344 0.337 0 O-C-N 123.572 0.545 . . . . 153.15 109.547 -171.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LEU . . . . . 0.606 ' CD1' ' O ' ' A' ' 445' ' ' HOH . 62.9 mt -71.58 -48.4 48.6 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 123.568 0.543 . . . . 129.22 110.767 -174.366 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -51.93 -9.4 0.09 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.998 1.319 . . . . 103.62 112.821 -176.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -104.98 31.06 5.06 Favored 'General case' 0 C--N 1.342 0.26 0 CA-C-O 121.177 0.513 . . . . 132.46 110.313 -174.167 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ASP . . . . . 0.683 ' OD1' ' CD ' ' A' ' 27' ' ' PRO 0.278 21.8 p-10 -29.57 -53.27 0.31 Allowed Pre-proline 0 CA--C 1.536 0.418 0 CA-C-O 117.721 -1.133 . . . . 174.38 113.507 175.3 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' PRO . . . . . 0.683 ' CD ' ' OD1' ' A' ' 26' ' ' ASP . 71.8 Cg_exo -48.56 74.53 0.01 OUTLIER 'Trans proline' 0 C--N 1.368 1.578 0 CA-C-N 122.123 1.794 . . . . 134.98 114.824 176.709 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' GLN . . . . . 0.55 ' N ' ' O ' ' A' ' 26' ' ' ASP . . . -53.44 119.15 4.47 Favored 'General case' 0 C--N 1.348 0.521 0 C-N-CA 125.068 1.347 . . . . 115.64 111.616 -156.129 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' TYR . . . . . 0.546 ' CD1' ' C ' ' A' ' 29' ' ' TYR . 5.7 p90 -165.72 -3.5 0.03 OUTLIER 'General case' 0 C--N 1.347 0.494 0 N-CA-C 114.083 1.142 . . . . 152.21 114.083 -161.738 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 18.2 m-30 -49.57 -24.15 2.0 Allowed 'General case' 0 C--O 1.227 -0.113 0 C-N-CA 116.842 -1.943 . . . . 143.37 107.482 170.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' SER . . . . . 0.505 ' N ' ' C ' ' A' ' 29' ' ' TYR . 3.9 t -58.22 -50.37 73.79 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 127.669 2.387 . . . . 121.09 112.127 166.812 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ARG . . . . . 0.494 ' N ' ' O ' ' A' ' 29' ' ' TYR . 59.3 mtt-85 -50.23 -48.93 54.25 Favored 'General case' 0 C--N 1.346 0.431 0 C-N-CA 123.965 0.906 . . . . 202.03 110.209 171.019 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.8 mt -63.06 -55.82 22.27 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.506 -0.77 . . . . 114.31 109.973 -178.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.75 -7.84 0.5 Allowed 'General case' 0 C--O 1.232 0.167 0 O-C-N 123.814 0.696 . . . . 100.64 110.874 -175.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -112.41 19.24 17.8 Favored 'General case' 0 C--N 1.343 0.292 0 C-N-CA 123.216 0.607 . . . . 147.71 110.477 -171.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' GLN . . . . . 0.552 ' NE2' ' O ' ' A' ' 61' ' ' PRO . 44.1 tt0 -78.41 -17.48 56.34 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 113.293 0.849 . . . . 167.86 113.293 -145.647 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLN . . . . . 0.432 ' CB ' ' O ' ' A' ' 36' ' ' GLN . . . 81.28 178.43 0.09 Allowed 'General case' 0 C--N 1.341 0.196 0 CA-C-N 118.25 0.477 . . . . 120.9 110.762 -178.699 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.7 132.97 94.08 Favored Pre-proline 0 C--N 1.342 0.267 0 CA-C-N 114.922 -1.035 . . . . 121.01 109.844 -175.483 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -59.04 150.57 72.22 Favored 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 121.749 1.633 . . . . 109.5 109.795 161.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . . . -117.75 6.97 12.39 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 107.912 -1.144 . . . . 94.0 107.912 -179.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -137.8 138.53 39.3 Favored 'General case' 0 C--N 1.344 0.352 0 O-C-N 124.959 1.412 . . . . 104.8 112.267 179.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 62.0 tp -103.26 124.33 48.45 Favored 'General case' 0 C--O 1.242 0.698 0 CA-C-N 114.698 -1.137 . . . . 89.55 109.502 160.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 8.3 t-105 -106.03 117.28 33.61 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 113.973 -1.467 . . . . 88.35 108.905 172.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 59.8 mt -104.55 116.47 48.42 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 N-CA-C 108.051 -1.092 . . . . 76.82 108.051 169.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -135.78 -168.54 11.57 Favored Glycine 0 CA--C 1.524 0.608 0 C-N-CA 119.305 -1.426 . . . . 85.82 112.75 -177.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 9.5 t -96.46 150.55 20.48 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 114.234 -0.983 . . . . 88.41 109.601 -172.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 45.5 m -71.17 -16.86 62.55 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 118.941 -0.552 . . . . 96.79 111.104 -178.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -62.5 77.26 0.02 OUTLIER 'General case' 0 C--N 1.346 0.439 0 N-CA-C 107.324 -1.361 . . . . 105.9 107.324 159.172 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.5 m -80.86 69.66 7.47 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 107.302 -1.37 . . . . 103.98 107.302 -176.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . . . -62.22 -45.66 92.36 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 113.664 -1.607 . . . . 124.74 109.586 -174.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . . . -143.06 141.05 18.68 Favored Pre-proline 0 C--N 1.343 0.291 0 N-CA-C 109.493 -0.558 . . . . 117.06 109.493 168.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -68.65 153.69 72.9 Favored 'Trans proline' 0 C--N 1.361 1.198 0 C-N-CA 122.769 2.313 . . . . 92.72 114.572 -179.174 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.94 -61.72 1.8 Allowed 'General case' 0 N--CA 1.456 -0.14 0 CA-C-N 115.937 -0.574 . . . . 87.89 110.578 -164.394 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 10.8 p-10 -45.0 -55.16 5.78 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 124.026 0.829 . . . . 92.71 109.891 179.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' GLN . . . . . 0.471 ' O ' ' C ' ' A' ' 56' ' ' ILE . 3.5 tt0 -46.1 -73.77 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.375 1.07 . . . . 116.7 110.596 175.701 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ILE . . . . . 0.471 ' C ' ' O ' ' A' ' 55' ' ' GLN . 70.0 mt -31.69 -51.05 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 108.331 -0.988 . . . . 100.69 108.331 179.573 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . . . -96.54 4.31 9.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 CA-C-N 114.97 -1.014 . . . . 103.01 108.698 -162.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' GLY . . . . . 0.435 ' N ' ' O ' ' A' ' 55' ' ' GLN . . . 51.2 76.8 0.15 Allowed Glycine 0 C--N 1.347 1.189 0 C-N-CA 125.978 1.751 . . . . 99.33 113.33 -178.953 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 24.7 mt -145.3 153.47 52.37 Favored Pre-proline 0 CA--C 1.519 -0.228 0 N-CA-C 107.354 -1.35 . . . . 92.68 107.354 176.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -51.06 141.39 37.78 Favored 'Trans proline' 0 C--N 1.353 0.804 0 N-CA-C 109.539 -0.985 . . . . 104.24 109.539 167.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' PRO . . . . . 0.555 ' O ' ' N ' ' A' ' 63' ' ' GLU . 81.2 Cg_exo -47.68 170.13 0.06 OUTLIER 'Trans proline' 0 C--N 1.356 0.95 0 C-N-CA 122.097 1.865 . . . . 117.22 109.476 170.32 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 58.17 -14.11 0.02 OUTLIER Glycine 0 CA--C 1.531 1.078 0 CA-C-N 117.602 0.183 . . . . 108.83 113.412 174.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLU . . . . . 0.555 ' N ' ' O ' ' A' ' 61' ' ' PRO . . . -71.71 -17.53 62.21 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.368 -0.975 . . . . 103.99 108.368 173.084 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 17.6 t -120.13 128.35 75.95 Favored 'Isoleucine or valine' 0 C--N 1.343 0.307 0 O-C-N 124.319 1.012 . . . . 90.87 110.05 175.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -88.0 131.92 34.45 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 124.781 1.232 . . . . 91.97 109.199 177.524 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 74.3 t -129.71 133.33 65.1 Favored 'Isoleucine or valine' 0 C--N 1.343 0.318 0 C-N-CA 119.196 -1.002 . . . . 90.08 112.763 -164.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -117.86 143.68 46.09 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 114.711 -1.132 . . . . 82.29 109.552 161.189 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 7.1 mtp85 -138.01 122.77 18.75 Favored 'General case' 0 C--N 1.348 0.529 0 N-CA-C 109.245 -0.65 . . . . 96.05 109.245 176.61 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 18.2 p30 -131.3 166.91 20.17 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 124.917 1.386 . . . . 85.37 109.062 168.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . 0.304 . . -67.2 108.14 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.343 0.326 0 N-CA-C 109.039 -0.726 . . . . 80.54 109.039 -177.589 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 86.76 20.31 0.07 Allowed 'General case' 0 C--O 1.234 0.253 0 C-N-CA 127.103 2.161 . . . . 64.01 111.358 173.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 44.79 59.48 3.38 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-O 121.241 0.544 . . . . 85.46 109.645 175.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 50.7 t -99.98 133.39 43.11 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 N-CA-C 107.271 -1.381 . . . . 78.98 107.271 -178.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' VAL . . . . . 0.587 ' N ' ' OE1' ' A' ' 159' ' ' GLN . 72.0 t -107.88 103.17 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 N-CA-C 107.819 -1.178 . . . . 82.49 107.819 170.851 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 88.6 t -82.22 133.11 29.87 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 O-C-N 124.091 0.869 . . . . 77.47 109.24 173.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -45.89 -34.53 3.91 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.174 0.99 . . . . 76.23 109.891 179.074 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 19.1 p -118.04 15.08 14.18 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.65 -0.704 . . . . 73.05 111.262 -166.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -84.71 104.87 15.06 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.48 -0.933 . . . . 86.82 108.48 179.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 9.5 tp -78.03 -13.65 59.79 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 118.659 -1.217 . . . . 85.0 109.433 -176.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 34.9 t-20 -58.44 -55.07 39.82 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-O 122.317 1.055 . . . . 73.49 110.513 172.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 27.1 t -77.73 -50.88 11.51 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.218 -0.901 . . . . 84.26 110.231 -178.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 27.1 mt -46.52 -42.82 16.28 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 119.614 -0.834 . . . . 70.51 109.437 -179.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -54.88 -56.69 16.8 Favored 'General case' 0 C--N 1.348 0.511 0 C-N-CA 123.7 0.8 . . . . 74.12 110.366 179.303 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 75.3 t -45.61 -46.46 4.63 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 C-N-CA 124.217 1.007 . . . . 81.59 109.971 174.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 27.0 mt -71.55 -50.53 39.15 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 C-N-CA 122.55 0.34 . . . . 71.15 111.164 -173.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 23.7 tm0? -56.71 -32.5 65.55 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 119.984 -0.686 . . . . 90.99 109.798 176.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -74.76 -42.43 58.22 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 120.998 0.428 . . . . 87.42 110.846 179.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.7 -47.58 68.97 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 120.167 -0.613 . . . . 80.28 111.312 -178.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 83.9 t -73.55 -61.09 1.83 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 124.05 0.94 . . . . 74.01 111.242 -176.045 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 56.0 m-20 -68.07 -32.05 72.11 Favored 'General case' 0 C--N 1.344 0.352 0 CA-C-N 116.387 -0.369 . . . . 105.6 111.357 -170.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 4.3 tp -116.22 -24.78 7.83 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 118.756 -1.178 . . . . 98.96 112.476 -171.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 13.0 mt -102.41 -6.36 23.07 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 114.968 -2.693 . . . . 84.34 107.474 -177.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 15.8 mmtm 39.2 59.74 1.64 Allowed 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 126.0 2.062 . . . . 121.96 107.416 -172.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 33.2 m -68.94 147.91 11.94 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 108.183 -1.043 . . . . 78.03 108.183 174.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . . . -82.14 -32.59 30.0 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 119.642 -0.823 . . . . 88.48 108.894 -173.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 75.5 m-70 -136.9 133.76 36.09 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.456 -0.572 . . . . 93.64 109.456 -168.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 46.2 t -108.84 140.35 27.83 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 N-CA-C 107.533 -1.284 . . . . 90.75 107.533 162.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 2.5 ptt? -144.72 123.71 12.79 Favored 'General case' 0 C--O 1.241 0.642 0 CA-C-O 121.776 0.798 . . . . 96.83 111.472 178.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 89.0 t -85.07 113.1 23.03 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 N-CA-C 105.853 -1.906 . . . . 91.76 105.853 175.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 2.9 t -115.12 105.32 18.38 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 C-N-CA 119.599 -0.84 . . . . 74.6 110.124 -176.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -80.19 174.03 54.97 Favored Glycine 0 CA--C 1.529 0.925 0 CA-C-N 115.534 -0.757 . . . . 92.07 111.848 168.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' HIS . . . . . 0.676 ' C ' ' CD1' ' A' ' 152' ' ' ILE . 6.1 p80 -149.96 125.52 10.3 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.444 0.64 . . . . 94.25 111.123 -170.534 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' TYR . . . . . 0.523 ' N ' ' CD1' ' A' ' 152' ' ' ILE . 61.3 m-85 -59.81 136.16 57.92 Favored 'General case' 0 C--N 1.342 0.262 0 CA-C-N 116.041 -0.527 . . . . 92.66 110.299 -175.027 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 78.32 22.21 68.3 Favored Glycine 0 CA--C 1.524 0.635 0 O-C-N 124.94 1.4 . . . . 79.84 112.054 178.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 47.4 t -58.41 127.95 34.7 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 125.64 1.576 . . . . 84.59 110.677 173.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 73.8 p -67.82 -34.96 77.76 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 124.64 1.176 . . . . 90.56 111.237 -174.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -61.67 -56.69 21.53 Favored Glycine 0 C--N 1.343 0.925 0 N-CA-C 111.222 -0.751 . . . . 93.29 111.222 174.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 97.9 t -62.3 -29.69 47.24 Favored 'Isoleucine or valine' 0 C--N 1.345 0.384 0 N-CA-C 109.468 -0.567 . . . . 91.14 109.468 -175.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -65.94 -61.99 1.74 Allowed 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 124.194 0.934 . . . . 109.58 109.04 175.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -50.78 -39.26 52.11 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 123.798 0.686 . . . . 96.52 109.885 -171.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' ALA . . . . . 0.411 ' O ' ' N ' ' A' ' 113' ' ' HIS . . . -57.65 -91.42 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 124.336 1.054 . . . . 110.1 108.688 175.331 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 11.3 tp -3.41 -57.5 0.0 OUTLIER 'General case' 0 C--N 1.342 0.264 0 C-N-CA 127.461 2.305 . . . . 118.24 113.013 168.542 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HIS . . . . . 0.5 ' O ' ' C ' ' A' ' 114' ' ' ASN . 55.8 m80 -102.69 53.74 0.78 Allowed 'General case' 0 C--N 1.342 0.251 0 N-CA-C 110.252 -0.277 . . . . 140.91 110.252 -174.756 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ASN . . . . . 0.5 ' C ' ' O ' ' A' ' 113' ' ' HIS . 7.6 t-20 0.1 76.74 0.0 OUTLIER 'General case' 0 C--N 1.342 0.245 0 C-N-CA 125.102 1.361 . . . . 139.92 110.812 -172.191 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . . . -108.13 121.03 44.0 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.094 -0.706 . . . . 118.24 109.094 -174.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . . . -65.56 133.49 51.32 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 108.812 -0.81 . . . . 96.68 108.812 175.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 3.5 t -131.54 -26.59 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 N-CA-C 107.729 -1.212 . . . . 85.65 107.729 -177.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 109.05 -141.13 15.88 Favored Glycine 0 C--N 1.343 0.955 0 N-CA-C 110.691 -0.963 . . . . 73.53 110.691 -171.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -39.91 -55.91 1.91 Allowed 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 112.246 0.461 . . . . 99.93 112.246 -172.679 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.55 -12.66 23.95 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.58 -0.282 . . . . 75.2 111.346 -167.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -51.54 -41.42 61.06 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 107.935 -1.135 . . . . 86.0 107.935 174.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -58.07 -47.55 82.84 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 124.711 1.257 . . . . 89.62 108.512 179.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' TRP . . . . . . . . . . . . . 52.4 t-105 -64.45 -41.51 96.5 Favored 'General case' 0 C--O 1.221 -0.444 0 N-CA-C 108.704 -0.85 . . . . 75.63 108.704 -176.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 65.4 mt -71.25 -14.93 62.4 Favored 'General case' 0 N--CA 1.455 -0.203 0 O-C-N 121.692 -0.63 . . . . 71.74 112.074 -174.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 30.2 m-70 -53.33 -37.11 61.99 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 109.165 -0.68 . . . . 98.01 109.165 177.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 85.9 m-70 -50.5 -38.97 47.09 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 124.983 1.427 . . . . 77.95 110.728 176.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 40.6 t -84.45 -37.08 12.42 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 N-CA-C 108.961 -0.755 . . . . 73.75 108.961 -175.328 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -54.91 -30.14 57.63 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 119.436 -0.906 . . . . 105.03 109.694 171.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -67.91 -42.64 80.79 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 108.062 -1.088 . . . . 89.95 108.062 -174.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 50.4 t -62.05 -38.77 81.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 CA-C-N 115.317 -0.856 . . . . 80.86 108.769 176.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . . . -57.63 -51.88 67.69 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.213 -1.032 . . . . 82.34 108.213 175.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . . . -56.64 -54.75 42.4 Favored 'General case' 0 C--N 1.348 0.527 0 O-C-N 124.013 0.82 . . . . 77.65 110.319 177.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -48.55 -42.41 33.36 Favored 'General case' 0 C--N 1.343 0.318 0 C-N-CA 125.399 1.48 . . . . 87.91 112.262 -177.625 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -113.03 32.68 5.54 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.505 0.322 . . . . 88.39 110.53 -174.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -52.18 -61.63 2.15 Favored 'General case' 0 C--N 1.343 0.284 0 O-C-N 124.021 0.825 . . . . 80.1 111.856 -173.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.39 -46.01 87.23 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 123.106 0.562 . . . . 99.6 111.408 -176.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 7.5 tt -50.13 -52.6 33.73 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.329 -0.619 . . . . 101.41 109.329 176.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 77.3 mt -67.03 -20.15 65.81 Favored 'General case' 0 C--N 1.341 0.222 0 O-C-N 124.001 0.813 . . . . 85.42 110.58 -174.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' GLU . . . . . 0.457 ' O ' ' N ' ' A' ' 141' ' ' TRP . 5.6 tp10 -60.95 -58.26 9.17 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 124.073 0.858 . . . . 121.13 110.128 176.476 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' ASP . . . . . 0.621 ' CB ' ' OG ' ' A' ' 218' ' ' SER . 2.0 m-20 -65.49 12.24 0.05 Allowed 'General case' 0 CA--C 1.532 0.274 0 O-C-N 123.309 0.381 . . . . 146.03 110.353 -168.289 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' TRP . . . . . 0.706 ' O ' ' N ' ' A' ' 143' ' ' LEU . 86.2 m95 -113.18 57.65 0.63 Allowed Pre-proline 0 N--CA 1.455 -0.2 0 N-CA-C 109.467 -0.568 . . . . 124.0 109.467 168.724 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' PRO . . . . . 1.18 ' CG ' ' O ' ' A' ' 440' ' ' HOH . 36.5 Cg_exo -54.87 16.61 0.02 OUTLIER 'Trans proline' 0 C--N 1.357 1.013 0 N-CA-C 117.704 2.155 . . . . 142.0 117.704 -161.212 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' LEU . . . . . 0.706 ' N ' ' O ' ' A' ' 141' ' ' TRP . . . -93.79 -139.27 0.21 Allowed 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 121.706 0.765 . . . . 118.67 111.721 -168.249 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -126.16 -73.37 0.2 Allowed Glycine 0 CA--C 1.526 0.775 0 C-N-CA 125.002 1.287 . . . . 124.98 110.218 171.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' GLU . . . . . 0.66 ' CB ' ' O ' ' A' ' 443' ' ' HOH . . . -61.46 -37.11 82.39 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 124.007 0.923 . . . . 108.54 110.35 -172.598 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -51.35 -68.15 0.19 Allowed 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 108.739 -0.837 . . . . 109.75 108.739 172.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' ARG . . . . . 0.678 ' NE ' ' O ' ' A' ' 401' ' ' HOH . 19.5 mtt180 -42.02 -53.97 3.7 Favored 'General case' 0 N--CA 1.455 -0.175 0 O-C-N 123.961 0.788 . . . . 150.86 109.289 179.664 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -53.16 -60.76 2.88 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.205 -0.907 . . . . 98.43 109.307 -179.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . . . -45.62 -60.6 2.1 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 107.516 -1.29 . . . . 88.01 107.516 177.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 45.4 mmt-85 -56.33 -33.04 65.24 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.481 -0.781 . . . . 146.36 110.925 -175.47 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' LEU . . . . . 0.463 ' N ' ' O ' ' A' ' 147' ' ' ARG . 29.3 tp -70.77 -51.12 29.07 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 119.373 -0.931 . . . . 95.25 111.003 176.934 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' ILE . . . . . 0.676 ' CD1' ' C ' ' A' ' 102' ' ' HIS . 0.1 OUTLIER -59.91 -22.04 23.16 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 C-N-CA 115.683 -2.407 . . . . 90.62 109.263 -177.082 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -74.18 -65.73 0.81 Allowed 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 121.671 0.748 . . . . 109.8 109.319 179.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 22.0 mt -43.26 -50.15 6.58 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.816 -0.629 . . . . 82.81 112.081 174.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -48.11 -42.81 30.06 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 120.17 -0.612 . . . . 71.88 111.073 177.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -72.19 -28.55 63.27 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 119.283 -0.967 . . . . 81.72 111.733 -174.236 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' ILE . . . . . . . . . . . . . 3.6 mt -71.26 -50.0 44.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 N-CA-C 109.422 -0.584 . . . . 70.18 109.422 179.749 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . . . -56.47 -54.1 49.76 Favored 'General case' 0 N--CA 1.442 -0.87 0 N-CA-C 106.908 -1.516 . . . . 66.66 106.908 -178.106 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' GLN . . . . . 0.587 ' OE1' ' N ' ' A' ' 74' ' ' VAL . 16.4 mm-40 -47.84 -43.87 28.57 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.419 -0.585 . . . . 81.86 109.419 -178.864 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 2.1 t -58.97 -46.55 91.49 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-N 116.031 -0.531 . . . . 78.12 110.377 177.167 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . . . -49.87 -37.43 12.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 N-CA-C 108.738 -0.838 . . . . 76.57 108.738 176.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' ASN . . . . . 0.528 ' ND2' ' O ' ' A' ' 74' ' ' VAL . 68.7 m-20 -64.74 -49.49 70.6 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.775 0.83 . . . . 83.43 110.445 -176.106 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' VAL . . . . . . . . . . . . . 93.0 t -55.52 -47.19 78.9 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 O-C-N 123.855 0.722 . . . . 91.55 109.805 175.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 22.5 m -69.94 -24.13 63.31 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.414 -0.812 . . . . 91.84 109.352 -171.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . . . -85.72 -12.17 51.82 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 119.643 -0.823 . . . . 73.96 109.874 179.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 25.8 p -59.38 155.03 15.52 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 118.649 -1.22 . . . . 74.05 109.503 -175.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 58.5 p -65.01 -45.72 84.34 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 107.356 -1.35 . . . . 81.15 107.356 175.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 17.4 mt -42.53 -58.47 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.193 0 O-C-N 124.22 0.95 . . . . 79.87 109.977 -178.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 39.5 t -67.34 -49.32 72.99 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.216 0 O-C-N 124.674 1.234 . . . . 78.38 110.399 -175.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' ASN . . . . . 0.472 ' CB ' ' O ' ' A' ' 417' ' ' HOH . 18.6 m-80 -57.43 -38.44 74.4 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 120.602 -0.439 . . . . 111.78 110.56 -176.984 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -66.39 -39.56 89.12 Favored 'General case' 0 N--CA 1.449 -0.502 0 O-C-N 123.783 0.677 . . . . 99.38 110.923 179.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -62.18 -45.81 91.72 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.301 -0.629 . . . . 77.26 109.301 -178.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' TRP . . . . . . . . . . . . . 45.0 m0 -61.83 -52.05 65.76 Favored 'General case' 0 C--N 1.347 0.47 0 O-C-N 124.934 1.396 . . . . 90.66 109.054 175.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -42.82 -46.71 5.34 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 116.316 -0.402 . . . . 100.09 109.956 174.285 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -91.78 14.68 14.71 Favored 'General case' 0 C--N 1.344 0.335 0 O-C-N 123.482 0.489 . . . . 108.58 111.208 -170.521 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' GLY . . . . . . . . . . . . . . . 91.31 -25.63 14.37 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-N 116.36 -0.382 . . . . 111.92 113.752 170.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -52.01 119.76 15.02 Favored Pre-proline 0 N--CA 1.454 -0.269 0 C-N-CA 122.602 0.361 . . . . 110.35 110.162 -171.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -63.14 129.05 24.44 Favored 'Trans proline' 0 C--N 1.355 0.89 0 C-N-CA 122.427 2.085 . . . . 112.64 114.638 174.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 40.9 tp -158.24 137.83 11.94 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 115.234 -0.894 . . . . 99.75 109.32 -175.663 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 180' ' ' THR . . . . . . . . . . . . 0.468 2.0 t -134.2 146.1 49.82 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 117.84 -1.544 . . . . 84.54 112.509 172.854 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 181' ' ' VAL . . . . . . . . . . . . . 89.9 t -122.6 125.88 73.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-N 114.413 -1.267 . . . . 83.37 108.037 -168.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 19.8 m-70 -121.76 132.32 54.55 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 119.021 -0.514 . . . . 91.06 111.612 -171.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 183' ' ' ALA . . . . . . . . . . . . . . . -83.16 122.13 27.98 Favored 'General case' 0 C--N 1.353 0.756 0 C-N-CA 125.761 1.625 . . . . 83.59 108.993 163.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 17.0 mt -148.64 145.23 27.65 Favored 'General case' 0 C--N 1.342 0.258 0 C-N-CA 123.033 0.533 . . . . 92.29 111.099 -170.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 185' ' ' VAL . . . . . . . . . . . . . 8.8 p -134.35 152.58 34.05 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-N 115.167 -0.924 . . . . 94.46 108.976 -178.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 9.3 p90 -137.11 147.89 46.34 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 121.261 0.553 . . . . 94.11 110.438 173.223 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 187' ' ' GLY . . . . . . . . . . . . . . . -93.87 130.39 10.29 Favored Glycine 0 C--N 1.339 0.695 0 N-CA-C 110.984 -0.846 . . . . 93.92 110.984 177.226 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 1.1 m -80.67 -18.74 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.194 0 C-N-CA 118.408 -1.317 . . . . 106.36 108.034 178.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 189' ' ' HIS . . . . . . . . . . . . . 18.1 p80 -67.83 -42.12 81.96 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 124.764 1.226 . . . . 118.59 111.48 179.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -128.59 8.29 5.85 Favored 'General case' 0 C--N 1.342 0.247 0 O-C-N 123.705 0.628 . . . . 104.69 111.495 -166.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . 65.87 -23.95 0.14 Allowed Glycine 0 CA--C 1.527 0.839 0 CA-C-O 119.333 -0.704 . . . . 103.49 113.363 176.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 192' ' ' ARG . . . . . . . . . . . . . . . -65.85 156.38 33.5 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 117.336 0.568 . . . . 108.45 110.647 -173.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 193' ' ' MET . . . . . . . . . . . . . 1.2 mtp -122.66 121.91 37.55 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.299 -0.864 . . . . 124.07 110.195 -176.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 194' ' ' ARG . . . . . . . . . . . . . . . -94.01 140.26 29.93 Favored 'General case' 0 C--O 1.24 0.572 0 CA-C-O 121.301 0.572 . . . . 99.39 110.66 -175.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -92.64 127.02 37.98 Favored 'General case' 0 C--N 1.346 0.42 0 CA-C-N 114.657 -1.156 . . . . 115.6 108.173 172.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 196' ' ' LEU . . . . . . . . . . . . . 8.6 mt -94.52 4.04 54.35 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 120.33 -0.548 . . . . 85.39 111.01 179.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . 56.47 50.1 64.92 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.508 -1.037 . . . . 85.64 110.508 -171.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 198' ' ' MET . . . . . . . . . . . . . 9.4 tpt -128.15 82.16 2.07 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 108.952 -0.758 . . . . 102.73 108.952 179.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 199' ' ' ALA . . . . . . . . . . . . . . . -134.71 94.63 3.21 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-O 121.432 0.634 . . . . 87.76 111.358 -178.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 200' ' ' VAL . . . . . . . . . . . . . 44.6 t -92.22 150.43 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 N-CA-C 108.532 -0.914 . . . . 79.52 108.532 -178.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 36.6 m -136.18 -29.89 0.97 Allowed 'General case' 0 C--N 1.345 0.395 0 O-C-N 125.227 1.579 . . . . 97.77 111.23 -169.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HIS . . . . . 0.702 ' O ' ' N ' ' A' ' 204' ' ' GLU . . . -143.85 153.12 42.02 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 104.907 -2.257 . . . . 82.44 104.907 172.194 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' ALA . . . . . . . . . . . . . . . -50.87 73.14 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 119.065 0.848 . . . . 88.47 111.324 179.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' GLU . . . . . 0.936 ' CA ' ' O ' ' A' ' 410' ' ' HOH . 1.7 pt-20 -122.96 33.22 5.47 Favored 'General case' 0 C--N 1.347 0.476 0 C-N-CA 128.67 2.788 . . . . 107.29 107.93 167.04 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . . . -65.05 -46.81 79.71 Favored 'General case' 0 C--O 1.223 -0.32 0 N-CA-C 108.021 -1.103 . . . . 91.66 108.021 -174.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' LEU . . . . . 0.79 ' CD1' ' O ' ' A' ' 428' ' ' HOH . 1.3 tm? -49.82 -43.4 48.64 Favored 'General case' 0 C--N 1.34 0.164 0 O-C-N 123.866 0.729 . . . . 119.52 109.897 -167.701 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . . . -80.16 -50.02 10.87 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-O 119.226 -0.416 . . . . 89.5 110.948 178.642 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -56.91 -32.21 65.69 Favored 'General case' 0 C--N 1.346 0.444 0 C-N-CA 120.38 -0.528 . . . . 107.96 110.626 -173.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -87.33 -43.16 12.35 Favored 'General case' 0 C--O 1.225 -0.225 0 C-N-CA 120.257 -0.577 . . . . 114.49 110.481 -174.465 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' TYR . . . . . . . . . . . . . . . -49.62 -50.51 42.59 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 107.786 -1.19 . . . . 98.49 107.786 178.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' ARG . . . . . . . . . . . . . 53.2 mtt180 -47.68 -60.57 2.46 Favored 'General case' 0 C--N 1.347 0.486 0 C-N-CA 124.581 1.153 . . . . 135.33 109.51 174.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' ARG . . . . . . . . . . . . . . . -58.57 -36.52 74.08 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 125.365 1.466 . . . . 100.71 111.459 -171.611 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -80.32 -25.84 39.1 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 123.461 0.704 . . . . 91.66 110.65 -178.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 70.1 t -56.46 -48.24 80.44 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 N-CA-C 108.236 -1.024 . . . . 137.02 108.236 174.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -60.18 21.71 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.711 1.604 . . . . 128.66 112.673 -178.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' ALA . . . . . 0.417 ' O ' ' C ' ' A' ' 217' ' ' LEU . . . -106.27 -64.19 1.19 Allowed 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 121.38 -0.825 . . . . 152.44 109.297 159.4 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' LEU . . . . . 0.417 ' C ' ' O ' ' A' ' 216' ' ' ALA . . . 21.54 84.15 0.01 OUTLIER 'General case' 0 C--N 1.343 0.298 0 C-N-CA 125.434 1.493 . . . . 165.53 111.176 178.656 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' SER . . . . . 0.621 ' OG ' ' CB ' ' A' ' 140' ' ' ASP . 21.7 p . . . . . 0 C--O 1.248 1.001 0 CA-C-O 117.828 -1.082 . . . . 139.62 109.341 169.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 401' ' ' HOH . . . . . 0.678 ' O ' ' NE ' ' A' ' 147' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 402' ' ' HOH . . . . . 0.463 ' O ' ' CB ' ' A' ' 27' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 407' ' ' HOH . . . . . 0.517 ' O ' ' CB ' ' A' ' 143' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 410' ' ' HOH . . . . . 0.936 ' O ' ' CA ' ' A' ' 204' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 417' ' ' HOH . . . . . 0.472 ' O ' ' CB ' ' A' ' 170' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 422' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 426' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 428' ' ' HOH . . . . . 0.79 ' O ' ' CD1' ' A' ' 206' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 431' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 432' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 435' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 436' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 438' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 439' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 440' ' ' HOH . . . . . 1.18 ' O ' ' CG ' ' A' ' 142' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 441' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 442' ' ' HOH . . . . . 0.449 ' O ' ' CB ' ' A' ' 63' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 443' ' ' HOH . . . . . 0.66 ' O ' ' CB ' ' A' ' 145' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 444' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 445' ' ' HOH . . . . . 0.606 ' O ' ' CD1' ' A' ' 23' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 446' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 447' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 448' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 449' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 450' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 7' ' ' PRO . . . . . 0.534 ' HB3' ' O ' ' A' ' 431' ' ' HOH . 3.5 Cg_exo . . . . . 0 CA--C 1.529 0.226 0 CA-C-O 120.733 0.222 . . . . 181.44 111.993 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . . . 52.63 7.09 0.06 Allowed 'General case' 0 C--N 1.343 0.301 0 C-N-CA 125.221 1.409 . . . . 174.49 109.958 -172.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' SER . . . . . 0.429 ' H ' ' C ' ' A' ' 7' ' ' PRO . . . -55.24 -16.72 3.53 Favored 'General case' 0 N--CA 1.453 -0.308 0 O-C-N 124.184 0.927 . . . . 151.07 110.111 -172.929 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . . . 71.31 -51.41 0.69 Allowed 'General case' 0 C--N 1.347 0.457 0 C-N-CA 125.831 1.652 . . . . 115.08 109.353 -176.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . . . -124.47 28.96 6.45 Favored 'General case' 0 C--N 1.344 0.343 0 C-N-CA 123.684 0.794 . . . . 94.04 110.022 -176.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . . . -45.55 -54.42 7.59 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 125.332 1.453 . . . . 102.59 110.533 175.586 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -39.75 -41.42 1.1 Allowed 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.032 -0.985 . . . . 110.04 109.183 178.732 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 20.6 m-20 -79.79 -37.08 36.04 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 114.66 -1.154 . . . . 100.08 110.295 -168.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -70.7 -26.64 63.51 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 124.238 0.961 . . . . 106.58 110.324 173.703 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ASP . . . . . 0.402 ' C ' ' N ' ' A' ' 18' ' ' TRP . 14.4 m-20 -73.67 -56.08 5.46 Favored 'General case' 0 C--N 1.343 0.323 0 N-CA-C 109.601 -0.518 . . . . 134.89 109.601 176.426 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.49 -15.26 1.6 Allowed 'General case' 0 C--N 1.349 0.553 0 CA-C-O 121.922 0.868 . . . . 101.18 108.723 -179.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' TRP . . . . . 0.402 ' N ' ' C ' ' A' ' 16' ' ' ASP . 54.2 t-105 -81.95 -58.74 2.84 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 114.403 -1.271 . . . . 130.61 111.91 178.585 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' VAL . . . . . 0.433 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 0.3 OUTLIER -56.31 -36.8 47.73 Favored 'Isoleucine or valine' 0 C--N 1.353 0.741 0 N-CA-C 107.265 -1.383 . . . . 96.49 107.265 175.55 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . . . -52.46 -50.29 62.94 Favored 'General case' 0 N--CA 1.452 -0.355 0 O-C-N 124.347 1.029 . . . . 96.52 109.537 173.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.6 -49.43 63.11 Favored 'General case' 0 C--N 1.345 0.401 0 CA-C-O 119.523 -0.275 . . . . 136.62 110.316 -179.674 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . . . -53.14 -39.59 63.64 Favored 'General case' 0 C--N 1.344 0.337 0 O-C-N 123.572 0.545 . . . . 153.15 109.547 -171.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LEU . . . . . 0.988 HD11 ' O ' ' A' ' 445' ' ' HOH . 62.9 mt -71.58 -48.4 48.6 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 123.568 0.543 . . . . 129.22 110.767 -174.366 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -51.93 -9.4 0.09 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.998 1.319 . . . . 103.62 112.821 -176.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -104.98 31.06 5.06 Favored 'General case' 0 C--N 1.342 0.26 0 CA-C-O 121.177 0.513 . . . . 132.46 110.313 -174.167 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ASP . . . . . 0.931 ' OD1' ' HD3' ' A' ' 27' ' ' PRO 0.278 21.8 p-10 -29.57 -53.27 0.31 Allowed Pre-proline 0 CA--C 1.536 0.418 0 CA-C-O 117.721 -1.133 . . . . 174.38 113.507 175.3 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 27' ' ' PRO . . . . . 0.931 ' HD3' ' OD1' ' A' ' 26' ' ' ASP . 71.8 Cg_exo -48.56 74.53 0.01 OUTLIER 'Trans proline' 0 C--N 1.368 1.578 0 CA-C-N 122.123 1.794 . . . . 134.98 114.824 176.709 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' GLN . . . . . 0.55 ' N ' ' O ' ' A' ' 26' ' ' ASP . . . -53.44 119.15 4.47 Favored 'General case' 0 C--N 1.348 0.521 0 C-N-CA 125.068 1.347 . . . . 115.64 111.616 -156.129 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' TYR . . . . . 0.669 ' HB2' ' HD2' ' A' ' 32' ' ' ARG . 5.7 p90 -165.72 -3.5 0.03 OUTLIER 'General case' 0 C--N 1.347 0.494 0 N-CA-C 114.083 1.142 . . . . 152.21 114.083 -161.738 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 18.2 m-30 -49.57 -24.15 2.0 Allowed 'General case' 0 C--O 1.227 -0.113 0 C-N-CA 116.842 -1.943 . . . . 143.37 107.482 170.543 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' SER . . . . . 0.505 ' N ' ' C ' ' A' ' 29' ' ' TYR . 3.9 t -58.22 -50.37 73.79 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 127.669 2.387 . . . . 121.09 112.127 166.812 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ARG . . . . . 0.669 ' HD2' ' HB2' ' A' ' 29' ' ' TYR . 59.3 mtt-85 -50.23 -48.93 54.25 Favored 'General case' 0 C--N 1.346 0.431 0 C-N-CA 123.965 0.906 . . . . 202.03 110.209 171.019 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LEU . . . . . 0.524 ' O ' ' HB2' ' A' ' 36' ' ' GLN . 6.8 mt -63.06 -55.82 22.27 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.506 -0.77 . . . . 114.31 109.973 -178.89 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.75 -7.84 0.5 Allowed 'General case' 0 C--O 1.232 0.167 0 O-C-N 123.814 0.696 . . . . 100.64 110.874 -175.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ASP . . . . . 0.435 ' H ' ' C ' ' A' ' 33' ' ' LEU . 54.0 m-20 -112.41 19.24 17.8 Favored 'General case' 0 C--N 1.343 0.292 0 C-N-CA 123.216 0.607 . . . . 147.71 110.477 -171.762 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' GLN . . . . . 0.524 ' HB2' ' O ' ' A' ' 33' ' ' LEU . 44.1 tt0 -78.41 -17.48 56.34 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 113.293 0.849 . . . . 167.86 113.293 -145.647 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLN . . . . . 0.432 ' CB ' ' O ' ' A' ' 36' ' ' GLN . . . 81.28 178.43 0.09 Allowed 'General case' 0 C--N 1.341 0.196 0 CA-C-N 118.25 0.477 . . . . 120.9 110.762 -178.699 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.7 132.97 94.08 Favored Pre-proline 0 C--N 1.342 0.267 0 CA-C-N 114.922 -1.035 . . . . 121.01 109.844 -175.483 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -59.04 150.57 72.22 Favored 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 121.749 1.633 . . . . 109.5 109.795 161.679 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . . . -117.75 6.97 12.39 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 107.912 -1.144 . . . . 94.0 107.912 -179.654 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -137.8 138.53 39.3 Favored 'General case' 0 C--N 1.344 0.352 0 O-C-N 124.959 1.412 . . . . 104.8 112.267 179.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' LEU . . . . . 0.594 ' HB3' HG22 ' A' ' 97' ' ' VAL . 62.0 tp -103.26 124.33 48.45 Favored 'General case' 0 C--O 1.242 0.698 0 CA-C-N 114.698 -1.137 . . . . 89.55 109.502 160.196 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 8.3 t-105 -106.03 117.28 33.61 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 113.973 -1.467 . . . . 88.35 108.905 172.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 59.8 mt -104.55 116.47 48.42 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 N-CA-C 108.051 -1.092 . . . . 76.82 108.051 169.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -135.78 -168.54 11.57 Favored Glycine 0 CA--C 1.524 0.608 0 C-N-CA 119.305 -1.426 . . . . 85.82 112.75 -177.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 9.5 t -96.46 150.55 20.48 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 114.234 -0.983 . . . . 88.41 109.601 -172.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 45.5 m -71.17 -16.86 62.55 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 118.941 -0.552 . . . . 96.79 111.104 -178.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ASP . . . . . 0.53 ' HB2' ' NE2' ' A' ' 102' ' ' HIS . 72.0 m-20 -62.5 77.26 0.02 OUTLIER 'General case' 0 C--N 1.346 0.439 0 N-CA-C 107.324 -1.361 . . . . 105.9 107.324 159.172 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.5 m -80.86 69.66 7.47 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 107.302 -1.37 . . . . 103.98 107.302 -176.187 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . . . -62.22 -45.66 92.36 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 113.664 -1.607 . . . . 124.74 109.586 -174.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . . . -143.06 141.05 18.68 Favored Pre-proline 0 C--N 1.343 0.291 0 N-CA-C 109.493 -0.558 . . . . 117.06 109.493 168.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -68.65 153.69 72.9 Favored 'Trans proline' 0 C--N 1.361 1.198 0 C-N-CA 122.769 2.313 . . . . 92.72 114.572 -179.174 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.94 -61.72 1.8 Allowed 'General case' 0 N--CA 1.456 -0.14 0 CA-C-N 115.937 -0.574 . . . . 87.89 110.578 -164.394 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 10.8 p-10 -45.0 -55.16 5.78 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 124.026 0.829 . . . . 92.71 109.891 179.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' GLN . . . . . 0.471 ' O ' ' C ' ' A' ' 56' ' ' ILE . 3.5 tt0 -46.1 -73.77 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.375 1.07 . . . . 116.7 110.596 175.701 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ILE . . . . . 0.471 ' C ' ' O ' ' A' ' 55' ' ' GLN . 70.0 mt -31.69 -51.05 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 108.331 -0.988 . . . . 100.69 108.331 179.573 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . . . -96.54 4.31 9.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 CA-C-N 114.97 -1.014 . . . . 103.01 108.698 -162.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 51.2 76.8 0.15 Allowed Glycine 0 C--N 1.347 1.189 0 C-N-CA 125.978 1.751 . . . . 99.33 113.33 -178.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 24.7 mt -145.3 153.47 52.37 Favored Pre-proline 0 CA--C 1.519 -0.228 0 N-CA-C 107.354 -1.35 . . . . 92.68 107.354 176.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' PRO . . . . . 0.545 ' HG2' ' O ' ' A' ' 442' ' ' HOH . 9.5 Cg_endo -51.06 141.39 37.78 Favored 'Trans proline' 0 C--N 1.353 0.804 0 N-CA-C 109.539 -0.985 . . . . 104.24 109.539 167.867 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' PRO . . . . . 0.555 ' O ' ' N ' ' A' ' 63' ' ' GLU . 81.2 Cg_exo -47.68 170.13 0.06 OUTLIER 'Trans proline' 0 C--N 1.356 0.95 0 C-N-CA 122.097 1.865 . . . . 117.22 109.476 170.32 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 58.17 -14.11 0.02 OUTLIER Glycine 0 CA--C 1.531 1.078 0 CA-C-N 117.602 0.183 . . . . 108.83 113.412 174.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLU . . . . . 0.555 ' N ' ' O ' ' A' ' 61' ' ' PRO . . . -71.71 -17.53 62.21 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.368 -0.975 . . . . 103.99 108.368 173.084 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 17.6 t -120.13 128.35 75.95 Favored 'Isoleucine or valine' 0 C--N 1.343 0.307 0 O-C-N 124.319 1.012 . . . . 90.87 110.05 175.069 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -88.0 131.92 34.45 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 124.781 1.232 . . . . 91.97 109.199 177.524 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 74.3 t -129.71 133.33 65.1 Favored 'Isoleucine or valine' 0 C--N 1.343 0.318 0 C-N-CA 119.196 -1.002 . . . . 90.08 112.763 -164.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' HIS . . . . . 0.428 ' HB2' HG11 ' A' ' 84' ' ' VAL . 58.8 t60 -117.86 143.68 46.09 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 114.711 -1.132 . . . . 82.29 109.552 161.189 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 7.1 mtp85 -138.01 122.77 18.75 Favored 'General case' 0 C--N 1.348 0.529 0 N-CA-C 109.245 -0.65 . . . . 96.05 109.245 176.61 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 18.2 p30 -131.3 166.91 20.17 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 124.917 1.386 . . . . 85.37 109.062 168.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . 0.304 . . -67.2 108.14 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.343 0.326 0 N-CA-C 109.039 -0.726 . . . . 80.54 109.039 -177.589 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 86.76 20.31 0.07 Allowed 'General case' 0 C--O 1.234 0.253 0 C-N-CA 127.103 2.161 . . . . 64.01 111.358 173.9 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ASN . . . . . 0.437 ' O ' ' HG3' ' A' ' 159' ' ' GLN . 1.3 p-10 44.79 59.48 3.38 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-O 121.241 0.544 . . . . 85.46 109.645 175.52 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 50.7 t -99.98 133.39 43.11 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 N-CA-C 107.271 -1.381 . . . . 78.98 107.271 -178.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' VAL . . . . . 0.509 ' N ' ' OE1' ' A' ' 159' ' ' GLN . 72.0 t -107.88 103.17 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 N-CA-C 107.819 -1.178 . . . . 82.49 107.819 170.851 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' VAL . . . . . 0.514 HG12 ' H ' ' A' ' 77' ' ' THR . 88.6 t -82.22 133.11 29.87 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 O-C-N 124.091 0.869 . . . . 77.47 109.24 173.019 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -45.89 -34.53 3.91 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.174 0.99 . . . . 76.23 109.891 179.074 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' THR . . . . . 0.514 ' H ' HG12 ' A' ' 75' ' ' VAL . 19.1 p -118.04 15.08 14.18 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.65 -0.704 . . . . 73.05 111.262 -166.424 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ASP . . . . . 0.45 ' HB2' ' HB ' ' A' ' 75' ' ' VAL . 18.2 t0 -84.71 104.87 15.06 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.48 -0.933 . . . . 86.82 108.48 179.225 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 9.5 tp -78.03 -13.65 59.79 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 118.659 -1.217 . . . . 85.0 109.433 -176.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 34.9 t-20 -58.44 -55.07 39.82 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-O 122.317 1.055 . . . . 73.49 110.513 172.203 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 27.1 t -77.73 -50.88 11.51 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.218 -0.901 . . . . 84.26 110.231 -178.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 27.1 mt -46.52 -42.82 16.28 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 119.614 -0.834 . . . . 70.51 109.437 -179.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -54.88 -56.69 16.8 Favored 'General case' 0 C--N 1.348 0.511 0 C-N-CA 123.7 0.8 . . . . 74.12 110.366 179.303 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 84' ' ' VAL . . . . . 0.428 HG11 ' HB2' ' A' ' 67' ' ' HIS . 75.3 t -45.61 -46.46 4.63 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 C-N-CA 124.217 1.007 . . . . 81.59 109.971 174.41 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 27.0 mt -71.55 -50.53 39.15 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 C-N-CA 122.55 0.34 . . . . 71.15 111.164 -173.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' GLN . . . . . 0.488 ' O ' ' HB2' ' A' ' 90' ' ' ASP . 23.7 tm0? -56.71 -32.5 65.55 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 119.984 -0.686 . . . . 90.99 109.798 176.638 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -74.76 -42.43 58.22 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 120.998 0.428 . . . . 87.42 110.846 179.128 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.7 -47.58 68.97 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 120.167 -0.613 . . . . 80.28 111.312 -178.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 83.9 t -73.55 -61.09 1.83 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 124.05 0.94 . . . . 74.01 111.242 -176.045 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ASP . . . . . 0.488 ' HB2' ' O ' ' A' ' 86' ' ' GLN . 56.0 m-20 -68.07 -32.05 72.11 Favored 'General case' 0 C--N 1.344 0.352 0 CA-C-N 116.387 -0.369 . . . . 105.6 111.357 -170.214 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 4.3 tp -116.22 -24.78 7.83 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 118.756 -1.178 . . . . 98.96 112.476 -171.297 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 13.0 mt -102.41 -6.36 23.07 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 114.968 -2.693 . . . . 84.34 107.474 -177.309 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 15.8 mmtm 39.2 59.74 1.64 Allowed 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 126.0 2.062 . . . . 121.96 107.416 -172.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 33.2 m -68.94 147.91 11.94 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 108.183 -1.043 . . . . 78.03 108.183 174.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . . . -82.14 -32.59 30.0 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 119.642 -0.823 . . . . 88.48 108.894 -173.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 75.5 m-70 -136.9 133.76 36.09 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.456 -0.572 . . . . 93.64 109.456 -168.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' VAL . . . . . 0.594 HG22 ' HB3' ' A' ' 42' ' ' LEU . 46.2 t -108.84 140.35 27.83 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 N-CA-C 107.533 -1.284 . . . . 90.75 107.533 162.487 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 2.5 ptt? -144.72 123.71 12.79 Favored 'General case' 0 C--O 1.241 0.642 0 CA-C-O 121.776 0.798 . . . . 96.83 111.472 178.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' VAL . . . . . 0.478 HG11 ' HB2' ' A' ' 159' ' ' GLN . 89.0 t -85.07 113.1 23.03 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 N-CA-C 105.853 -1.906 . . . . 91.76 105.853 175.26 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 100' ' ' VAL . . . . . 0.548 ' HA ' ' O ' ' A' ' 184' ' ' LEU . 2.9 t -115.12 105.32 18.38 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 C-N-CA 119.599 -0.84 . . . . 74.6 110.124 -176.499 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -80.19 174.03 54.97 Favored Glycine 0 CA--C 1.529 0.925 0 CA-C-N 115.534 -0.757 . . . . 92.07 111.848 168.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' HIS . . . . . 0.691 ' C ' HD12 ' A' ' 152' ' ' ILE . 6.1 p80 -149.96 125.52 10.3 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.444 0.64 . . . . 94.25 111.123 -170.534 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' TYR . . . . . 0.904 ' HA ' HD13 ' A' ' 152' ' ' ILE . 61.3 m-85 -59.81 136.16 57.92 Favored 'General case' 0 C--N 1.342 0.262 0 CA-C-N 116.041 -0.527 . . . . 92.66 110.299 -175.027 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' GLY . . . . . 0.595 ' HA2' ' CE2' ' A' ' 148' ' ' TYR . . . 78.32 22.21 68.3 Favored Glycine 0 CA--C 1.524 0.635 0 O-C-N 124.94 1.4 . . . . 79.84 112.054 178.199 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 105' ' ' CYS . . . . . 0.55 ' HA ' ' CE1' ' A' ' 102' ' ' HIS . 47.4 t -58.41 127.95 34.7 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 125.64 1.576 . . . . 84.59 110.677 173.715 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 73.8 p -67.82 -34.96 77.76 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 124.64 1.176 . . . . 90.56 111.237 -174.481 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -61.67 -56.69 21.53 Favored Glycine 0 C--N 1.343 0.925 0 N-CA-C 111.222 -0.751 . . . . 93.29 111.222 174.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 97.9 t -62.3 -29.69 47.24 Favored 'Isoleucine or valine' 0 C--N 1.345 0.384 0 N-CA-C 109.468 -0.567 . . . . 91.14 109.468 -175.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -65.94 -61.99 1.74 Allowed 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 124.194 0.934 . . . . 109.58 109.04 175.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -50.78 -39.26 52.11 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 123.798 0.686 . . . . 96.52 109.885 -171.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' ALA . . . . . 0.411 ' O ' ' N ' ' A' ' 113' ' ' HIS . . . -57.65 -91.42 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 124.336 1.054 . . . . 110.1 108.688 175.331 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 112' ' ' LEU . . . . . 0.425 HD13 HD22 ' A' ' 151' ' ' LEU . 11.3 tp -3.41 -57.5 0.0 OUTLIER 'General case' 0 C--N 1.342 0.264 0 C-N-CA 127.461 2.305 . . . . 118.24 113.013 168.542 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HIS . . . . . 0.5 ' O ' ' C ' ' A' ' 114' ' ' ASN . 55.8 m80 -102.69 53.74 0.78 Allowed 'General case' 0 C--N 1.342 0.251 0 N-CA-C 110.252 -0.277 . . . . 140.91 110.252 -174.756 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ASN . . . . . 0.5 ' C ' ' O ' ' A' ' 113' ' ' HIS . 7.6 t-20 0.1 76.74 0.0 OUTLIER 'General case' 0 C--N 1.342 0.245 0 C-N-CA 125.102 1.361 . . . . 139.92 110.812 -172.191 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . . . -108.13 121.03 44.0 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.094 -0.706 . . . . 118.24 109.094 -174.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . . . -65.56 133.49 51.32 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 108.812 -0.81 . . . . 96.68 108.812 175.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 3.5 t -131.54 -26.59 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 N-CA-C 107.729 -1.212 . . . . 85.65 107.729 -177.169 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 109.05 -141.13 15.88 Favored Glycine 0 C--N 1.343 0.955 0 N-CA-C 110.691 -0.963 . . . . 73.53 110.691 -171.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -39.91 -55.91 1.91 Allowed 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 112.246 0.461 . . . . 99.93 112.246 -172.679 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.55 -12.66 23.95 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.58 -0.282 . . . . 75.2 111.346 -167.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -51.54 -41.42 61.06 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 107.935 -1.135 . . . . 86.0 107.935 174.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -58.07 -47.55 82.84 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 124.711 1.257 . . . . 89.62 108.512 179.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' TRP . . . . . . . . . . . . . 52.4 t-105 -64.45 -41.51 96.5 Favored 'General case' 0 C--O 1.221 -0.444 0 N-CA-C 108.704 -0.85 . . . . 75.63 108.704 -176.415 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 65.4 mt -71.25 -14.93 62.4 Favored 'General case' 0 N--CA 1.455 -0.203 0 O-C-N 121.692 -0.63 . . . . 71.74 112.074 -174.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 12.3 m170 -53.33 -37.11 61.99 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 109.165 -0.68 . . . . 98.01 109.165 177.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 85.9 m-70 -50.5 -38.97 47.09 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 124.983 1.427 . . . . 77.95 110.728 176.069 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 40.6 t -84.45 -37.08 12.42 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 N-CA-C 108.961 -0.755 . . . . 73.75 108.961 -175.328 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -54.91 -30.14 57.63 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 119.436 -0.906 . . . . 105.03 109.694 171.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -67.91 -42.64 80.79 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 108.062 -1.088 . . . . 89.95 108.062 -174.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 50.4 t -62.05 -38.77 81.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 CA-C-N 115.317 -0.856 . . . . 80.86 108.769 176.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . . . -57.63 -51.88 67.69 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.213 -1.032 . . . . 82.34 108.213 175.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . . . -56.64 -54.75 42.4 Favored 'General case' 0 C--N 1.348 0.527 0 O-C-N 124.013 0.82 . . . . 77.65 110.319 177.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' LYS . . . . . 0.485 ' HE3' ' O ' ' A' ' 419' ' ' HOH . 0.3 OUTLIER -48.55 -42.41 33.36 Favored 'General case' 0 C--N 1.343 0.318 0 C-N-CA 125.399 1.48 . . . . 87.91 112.262 -177.625 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -113.03 32.68 5.54 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.505 0.322 . . . . 88.39 110.53 -174.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -52.18 -61.63 2.15 Favored 'General case' 0 C--N 1.343 0.284 0 O-C-N 124.021 0.825 . . . . 80.1 111.856 -173.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.39 -46.01 87.23 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 123.106 0.562 . . . . 99.6 111.408 -176.489 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' LEU . . . . . 0.516 HD23 ' C ' ' A' ' 137' ' ' LEU . 7.5 tt -50.13 -52.6 33.73 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.329 -0.619 . . . . 101.41 109.329 176.142 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 77.3 mt -67.03 -20.15 65.81 Favored 'General case' 0 C--N 1.341 0.222 0 O-C-N 124.001 0.813 . . . . 85.42 110.58 -174.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' GLU . . . . . 0.511 ' OE2' ' HA ' ' A' ' 139' ' ' GLU . 5.6 tp10 -60.95 -58.26 9.17 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 124.073 0.858 . . . . 121.13 110.128 176.476 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 140' ' ' ASP . . . . . 0.893 ' HB2' ' OG ' ' A' ' 218' ' ' SER . 2.0 m-20 -65.49 12.24 0.05 Allowed 'General case' 0 CA--C 1.532 0.274 0 O-C-N 123.309 0.381 . . . . 146.03 110.353 -168.289 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 141' ' ' TRP . . . . . 0.653 ' O ' ' N ' ' A' ' 143' ' ' LEU . 86.2 m95 -113.18 57.65 0.63 Allowed Pre-proline 0 N--CA 1.455 -0.2 0 N-CA-C 109.467 -0.568 . . . . 124.0 109.467 168.724 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 142' ' ' PRO . . . . . 1.225 ' HG3' ' O ' ' A' ' 440' ' ' HOH . 36.5 Cg_exo -54.87 16.61 0.02 OUTLIER 'Trans proline' 0 C--N 1.357 1.013 0 N-CA-C 117.704 2.155 . . . . 142.0 117.704 -161.212 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 143' ' ' LEU . . . . . 0.653 ' N ' ' O ' ' A' ' 141' ' ' TRP . . . -93.79 -139.27 0.21 Allowed 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 121.706 0.765 . . . . 118.67 111.721 -168.249 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -126.16 -73.37 0.2 Allowed Glycine 0 CA--C 1.526 0.775 0 C-N-CA 125.002 1.287 . . . . 124.98 110.218 171.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' GLU . . . . . 0.66 ' CB ' ' O ' ' A' ' 443' ' ' HOH . . . -61.46 -37.11 82.39 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 124.007 0.923 . . . . 108.54 110.35 -172.598 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -51.35 -68.15 0.19 Allowed 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 108.739 -0.837 . . . . 109.75 108.739 172.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' ARG . . . . . 0.545 ' NE ' ' O ' ' A' ' 401' ' ' HOH . 19.5 mtt180 -42.02 -53.97 3.7 Favored 'General case' 0 N--CA 1.455 -0.175 0 O-C-N 123.961 0.788 . . . . 150.86 109.289 179.664 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 148' ' ' TYR . . . . . 0.595 ' CE2' ' HA2' ' A' ' 104' ' ' GLY . 34.0 t80 -53.16 -60.76 2.88 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.205 -0.907 . . . . 98.43 109.307 -179.902 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 149' ' ' ARG . . . . . 0.532 ' O ' ' HG3' ' A' ' 153' ' ' GLU . . . -45.62 -60.6 2.1 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 107.516 -1.29 . . . . 88.01 107.516 177.543 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 150' ' ' ARG . . . . . 0.445 ' HA ' ' OE1' ' A' ' 153' ' ' GLU . 45.4 mmt-85 -56.33 -33.04 65.24 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.481 -0.781 . . . . 146.36 110.925 -175.47 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 151' ' ' LEU . . . . . 0.425 HD22 HD13 ' A' ' 112' ' ' LEU . 29.3 tp -70.77 -51.12 29.07 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 119.373 -0.931 . . . . 95.25 111.003 176.934 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 152' ' ' ILE . . . . . 0.904 HD13 ' HA ' ' A' ' 103' ' ' TYR . 0.1 OUTLIER -59.91 -22.04 23.16 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 C-N-CA 115.683 -2.407 . . . . 90.62 109.263 -177.082 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 153' ' ' GLU . . . . . 0.532 ' HG3' ' O ' ' A' ' 149' ' ' ARG . 47.2 mt-10 -74.18 -65.73 0.81 Allowed 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 121.671 0.748 . . . . 109.8 109.319 179.065 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 22.0 mt -43.26 -50.15 6.58 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.816 -0.629 . . . . 82.81 112.081 174.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -48.11 -42.81 30.06 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 120.17 -0.612 . . . . 71.88 111.073 177.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -72.19 -28.55 63.27 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 119.283 -0.967 . . . . 81.72 111.733 -174.236 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 157' ' ' ILE . . . . . . . . . . . . . 3.6 mt -71.26 -50.0 44.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 N-CA-C 109.422 -0.584 . . . . 70.18 109.422 179.749 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . . . -56.47 -54.1 49.76 Favored 'General case' 0 N--CA 1.442 -0.87 0 N-CA-C 106.908 -1.516 . . . . 66.66 106.908 -178.106 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 159' ' ' GLN . . . . . 0.529 ' O ' ' HB2' ' A' ' 162' ' ' ASN . 16.4 mm-40 -47.84 -43.87 28.57 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.419 -0.585 . . . . 81.86 109.419 -178.864 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 2.1 t -58.97 -46.55 91.49 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-N 116.031 -0.531 . . . . 78.12 110.377 177.167 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . . . -49.87 -37.43 12.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 N-CA-C 108.738 -0.838 . . . . 76.57 108.738 176.279 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 162' ' ' ASN . . . . . 0.529 ' HB2' ' O ' ' A' ' 159' ' ' GLN . 68.7 m-20 -64.74 -49.49 70.6 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.775 0.83 . . . . 83.43 110.445 -176.106 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 163' ' ' VAL . . . . . . . . . . . . . 93.0 t -55.52 -47.19 78.9 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 O-C-N 123.855 0.722 . . . . 91.55 109.805 175.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 22.5 m -69.94 -24.13 63.31 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.414 -0.812 . . . . 91.84 109.352 -171.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . . . -85.72 -12.17 51.82 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 119.643 -0.823 . . . . 73.96 109.874 179.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 25.8 p -59.38 155.03 15.52 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 118.649 -1.22 . . . . 74.05 109.503 -175.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 58.5 p -65.01 -45.72 84.34 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 107.356 -1.35 . . . . 81.15 107.356 175.264 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 17.4 mt -42.53 -58.47 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.193 0 O-C-N 124.22 0.95 . . . . 79.87 109.977 -178.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 39.5 t -67.34 -49.32 72.99 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.216 0 O-C-N 124.674 1.234 . . . . 78.38 110.399 -175.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 170' ' ' ASN . . . . . 0.776 ' HB3' ' O ' ' A' ' 417' ' ' HOH . 18.6 m-80 -57.43 -38.44 74.4 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 120.602 -0.439 . . . . 111.78 110.56 -176.984 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 171' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -66.39 -39.56 89.12 Favored 'General case' 0 N--CA 1.449 -0.502 0 O-C-N 123.783 0.677 . . . . 99.38 110.923 179.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 172' ' ' ALA . . . . . 0.441 ' HA ' ' CZ ' ' A' ' 175' ' ' ARG . . . -62.18 -45.81 91.72 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.301 -0.629 . . . . 77.26 109.301 -178.342 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 173' ' ' TRP . . . . . . . . . . . . . 45.0 m0 -61.83 -52.05 65.76 Favored 'General case' 0 C--N 1.347 0.47 0 O-C-N 124.934 1.396 . . . . 90.66 109.054 175.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -42.82 -46.71 5.34 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 116.316 -0.402 . . . . 100.09 109.956 174.285 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 175' ' ' ARG . . . . . 0.441 ' CZ ' ' HA ' ' A' ' 172' ' ' ALA . 0.5 OUTLIER -91.78 14.68 14.71 Favored 'General case' 0 C--N 1.344 0.335 0 O-C-N 123.482 0.489 . . . . 108.58 111.208 -170.521 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 176' ' ' GLY . . . . . . . . . . . . . . . 91.31 -25.63 14.37 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-N 116.36 -0.382 . . . . 111.92 113.752 170.282 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -52.01 119.76 15.02 Favored Pre-proline 0 N--CA 1.454 -0.269 0 C-N-CA 122.602 0.361 . . . . 110.35 110.162 -171.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 178' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -63.14 129.05 24.44 Favored 'Trans proline' 0 C--N 1.355 0.89 0 C-N-CA 122.427 2.085 . . . . 112.64 114.638 174.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 40.9 tp -158.24 137.83 11.94 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 115.234 -0.894 . . . . 99.75 109.32 -175.663 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 180' ' ' THR . . . . . 0.582 ' HB ' ' OG ' ' A' ' 201' ' ' SER 0.468 2.0 t -134.2 146.1 49.82 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 117.84 -1.544 . . . . 84.54 112.509 172.854 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 181' ' ' VAL . . . . . 0.525 ' O ' ' HA ' ' A' ' 199' ' ' ALA . 89.9 t -122.6 125.88 73.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-N 114.413 -1.267 . . . . 83.37 108.037 -168.618 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 182' ' ' HIS . . . . . 0.66 ' HA ' ' O ' ' A' ' 198' ' ' MET . 19.8 m-70 -121.76 132.32 54.55 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 119.021 -0.514 . . . . 91.06 111.612 -171.086 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 183' ' ' ALA . . . . . 0.421 ' O ' HD23 ' A' ' 184' ' ' LEU . . . -83.16 122.13 27.98 Favored 'General case' 0 C--N 1.353 0.756 0 C-N-CA 125.761 1.625 . . . . 83.59 108.993 163.585 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 184' ' ' LEU . . . . . 0.548 ' O ' ' HA ' ' A' ' 100' ' ' VAL . 17.0 mt -148.64 145.23 27.65 Favored 'General case' 0 C--N 1.342 0.258 0 C-N-CA 123.033 0.533 . . . . 92.29 111.099 -170.155 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 185' ' ' VAL . . . . . . . . . . . . . 8.8 p -134.35 152.58 34.05 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-N 115.167 -0.924 . . . . 94.46 108.976 -178.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 186' ' ' TYR . . . . . 0.471 ' CB ' ' HG2' ' A' ' 193' ' ' MET . 9.3 p90 -137.11 147.89 46.34 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 121.261 0.553 . . . . 94.11 110.438 173.223 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 187' ' ' GLY . . . . . . . . . . . . . . . -93.87 130.39 10.29 Favored Glycine 0 C--N 1.339 0.695 0 N-CA-C 110.984 -0.846 . . . . 93.92 110.984 177.226 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 1.1 m -80.67 -18.74 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.194 0 C-N-CA 118.408 -1.317 . . . . 106.36 108.034 178.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 189' ' ' HIS . . . . . 0.41 ' ND1' ' HB3' ' A' ' 190' ' ' ASP . 18.1 p80 -67.83 -42.12 81.96 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 124.764 1.226 . . . . 118.59 111.48 179.279 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 190' ' ' ASP . . . . . 0.419 ' C ' ' H ' ' A' ' 192' ' ' ARG . 2.0 p-10 -128.59 8.29 5.85 Favored 'General case' 0 C--N 1.342 0.247 0 O-C-N 123.705 0.628 . . . . 104.69 111.495 -166.169 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . 65.87 -23.95 0.14 Allowed Glycine 0 CA--C 1.527 0.839 0 CA-C-O 119.333 -0.704 . . . . 103.49 113.363 176.981 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 192' ' ' ARG . . . . . 0.419 ' H ' ' C ' ' A' ' 190' ' ' ASP . . . -65.85 156.38 33.5 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 117.336 0.568 . . . . 108.45 110.647 -173.707 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 193' ' ' MET . . . . . 0.471 ' HG2' ' CB ' ' A' ' 186' ' ' TYR . 1.2 mtp -122.66 121.91 37.55 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.299 -0.864 . . . . 124.07 110.195 -176.118 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 194' ' ' ARG . . . . . . . . . . . . . . . -94.01 140.26 29.93 Favored 'General case' 0 C--O 1.24 0.572 0 CA-C-O 121.301 0.572 . . . . 99.39 110.66 -175.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -92.64 127.02 37.98 Favored 'General case' 0 C--N 1.346 0.42 0 CA-C-N 114.657 -1.156 . . . . 115.6 108.173 172.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 196' ' ' LEU . . . . . . . . . . . . . 8.6 mt -94.52 4.04 54.35 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 120.33 -0.548 . . . . 85.39 111.01 179.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . 56.47 50.1 64.92 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.508 -1.037 . . . . 85.64 110.508 -171.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 198' ' ' MET . . . . . 0.763 ' CE ' HG22 ' A' ' 209' ' ' THR . 9.4 tpt -128.15 82.16 2.07 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 108.952 -0.758 . . . . 102.73 108.952 179.981 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 199' ' ' ALA . . . . . 0.525 ' HA ' ' O ' ' A' ' 181' ' ' VAL . . . -134.71 94.63 3.21 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-O 121.432 0.634 . . . . 87.76 111.358 -178.854 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 200' ' ' VAL . . . . . . . . . . . . . 44.6 t -92.22 150.43 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 N-CA-C 108.532 -0.914 . . . . 79.52 108.532 -178.062 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 201' ' ' SER . . . . . 0.582 ' OG ' ' HB ' ' A' ' 180' ' ' THR . 36.6 m -136.18 -29.89 0.97 Allowed 'General case' 0 C--N 1.345 0.395 0 O-C-N 125.227 1.579 . . . . 97.77 111.23 -169.692 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HIS . . . . . 0.69 ' O ' ' N ' ' A' ' 204' ' ' GLU . . . -143.85 153.12 42.02 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 104.907 -2.257 . . . . 82.44 104.907 172.194 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 203' ' ' ALA . . . . . . . . . . . . . . . -50.87 73.14 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 119.065 0.848 . . . . 88.47 111.324 179.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 204' ' ' GLU . . . . . 1.19 ' HA ' ' O ' ' A' ' 410' ' ' HOH . 1.7 pt-20 -122.96 33.22 5.47 Favored 'General case' 0 C--N 1.347 0.476 0 C-N-CA 128.67 2.788 . . . . 107.29 107.93 167.04 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 205' ' ' GLN . . . . . 0.762 ' O ' HG23 ' A' ' 209' ' ' THR . . . -65.05 -46.81 79.71 Favored 'General case' 0 C--O 1.223 -0.32 0 N-CA-C 108.021 -1.103 . . . . 91.66 108.021 -174.082 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 206' ' ' LEU . . . . . 1.067 HD13 ' O ' ' A' ' 428' ' ' HOH . 1.3 tm? -49.82 -43.4 48.64 Favored 'General case' 0 C--N 1.34 0.164 0 O-C-N 123.866 0.729 . . . . 119.52 109.897 -167.701 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . . . -80.16 -50.02 10.87 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-O 119.226 -0.416 . . . . 89.5 110.948 178.642 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -56.91 -32.21 65.69 Favored 'General case' 0 C--N 1.346 0.444 0 C-N-CA 120.38 -0.528 . . . . 107.96 110.626 -173.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 209' ' ' THR . . . . . 0.763 HG22 ' CE ' ' A' ' 198' ' ' MET . 1.0 OUTLIER -87.33 -43.16 12.35 Favored 'General case' 0 C--O 1.225 -0.225 0 C-N-CA 120.257 -0.577 . . . . 114.49 110.481 -174.465 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 210' ' ' TYR . . . . . 0.828 ' O ' HG23 ' A' ' 214' ' ' VAL . . . -49.62 -50.51 42.59 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 107.786 -1.19 . . . . 98.49 107.786 178.231 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 211' ' ' ARG . . . . . 0.516 ' O ' ' HB ' ' A' ' 214' ' ' VAL . 53.2 mtt180 -47.68 -60.57 2.46 Favored 'General case' 0 C--N 1.347 0.486 0 C-N-CA 124.581 1.153 . . . . 135.33 109.51 174.091 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 212' ' ' ARG . . . . . . . . . . . . . . . -58.57 -36.52 74.08 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 125.365 1.466 . . . . 100.71 111.459 -171.611 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -80.32 -25.84 39.1 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 123.461 0.704 . . . . 91.66 110.65 -178.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 214' ' ' VAL . . . . . 0.828 HG23 ' O ' ' A' ' 210' ' ' TYR . 70.1 t -56.46 -48.24 80.44 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 N-CA-C 108.236 -1.024 . . . . 137.02 108.236 174.556 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -60.18 21.71 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.711 1.604 . . . . 128.66 112.673 -178.027 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 216' ' ' ALA . . . . . 0.772 ' HB2' ' O ' ' A' ' 434' ' ' HOH . . . -106.27 -64.19 1.19 Allowed 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 121.38 -0.825 . . . . 152.44 109.297 159.4 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 217' ' ' LEU . . . . . 0.417 ' C ' ' O ' ' A' ' 216' ' ' ALA . . . 21.54 84.15 0.01 OUTLIER 'General case' 0 C--N 1.343 0.298 0 C-N-CA 125.434 1.493 . . . . 165.53 111.176 178.656 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 218' ' ' SER . . . . . 0.893 ' OG ' ' HB2' ' A' ' 140' ' ' ASP . 21.7 p . . . . . 0 C--O 1.248 1.001 0 CA-C-O 117.828 -1.082 . . . . 139.62 109.341 169.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 301' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 401' ' ' HOH . . . . . 0.676 ' O ' ' HA ' ' A' ' 142' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 402' ' ' HOH . . . . . 0.553 ' O ' ' HB2' ' A' ' 27' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 407' ' ' HOH . . . . . 0.517 ' O ' ' CB ' ' A' ' 143' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 410' ' ' HOH . . . . . 1.19 ' O ' ' HA ' ' A' ' 204' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 417' ' ' HOH . . . . . 0.776 ' O ' ' HB3' ' A' ' 170' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 419' ' ' HOH . . . . . 0.485 ' O ' ' HE3' ' A' ' 133' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 422' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 426' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 428' ' ' HOH . . . . . 1.067 ' O ' HD13 ' A' ' 206' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 431' ' ' HOH . . . . . 0.534 ' O ' ' HB3' ' A' ' 7' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 432' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 434' ' ' HOH . . . . . 0.772 ' O ' ' HB2' ' A' ' 216' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 435' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 436' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 438' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 439' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 440' ' ' HOH . . . . . 1.225 ' O ' ' HG3' ' A' ' 142' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 441' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 442' ' ' HOH . . . . . 0.545 ' O ' ' HG2' ' A' ' 60' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 443' ' ' HOH . . . . . 0.66 ' O ' ' CB ' ' A' ' 145' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 444' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 445' ' ' HOH . . . . . 0.988 ' O ' HD11 ' A' ' 23' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 446' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 447' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 448' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 449' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 450' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.534 ' HB3' ' O ' ' A' ' 431' ' ' HOH . 3.5 Cg_exo . . . . . 0 CA--C 1.529 0.226 0 CA-C-O 120.733 0.222 . . . . 181.44 111.993 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . . . 52.63 7.09 0.06 Allowed 'General case' 0 C--N 1.343 0.301 0 C-N-CA 125.221 1.409 . . . . 174.49 109.958 -172.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' SER . . . . . 0.429 ' H ' ' C ' ' A' ' 7' ' ' PRO . . . -55.24 -16.72 3.53 Favored 'General case' 0 N--CA 1.453 -0.308 0 O-C-N 124.184 0.927 . . . . 151.07 110.111 -172.929 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . . . 71.31 -51.41 0.69 Allowed 'General case' 0 C--N 1.347 0.457 0 C-N-CA 125.831 1.652 . . . . 115.08 109.353 -176.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . . . -124.47 28.96 6.45 Favored 'General case' 0 C--N 1.344 0.343 0 C-N-CA 123.684 0.794 . . . . 94.04 110.022 -176.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . . . -45.55 -54.42 7.59 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 125.332 1.453 . . . . 102.59 110.533 175.586 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -39.75 -41.42 1.1 Allowed 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.032 -0.985 . . . . 110.04 109.183 178.732 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 20.6 m-20 -79.79 -37.08 36.04 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 114.66 -1.154 . . . . 100.08 110.295 -168.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -70.7 -26.64 63.51 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 124.238 0.961 . . . . 106.58 110.324 173.703 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.402 ' C ' ' N ' ' A' ' 18' ' ' TRP . 14.4 m-20 -73.67 -56.08 5.46 Favored 'General case' 0 C--N 1.343 0.323 0 N-CA-C 109.601 -0.518 . . . . 134.89 109.601 176.426 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.49 -15.26 1.6 Allowed 'General case' 0 C--N 1.349 0.553 0 CA-C-O 121.922 0.868 . . . . 101.18 108.723 -179.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.402 ' N ' ' C ' ' A' ' 16' ' ' ASP . 54.2 t-105 -81.95 -58.74 2.84 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 114.403 -1.271 . . . . 130.61 111.91 178.585 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.433 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 0.3 OUTLIER -56.31 -36.8 47.73 Favored 'Isoleucine or valine' 0 C--N 1.353 0.741 0 N-CA-C 107.265 -1.383 . . . . 96.49 107.265 175.55 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . . . -52.46 -50.29 62.94 Favored 'General case' 0 N--CA 1.452 -0.355 0 O-C-N 124.347 1.029 . . . . 96.52 109.537 173.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.6 -49.43 63.11 Favored 'General case' 0 C--N 1.345 0.401 0 CA-C-O 119.523 -0.275 . . . . 136.62 110.316 -179.674 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . . . -53.14 -39.59 63.64 Favored 'General case' 0 C--N 1.344 0.337 0 O-C-N 123.572 0.545 . . . . 153.15 109.547 -171.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.988 HD11 ' O ' ' A' ' 445' ' ' HOH . 62.9 mt -71.58 -48.4 48.6 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 123.568 0.543 . . . . 129.22 110.767 -174.366 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -51.93 -9.4 0.09 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.998 1.319 . . . . 103.62 112.821 -176.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -104.98 31.06 5.06 Favored 'General case' 0 C--N 1.342 0.26 0 CA-C-O 121.177 0.513 . . . . 132.46 110.313 -174.167 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.931 ' OD1' ' HD3' ' A' ' 27' ' ' PRO 0.278 21.8 p-10 -29.57 -53.27 0.31 Allowed Pre-proline 0 CA--C 1.536 0.418 0 CA-C-O 117.721 -1.133 . . . . 174.38 113.507 175.3 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.931 ' HD3' ' OD1' ' A' ' 26' ' ' ASP . 71.8 Cg_exo -48.56 74.53 0.01 OUTLIER 'Trans proline' 0 C--N 1.368 1.578 0 CA-C-N 122.123 1.794 . . . . 134.98 114.824 176.709 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.55 ' N ' ' O ' ' A' ' 26' ' ' ASP . . . -53.44 119.15 4.47 Favored 'General case' 0 C--N 1.348 0.521 0 C-N-CA 125.068 1.347 . . . . 115.64 111.616 -156.129 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.669 ' HB2' ' HD2' ' A' ' 32' ' ' ARG . 5.7 p90 -165.72 -3.5 0.03 OUTLIER 'General case' 0 C--N 1.347 0.494 0 N-CA-C 114.083 1.142 . . . . 152.21 114.083 -161.738 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 18.2 m-30 -49.57 -24.15 2.0 Allowed 'General case' 0 C--O 1.227 -0.113 0 C-N-CA 116.842 -1.943 . . . . 143.37 107.482 170.543 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' SER . . . . . 0.505 ' N ' ' C ' ' A' ' 29' ' ' TYR . 3.9 t -58.22 -50.37 73.79 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 127.669 2.387 . . . . 121.09 112.127 166.812 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.669 ' HD2' ' HB2' ' A' ' 29' ' ' TYR . 59.3 mtt-85 -50.23 -48.93 54.25 Favored 'General case' 0 C--N 1.346 0.431 0 C-N-CA 123.965 0.906 . . . . 202.03 110.209 171.019 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.524 ' O ' ' HB2' ' A' ' 36' ' ' GLN . 6.8 mt -63.06 -55.82 22.27 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.506 -0.77 . . . . 114.31 109.973 -178.89 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.75 -7.84 0.5 Allowed 'General case' 0 C--O 1.232 0.167 0 O-C-N 123.814 0.696 . . . . 100.64 110.874 -175.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.435 ' H ' ' C ' ' A' ' 33' ' ' LEU . 54.0 m-20 -112.41 19.24 17.8 Favored 'General case' 0 C--N 1.343 0.292 0 C-N-CA 123.216 0.607 . . . . 147.71 110.477 -171.762 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.524 ' HB2' ' O ' ' A' ' 33' ' ' LEU . 44.1 tt0 -78.41 -17.48 56.34 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 113.293 0.849 . . . . 167.86 113.293 -145.647 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.432 ' CB ' ' O ' ' A' ' 36' ' ' GLN . . . 81.28 178.43 0.09 Allowed 'General case' 0 C--N 1.341 0.196 0 CA-C-N 118.25 0.477 . . . . 120.9 110.762 -178.699 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.7 132.97 94.08 Favored Pre-proline 0 C--N 1.342 0.267 0 CA-C-N 114.922 -1.035 . . . . 121.01 109.844 -175.483 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -59.04 150.57 72.22 Favored 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 121.749 1.633 . . . . 109.5 109.795 161.679 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . . . -117.75 6.97 12.39 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 107.912 -1.144 . . . . 94.0 107.912 -179.654 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -137.8 138.53 39.3 Favored 'General case' 0 C--N 1.344 0.352 0 O-C-N 124.959 1.412 . . . . 104.8 112.267 179.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.594 ' HB3' HG22 ' A' ' 97' ' ' VAL . 62.0 tp -103.26 124.33 48.45 Favored 'General case' 0 C--O 1.242 0.698 0 CA-C-N 114.698 -1.137 . . . . 89.55 109.502 160.196 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 8.3 t-105 -106.03 117.28 33.61 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 113.973 -1.467 . . . . 88.35 108.905 172.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 59.8 mt -104.55 116.47 48.42 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 N-CA-C 108.051 -1.092 . . . . 76.82 108.051 169.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -135.78 -168.54 11.57 Favored Glycine 0 CA--C 1.524 0.608 0 C-N-CA 119.305 -1.426 . . . . 85.82 112.75 -177.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 9.5 t -96.46 150.55 20.48 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 114.234 -0.983 . . . . 88.41 109.601 -172.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 45.5 m -71.17 -16.86 62.55 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 118.941 -0.552 . . . . 96.79 111.104 -178.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.53 ' HB2' ' NE2' ' A' ' 102' ' ' HIS . 72.0 m-20 -62.5 77.26 0.02 OUTLIER 'General case' 0 C--N 1.346 0.439 0 N-CA-C 107.324 -1.361 . . . . 105.9 107.324 159.172 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.5 m -80.86 69.66 7.47 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 107.302 -1.37 . . . . 103.98 107.302 -176.187 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . . . -62.22 -45.66 92.36 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 113.664 -1.607 . . . . 124.74 109.586 -174.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . . . -143.06 141.05 18.68 Favored Pre-proline 0 C--N 1.343 0.291 0 N-CA-C 109.493 -0.558 . . . . 117.06 109.493 168.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -68.65 153.69 72.9 Favored 'Trans proline' 0 C--N 1.361 1.198 0 C-N-CA 122.769 2.313 . . . . 92.72 114.572 -179.174 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.94 -61.72 1.8 Allowed 'General case' 0 N--CA 1.456 -0.14 0 CA-C-N 115.937 -0.574 . . . . 87.89 110.578 -164.394 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 10.8 p-10 -45.0 -55.16 5.78 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 124.026 0.829 . . . . 92.71 109.891 179.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.471 ' O ' ' C ' ' A' ' 56' ' ' ILE . 3.5 tt0 -46.1 -73.77 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.375 1.07 . . . . 116.7 110.596 175.701 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.471 ' C ' ' O ' ' A' ' 55' ' ' GLN . 70.0 mt -31.69 -51.05 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 108.331 -0.988 . . . . 100.69 108.331 179.573 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . . . -96.54 4.31 9.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 CA-C-N 114.97 -1.014 . . . . 103.01 108.698 -162.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 51.2 76.8 0.15 Allowed Glycine 0 C--N 1.347 1.189 0 C-N-CA 125.978 1.751 . . . . 99.33 113.33 -178.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 24.7 mt -145.3 153.47 52.37 Favored Pre-proline 0 CA--C 1.519 -0.228 0 N-CA-C 107.354 -1.35 . . . . 92.68 107.354 176.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.545 ' HG2' ' O ' ' A' ' 442' ' ' HOH . 9.5 Cg_endo -51.06 141.39 37.78 Favored 'Trans proline' 0 C--N 1.353 0.804 0 N-CA-C 109.539 -0.985 . . . . 104.24 109.539 167.867 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.555 ' O ' ' N ' ' A' ' 63' ' ' GLU . 81.2 Cg_exo -47.68 170.13 0.06 OUTLIER 'Trans proline' 0 C--N 1.356 0.95 0 C-N-CA 122.097 1.865 . . . . 117.22 109.476 170.32 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 58.17 -14.11 0.02 OUTLIER Glycine 0 CA--C 1.531 1.078 0 CA-C-N 117.602 0.183 . . . . 108.83 113.412 174.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.555 ' N ' ' O ' ' A' ' 61' ' ' PRO . . . -71.71 -17.53 62.21 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.368 -0.975 . . . . 103.99 108.368 173.084 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 17.6 t -120.13 128.35 75.95 Favored 'Isoleucine or valine' 0 C--N 1.343 0.307 0 O-C-N 124.319 1.012 . . . . 90.87 110.05 175.069 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -88.0 131.92 34.45 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 124.781 1.232 . . . . 91.97 109.199 177.524 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 74.3 t -129.71 133.33 65.1 Favored 'Isoleucine or valine' 0 C--N 1.343 0.318 0 C-N-CA 119.196 -1.002 . . . . 90.08 112.763 -164.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.428 ' HB2' HG11 ' A' ' 84' ' ' VAL . 58.8 t60 -117.86 143.68 46.09 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 114.711 -1.132 . . . . 82.29 109.552 161.189 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 7.1 mtp85 -138.01 122.77 18.75 Favored 'General case' 0 C--N 1.348 0.529 0 N-CA-C 109.245 -0.65 . . . . 96.05 109.245 176.61 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 18.2 p30 -131.3 166.91 20.17 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 124.917 1.386 . . . . 85.37 109.062 168.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . 0.304 . . -67.2 108.14 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.343 0.326 0 N-CA-C 109.039 -0.726 . . . . 80.54 109.039 -177.589 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 86.76 20.31 0.07 Allowed 'General case' 0 C--O 1.234 0.253 0 C-N-CA 127.103 2.161 . . . . 64.01 111.358 173.9 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.437 ' O ' ' HG3' ' A' ' 159' ' ' GLN . 1.3 p-10 44.79 59.48 3.38 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-O 121.241 0.544 . . . . 85.46 109.645 175.52 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 50.7 t -99.98 133.39 43.11 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 N-CA-C 107.271 -1.381 . . . . 78.98 107.271 -178.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.509 ' N ' ' OE1' ' A' ' 159' ' ' GLN . 72.0 t -107.88 103.17 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 N-CA-C 107.819 -1.178 . . . . 82.49 107.819 170.851 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.514 HG12 ' H ' ' A' ' 77' ' ' THR . 88.6 t -82.22 133.11 29.87 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 O-C-N 124.091 0.869 . . . . 77.47 109.24 173.019 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -45.89 -34.53 3.91 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.174 0.99 . . . . 76.23 109.891 179.074 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' THR . . . . . 0.514 ' H ' HG12 ' A' ' 75' ' ' VAL . 19.1 p -118.04 15.08 14.18 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.65 -0.704 . . . . 73.05 111.262 -166.424 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.45 ' HB2' ' HB ' ' A' ' 75' ' ' VAL . 18.2 t0 -84.71 104.87 15.06 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.48 -0.933 . . . . 86.82 108.48 179.225 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 9.5 tp -78.03 -13.65 59.79 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 118.659 -1.217 . . . . 85.0 109.433 -176.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 34.9 t-20 -58.44 -55.07 39.82 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-O 122.317 1.055 . . . . 73.49 110.513 172.203 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 27.1 t -77.73 -50.88 11.51 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.218 -0.901 . . . . 84.26 110.231 -178.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 27.1 mt -46.52 -42.82 16.28 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 119.614 -0.834 . . . . 70.51 109.437 -179.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -54.88 -56.69 16.8 Favored 'General case' 0 C--N 1.348 0.511 0 C-N-CA 123.7 0.8 . . . . 74.12 110.366 179.303 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.428 HG11 ' HB2' ' A' ' 67' ' ' HIS . 75.3 t -45.61 -46.46 4.63 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 C-N-CA 124.217 1.007 . . . . 81.59 109.971 174.41 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 27.0 mt -71.55 -50.53 39.15 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 C-N-CA 122.55 0.34 . . . . 71.15 111.164 -173.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.488 ' O ' ' HB2' ' A' ' 90' ' ' ASP . 23.7 tm0? -56.71 -32.5 65.55 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 119.984 -0.686 . . . . 90.99 109.798 176.638 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -74.76 -42.43 58.22 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 120.998 0.428 . . . . 87.42 110.846 179.128 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.7 -47.58 68.97 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 120.167 -0.613 . . . . 80.28 111.312 -178.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 83.9 t -73.55 -61.09 1.83 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 124.05 0.94 . . . . 74.01 111.242 -176.045 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ASP . . . . . 0.488 ' HB2' ' O ' ' A' ' 86' ' ' GLN . 56.0 m-20 -68.07 -32.05 72.11 Favored 'General case' 0 C--N 1.344 0.352 0 CA-C-N 116.387 -0.369 . . . . 105.6 111.357 -170.214 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 4.3 tp -116.22 -24.78 7.83 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 118.756 -1.178 . . . . 98.96 112.476 -171.297 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 13.0 mt -102.41 -6.36 23.07 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 114.968 -2.693 . . . . 84.34 107.474 -177.309 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 15.8 mmtm 39.2 59.74 1.64 Allowed 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 126.0 2.062 . . . . 121.96 107.416 -172.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 33.2 m -68.94 147.91 11.94 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 108.183 -1.043 . . . . 78.03 108.183 174.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . . . -82.14 -32.59 30.0 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 119.642 -0.823 . . . . 88.48 108.894 -173.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 75.5 m-70 -136.9 133.76 36.09 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.456 -0.572 . . . . 93.64 109.456 -168.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.594 HG22 ' HB3' ' A' ' 42' ' ' LEU . 46.2 t -108.84 140.35 27.83 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 N-CA-C 107.533 -1.284 . . . . 90.75 107.533 162.487 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 2.5 ptt? -144.72 123.71 12.79 Favored 'General case' 0 C--O 1.241 0.642 0 CA-C-O 121.776 0.798 . . . . 96.83 111.472 178.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.478 HG11 ' HB2' ' A' ' 159' ' ' GLN . 89.0 t -85.07 113.1 23.03 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 N-CA-C 105.853 -1.906 . . . . 91.76 105.853 175.26 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.548 ' HA ' ' O ' ' A' ' 184' ' ' LEU . 2.9 t -115.12 105.32 18.38 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 C-N-CA 119.599 -0.84 . . . . 74.6 110.124 -176.499 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -80.19 174.03 54.97 Favored Glycine 0 CA--C 1.529 0.925 0 CA-C-N 115.534 -0.757 . . . . 92.07 111.848 168.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' HIS . . . . . 0.691 ' C ' HD12 ' A' ' 152' ' ' ILE . 6.1 p80 -149.96 125.52 10.3 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.444 0.64 . . . . 94.25 111.123 -170.534 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' TYR . . . . . 0.904 ' HA ' HD13 ' A' ' 152' ' ' ILE . 61.3 m-85 -59.81 136.16 57.92 Favored 'General case' 0 C--N 1.342 0.262 0 CA-C-N 116.041 -0.527 . . . . 92.66 110.299 -175.027 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' GLY . . . . . 0.595 ' HA2' ' CE2' ' A' ' 148' ' ' TYR . . . 78.32 22.21 68.3 Favored Glycine 0 CA--C 1.524 0.635 0 O-C-N 124.94 1.4 . . . . 79.84 112.054 178.199 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.55 ' HA ' ' CE1' ' A' ' 102' ' ' HIS . 47.4 t -58.41 127.95 34.7 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 125.64 1.576 . . . . 84.59 110.677 173.715 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 73.8 p -67.82 -34.96 77.76 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 124.64 1.176 . . . . 90.56 111.237 -174.481 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -61.67 -56.69 21.53 Favored Glycine 0 C--N 1.343 0.925 0 N-CA-C 111.222 -0.751 . . . . 93.29 111.222 174.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 97.9 t -62.3 -29.69 47.24 Favored 'Isoleucine or valine' 0 C--N 1.345 0.384 0 N-CA-C 109.468 -0.567 . . . . 91.14 109.468 -175.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -65.94 -61.99 1.74 Allowed 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 124.194 0.934 . . . . 109.58 109.04 175.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -50.78 -39.26 52.11 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 123.798 0.686 . . . . 96.52 109.885 -171.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' ALA . . . . . 0.411 ' O ' ' N ' ' A' ' 113' ' ' HIS . . . -57.65 -91.42 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 124.336 1.054 . . . . 110.1 108.688 175.331 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.425 HD13 HD22 ' A' ' 151' ' ' LEU . 11.3 tp -3.41 -57.5 0.0 OUTLIER 'General case' 0 C--N 1.342 0.264 0 C-N-CA 127.461 2.305 . . . . 118.24 113.013 168.542 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HIS . . . . . 0.5 ' O ' ' C ' ' A' ' 114' ' ' ASN . 55.8 m80 -102.69 53.74 0.78 Allowed 'General case' 0 C--N 1.342 0.251 0 N-CA-C 110.252 -0.277 . . . . 140.91 110.252 -174.756 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ASN . . . . . 0.5 ' C ' ' O ' ' A' ' 113' ' ' HIS . 7.6 t-20 0.1 76.74 0.0 OUTLIER 'General case' 0 C--N 1.342 0.245 0 C-N-CA 125.102 1.361 . . . . 139.92 110.812 -172.191 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . . . -108.13 121.03 44.0 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.094 -0.706 . . . . 118.24 109.094 -174.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . . . -65.56 133.49 51.32 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 108.812 -0.81 . . . . 96.68 108.812 175.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 3.5 t -131.54 -26.59 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 N-CA-C 107.729 -1.212 . . . . 85.65 107.729 -177.169 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 109.05 -141.13 15.88 Favored Glycine 0 C--N 1.343 0.955 0 N-CA-C 110.691 -0.963 . . . . 73.53 110.691 -171.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -39.91 -55.91 1.91 Allowed 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 112.246 0.461 . . . . 99.93 112.246 -172.679 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.55 -12.66 23.95 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.58 -0.282 . . . . 75.2 111.346 -167.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -51.54 -41.42 61.06 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 107.935 -1.135 . . . . 86.0 107.935 174.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ASN . . . . . 0.489 ' HA ' ' HD2' ' A' ' 125' ' ' HIS . 68.2 m-80 -58.07 -47.55 82.84 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 124.711 1.257 . . . . 89.62 108.512 179.879 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' TRP . . . . . . . . . . . . . 52.4 t-105 -64.45 -41.51 96.5 Favored 'General case' 0 C--O 1.221 -0.444 0 N-CA-C 108.704 -0.85 . . . . 75.63 108.704 -176.415 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 65.4 mt -71.25 -14.93 62.4 Favored 'General case' 0 N--CA 1.455 -0.203 0 O-C-N 121.692 -0.63 . . . . 71.74 112.074 -174.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' HIS . . . . . 0.489 ' HD2' ' HA ' ' A' ' 122' ' ' ASN . 30.2 m-70 -53.33 -37.11 61.99 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 109.165 -0.68 . . . . 98.01 109.165 177.88 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 85.9 m-70 -50.5 -38.97 47.09 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 124.983 1.427 . . . . 77.95 110.728 176.069 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 40.6 t -84.45 -37.08 12.42 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 N-CA-C 108.961 -0.755 . . . . 73.75 108.961 -175.328 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -54.91 -30.14 57.63 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 119.436 -0.906 . . . . 105.03 109.694 171.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -67.91 -42.64 80.79 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 108.062 -1.088 . . . . 89.95 108.062 -174.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 50.4 t -62.05 -38.77 81.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 CA-C-N 115.317 -0.856 . . . . 80.86 108.769 176.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . . . -57.63 -51.88 67.69 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.213 -1.032 . . . . 82.34 108.213 175.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . . . -56.64 -54.75 42.4 Favored 'General case' 0 C--N 1.348 0.527 0 O-C-N 124.013 0.82 . . . . 77.65 110.319 177.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.485 ' HE3' ' O ' ' A' ' 419' ' ' HOH . 0.3 OUTLIER -48.55 -42.41 33.36 Favored 'General case' 0 C--N 1.343 0.318 0 C-N-CA 125.399 1.48 . . . . 87.91 112.262 -177.625 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -113.03 32.68 5.54 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.505 0.322 . . . . 88.39 110.53 -174.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -52.18 -61.63 2.15 Favored 'General case' 0 C--N 1.343 0.284 0 O-C-N 124.021 0.825 . . . . 80.1 111.856 -173.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.39 -46.01 87.23 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 123.106 0.562 . . . . 99.6 111.408 -176.489 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.516 HD23 ' C ' ' A' ' 137' ' ' LEU . 7.5 tt -50.13 -52.6 33.73 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.329 -0.619 . . . . 101.41 109.329 176.142 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 77.3 mt -67.03 -20.15 65.81 Favored 'General case' 0 C--N 1.341 0.222 0 O-C-N 124.001 0.813 . . . . 85.42 110.58 -174.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.511 ' OE2' ' HA ' ' A' ' 139' ' ' GLU . 5.6 tp10 -60.95 -58.26 9.17 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 124.073 0.858 . . . . 121.13 110.128 176.476 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.893 ' HB2' ' OG ' ' A' ' 218' ' ' SER . 2.0 m-20 -65.49 12.24 0.05 Allowed 'General case' 0 CA--C 1.532 0.274 0 O-C-N 123.309 0.381 . . . . 146.03 110.353 -168.289 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' TRP . . . . . 0.653 ' O ' ' N ' ' A' ' 143' ' ' LEU . 86.2 m95 -113.18 57.65 0.63 Allowed Pre-proline 0 N--CA 1.455 -0.2 0 N-CA-C 109.467 -0.568 . . . . 124.0 109.467 168.724 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' PRO . . . . . 1.225 ' HG3' ' O ' ' A' ' 440' ' ' HOH . 36.5 Cg_exo -54.87 16.61 0.02 OUTLIER 'Trans proline' 0 C--N 1.357 1.013 0 N-CA-C 117.704 2.155 . . . . 142.0 117.704 -161.212 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.653 ' N ' ' O ' ' A' ' 141' ' ' TRP . . . -93.79 -139.27 0.21 Allowed 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 121.706 0.765 . . . . 118.67 111.721 -168.249 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -126.16 -73.37 0.2 Allowed Glycine 0 CA--C 1.526 0.775 0 C-N-CA 125.002 1.287 . . . . 124.98 110.218 171.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' GLU . . . . . 0.66 ' CB ' ' O ' ' A' ' 443' ' ' HOH . . . -61.46 -37.11 82.39 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 124.007 0.923 . . . . 108.54 110.35 -172.598 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -51.35 -68.15 0.19 Allowed 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 108.739 -0.837 . . . . 109.75 108.739 172.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' ARG . . . . . 0.545 ' NE ' ' O ' ' A' ' 401' ' ' HOH . 19.5 mtt180 -42.02 -53.97 3.7 Favored 'General case' 0 N--CA 1.455 -0.175 0 O-C-N 123.961 0.788 . . . . 150.86 109.289 179.664 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' TYR . . . . . 0.595 ' CE2' ' HA2' ' A' ' 104' ' ' GLY . 34.0 t80 -53.16 -60.76 2.88 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.205 -0.907 . . . . 98.43 109.307 -179.902 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' ARG . . . . . 0.532 ' O ' ' HG3' ' A' ' 153' ' ' GLU . . . -45.62 -60.6 2.1 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 107.516 -1.29 . . . . 88.01 107.516 177.543 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' ARG . . . . . 0.445 ' HA ' ' OE1' ' A' ' 153' ' ' GLU . 45.4 mmt-85 -56.33 -33.04 65.24 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.481 -0.781 . . . . 146.36 110.925 -175.47 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' LEU . . . . . 0.425 HD22 HD13 ' A' ' 112' ' ' LEU . 29.3 tp -70.77 -51.12 29.07 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 119.373 -0.931 . . . . 95.25 111.003 176.934 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' ILE . . . . . 0.904 HD13 ' HA ' ' A' ' 103' ' ' TYR . 0.1 OUTLIER -59.91 -22.04 23.16 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 C-N-CA 115.683 -2.407 . . . . 90.62 109.263 -177.082 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' GLU . . . . . 0.532 ' HG3' ' O ' ' A' ' 149' ' ' ARG . 47.2 mt-10 -74.18 -65.73 0.81 Allowed 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 121.671 0.748 . . . . 109.8 109.319 179.065 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 22.0 mt -43.26 -50.15 6.58 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.816 -0.629 . . . . 82.81 112.081 174.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -48.11 -42.81 30.06 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 120.17 -0.612 . . . . 71.88 111.073 177.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -72.19 -28.55 63.27 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 119.283 -0.967 . . . . 81.72 111.733 -174.236 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' ILE . . . . . . . . . . . . . 3.6 mt -71.26 -50.0 44.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 N-CA-C 109.422 -0.584 . . . . 70.18 109.422 179.749 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . . . -56.47 -54.1 49.76 Favored 'General case' 0 N--CA 1.442 -0.87 0 N-CA-C 106.908 -1.516 . . . . 66.66 106.908 -178.106 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' GLN . . . . . 0.529 ' O ' ' HB2' ' A' ' 162' ' ' ASN . 16.4 mm-40 -47.84 -43.87 28.57 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.419 -0.585 . . . . 81.86 109.419 -178.864 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 2.1 t -58.97 -46.55 91.49 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-N 116.031 -0.531 . . . . 78.12 110.377 177.167 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . . . -49.87 -37.43 12.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 N-CA-C 108.738 -0.838 . . . . 76.57 108.738 176.279 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' ASN . . . . . 0.529 ' HB2' ' O ' ' A' ' 159' ' ' GLN . 68.7 m-20 -64.74 -49.49 70.6 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.775 0.83 . . . . 83.43 110.445 -176.106 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' VAL . . . . . . . . . . . . . 93.0 t -55.52 -47.19 78.9 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 O-C-N 123.855 0.722 . . . . 91.55 109.805 175.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 22.5 m -69.94 -24.13 63.31 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.414 -0.812 . . . . 91.84 109.352 -171.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . . . -85.72 -12.17 51.82 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 119.643 -0.823 . . . . 73.96 109.874 179.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 25.8 p -59.38 155.03 15.52 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 118.649 -1.22 . . . . 74.05 109.503 -175.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 58.5 p -65.01 -45.72 84.34 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 107.356 -1.35 . . . . 81.15 107.356 175.264 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 17.4 mt -42.53 -58.47 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.193 0 O-C-N 124.22 0.95 . . . . 79.87 109.977 -178.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 39.5 t -67.34 -49.32 72.99 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.216 0 O-C-N 124.674 1.234 . . . . 78.38 110.399 -175.507 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' ASN . . . . . 0.776 ' HB3' ' O ' ' A' ' 417' ' ' HOH . 18.6 m-80 -57.43 -38.44 74.4 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 120.602 -0.439 . . . . 111.78 110.56 -176.984 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -66.39 -39.56 89.12 Favored 'General case' 0 N--CA 1.449 -0.502 0 O-C-N 123.783 0.677 . . . . 99.38 110.923 179.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' ALA . . . . . 0.441 ' HA ' ' CZ ' ' A' ' 175' ' ' ARG . . . -62.18 -45.81 91.72 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.301 -0.629 . . . . 77.26 109.301 -178.342 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' TRP . . . . . . . . . . . . . 45.0 m0 -61.83 -52.05 65.76 Favored 'General case' 0 C--N 1.347 0.47 0 O-C-N 124.934 1.396 . . . . 90.66 109.054 175.574 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -42.82 -46.71 5.34 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 116.316 -0.402 . . . . 100.09 109.956 174.285 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' ARG . . . . . 0.441 ' CZ ' ' HA ' ' A' ' 172' ' ' ALA . 0.5 OUTLIER -91.78 14.68 14.71 Favored 'General case' 0 C--N 1.344 0.335 0 O-C-N 123.482 0.489 . . . . 108.58 111.208 -170.521 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' GLY . . . . . . . . . . . . . . . 91.31 -25.63 14.37 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-N 116.36 -0.382 . . . . 111.92 113.752 170.282 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -52.01 119.76 15.02 Favored Pre-proline 0 N--CA 1.454 -0.269 0 C-N-CA 122.602 0.361 . . . . 110.35 110.162 -171.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -63.14 129.05 24.44 Favored 'Trans proline' 0 C--N 1.355 0.89 0 C-N-CA 122.427 2.085 . . . . 112.64 114.638 174.968 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 40.9 tp -158.24 137.83 11.94 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 115.234 -0.894 . . . . 99.75 109.32 -175.663 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 180' ' ' THR . . . . . 0.582 ' HB ' ' OG ' ' A' ' 201' ' ' SER 0.468 2.0 t -134.2 146.1 49.82 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 117.84 -1.544 . . . . 84.54 112.509 172.854 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 181' ' ' VAL . . . . . 0.525 ' O ' ' HA ' ' A' ' 199' ' ' ALA . 89.9 t -122.6 125.88 73.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-N 114.413 -1.267 . . . . 83.37 108.037 -168.618 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' HIS . . . . . 0.66 ' HA ' ' O ' ' A' ' 198' ' ' MET . 19.8 m-70 -121.76 132.32 54.55 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 119.021 -0.514 . . . . 91.06 111.612 -171.086 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 183' ' ' ALA . . . . . 0.421 ' O ' HD23 ' A' ' 184' ' ' LEU . . . -83.16 122.13 27.98 Favored 'General case' 0 C--N 1.353 0.756 0 C-N-CA 125.761 1.625 . . . . 83.59 108.993 163.585 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 184' ' ' LEU . . . . . 0.548 ' O ' ' HA ' ' A' ' 100' ' ' VAL . 17.0 mt -148.64 145.23 27.65 Favored 'General case' 0 C--N 1.342 0.258 0 C-N-CA 123.033 0.533 . . . . 92.29 111.099 -170.155 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 185' ' ' VAL . . . . . . . . . . . . . 8.8 p -134.35 152.58 34.05 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-N 115.167 -0.924 . . . . 94.46 108.976 -178.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 186' ' ' TYR . . . . . 0.471 ' CB ' ' HG2' ' A' ' 193' ' ' MET . 9.3 p90 -137.11 147.89 46.34 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 121.261 0.553 . . . . 94.11 110.438 173.223 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 187' ' ' GLY . . . . . . . . . . . . . . . -93.87 130.39 10.29 Favored Glycine 0 C--N 1.339 0.695 0 N-CA-C 110.984 -0.846 . . . . 93.92 110.984 177.226 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 1.1 m -80.67 -18.74 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.194 0 C-N-CA 118.408 -1.317 . . . . 106.36 108.034 178.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 189' ' ' HIS . . . . . 0.41 ' ND1' ' HB3' ' A' ' 190' ' ' ASP . 18.1 p80 -67.83 -42.12 81.96 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 124.764 1.226 . . . . 118.59 111.48 179.279 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 190' ' ' ASP . . . . . 0.419 ' C ' ' H ' ' A' ' 192' ' ' ARG . 2.0 p-10 -128.59 8.29 5.85 Favored 'General case' 0 C--N 1.342 0.247 0 O-C-N 123.705 0.628 . . . . 104.69 111.495 -166.169 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . 65.87 -23.95 0.14 Allowed Glycine 0 CA--C 1.527 0.839 0 CA-C-O 119.333 -0.704 . . . . 103.49 113.363 176.981 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 192' ' ' ARG . . . . . 0.419 ' H ' ' C ' ' A' ' 190' ' ' ASP . . . -65.85 156.38 33.5 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 117.336 0.568 . . . . 108.45 110.647 -173.707 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 193' ' ' MET . . . . . 0.471 ' HG2' ' CB ' ' A' ' 186' ' ' TYR . 1.2 mtp -122.66 121.91 37.55 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.299 -0.864 . . . . 124.07 110.195 -176.118 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 194' ' ' ARG . . . . . . . . . . . . . . . -94.01 140.26 29.93 Favored 'General case' 0 C--O 1.24 0.572 0 CA-C-O 121.301 0.572 . . . . 99.39 110.66 -175.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -92.64 127.02 37.98 Favored 'General case' 0 C--N 1.346 0.42 0 CA-C-N 114.657 -1.156 . . . . 115.6 108.173 172.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 196' ' ' LEU . . . . . . . . . . . . . 8.6 mt -94.52 4.04 54.35 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 120.33 -0.548 . . . . 85.39 111.01 179.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . 56.47 50.1 64.92 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.508 -1.037 . . . . 85.64 110.508 -171.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 198' ' ' MET . . . . . 0.763 ' CE ' HG22 ' A' ' 209' ' ' THR . 9.4 tpt -128.15 82.16 2.07 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 108.952 -0.758 . . . . 102.73 108.952 179.981 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 199' ' ' ALA . . . . . 0.525 ' HA ' ' O ' ' A' ' 181' ' ' VAL . . . -134.71 94.63 3.21 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-O 121.432 0.634 . . . . 87.76 111.358 -178.854 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 200' ' ' VAL . . . . . . . . . . . . . 44.6 t -92.22 150.43 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 N-CA-C 108.532 -0.914 . . . . 79.52 108.532 -178.062 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' SER . . . . . 0.582 ' OG ' ' HB ' ' A' ' 180' ' ' THR . 36.6 m -136.18 -29.89 0.97 Allowed 'General case' 0 C--N 1.345 0.395 0 O-C-N 125.227 1.579 . . . . 97.77 111.23 -169.692 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HIS . . . . . 0.69 ' O ' ' N ' ' A' ' 204' ' ' GLU . . . -143.85 153.12 42.02 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 104.907 -2.257 . . . . 82.44 104.907 172.194 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' ALA . . . . . . . . . . . . . . . -50.87 73.14 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 119.065 0.848 . . . . 88.47 111.324 179.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' GLU . . . . . 1.19 ' HA ' ' O ' ' A' ' 410' ' ' HOH . 1.7 pt-20 -122.96 33.22 5.47 Favored 'General case' 0 C--N 1.347 0.476 0 C-N-CA 128.67 2.788 . . . . 107.29 107.93 167.04 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' GLN . . . . . 0.762 ' O ' HG23 ' A' ' 209' ' ' THR . . . -65.05 -46.81 79.71 Favored 'General case' 0 C--O 1.223 -0.32 0 N-CA-C 108.021 -1.103 . . . . 91.66 108.021 -174.082 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' LEU . . . . . 1.067 HD13 ' O ' ' A' ' 428' ' ' HOH . 1.3 tm? -49.82 -43.4 48.64 Favored 'General case' 0 C--N 1.34 0.164 0 O-C-N 123.866 0.729 . . . . 119.52 109.897 -167.701 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . . . -80.16 -50.02 10.87 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-O 119.226 -0.416 . . . . 89.5 110.948 178.642 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -56.91 -32.21 65.69 Favored 'General case' 0 C--N 1.346 0.444 0 C-N-CA 120.38 -0.528 . . . . 107.96 110.626 -173.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' THR . . . . . 0.763 HG22 ' CE ' ' A' ' 198' ' ' MET . 1.0 OUTLIER -87.33 -43.16 12.35 Favored 'General case' 0 C--O 1.225 -0.225 0 C-N-CA 120.257 -0.577 . . . . 114.49 110.481 -174.465 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' TYR . . . . . 0.828 ' O ' HG23 ' A' ' 214' ' ' VAL . . . -49.62 -50.51 42.59 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 107.786 -1.19 . . . . 98.49 107.786 178.231 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' ARG . . . . . 0.516 ' O ' ' HB ' ' A' ' 214' ' ' VAL . 53.2 mtt180 -47.68 -60.57 2.46 Favored 'General case' 0 C--N 1.347 0.486 0 C-N-CA 124.581 1.153 . . . . 135.33 109.51 174.091 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' ARG . . . . . . . . . . . . . . . -58.57 -36.52 74.08 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 125.365 1.466 . . . . 100.71 111.459 -171.611 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -80.32 -25.84 39.1 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 123.461 0.704 . . . . 91.66 110.65 -178.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.828 HG23 ' O ' ' A' ' 210' ' ' TYR . 70.1 t -56.46 -48.24 80.44 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 N-CA-C 108.236 -1.024 . . . . 137.02 108.236 174.556 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -60.18 21.71 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.711 1.604 . . . . 128.66 112.673 -178.027 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' ALA . . . . . 0.772 ' HB2' ' O ' ' A' ' 434' ' ' HOH . . . -106.27 -64.19 1.19 Allowed 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 121.38 -0.825 . . . . 152.44 109.297 159.4 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' LEU . . . . . 0.417 ' C ' ' O ' ' A' ' 216' ' ' ALA . . . 21.54 84.15 0.01 OUTLIER 'General case' 0 C--N 1.343 0.298 0 C-N-CA 125.434 1.493 . . . . 165.53 111.176 178.656 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' SER . . . . . 0.893 ' OG ' ' HB2' ' A' ' 140' ' ' ASP . 21.7 p . . . . . 0 C--O 1.248 1.001 0 CA-C-O 117.828 -1.082 . . . . 139.62 109.341 169.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 401' ' ' HOH . . . . . 0.676 ' O ' ' HA ' ' A' ' 142' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 402' ' ' HOH . . . . . 0.553 ' O ' ' HB2' ' A' ' 27' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 407' ' ' HOH . . . . . 0.517 ' O ' ' CB ' ' A' ' 143' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 410' ' ' HOH . . . . . 1.19 ' O ' ' HA ' ' A' ' 204' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 417' ' ' HOH . . . . . 0.776 ' O ' ' HB3' ' A' ' 170' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 419' ' ' HOH . . . . . 0.485 ' O ' ' HE3' ' A' ' 133' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 422' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 426' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 428' ' ' HOH . . . . . 1.067 ' O ' HD13 ' A' ' 206' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 431' ' ' HOH . . . . . 0.534 ' O ' ' HB3' ' A' ' 7' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 432' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 434' ' ' HOH . . . . . 0.772 ' O ' ' HB2' ' A' ' 216' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 435' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 436' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 438' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 439' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 440' ' ' HOH . . . . . 1.225 ' O ' ' HG3' ' A' ' 142' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 441' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 442' ' ' HOH . . . . . 0.545 ' O ' ' HG2' ' A' ' 60' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 443' ' ' HOH . . . . . 0.66 ' O ' ' CB ' ' A' ' 145' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 444' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 445' ' ' HOH . . . . . 0.988 ' O ' HD11 ' A' ' 23' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 446' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 447' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 448' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 449' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 450' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_