data_4wo1_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 4wo1 _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.265 0 CA-C-O 120.648 0.261 . . . . 74.36 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 7.2 p -113.36 -91.58 0.5 Allowed 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 112.247 0.462 . . . . 71.16 112.247 -179.355 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 4.1 p -145.31 141.47 22.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 N-CA-C 108.923 -0.769 . . . . 40.46 108.923 172.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 85.5 p -73.9 153.0 88.99 Favored Pre-proline 0 CA--C 1.516 -0.343 0 N-CA-C 108.808 -0.812 . . . . 46.39 108.808 179.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -65.63 -28.79 52.47 Favored 'Trans proline' 0 N--CA 1.463 -0.303 0 O-C-N 122.602 0.79 . . . . 35.01 112.06 -175.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -74.9 -40.97 34.53 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 121.307 -0.473 . . . . 33.21 112.586 179.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.7 t -64.13 -43.37 97.41 Favored 'Isoleucine or valine' 0 C--O 1.246 0.882 0 CA-C-O 120.978 0.418 . . . . 34.42 110.938 177.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 43.2 tp -61.64 -45.06 95.67 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 119.685 -0.806 . . . . 24.74 111.215 179.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.35 -39.01 91.82 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.145 -0.687 . . . . 28.1 109.145 -174.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -64.4 -49.87 62.89 Favored Glycine 0 N--CA 1.453 -0.209 0 CA-C-N 116.072 -0.513 . . . . 31.81 111.937 -179.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 91.6 mt -54.6 -48.58 70.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 112.75 0.648 . . . . 44.78 112.75 176.048 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 72.8 t -72.61 -47.41 50.98 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.059 0 CA-C-N 115.943 -0.571 . . . . 29.07 110.474 -173.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 45.0 t -63.75 -39.42 85.32 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.407 0 N-CA-C 107.813 -1.18 . . . . 32.03 107.813 179.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.1 -42.4 97.04 Favored Glycine 0 CA--C 1.522 0.513 0 CA-C-N 115.915 -0.584 . . . . 27.43 112.761 171.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -62.35 -45.61 92.39 Favored 'General case' 0 CA--C 1.508 -0.665 0 N-CA-C 109.169 -0.678 . . . . 44.46 109.169 -179.174 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 70.1 mt -70.05 -40.19 75.25 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.667 -0.697 . . . . 26.9 111.901 -175.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 27.1 m -63.99 -39.85 86.94 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.343 0 C-N-CA 118.67 -1.212 . . . . 32.29 108.381 -178.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 46.9 tp -63.39 -42.47 98.82 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.428 0.632 . . . . 35.09 111.053 178.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 37.3 m -53.99 -43.32 69.9 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.419 -0.81 . . . . 29.74 111.572 174.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 41.0 t -67.33 -44.55 87.17 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.34 0 CA-C-N 116.184 -0.462 . . . . 33.03 111.796 178.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 17.1 tp -59.4 -42.5 91.88 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.849 -0.34 . . . . 42.86 111.907 178.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 74.6 mt -64.75 -45.19 95.89 Favored 'Isoleucine or valine' 0 C--O 1.24 0.593 0 CA-C-O 121.419 0.628 . . . . 30.72 110.747 178.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -56.76 -49.29 75.71 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.688 -0.687 . . . . 22.91 111.699 178.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 58.1 mt -56.74 -44.04 81.31 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 121.07 0.462 . . . . 30.72 110.968 176.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -69.41 -34.32 74.31 Favored 'General case' 0 C--O 1.218 -0.579 0 CA-C-N 115.651 -0.704 . . . . 22.77 110.529 -175.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 41.7 t -69.67 -41.75 80.21 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.654 0 N-CA-C 108.228 -1.027 . . . . 31.77 108.228 178.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 83.9 t80 -56.69 -53.18 60.71 Favored 'General case' 0 C--O 1.241 0.612 0 C-N-CA 119.58 -0.848 . . . . 36.86 110.433 178.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -74.48 -35.84 63.27 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 113.603 0.964 . . . . 31.66 113.603 -170.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 18.2 mt -63.84 -22.9 67.14 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.462 -0.495 . . . . 43.68 109.921 171.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -78.73 -18.93 74.39 Favored Glycine 0 C--N 1.334 0.463 0 CA-C-N 116.151 -0.477 . . . . 49.97 113.461 174.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . . . -74.48 -24.33 59.0 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.754 0.312 . . . . 54.49 110.713 176.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 16.2 mt . . . . . 0 C--O 1.233 0.23 0 N-CA-C 108.736 -0.839 . . . . 72.54 108.736 169.154 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.652 0 N-CA-C 112.452 0.538 . . . . 69.52 112.452 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 2.4 m 54.8 -118.73 1.34 Allowed 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.279 1.432 . . . . 81.44 113.535 175.717 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 7.2 p -148.27 142.72 19.15 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 N-CA-C 106.849 -1.538 . . . . 50.75 106.849 -170.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 44.4 p -79.72 150.28 72.43 Favored Pre-proline 0 CA--C 1.517 -0.302 0 N-CA-C 107.047 -1.464 . . . . 43.57 107.047 179.003 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -58.62 -34.04 98.6 Favored 'Trans proline' 0 CA--C 1.535 0.566 0 C-N-CA 120.811 1.007 . . . . 32.98 113.895 -175.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -71.9 -38.49 60.29 Favored Glycine 0 CA--C 1.519 0.298 0 C-N-CA 121.428 -0.415 . . . . 40.68 113.603 -177.061 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.5 t -69.39 -44.89 79.84 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 123.361 0.665 . . . . 40.17 111.586 179.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 54.5 tp -60.39 -40.62 91.56 Favored 'General case' 0 CA--C 1.507 -0.698 0 N-CA-C 109.154 -0.684 . . . . 35.04 109.154 175.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.29 -45.9 91.19 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.645 -0.707 . . . . 30.91 110.678 -177.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' GLY . . . . . . . . . . . . . . . -65.09 -42.83 96.39 Favored Glycine 0 C--O 1.222 -0.615 0 C-N-CA 121.479 -0.391 . . . . 36.82 113.33 179.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' ILE . . . . . . . . . . . . . 67.9 mt -60.79 -47.52 92.86 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 N-CA-C 113.045 0.757 . . . . 43.53 113.045 177.106 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 46.7 t -73.56 -41.2 55.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.871 -0.604 . . . . 28.69 111.015 -175.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 24.3 m -72.8 -31.96 38.55 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.545 0 C-N-CA 116.672 -2.011 . . . . 48.95 107.816 179.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.22 -36.19 91.43 Favored Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 109.161 -1.575 . . . . 33.22 109.161 178.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -62.25 -50.09 73.1 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.55 0.69 . . . . 36.83 111.823 178.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' LEU . . . . . . . . . . . . . 18.1 mt -72.34 -34.47 68.05 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.601 0.593 . . . . 29.23 112.601 -176.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 23.1 m -66.63 -37.76 80.22 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 C-N-CA 118.192 -1.403 . . . . 53.72 109.645 177.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 26.8 tp -63.25 -43.35 98.26 Favored 'General case' 0 CA--C 1.502 -0.872 0 CA-C-O 121.168 0.509 . . . . 38.88 109.639 176.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 19.3 m -58.61 -37.92 76.9 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.39 -0.823 . . . . 29.69 110.84 177.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 38.4 t -70.02 -38.1 74.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 C-N-CA 119.872 -0.731 . . . . 34.73 111.112 176.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 13.3 tp -65.23 -43.16 92.32 Favored 'General case' 0 CA--C 1.511 -0.541 0 C-N-CA 120.785 -0.366 . . . . 49.56 111.431 -178.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 80.2 mt -65.67 -38.35 82.09 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 CA-C-N 116.109 -0.496 . . . . 46.06 111.045 179.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.99 -54.14 49.62 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.744 -0.662 . . . . 27.26 111.923 177.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 76.0 mt -50.04 -47.18 53.5 Favored 'General case' 0 C--O 1.213 -0.829 0 CA-C-N 115.707 -0.679 . . . . 30.65 112.483 170.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.41 -47.93 81.92 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 111.902 0.334 . . . . 22.44 111.902 -178.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 14.6 t -62.96 -40.32 88.5 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.619 0 CA-C-N 116.636 -0.256 . . . . 35.52 110.312 178.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -58.82 -51.62 69.2 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 118.458 -1.297 . . . . 39.31 109.781 177.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -75.06 -33.31 61.7 Favored 'General case' 0 CA--C 1.517 -0.305 0 C-N-CA 119.666 -0.813 . . . . 41.0 111.837 -170.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 20.3 mt -62.2 -31.78 72.34 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 108.307 -0.997 . . . . 41.45 108.307 171.676 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -63.08 -26.75 69.49 Favored Glycine 0 CA--C 1.526 0.734 0 N-CA-C 114.446 0.538 . . . . 35.1 114.446 175.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' ARG . . . . . . . . . . . . . . . -81.77 -6.76 59.35 Favored 'General case' 0 C--N 1.33 -0.266 0 O-C-N 122.326 -0.514 . . . . 59.2 111.777 -178.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 80.7 mt . . . . . 0 C--N 1.331 -0.199 0 N-CA-C 109.869 -0.419 . . . . 66.55 109.869 176.626 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 9' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.352 0 N-CA-C 112.264 0.468 . . . . 52.76 112.264 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 10' ' ' THR . . . . . . . . . . . . . 4.9 t -131.32 146.69 52.4 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.172 -0.467 . . . . 61.78 111.092 177.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 11' ' ' VAL . . . . . . . . . . . . . 45.6 t -73.92 134.25 29.98 Favored 'Isoleucine or valine' 0 C--O 1.238 0.49 0 CA-C-N 116.611 -0.268 . . . . 39.71 111.012 -177.13 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 12' ' ' SER . . . . . . . . . . . . . 83.5 p -71.11 152.35 94.71 Favored Pre-proline 0 N--CA 1.467 0.423 0 N-CA-C 109.509 -0.552 . . . . 38.1 109.509 179.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 13' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_exo -55.34 -44.25 50.68 Favored 'Trans proline' 0 CA--C 1.516 -0.385 0 C-N-CA 121.194 1.263 . . . . 30.65 112.62 179.24 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.16 -46.47 94.17 Favored Glycine 0 C--O 1.245 0.796 0 O-C-N 123.907 0.755 . . . . 25.0 113.493 176.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 15' ' ' VAL . . . . . . . . . . . . . 42.0 t -60.1 -48.31 88.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 C-N-CA 120.038 -0.665 . . . . 29.51 111.02 176.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 16' ' ' LEU . . . . . . . . . . . . . 61.9 tp -54.07 -47.15 71.98 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 120.765 0.317 . . . . 31.42 110.602 177.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.03 -47.75 84.09 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-N 116.214 -0.448 . . . . 24.21 111.78 178.435 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 18' ' ' GLY . . . . . . . . . . . . . . . -61.76 -40.31 98.63 Favored Glycine 0 CA--C 1.522 0.526 0 C-N-CA 120.972 -0.632 . . . . 23.66 112.948 -179.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 19' ' ' ILE . . . . . . . . . . . . . 15.9 mm -67.12 -49.21 75.2 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.293 0 O-C-N 122.698 -0.296 . . . . 42.53 110.672 179.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 20' ' ' VAL . . . . . . . . . . . . . 38.4 t -54.36 -48.51 68.14 Favored 'Isoleucine or valine' 0 C--O 1.242 0.693 0 CA-C-N 116.171 -0.468 . . . . 37.53 111.033 177.269 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 21' ' ' VAL . . . . . . . . . . . . . 17.8 t -65.91 -40.03 86.33 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 CA-C-O 121.236 0.541 . . . . 28.46 111.831 -178.894 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.51 -43.5 94.08 Favored Glycine 0 C--O 1.241 0.584 0 N-CA-C 110.429 -1.068 . . . . 22.94 110.429 175.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -62.23 -51.3 68.32 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.225 0.536 . . . . 40.58 109.763 -178.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 24' ' ' LEU . . . . . . . . . . . . . 2.3 tp -57.63 -39.83 77.82 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.225 -0.443 . . . . 41.17 111.322 178.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 25' ' ' VAL . . . . . . . . . . . . . 50.3 t -66.3 -47.71 83.39 Favored 'Isoleucine or valine' 0 C--O 1.24 0.582 0 CA-C-O 121.326 0.584 . . . . 25.64 112.451 -178.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 33.3 tp -63.61 -37.68 88.27 Favored 'General case' 0 C--O 1.24 0.585 0 C-N-CA 120.357 -0.537 . . . . 43.49 111.399 175.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 27' ' ' THR . . . . . . . . . . . . . 94.6 m -58.23 -48.42 80.43 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 112.108 0.41 . . . . 23.3 112.108 176.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 28' ' ' VAL . . . . . . . . . . . . . 18.6 m -72.3 -27.37 26.33 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.252 0 C-N-CA 118.551 -1.26 . . . . 25.4 111.226 -176.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 79.2 mt -72.79 -36.89 67.71 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-O 121.27 0.557 . . . . 36.57 111.827 179.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 30' ' ' ILE . . . . . . . . . . . . . 35.9 mt -64.01 -42.28 95.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.633 -0.712 . . . . 26.28 109.641 176.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.74 -52.33 65.96 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 114.557 -1.201 . . . . 25.46 110.701 175.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 32' ' ' LEU . . . . . . . . . . . . . 44.3 tp -56.44 -39.73 73.6 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 123.34 0.4 . . . . 33.18 111.836 179.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.75 -47.56 84.23 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.437 0.532 . . . . 31.97 112.437 177.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 34' ' ' VAL . . . . . . . . . . . . . 91.1 t -68.44 -36.96 77.03 Favored 'Isoleucine or valine' 0 C--O 1.241 0.61 0 CA-C-O 121.045 0.45 . . . . 32.33 111.587 -177.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 35' ' ' TYR . . . . . . . . . . . . . 92.4 t80 -57.89 -48.75 78.95 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.826 -0.805 . . . . 45.71 108.826 173.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 36' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -63.62 -51.21 66.23 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 121.017 -0.273 . . . . 35.86 111.6 -179.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 37' ' ' LEU . . . . . . . . . . . . . 92.7 mt -64.58 -34.65 78.76 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.756 -0.378 . . . . 38.03 111.966 -176.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . -63.86 -29.18 74.06 Favored Glycine 0 CA--C 1.521 0.415 0 CA-C-N 116.396 -0.366 . . . . 42.82 112.65 178.02 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 39' ' ' ARG . . . . . . . . . . . . . . . -88.36 11.84 15.71 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.323 0.49 . . . . 63.11 112.323 -179.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 40' ' ' LEU . . . . . . . . . . . . . 21.5 mt . . . . . 0 C--O 1.234 0.276 0 CA-C-O 121.375 0.607 . . . . 87.84 112.088 179.962 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 9' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.149 0 CA-C-O 120.852 0.358 . . . . 59.48 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 10' ' ' THR . . . . . . . . . . . . . 1.2 t -137.81 149.5 46.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.27 0.557 . . . . 60.77 110.623 179.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 11' ' ' VAL . . . . . . . . . . . . . 58.9 t -81.41 129.43 37.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.852 -0.613 . . . . 39.57 111.303 -176.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 12' ' ' SER . . . . . . . . . . . . . 23.2 p -66.86 155.76 88.93 Favored Pre-proline 0 CA--C 1.534 0.331 0 CA-C-N 116.445 -0.343 . . . . 46.26 111.837 176.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 13' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -57.5 -42.48 60.72 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.015 1.81 . . . . 43.85 112.959 179.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . -57.19 -52.83 49.11 Favored Glycine 0 N--CA 1.447 -0.617 0 O-C-N 123.459 0.475 . . . . 38.13 112.71 178.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 15' ' ' VAL . . . . . . . . . . . . . 60.8 t -60.34 -44.15 95.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 116.871 0.335 . . . . 39.24 111.785 178.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 16' ' ' LEU . . . . . . . . . . . . . 29.9 tp -56.11 -46.29 79.17 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.173 -0.611 . . . . 31.93 110.523 177.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.78 -45.79 91.04 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.289 -0.414 . . . . 26.4 111.001 178.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 18' ' ' GLY . . . . . . . . . . . . . . . -57.66 -43.92 94.19 Favored Glycine 0 CA--C 1.527 0.8 0 C-N-CA 119.951 -1.119 . . . . 23.43 113.054 176.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 19' ' ' ILE . . . . . . . . . . . . . 25.5 mm -68.05 -43.87 85.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 O-C-N 122.425 -0.456 . . . . 40.4 109.959 -177.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 20' ' ' VAL . . . . . . . . . . . . . 9.2 t -61.16 -39.19 81.58 Favored 'Isoleucine or valine' 0 C--O 1.242 0.701 0 CA-C-O 121.356 0.598 . . . . 36.6 110.158 -178.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 21' ' ' VAL . . . . . . . . . . . . . 11.9 t -74.05 -40.19 51.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.212 -0.449 . . . . 33.85 111.287 179.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.91 -43.46 94.84 Favored Glycine 0 C--O 1.244 0.772 0 CA-C-O 121.188 0.327 . . . . 28.42 112.713 174.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 23' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -58.71 -53.33 59.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.766 -0.217 . . . . 36.49 111.459 174.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 24' ' ' LEU . . . . . . . . . . . . . 8.4 tt -54.16 -42.42 69.57 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.538 -0.301 . . . . 35.14 110.969 179.328 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 25' ' ' VAL . . . . . . . . . . . . . 28.4 t -68.98 -45.89 79.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 C-N-CA 120.832 -0.347 . . . . 26.48 110.617 -174.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 52.4 mt -63.11 -37.87 88.92 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.744 -0.382 . . . . 30.34 111.582 175.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 27' ' ' THR . . . . . . . . . . . . . 99.7 m -59.85 -48.91 79.79 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.615 0.598 . . . . 23.43 112.615 178.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 28' ' ' VAL . . . . . . . . . . . . . 25.3 m -70.1 -30.32 43.32 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 C-N-CA 119.913 -0.715 . . . . 23.54 111.119 -176.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 29' ' ' LEU . . . . . . . . . . . . . 80.1 mt -73.64 -31.96 63.78 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.022 0.439 . . . . 26.62 111.575 178.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 30' ' ' ILE . . . . . . . . . . . . . 43.0 mt -68.81 -38.33 78.62 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 N-CA-C 108.721 -0.844 . . . . 27.34 108.721 174.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.98 -45.56 77.32 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.083 -0.508 . . . . 22.26 110.721 177.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 32' ' ' LEU . . . . . . . . . . . . . 44.4 tp -57.75 -44.72 86.28 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.627 -0.261 . . . . 33.39 111.481 176.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.31 -41.6 76.23 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.548 0.573 . . . . 29.73 112.548 -179.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 34' ' ' VAL . . . . . . . . . . . . . 88.2 t -74.89 -31.45 25.73 Favored 'Isoleucine or valine' 0 C--O 1.244 0.803 0 CA-C-O 121.271 0.558 . . . . 35.54 111.697 -179.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 35' ' ' TYR . . . . . . . . . . . . . 86.4 t80 -59.12 -55.39 35.67 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 109.259 -0.645 . . . . 36.49 109.259 172.13 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 36' ' ' PHE . . . . . . . . . . . . . 19.1 m-30 -57.76 -49.02 77.96 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 112.75 0.648 . . . . 41.29 112.75 179.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 37' ' ' LEU . . . . . . . . . . . . . 42.4 mt -68.09 -39.4 82.89 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.268 -0.424 . . . . 45.87 111.615 -174.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 38' ' ' GLY . . . . . . . . . . . . . . . -61.5 -22.52 61.54 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 121.401 -0.428 . . . . 48.13 112.23 176.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 39' ' ' ARG . . . . . . . . . . . . . . . -79.24 -18.66 52.41 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.448 0.536 . . . . 67.36 112.448 -179.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 40' ' ' LEU . . . . . . . . . . . . . 18.6 mt . . . . . 0 C--N 1.329 -0.324 0 CA-C-O 121.341 0.591 . . . . 83.99 110.87 178.275 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' OLC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' OLC . . . . . 0.667 ' O23' ' O ' ' B' ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' OLC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 101' ' ' OLC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 101' ' ' OLC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 102' ' ' OLC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 201' ' ' HOH . . . . . 0.667 ' O ' ' O23' ' B' ' 101' ' ' OLC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.265 0 CA-C-O 120.648 0.261 . . . . 74.359999999999999 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 7.2 p -113.36 -91.58 0.5 Allowed 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 112.247 0.462 . . . . 71.159999999999997 112.247 -179.355 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' VAL . . . . . 0.461 ' HB ' HG23 ' B' ' 11' ' ' VAL . 4.1 p -145.31 141.47 22.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 N-CA-C 108.923 -0.769 . . . . 40.460000000000001 108.923 172.649 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 85.5 p -73.9 153.0 88.99 Favored Pre-proline 0 CA--C 1.516 -0.343 0 N-CA-C 108.808 -0.812 . . . . 46.390000000000001 108.808 179.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -65.63 -28.79 52.47 Favored 'Trans proline' 0 N--CA 1.463 -0.303 0 O-C-N 122.602 0.79 . . . . 35.009999999999998 112.06 -175.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -74.9 -40.97 34.53 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 121.307 -0.473 . . . . 33.210000000000001 112.586 179.657 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' VAL . . . . . 0.427 HG21 ' HA ' ' B' ' 10' ' ' THR . 21.7 t -64.13 -43.37 97.41 Favored 'Isoleucine or valine' 0 C--O 1.246 0.882 0 CA-C-O 120.978 0.418 . . . . 34.420000000000002 110.938 177.358 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 43.2 tp -61.64 -45.06 95.67 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 119.685 -0.806 . . . . 24.739999999999998 111.215 179.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.35 -39.01 91.82 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.145 -0.687 . . . . 28.100000000000001 109.145 -174.088 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -64.4 -49.87 62.89 Favored Glycine 0 N--CA 1.453 -0.209 0 CA-C-N 116.072 -0.513 . . . . 31.809999999999999 111.937 -179.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 91.6 mt -54.6 -48.58 70.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 112.75 0.648 . . . . 44.780000000000001 112.75 176.048 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 72.8 t -72.61 -47.41 50.98 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.059 0 CA-C-N 115.943 -0.571 . . . . 29.07 110.474 -173.414 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 45.0 t -63.75 -39.42 85.32 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.407 0 N-CA-C 107.813 -1.18 . . . . 32.030000000000001 107.813 179.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.1 -42.4 97.04 Favored Glycine 0 CA--C 1.522 0.513 0 CA-C-N 115.915 -0.584 . . . . 27.43 112.761 171.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -62.35 -45.61 92.39 Favored 'General case' 0 CA--C 1.508 -0.665 0 N-CA-C 109.169 -0.678 . . . . 44.460000000000001 109.169 -179.174 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 70.1 mt -70.05 -40.19 75.25 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.667 -0.697 . . . . 26.899999999999999 111.901 -175.75 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 27.1 m -63.99 -39.85 86.94 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.343 0 C-N-CA 118.67 -1.212 . . . . 32.289999999999999 108.381 -178.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 46.9 tp -63.39 -42.47 98.82 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.428 0.632 . . . . 35.090000000000003 111.053 178.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 37.3 m -53.99 -43.32 69.9 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.419 -0.81 . . . . 29.739999999999998 111.572 174.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 41.0 t -67.33 -44.55 87.17 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.34 0 CA-C-N 116.184 -0.462 . . . . 33.030000000000001 111.796 178.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 17.1 tp -59.4 -42.5 91.88 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.849 -0.34 . . . . 42.859999999999999 111.907 178.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 74.6 mt -64.75 -45.19 95.89 Favored 'Isoleucine or valine' 0 C--O 1.24 0.593 0 CA-C-O 121.419 0.628 . . . . 30.719999999999999 110.747 178.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ALA . . . . . 0.67 ' HB1' HG21 ' D' ' 34' ' ' VAL . . . -56.76 -49.29 75.71 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.688 -0.687 . . . . 22.91 111.699 178.132 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 58.1 mt -56.74 -44.04 81.31 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 121.07 0.462 . . . . 30.719999999999999 110.968 176.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -69.41 -34.32 74.31 Favored 'General case' 0 C--O 1.218 -0.579 0 CA-C-N 115.651 -0.704 . . . . 22.77 110.529 -175.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 41.7 t -69.67 -41.75 80.21 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.654 0 N-CA-C 108.228 -1.027 . . . . 31.77 108.228 178.056 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 83.9 t80 -56.69 -53.18 60.71 Favored 'General case' 0 C--O 1.241 0.612 0 C-N-CA 119.58 -0.848 . . . . 36.859999999999999 110.433 178.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -74.48 -35.84 63.27 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 113.603 0.964 . . . . 31.66 113.603 -170.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 18.2 mt -63.84 -22.9 67.14 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.462 -0.495 . . . . 43.68 109.921 171.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -78.73 -18.93 74.39 Favored Glycine 0 C--N 1.334 0.463 0 CA-C-N 116.151 -0.477 . . . . 49.969999999999999 113.461 174.055 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . . . -74.48 -24.33 59.0 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.754 0.312 . . . . 54.490000000000002 110.713 176.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 16.2 mt . . . . . 0 C--O 1.233 0.23 0 N-CA-C 108.736 -0.839 . . . . 72.540000000000006 108.736 169.154 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.652 0 N-CA-C 112.452 0.538 . . . . 69.519999999999996 112.452 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 10' ' ' THR . . . . . 0.642 HG22 HG12 ' B' ' 11' ' ' VAL . 2.4 m 54.8 -118.73 1.34 Allowed 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.279 1.432 . . . . 81.439999999999998 113.535 175.717 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 11' ' ' VAL . . . . . 0.642 HG12 HG22 ' B' ' 10' ' ' THR . 7.2 p -148.27 142.72 19.15 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 N-CA-C 106.849 -1.538 . . . . 50.75 106.849 -170.836 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 44.4 p -79.72 150.28 72.43 Favored Pre-proline 0 CA--C 1.517 -0.302 0 N-CA-C 107.047 -1.464 . . . . 43.57 107.047 179.003 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -58.62 -34.04 98.6 Favored 'Trans proline' 0 CA--C 1.535 0.566 0 C-N-CA 120.811 1.007 . . . . 32.979999999999997 113.895 -175.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -71.9 -38.49 60.29 Favored Glycine 0 CA--C 1.519 0.298 0 C-N-CA 121.428 -0.415 . . . . 40.68 113.603 -177.061 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.5 t -69.39 -44.89 79.84 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 123.361 0.665 . . . . 40.170000000000002 111.586 179.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 54.5 tp -60.39 -40.62 91.56 Favored 'General case' 0 CA--C 1.507 -0.698 0 N-CA-C 109.154 -0.684 . . . . 35.039999999999999 109.154 175.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' ALA . . . . . 0.44 ' O ' HG22 ' B' ' 21' ' ' VAL . . . -62.29 -45.9 91.19 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.645 -0.707 . . . . 30.91 110.678 -177.42 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 18' ' ' GLY . . . . . 0.685 ' HA3' ' H11' ' B' ' 102' ' ' OLC . . . -65.09 -42.83 96.39 Favored Glycine 0 C--O 1.222 -0.615 0 C-N-CA 121.479 -0.391 . . . . 36.82 113.33 179.216 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 19' ' ' ILE . . . . . . . . . . . . . 67.9 mt -60.79 -47.52 92.86 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 N-CA-C 113.045 0.757 . . . . 43.530000000000001 113.045 177.106 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 46.7 t -73.56 -41.2 55.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.871 -0.604 . . . . 28.690000000000001 111.015 -175.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' VAL . . . . . 0.471 HG23 ' H3 ' ' B' ' 102' ' ' OLC . 24.3 m -72.8 -31.96 38.55 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.545 0 C-N-CA 116.672 -2.011 . . . . 48.950000000000003 107.816 179.588 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 22' ' ' GLY . . . . . 0.647 ' HA3' ' H7 ' ' B' ' 102' ' ' OLC . . . -66.22 -36.19 91.43 Favored Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 109.161 -1.575 . . . . 33.219999999999999 109.161 178.039 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 23' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -62.25 -50.09 73.1 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.55 0.69 . . . . 36.829999999999998 111.823 178.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' LEU . . . . . . . . . . . . . 18.1 mt -72.34 -34.47 68.05 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.601 0.593 . . . . 29.23 112.601 -176.028 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 23.1 m -66.63 -37.76 80.22 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 C-N-CA 118.192 -1.403 . . . . 53.719999999999999 109.645 177.436 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 26.8 tp -63.25 -43.35 98.26 Favored 'General case' 0 CA--C 1.502 -0.872 0 CA-C-O 121.168 0.509 . . . . 38.880000000000003 109.639 176.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 19.3 m -58.61 -37.92 76.9 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.39 -0.823 . . . . 29.690000000000001 110.84 177.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 38.4 t -70.02 -38.1 74.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 C-N-CA 119.872 -0.731 . . . . 34.729999999999997 111.112 176.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 13.3 tp -65.23 -43.16 92.32 Favored 'General case' 0 CA--C 1.511 -0.541 0 C-N-CA 120.785 -0.366 . . . . 49.560000000000002 111.431 -178.727 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 80.2 mt -65.67 -38.35 82.09 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 CA-C-N 116.109 -0.496 . . . . 46.060000000000002 111.045 179.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' ALA . . . . . 0.49 ' HB1' HG21 ' C' ' 34' ' ' VAL . . . -59.99 -54.14 49.62 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.744 -0.662 . . . . 27.260000000000002 111.923 177.588 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 76.0 mt -50.04 -47.18 53.5 Favored 'General case' 0 C--O 1.213 -0.829 0 CA-C-N 115.707 -0.679 . . . . 30.649999999999999 112.483 170.846 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.41 -47.93 81.92 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 111.902 0.334 . . . . 22.440000000000001 111.902 -178.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 14.6 t -62.96 -40.32 88.5 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.619 0 CA-C-N 116.636 -0.256 . . . . 35.520000000000003 110.312 178.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -58.82 -51.62 69.2 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 118.458 -1.297 . . . . 39.310000000000002 109.781 177.891 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -75.06 -33.31 61.7 Favored 'General case' 0 CA--C 1.517 -0.305 0 C-N-CA 119.666 -0.813 . . . . 41.0 111.837 -170.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 20.3 mt -62.2 -31.78 72.34 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 108.307 -0.997 . . . . 41.450000000000003 108.307 171.676 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -63.08 -26.75 69.49 Favored Glycine 0 CA--C 1.526 0.734 0 N-CA-C 114.446 0.538 . . . . 35.100000000000001 114.446 175.297 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' ARG . . . . . . . . . . . . . . . -81.77 -6.76 59.35 Favored 'General case' 0 C--N 1.33 -0.266 0 O-C-N 122.326 -0.514 . . . . 59.200000000000003 111.777 -178.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 80.7 mt . . . . . 0 C--N 1.331 -0.199 0 N-CA-C 109.869 -0.419 . . . . 66.549999999999997 109.869 176.626 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 9' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.352 0 N-CA-C 112.264 0.468 . . . . 52.759999999999998 112.264 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 10' ' ' THR . . . . . . . . . . . . . 4.9 t -131.32 146.69 52.4 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.172 -0.467 . . . . 61.780000000000001 111.092 177.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 11' ' ' VAL . . . . . . . . . . . . . 45.6 t -73.92 134.25 29.98 Favored 'Isoleucine or valine' 0 C--O 1.238 0.49 0 CA-C-N 116.611 -0.268 . . . . 39.710000000000001 111.012 -177.13 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 12' ' ' SER . . . . . . . . . . . . . 83.5 p -71.11 152.35 94.71 Favored Pre-proline 0 N--CA 1.467 0.423 0 N-CA-C 109.509 -0.552 . . . . 38.100000000000001 109.509 179.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 13' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_exo -55.34 -44.25 50.68 Favored 'Trans proline' 0 CA--C 1.516 -0.385 0 C-N-CA 121.194 1.263 . . . . 30.649999999999999 112.62 179.24 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.16 -46.47 94.17 Favored Glycine 0 C--O 1.245 0.796 0 O-C-N 123.907 0.755 . . . . 25.0 113.493 176.775 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 15' ' ' VAL . . . . . . . . . . . . . 42.0 t -60.1 -48.31 88.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 C-N-CA 120.038 -0.665 . . . . 29.510000000000002 111.02 176.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 16' ' ' LEU . . . . . . . . . . . . . 61.9 tp -54.07 -47.15 71.98 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 120.765 0.317 . . . . 31.420000000000002 110.602 177.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.03 -47.75 84.09 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-N 116.214 -0.448 . . . . 24.210000000000001 111.78 178.435 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 18' ' ' GLY . . . . . 0.592 ' HA3' ' H21' ' C' ' 101' ' ' OLC . . . -61.76 -40.31 98.63 Favored Glycine 0 CA--C 1.522 0.526 0 C-N-CA 120.972 -0.632 . . . . 23.66 112.948 -179.205 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 19' ' ' ILE . . . . . . . . . . . . . 15.9 mm -67.12 -49.21 75.2 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.293 0 O-C-N 122.698 -0.296 . . . . 42.530000000000001 110.672 179.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 20' ' ' VAL . . . . . . . . . . . . . 38.4 t -54.36 -48.51 68.14 Favored 'Isoleucine or valine' 0 C--O 1.242 0.693 0 CA-C-N 116.171 -0.468 . . . . 37.530000000000001 111.033 177.269 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 21' ' ' VAL . . . . . . . . . . . . . 17.8 t -65.91 -40.03 86.33 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 CA-C-O 121.236 0.541 . . . . 28.460000000000001 111.831 -178.894 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.51 -43.5 94.08 Favored Glycine 0 C--O 1.241 0.584 0 N-CA-C 110.429 -1.068 . . . . 22.940000000000001 110.429 175.709 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -62.23 -51.3 68.32 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.225 0.536 . . . . 40.579999999999998 109.763 -178.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 24' ' ' LEU . . . . . . . . . . . . . 2.3 tp -57.63 -39.83 77.82 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.225 -0.443 . . . . 41.170000000000002 111.322 178.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 25' ' ' VAL . . . . . . . . . . . . . 50.3 t -66.3 -47.71 83.39 Favored 'Isoleucine or valine' 0 C--O 1.24 0.582 0 CA-C-O 121.326 0.584 . . . . 25.640000000000001 112.451 -178.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 33.3 tp -63.61 -37.68 88.27 Favored 'General case' 0 C--O 1.24 0.585 0 C-N-CA 120.357 -0.537 . . . . 43.490000000000002 111.399 175.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 27' ' ' THR . . . . . . . . . . . . . 94.6 m -58.23 -48.42 80.43 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 112.108 0.41 . . . . 23.300000000000001 112.108 176.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 28' ' ' VAL . . . . . . . . . . . . . 18.6 m -72.3 -27.37 26.33 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.252 0 C-N-CA 118.551 -1.26 . . . . 25.399999999999999 111.226 -176.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 79.2 mt -72.79 -36.89 67.71 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-O 121.27 0.557 . . . . 36.57 111.827 179.588 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 30' ' ' ILE . . . . . . . . . . . . . 35.9 mt -64.01 -42.28 95.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.633 -0.712 . . . . 26.280000000000001 109.641 176.645 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.74 -52.33 65.96 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 114.557 -1.201 . . . . 25.460000000000001 110.701 175.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 32' ' ' LEU . . . . . . . . . . . . . 44.3 tp -56.44 -39.73 73.6 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 123.34 0.4 . . . . 33.18 111.836 179.229 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.75 -47.56 84.23 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.437 0.532 . . . . 31.969999999999999 112.437 177.192 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 34' ' ' VAL . . . . . 0.49 HG21 ' HB1' ' B' ' 31' ' ' ALA . 91.1 t -68.44 -36.96 77.03 Favored 'Isoleucine or valine' 0 C--O 1.241 0.61 0 CA-C-O 121.045 0.45 . . . . 32.329999999999998 111.587 -177.701 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 35' ' ' TYR . . . . . 0.597 ' HA ' ' H8 ' ' A' ' 102' ' ' OLC . 92.4 t80 -57.89 -48.75 78.95 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.826 -0.805 . . . . 45.710000000000001 108.826 173.973 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 36' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -63.62 -51.21 66.23 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 121.017 -0.273 . . . . 35.859999999999999 111.6 -179.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 37' ' ' LEU . . . . . 0.431 ' HA ' HD12 ' C' ' 40' ' ' LEU . 92.7 mt -64.58 -34.65 78.76 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.756 -0.378 . . . . 38.030000000000001 111.966 -176.952 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . -63.86 -29.18 74.06 Favored Glycine 0 CA--C 1.521 0.415 0 CA-C-N 116.396 -0.366 . . . . 42.82 112.65 178.02 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 39' ' ' ARG . . . . . . . . . . . . . . . -88.36 11.84 15.71 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.323 0.49 . . . . 63.109999999999999 112.323 -179.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 40' ' ' LEU . . . . . 0.431 HD12 ' HA ' ' C' ' 37' ' ' LEU . 21.5 mt . . . . . 0 C--O 1.234 0.276 0 CA-C-O 121.375 0.607 . . . . 87.840000000000003 112.088 179.962 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 9' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.149 0 CA-C-O 120.852 0.358 . . . . 59.479999999999997 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 10' ' ' THR . . . . . . . . . . . . . 1.2 t -137.81 149.5 46.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.27 0.557 . . . . 60.770000000000003 110.623 179.774 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 11' ' ' VAL . . . . . . . . . . . . . 58.9 t -81.41 129.43 37.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.852 -0.613 . . . . 39.57 111.303 -176.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 12' ' ' SER . . . . . . . . . . . . . 23.2 p -66.86 155.76 88.93 Favored Pre-proline 0 CA--C 1.534 0.331 0 CA-C-N 116.445 -0.343 . . . . 46.259999999999998 111.837 176.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 13' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -57.5 -42.48 60.72 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.015 1.81 . . . . 43.850000000000001 112.959 179.578 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . -57.19 -52.83 49.11 Favored Glycine 0 N--CA 1.447 -0.617 0 O-C-N 123.459 0.475 . . . . 38.130000000000003 112.71 178.099 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 15' ' ' VAL . . . . . . . . . . . . . 60.8 t -60.34 -44.15 95.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 116.871 0.335 . . . . 39.240000000000002 111.785 178.976 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 16' ' ' LEU . . . . . . . . . . . . . 29.9 tp -56.11 -46.29 79.17 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.173 -0.611 . . . . 31.93 110.523 177.324 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.78 -45.79 91.04 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.289 -0.414 . . . . 26.399999999999999 111.001 178.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 18' ' ' GLY . . . . . . . . . . . . . . . -57.66 -43.92 94.19 Favored Glycine 0 CA--C 1.527 0.8 0 C-N-CA 119.951 -1.119 . . . . 23.43 113.054 176.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 19' ' ' ILE . . . . . . . . . . . . . 25.5 mm -68.05 -43.87 85.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 O-C-N 122.425 -0.456 . . . . 40.399999999999999 109.959 -177.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 20' ' ' VAL . . . . . . . . . . . . . 9.2 t -61.16 -39.19 81.58 Favored 'Isoleucine or valine' 0 C--O 1.242 0.701 0 CA-C-O 121.356 0.598 . . . . 36.600000000000001 110.158 -178.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 21' ' ' VAL . . . . . . . . . . . . . 11.9 t -74.05 -40.19 51.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.212 -0.449 . . . . 33.850000000000001 111.287 179.344 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 22' ' ' GLY . . . . . 0.463 ' HA2' ' H6 ' ' D' ' 102' ' ' OLC . . . -57.91 -43.46 94.84 Favored Glycine 0 C--O 1.244 0.772 0 CA-C-O 121.188 0.327 . . . . 28.420000000000002 112.713 174.438 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 23' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -58.71 -53.33 59.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.766 -0.217 . . . . 36.490000000000002 111.459 174.105 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 24' ' ' LEU . . . . . . . . . . . . . 8.4 tt -54.16 -42.42 69.57 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.538 -0.301 . . . . 35.140000000000001 110.969 179.328 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 25' ' ' VAL . . . . . . . . . . . . . 28.4 t -68.98 -45.89 79.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 C-N-CA 120.832 -0.347 . . . . 26.48 110.617 -174.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 52.4 mt -63.11 -37.87 88.92 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.744 -0.382 . . . . 30.34 111.582 175.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 27' ' ' THR . . . . . . . . . . . . . 99.7 m -59.85 -48.91 79.79 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.615 0.598 . . . . 23.43 112.615 178.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 28' ' ' VAL . . . . . . . . . . . . . 25.3 m -70.1 -30.32 43.32 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 C-N-CA 119.913 -0.715 . . . . 23.539999999999999 111.119 -176.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 29' ' ' LEU . . . . . . . . . . . . . 80.1 mt -73.64 -31.96 63.78 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.022 0.439 . . . . 26.620000000000001 111.575 178.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 30' ' ' ILE . . . . . . . . . . . . . 43.0 mt -68.81 -38.33 78.62 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 N-CA-C 108.721 -0.844 . . . . 27.34 108.721 174.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.98 -45.56 77.32 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.083 -0.508 . . . . 22.260000000000002 110.721 177.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 32' ' ' LEU . . . . . . . . . . . . . 44.4 tp -57.75 -44.72 86.28 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.627 -0.261 . . . . 33.390000000000001 111.481 176.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.31 -41.6 76.23 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.548 0.573 . . . . 29.73 112.548 -179.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 34' ' ' VAL . . . . . 0.67 HG21 ' HB1' ' A' ' 31' ' ' ALA . 88.2 t -74.89 -31.45 25.73 Favored 'Isoleucine or valine' 0 C--O 1.244 0.803 0 CA-C-O 121.271 0.558 . . . . 35.539999999999999 111.697 -179.675 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 35' ' ' TYR . . . . . . . . . . . . . 86.4 t80 -59.12 -55.39 35.67 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 109.259 -0.645 . . . . 36.490000000000002 109.259 172.13 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 36' ' ' PHE . . . . . . . . . . . . . 19.1 m-30 -57.76 -49.02 77.96 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 112.75 0.648 . . . . 41.289999999999999 112.75 179.059 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 37' ' ' LEU . . . . . . . . . . . . . 42.4 mt -68.09 -39.4 82.89 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.268 -0.424 . . . . 45.869999999999997 111.615 -174.334 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 38' ' ' GLY . . . . . . . . . . . . . . . -61.5 -22.52 61.54 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 121.401 -0.428 . . . . 48.130000000000003 112.23 176.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 39' ' ' ARG . . . . . . . . . . . . . . . -79.24 -18.66 52.41 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.448 0.536 . . . . 67.359999999999999 112.448 -179.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 40' ' ' LEU . . . . . . . . . . . . . 18.6 mt . . . . . 0 C--N 1.329 -0.324 0 CA-C-O 121.341 0.591 . . . . 83.989999999999995 110.87 178.275 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 102' ' ' OLC . . . . . 0.597 ' H8 ' ' HA ' ' C' ' 35' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' OLC . . . . . 0.621 ' O23' ' O ' ' B' ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' OLC . . . . . 0.685 ' H11' ' HA3' ' B' ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 101' ' ' OLC . . . . . 0.592 ' H21' ' HA3' ' C' ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 101' ' ' OLC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 102' ' ' OLC . . . . . 0.463 ' H6 ' ' HA2' ' D' ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 201' ' ' HOH . . . . . 0.621 ' O ' ' O23' ' B' ' 101' ' ' OLC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.265 0 CA-C-O 120.648 0.261 . . . . 74.359999999999999 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 7.2 p -113.36 -91.58 0.5 Allowed 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 112.247 0.462 . . . . 71.159999999999997 112.247 -179.355 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.461 ' HB ' HG23 ' B' ' 11' ' ' VAL . 4.1 p -145.31 141.47 22.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 N-CA-C 108.923 -0.769 . . . . 40.460000000000001 108.923 172.649 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 85.5 p -73.9 153.0 88.99 Favored Pre-proline 0 CA--C 1.516 -0.343 0 N-CA-C 108.808 -0.812 . . . . 46.390000000000001 108.808 179.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -65.63 -28.79 52.47 Favored 'Trans proline' 0 N--CA 1.463 -0.303 0 O-C-N 122.602 0.79 . . . . 35.009999999999998 112.06 -175.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -74.9 -40.97 34.53 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 121.307 -0.473 . . . . 33.210000000000001 112.586 179.657 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.427 HG21 ' HA ' ' B' ' 10' ' ' THR . 21.7 t -64.13 -43.37 97.41 Favored 'Isoleucine or valine' 0 C--O 1.246 0.882 0 CA-C-O 120.978 0.418 . . . . 34.420000000000002 110.938 177.358 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 43.2 tp -61.64 -45.06 95.67 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 119.685 -0.806 . . . . 24.739999999999998 111.215 179.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.35 -39.01 91.82 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.145 -0.687 . . . . 28.100000000000001 109.145 -174.088 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -64.4 -49.87 62.89 Favored Glycine 0 N--CA 1.453 -0.209 0 CA-C-N 116.072 -0.513 . . . . 31.809999999999999 111.937 -179.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 91.6 mt -54.6 -48.58 70.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 112.75 0.648 . . . . 44.780000000000001 112.75 176.048 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 72.8 t -72.61 -47.41 50.98 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.059 0 CA-C-N 115.943 -0.571 . . . . 29.07 110.474 -173.414 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 45.0 t -63.75 -39.42 85.32 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.407 0 N-CA-C 107.813 -1.18 . . . . 32.030000000000001 107.813 179.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.1 -42.4 97.04 Favored Glycine 0 CA--C 1.522 0.513 0 CA-C-N 115.915 -0.584 . . . . 27.43 112.761 171.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -62.35 -45.61 92.39 Favored 'General case' 0 CA--C 1.508 -0.665 0 N-CA-C 109.169 -0.678 . . . . 44.460000000000001 109.169 -179.174 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 70.1 mt -70.05 -40.19 75.25 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.667 -0.697 . . . . 26.899999999999999 111.901 -175.75 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 27.1 m -63.99 -39.85 86.94 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.343 0 C-N-CA 118.67 -1.212 . . . . 32.289999999999999 108.381 -178.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 46.9 tp -63.39 -42.47 98.82 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.428 0.632 . . . . 35.090000000000003 111.053 178.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 37.3 m -53.99 -43.32 69.9 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.419 -0.81 . . . . 29.739999999999998 111.572 174.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 41.0 t -67.33 -44.55 87.17 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.34 0 CA-C-N 116.184 -0.462 . . . . 33.030000000000001 111.796 178.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 17.1 tp -59.4 -42.5 91.88 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.849 -0.34 . . . . 42.859999999999999 111.907 178.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 74.6 mt -64.75 -45.19 95.89 Favored 'Isoleucine or valine' 0 C--O 1.24 0.593 0 CA-C-O 121.419 0.628 . . . . 30.719999999999999 110.747 178.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.67 ' HB1' HG21 ' D' ' 34' ' ' VAL . . . -56.76 -49.29 75.71 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.688 -0.687 . . . . 22.91 111.699 178.132 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 58.1 mt -56.74 -44.04 81.31 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 121.07 0.462 . . . . 30.719999999999999 110.968 176.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -69.41 -34.32 74.31 Favored 'General case' 0 C--O 1.218 -0.579 0 CA-C-N 115.651 -0.704 . . . . 22.77 110.529 -175.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 41.7 t -69.67 -41.75 80.21 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.654 0 N-CA-C 108.228 -1.027 . . . . 31.77 108.228 178.056 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 83.9 t80 -56.69 -53.18 60.71 Favored 'General case' 0 C--O 1.241 0.612 0 C-N-CA 119.58 -0.848 . . . . 36.859999999999999 110.433 178.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -74.48 -35.84 63.27 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 113.603 0.964 . . . . 31.66 113.603 -170.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 18.2 mt -63.84 -22.9 67.14 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.462 -0.495 . . . . 43.68 109.921 171.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -78.73 -18.93 74.39 Favored Glycine 0 C--N 1.334 0.463 0 CA-C-N 116.151 -0.477 . . . . 49.969999999999999 113.461 174.055 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . . . -74.48 -24.33 59.0 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.754 0.312 . . . . 54.490000000000002 110.713 176.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 16.2 mt . . . . . 0 C--O 1.233 0.23 0 N-CA-C 108.736 -0.839 . . . . 72.540000000000006 108.736 169.154 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.652 0 N-CA-C 112.452 0.538 . . . . 69.519999999999996 112.452 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' THR . . . . . 0.642 HG22 HG12 ' B' ' 11' ' ' VAL . 2.4 m 54.8 -118.73 1.34 Allowed 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.279 1.432 . . . . 81.439999999999998 113.535 175.717 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' VAL . . . . . 0.642 HG12 HG22 ' B' ' 10' ' ' THR . 7.2 p -148.27 142.72 19.15 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 N-CA-C 106.849 -1.538 . . . . 50.75 106.849 -170.836 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 44.4 p -79.72 150.28 72.43 Favored Pre-proline 0 CA--C 1.517 -0.302 0 N-CA-C 107.047 -1.464 . . . . 43.57 107.047 179.003 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -58.62 -34.04 98.6 Favored 'Trans proline' 0 CA--C 1.535 0.566 0 C-N-CA 120.811 1.007 . . . . 32.979999999999997 113.895 -175.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -71.9 -38.49 60.29 Favored Glycine 0 CA--C 1.519 0.298 0 C-N-CA 121.428 -0.415 . . . . 40.68 113.603 -177.061 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.5 t -69.39 -44.89 79.84 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 123.361 0.665 . . . . 40.170000000000002 111.586 179.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 54.5 tp -60.39 -40.62 91.56 Favored 'General case' 0 CA--C 1.507 -0.698 0 N-CA-C 109.154 -0.684 . . . . 35.039999999999999 109.154 175.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' ALA . . . . . 0.44 ' O ' HG22 ' B' ' 21' ' ' VAL . . . -62.29 -45.9 91.19 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.645 -0.707 . . . . 30.91 110.678 -177.42 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' GLY . . . . . 0.685 ' HA3' ' H11' ' B' ' 102' ' ' OLC . . . -65.09 -42.83 96.39 Favored Glycine 0 C--O 1.222 -0.615 0 C-N-CA 121.479 -0.391 . . . . 36.82 113.33 179.216 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' ILE . . . . . . . . . . . . . 67.9 mt -60.79 -47.52 92.86 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 N-CA-C 113.045 0.757 . . . . 43.530000000000001 113.045 177.106 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 46.7 t -73.56 -41.2 55.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.871 -0.604 . . . . 28.690000000000001 111.015 -175.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' VAL . . . . . 0.471 HG23 ' H3 ' ' B' ' 102' ' ' OLC . 24.3 m -72.8 -31.96 38.55 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.545 0 C-N-CA 116.672 -2.011 . . . . 48.950000000000003 107.816 179.588 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' GLY . . . . . 0.647 ' HA3' ' H7 ' ' B' ' 102' ' ' OLC . . . -66.22 -36.19 91.43 Favored Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 109.161 -1.575 . . . . 33.219999999999999 109.161 178.039 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -62.25 -50.09 73.1 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.55 0.69 . . . . 36.829999999999998 111.823 178.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' LEU . . . . . . . . . . . . . 18.1 mt -72.34 -34.47 68.05 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.601 0.593 . . . . 29.23 112.601 -176.028 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 23.1 m -66.63 -37.76 80.22 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 C-N-CA 118.192 -1.403 . . . . 53.719999999999999 109.645 177.436 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 26.8 tp -63.25 -43.35 98.26 Favored 'General case' 0 CA--C 1.502 -0.872 0 CA-C-O 121.168 0.509 . . . . 38.880000000000003 109.639 176.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 19.3 m -58.61 -37.92 76.9 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.39 -0.823 . . . . 29.690000000000001 110.84 177.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 38.4 t -70.02 -38.1 74.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 C-N-CA 119.872 -0.731 . . . . 34.729999999999997 111.112 176.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 13.3 tp -65.23 -43.16 92.32 Favored 'General case' 0 CA--C 1.511 -0.541 0 C-N-CA 120.785 -0.366 . . . . 49.560000000000002 111.431 -178.727 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 80.2 mt -65.67 -38.35 82.09 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 CA-C-N 116.109 -0.496 . . . . 46.060000000000002 111.045 179.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' ALA . . . . . 0.49 ' HB1' HG21 ' C' ' 34' ' ' VAL . . . -59.99 -54.14 49.62 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.744 -0.662 . . . . 27.260000000000002 111.923 177.588 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 76.0 mt -50.04 -47.18 53.5 Favored 'General case' 0 C--O 1.213 -0.829 0 CA-C-N 115.707 -0.679 . . . . 30.649999999999999 112.483 170.846 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.41 -47.93 81.92 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 111.902 0.334 . . . . 22.440000000000001 111.902 -178.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 14.6 t -62.96 -40.32 88.5 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.619 0 CA-C-N 116.636 -0.256 . . . . 35.520000000000003 110.312 178.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -58.82 -51.62 69.2 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 118.458 -1.297 . . . . 39.310000000000002 109.781 177.891 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -75.06 -33.31 61.7 Favored 'General case' 0 CA--C 1.517 -0.305 0 C-N-CA 119.666 -0.813 . . . . 41.0 111.837 -170.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 20.3 mt -62.2 -31.78 72.34 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 108.307 -0.997 . . . . 41.450000000000003 108.307 171.676 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -63.08 -26.75 69.49 Favored Glycine 0 CA--C 1.526 0.734 0 N-CA-C 114.446 0.538 . . . . 35.100000000000001 114.446 175.297 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' ARG . . . . . . . . . . . . . . . -81.77 -6.76 59.35 Favored 'General case' 0 C--N 1.33 -0.266 0 O-C-N 122.326 -0.514 . . . . 59.200000000000003 111.777 -178.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 80.7 mt . . . . . 0 C--N 1.331 -0.199 0 N-CA-C 109.869 -0.419 . . . . 66.549999999999997 109.869 176.626 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 9' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.352 0 N-CA-C 112.264 0.468 . . . . 52.759999999999998 112.264 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 10' ' ' THR . . . . . . . . . . . . . 4.9 t -131.32 146.69 52.4 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.172 -0.467 . . . . 61.780000000000001 111.092 177.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 11' ' ' VAL . . . . . . . . . . . . . 45.6 t -73.92 134.25 29.98 Favored 'Isoleucine or valine' 0 C--O 1.238 0.49 0 CA-C-N 116.611 -0.268 . . . . 39.710000000000001 111.012 -177.13 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 12' ' ' SER . . . . . . . . . . . . . 83.5 p -71.11 152.35 94.71 Favored Pre-proline 0 N--CA 1.467 0.423 0 N-CA-C 109.509 -0.552 . . . . 38.100000000000001 109.509 179.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 13' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_exo -55.34 -44.25 50.68 Favored 'Trans proline' 0 CA--C 1.516 -0.385 0 C-N-CA 121.194 1.263 . . . . 30.649999999999999 112.62 179.24 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.16 -46.47 94.17 Favored Glycine 0 C--O 1.245 0.796 0 O-C-N 123.907 0.755 . . . . 25.0 113.493 176.775 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 15' ' ' VAL . . . . . . . . . . . . . 42.0 t -60.1 -48.31 88.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 C-N-CA 120.038 -0.665 . . . . 29.510000000000002 111.02 176.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 16' ' ' LEU . . . . . . . . . . . . . 61.9 tp -54.07 -47.15 71.98 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 120.765 0.317 . . . . 31.420000000000002 110.602 177.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.03 -47.75 84.09 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-N 116.214 -0.448 . . . . 24.210000000000001 111.78 178.435 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 18' ' ' GLY . . . . . 0.592 ' HA3' ' H21' ' C' ' 101' ' ' OLC . . . -61.76 -40.31 98.63 Favored Glycine 0 CA--C 1.522 0.526 0 C-N-CA 120.972 -0.632 . . . . 23.66 112.948 -179.205 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 19' ' ' ILE . . . . . . . . . . . . . 15.9 mm -67.12 -49.21 75.2 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.293 0 O-C-N 122.698 -0.296 . . . . 42.530000000000001 110.672 179.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 20' ' ' VAL . . . . . . . . . . . . . 38.4 t -54.36 -48.51 68.14 Favored 'Isoleucine or valine' 0 C--O 1.242 0.693 0 CA-C-N 116.171 -0.468 . . . . 37.530000000000001 111.033 177.269 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 21' ' ' VAL . . . . . . . . . . . . . 17.8 t -65.91 -40.03 86.33 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 CA-C-O 121.236 0.541 . . . . 28.460000000000001 111.831 -178.894 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.51 -43.5 94.08 Favored Glycine 0 C--O 1.241 0.584 0 N-CA-C 110.429 -1.068 . . . . 22.940000000000001 110.429 175.709 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -62.23 -51.3 68.32 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.225 0.536 . . . . 40.579999999999998 109.763 -178.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 24' ' ' LEU . . . . . . . . . . . . . 2.3 tp -57.63 -39.83 77.82 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.225 -0.443 . . . . 41.170000000000002 111.322 178.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 25' ' ' VAL . . . . . . . . . . . . . 50.3 t -66.3 -47.71 83.39 Favored 'Isoleucine or valine' 0 C--O 1.24 0.582 0 CA-C-O 121.326 0.584 . . . . 25.640000000000001 112.451 -178.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 33.3 tp -63.61 -37.68 88.27 Favored 'General case' 0 C--O 1.24 0.585 0 C-N-CA 120.357 -0.537 . . . . 43.490000000000002 111.399 175.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 27' ' ' THR . . . . . . . . . . . . . 94.6 m -58.23 -48.42 80.43 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 112.108 0.41 . . . . 23.300000000000001 112.108 176.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 28' ' ' VAL . . . . . . . . . . . . . 18.6 m -72.3 -27.37 26.33 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.252 0 C-N-CA 118.551 -1.26 . . . . 25.399999999999999 111.226 -176.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 79.2 mt -72.79 -36.89 67.71 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-O 121.27 0.557 . . . . 36.57 111.827 179.588 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 30' ' ' ILE . . . . . . . . . . . . . 35.9 mt -64.01 -42.28 95.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.633 -0.712 . . . . 26.280000000000001 109.641 176.645 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.74 -52.33 65.96 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 114.557 -1.201 . . . . 25.460000000000001 110.701 175.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 32' ' ' LEU . . . . . . . . . . . . . 44.3 tp -56.44 -39.73 73.6 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 123.34 0.4 . . . . 33.18 111.836 179.229 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.75 -47.56 84.23 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.437 0.532 . . . . 31.969999999999999 112.437 177.192 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 34' ' ' VAL . . . . . 0.49 HG21 ' HB1' ' B' ' 31' ' ' ALA . 91.1 t -68.44 -36.96 77.03 Favored 'Isoleucine or valine' 0 C--O 1.241 0.61 0 CA-C-O 121.045 0.45 . . . . 32.329999999999998 111.587 -177.701 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 35' ' ' TYR . . . . . 0.597 ' HA ' ' H8 ' ' A' ' 102' ' ' OLC . 92.4 t80 -57.89 -48.75 78.95 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.826 -0.805 . . . . 45.710000000000001 108.826 173.973 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 36' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -63.62 -51.21 66.23 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 121.017 -0.273 . . . . 35.859999999999999 111.6 -179.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 37' ' ' LEU . . . . . 0.431 ' HA ' HD12 ' C' ' 40' ' ' LEU . 92.7 mt -64.58 -34.65 78.76 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.756 -0.378 . . . . 38.030000000000001 111.966 -176.952 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . -63.86 -29.18 74.06 Favored Glycine 0 CA--C 1.521 0.415 0 CA-C-N 116.396 -0.366 . . . . 42.82 112.65 178.02 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 39' ' ' ARG . . . . . . . . . . . . . . . -88.36 11.84 15.71 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.323 0.49 . . . . 63.109999999999999 112.323 -179.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 40' ' ' LEU . . . . . 0.431 HD12 ' HA ' ' C' ' 37' ' ' LEU . 21.5 mt . . . . . 0 C--O 1.234 0.276 0 CA-C-O 121.375 0.607 . . . . 87.840000000000003 112.088 179.962 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 9' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.149 0 CA-C-O 120.852 0.358 . . . . 59.479999999999997 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 10' ' ' THR . . . . . . . . . . . . . 1.2 t -137.81 149.5 46.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.27 0.557 . . . . 60.770000000000003 110.623 179.774 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 11' ' ' VAL . . . . . . . . . . . . . 58.9 t -81.41 129.43 37.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.852 -0.613 . . . . 39.57 111.303 -176.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 12' ' ' SER . . . . . . . . . . . . . 23.2 p -66.86 155.76 88.93 Favored Pre-proline 0 CA--C 1.534 0.331 0 CA-C-N 116.445 -0.343 . . . . 46.259999999999998 111.837 176.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 13' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -57.5 -42.48 60.72 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.015 1.81 . . . . 43.850000000000001 112.959 179.578 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . -57.19 -52.83 49.11 Favored Glycine 0 N--CA 1.447 -0.617 0 O-C-N 123.459 0.475 . . . . 38.130000000000003 112.71 178.099 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 15' ' ' VAL . . . . . . . . . . . . . 60.8 t -60.34 -44.15 95.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 116.871 0.335 . . . . 39.240000000000002 111.785 178.976 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 16' ' ' LEU . . . . . . . . . . . . . 29.9 tp -56.11 -46.29 79.17 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.173 -0.611 . . . . 31.93 110.523 177.324 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.78 -45.79 91.04 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.289 -0.414 . . . . 26.399999999999999 111.001 178.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 18' ' ' GLY . . . . . . . . . . . . . . . -57.66 -43.92 94.19 Favored Glycine 0 CA--C 1.527 0.8 0 C-N-CA 119.951 -1.119 . . . . 23.43 113.054 176.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 19' ' ' ILE . . . . . . . . . . . . . 25.5 mm -68.05 -43.87 85.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 O-C-N 122.425 -0.456 . . . . 40.399999999999999 109.959 -177.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 20' ' ' VAL . . . . . . . . . . . . . 9.2 t -61.16 -39.19 81.58 Favored 'Isoleucine or valine' 0 C--O 1.242 0.701 0 CA-C-O 121.356 0.598 . . . . 36.600000000000001 110.158 -178.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 21' ' ' VAL . . . . . . . . . . . . . 11.9 t -74.05 -40.19 51.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.212 -0.449 . . . . 33.850000000000001 111.287 179.344 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 22' ' ' GLY . . . . . 0.463 ' HA2' ' H6 ' ' D' ' 102' ' ' OLC . . . -57.91 -43.46 94.84 Favored Glycine 0 C--O 1.244 0.772 0 CA-C-O 121.188 0.327 . . . . 28.420000000000002 112.713 174.438 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 23' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -58.71 -53.33 59.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.766 -0.217 . . . . 36.490000000000002 111.459 174.105 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 24' ' ' LEU . . . . . . . . . . . . . 8.4 tt -54.16 -42.42 69.57 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.538 -0.301 . . . . 35.140000000000001 110.969 179.328 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 25' ' ' VAL . . . . . . . . . . . . . 28.4 t -68.98 -45.89 79.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 C-N-CA 120.832 -0.347 . . . . 26.48 110.617 -174.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 52.4 mt -63.11 -37.87 88.92 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.744 -0.382 . . . . 30.34 111.582 175.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 27' ' ' THR . . . . . . . . . . . . . 99.7 m -59.85 -48.91 79.79 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.615 0.598 . . . . 23.43 112.615 178.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 28' ' ' VAL . . . . . . . . . . . . . 25.3 m -70.1 -30.32 43.32 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 C-N-CA 119.913 -0.715 . . . . 23.539999999999999 111.119 -176.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 29' ' ' LEU . . . . . . . . . . . . . 80.1 mt -73.64 -31.96 63.78 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.022 0.439 . . . . 26.620000000000001 111.575 178.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 30' ' ' ILE . . . . . . . . . . . . . 43.0 mt -68.81 -38.33 78.62 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 N-CA-C 108.721 -0.844 . . . . 27.34 108.721 174.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.98 -45.56 77.32 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.083 -0.508 . . . . 22.260000000000002 110.721 177.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 32' ' ' LEU . . . . . . . . . . . . . 44.4 tp -57.75 -44.72 86.28 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.627 -0.261 . . . . 33.390000000000001 111.481 176.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.31 -41.6 76.23 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.548 0.573 . . . . 29.73 112.548 -179.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 34' ' ' VAL . . . . . 0.67 HG21 ' HB1' ' A' ' 31' ' ' ALA . 88.2 t -74.89 -31.45 25.73 Favored 'Isoleucine or valine' 0 C--O 1.244 0.803 0 CA-C-O 121.271 0.558 . . . . 35.539999999999999 111.697 -179.675 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 35' ' ' TYR . . . . . . . . . . . . . 86.4 t80 -59.12 -55.39 35.67 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 109.259 -0.645 . . . . 36.490000000000002 109.259 172.13 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 36' ' ' PHE . . . . . . . . . . . . . 19.1 m-30 -57.76 -49.02 77.96 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 112.75 0.648 . . . . 41.289999999999999 112.75 179.059 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 37' ' ' LEU . . . . . . . . . . . . . 42.4 mt -68.09 -39.4 82.89 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.268 -0.424 . . . . 45.869999999999997 111.615 -174.334 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 38' ' ' GLY . . . . . . . . . . . . . . . -61.5 -22.52 61.54 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 121.401 -0.428 . . . . 48.130000000000003 112.23 176.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 39' ' ' ARG . . . . . . . . . . . . . . . -79.24 -18.66 52.41 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.448 0.536 . . . . 67.359999999999999 112.448 -179.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 40' ' ' LEU . . . . . . . . . . . . . 18.6 mt . . . . . 0 C--N 1.329 -0.324 0 CA-C-O 121.341 0.591 . . . . 83.989999999999995 110.87 178.275 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' OLC . . . . . 0.597 ' H8 ' ' HA ' ' C' ' 35' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' OLC . . . . . 0.621 ' O23' ' O ' ' B' ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' OLC . . . . . 0.685 ' H11' ' HA3' ' B' ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 101' ' ' OLC . . . . . 0.592 ' H21' ' HA3' ' C' ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 101' ' ' OLC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 102' ' ' OLC . . . . . 0.463 ' H6 ' ' HA2' ' D' ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 201' ' ' HOH . . . . . 0.621 ' O ' ' O23' ' B' ' 101' ' ' OLC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_