data_4utq_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 4utq _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 ' 5' ' ' ARG . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.263 0 CA-C-O 117.254 -1.355 . . . . 0.0 110.527 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . . . -58.28 -41.34 84.14 Favored 'General case' 0 C--O 1.21 -1.013 0 O-C-N 124.14 0.9 . . . . 0.0 113.072 178.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . . . -65.79 -36.03 82.36 Favored 'General case' 0 CA--C 1.509 -0.602 0 O-C-N 120.506 -1.371 . . . . 0.0 113.176 177.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . . . -64.07 -45.84 86.96 Favored 'General case' 0 N--CA 1.437 -1.086 0 C-N-CA 119.369 -0.933 . . . . 0.0 111.227 173.318 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . . . -54.36 -23.46 10.53 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.596 0 O-C-N 124.396 1.06 . . . . 0.0 113.629 170.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . . . -90.16 -14.85 8.84 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.844 0 CA-C-O 123.93 1.824 . . . . 0.0 114.498 176.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -85.59 -46.83 10.43 Favored 'General case' 0 C--N 1.314 -0.95 0 O-C-N 118.946 -2.346 . . . . 0.0 113.035 172.361 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . . . -56.91 -45.89 82.33 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.551 -1.343 . . . . 0.0 113.928 176.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . . . -59.06 -44.97 91.89 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 -179.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . . . -64.37 -39.76 94.5 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 123.19 0.596 . . . . 0.0 111.451 -175.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . . . -58.06 -52.08 62.9 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.297 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.982 168.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . . . -58.43 -43.3 88.68 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 119.551 1.068 . . . . 0.0 112.971 179.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . . . -56.79 -47.32 80.48 Favored 'General case' 0 CA--C 1.506 -0.727 0 N-CA-C 115.248 1.573 . . . . 0.0 115.248 171.592 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . . . -55.29 -57.85 10.13 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-O 117.164 -1.398 . . . . 0.0 107.728 172.885 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . . . -50.8 -43.86 25.39 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 CA-C-N 120.132 1.333 . . . . 0.0 111.972 -174.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . . . -61.22 -43.21 99.24 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 176.606 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . . . -57.06 -45.47 83.23 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 118.964 0.802 . . . . 0.0 112.648 172.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.85 -44.82 86.78 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-O 118.565 -0.731 . . . . 0.0 111.771 178.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . . . . . . . . 0 C--O 1.19 -2.054 0 C-N-CA 124.4 1.08 . . . . 0.0 113.447 178.588 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 352' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.112 0 N-CA-C 112.557 -0.217 . . . . 0.0 112.557 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 353' ' ' ASN . . . . . . . . . . . . . . . -51.27 -43.89 61.68 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 114.694 1.368 . . . . 0.0 114.694 -172.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 354' ' ' TRP . . . . . . . . . . . . . . . -57.61 -31.44 66.22 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 174.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 355' ' ' GLY . . . . . . . . . . . . . . . -74.45 -43.5 30.41 Favored Glycine 0 C--N 1.333 0.38 0 O-C-N 121.394 -0.816 . . . . 0.0 114.469 171.153 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 356' ' ' PHE . . . . . . . . . . . . . . . -60.12 -30.02 69.01 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 114.68 1.363 . . . . 0.0 114.68 175.112 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 357' ' ' SER . . . . . . . . . . . . . . . -62.29 -45.98 90.84 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 166.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 358' ' ' ILE . . . . . . . . . . . . . . . -65.16 -32.46 58.35 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 O-C-N 121.093 -1.004 . . . . 0.0 112.728 177.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 359' ' ' ILE . . . . . . . . . . . . . . . -61.58 -43.32 96.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 123.376 0.67 . . . . 0.0 110.754 169.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 360' ' ' ILE . . . . . . . . . . . . . . . -70.4 -42.64 78.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 O-C-N 121.243 -0.911 . . . . 0.0 112.302 -179.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 361' ' ' ILE . . . . . . . . . . . . . . . -60.51 -39.22 80.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 CA-C-N 118.92 0.782 . . . . 0.0 111.152 175.417 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 362' ' ' THR . . . . . . . . . . . . . . . -60.37 -42.28 95.49 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.597 0.759 . . . . 0.0 111.254 173.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 363' ' ' PHE . . . . . . . . . . . . . . . -62.81 -39.47 94.37 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 117.767 2.506 . . . . 0.0 117.767 173.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 364' ' ' ILE . . . . . . . . . . . . . . . -60.84 -42.05 91.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 123.013 0.525 . . . . 0.0 110.588 173.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 365' ' ' VAL . . . . . . . . . . . . . . . -67.4 -43.65 87.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 C-N-CA 123.952 0.901 . . . . 0.0 111.795 176.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 366' ' ' ARG . . . . . . . . . . . . . . . -61.94 -31.66 72.01 Favored 'General case' 0 N--CA 1.479 0.986 0 O-C-N 120.958 -1.089 . . . . 0.0 113.412 172.137 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 367' ' ' GLY . . . . . . . . . . . . . . . -72.35 -32.87 61.98 Favored Glycine 0 CA--C 1.53 1.0 0 C-N-CA 125.499 1.523 . . . . 0.0 114.266 178.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 368' ' ' ILE . . . . . . . . . . . . . . . -64.23 -31.3 52.88 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 CA-C-N 118.685 1.242 . . . . 0.0 111.239 173.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 369' ' ' MET . . . . . . . . . . . . . . . -74.2 -10.26 59.43 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 114.573 1.323 . . . . 0.0 114.573 176.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 370' ' ' TYR . . . . . . . . . . . . . . . -71.5 -78.37 0.06 OUTLIER Pre-proline 0 CA--C 1.548 0.87 0 N-CA-C 119.45 3.13 . . . . 0.0 119.45 -153.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 371' ' ' PRO . . . . . . . . . . . . . . . . . . . . 0 C--N 1.352 0.731 0 CA-C-N 121.768 1.667 . . . . 0.0 112.857 177.562 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 419' ' ' PRO . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.708 0 N-CA-C 113.727 0.626 . . . . 0.0 113.727 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 420' ' ' LEU . . . . . . . . . . . . . . . -57.66 -43.96 85.33 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.103 1.761 . . . . 0.0 113.657 -178.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . -69.82 -21.91 76.76 Favored Glycine 0 CA--C 1.531 1.087 0 CA-C-O 119.414 -0.659 . . . . 0.0 113.73 -175.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . -88.35 -40.22 6.54 Favored Glycine 0 CA--C 1.532 1.113 0 CA-C-N 117.84 0.82 . . . . 0.0 112.765 163.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 423' ' ' CYS . . . . . . . . . . . . . . . -55.28 -40.68 71.31 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.863 1.665 . . . . 0.0 115.374 -178.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 424' ' ' PHE . . . . . . . . . . . . . . . -72.98 -44.11 8.11 Favored Pre-proline 0 CA--C 1.541 0.622 0 CA-C-N 120.445 1.475 . . . . 0.0 114.304 179.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 425' ' ' PRO . . . . . . . . . . . . . . . -56.96 -41.24 77.41 Favored 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 122.714 2.276 . . . . 0.0 114.071 164.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . . . -70.8 -37.92 73.3 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -179.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 427' ' ' LEU . . . . . . . . . . . . . . . -64.27 -47.88 77.84 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.403 1.001 . . . . 0.0 110.504 170.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 428' ' ' ILE . . . . . . . . . . . . . . . -62.74 -32.09 54.48 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 C-N-CA 123.968 0.907 . . . . 0.0 112.591 -179.17 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 429' ' ' GLN . . . . . . . . . . . . . . . -58.07 -30.63 66.36 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.572 1.149 . . . . 0.0 112.088 176.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 430' ' ' MET . . . . . . . . . . . . . . . -72.51 -57.31 3.48 Favored Pre-proline 0 CA--C 1.543 0.678 0 N-CA-C 115.172 1.545 . . . . 0.0 115.172 -178.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . . . -58.51 -32.15 95.87 Favored 'Trans proline' 0 C--N 1.353 0.766 0 CA-C-N 122.078 1.778 . . . . 0.0 113.423 177.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 432' ' ' ILE . . . . . . . . . . . . . . . -75.66 -40.42 40.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 CA-C-O 116.764 -1.588 . . . . 0.0 112.611 176.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 433' ' ' PHE . . . . . . . . . . . . . . . -68.65 -30.99 69.81 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 122.467 2.394 . . . . 0.0 113.069 175.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 434' ' ' LEU . . . . . . . . . . . . . . . -64.7 -49.29 71.47 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.461 0.704 . . . . 0.0 110.862 172.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -61.98 -42.99 99.75 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 118.457 0.571 . . . . 0.0 112.346 177.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . . . -57.63 -51.25 70.28 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.864 0.866 . . . . 0.0 112.83 175.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 437' ' ' TYR . . . . . . . . . . . . . . . -108.89 -5.56 16.12 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 115.654 1.724 . . . . 0.0 115.654 -160.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 438' ' ' TYR . . . . . . . . . . . . . . . -66.91 -43.96 82.0 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.581 0.752 . . . . 0.0 111.6 150.827 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 439' ' ' MET . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.456 0 C-N-CA 124.215 1.006 . . . . 0.0 111.701 -179.913 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 465' ' ' TYR . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.323 0 N-CA-C 116.05 1.87 . . . . 0.0 116.05 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . . . -81.34 -33.63 12.76 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -170.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . . . -70.48 -37.25 6.61 Favored Pre-proline 0 CA--C 1.548 0.899 0 CA-C-O 117.31 -1.328 . . . . 0.0 112.592 177.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 468' ' ' PRO . . . . . . . . . . . . . . . -59.94 -34.88 94.97 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 122.73 2.286 . . . . 0.0 115.283 165.204 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . . . -64.33 -48.77 83.95 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 CA-C-N 120.343 1.429 . . . . 0.0 111.099 171.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 470' ' ' LEU . . . . . . . . . . . . . . . -61.15 -42.05 97.85 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.126 0.57 . . . . 0.0 111.525 -179.269 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 471' ' ' MET . . . . . . . . . . . . . . . -73.15 -30.86 63.9 Favored 'General case' 0 CA--C 1.539 0.524 0 O-C-N 121.462 -0.773 . . . . 0.0 113.079 175.102 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . -68.6 -39.93 86.26 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 124.693 1.14 . . . . 0.0 113.913 174.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 473' ' ' VAL . . . . . . . . . . . . . . . -68.39 -39.84 81.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 O-C-N 121.223 -1.163 . . . . 0.0 110.485 171.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . . . -56.74 -41.08 76.9 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 113.952 1.093 . . . . 0.0 113.952 168.093 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 475' ' ' MET . . . . . . . . . . . . . . . -69.29 -38.17 78.19 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.584 1.154 . . . . 0.0 113.053 175.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . . . -63.23 -33.58 75.81 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 116.1 1.889 . . . . 0.0 116.1 174.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . . . -67.98 -39.33 83.34 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 168.219 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . . . -66.75 -37.39 79.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 124.052 0.941 . . . . 0.0 111.509 176.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 479' ' ' GLN . . . . . . . . . . . . . . . -72.82 -41.18 65.17 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.565 1.546 . . . . 0.0 112.731 176.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.574 0 C-N-CA 124.784 1.234 . . . . 0.0 111.006 -177.101 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 494' ' ' ILE . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.564 0 CA-C-O 118.179 -0.915 . . . . 0.0 113.167 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 495' ' ' MET . . . . . . . . . . . . . . . -68.05 -26.22 65.75 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 114.821 1.415 . . . . 0.0 114.821 -171.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 496' ' ' THR . . . . . . . . . . . . . . . -84.07 -36.45 23.03 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 115.579 1.696 . . . . 0.0 115.579 163.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . . . -64.97 -34.1 77.63 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 115.694 1.739 . . . . 0.0 115.694 -175.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 498' ' ' MET . . . . . . . . . . . . . . . -72.12 -43.2 10.13 Favored Pre-proline 0 N--CA 1.474 0.743 0 CA-C-O 117.239 -1.362 . . . . 0.0 113.966 173.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 499' ' ' PRO . . . . . . . . . . . . . . . -57.5 -31.48 91.58 Favored 'Trans proline' 0 C--N 1.351 0.692 0 C-N-CA 123.159 2.573 . . . . 0.0 115.305 164.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . . . -71.5 -42.2 72.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 CA-C-O 117.516 -1.231 . . . . 0.0 111.057 172.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 501' ' ' ILE . . . . . . . . . . . . . . . -63.19 -39.51 85.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 CA-C-N 120.871 1.669 . . . . 0.0 111.721 173.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . . . -60.86 -39.65 89.93 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 121.507 -0.745 . . . . 0.0 112.697 171.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 503' ' ' THR . . . . . . . . . . . . . . . -61.36 -45.53 93.99 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 117.476 -1.25 . . . . 0.0 111.639 171.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 504' ' ' VAL . . . . . . . . . . . . . . . -61.82 -42.48 94.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 CA-C-N 119.772 1.169 . . . . 0.0 112.648 178.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . . . -57.71 -36.97 72.71 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 170.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 506' ' ' PHE . . . . . . . . . . . . . . . -77.09 -21.96 53.54 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.287 0.635 . . . . 0.0 112.675 -178.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . . . -68.37 -32.78 73.11 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.119 -0.988 . . . . 0.0 112.482 169.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 508' ' ' TRP . . . . . . . . . . . . . . . -82.29 -29.96 30.85 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.21 1.404 . . . . 0.0 113.073 176.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 509' ' ' PHE . . . . . . . . . . . . . . . -121.41 52.25 3.06 Favored Pre-proline 0 CA--C 1.556 1.189 0 N-CA-C 115.756 1.761 . . . . 0.0 115.756 -178.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 510' ' ' PRO . . . . . . . . . . . . . . . -56.82 123.25 13.4 Favored 'Trans proline' 0 C--N 1.356 0.921 0 CA-C-N 122.15 1.804 . . . . 0.0 112.94 177.171 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 511' ' ' SER . . . . . . . . . . . . . . . -154.4 152.33 30.06 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.022 1.329 . . . . 0.0 110.52 179.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . 117.8 -179.45 17.2 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 124.852 1.215 . . . . 0.0 114.152 -172.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . . . -125.48 137.03 53.95 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 125.267 1.427 . . . . 0.0 109.564 179.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . . . -53.58 -50.35 50.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 124.663 1.185 . . . . 0.0 113.076 -164.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . . . -58.59 -47.1 85.43 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.895 0.771 . . . . 0.0 112.261 -178.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 516' ' ' TYR . . . . . . . . . . . . . . . -69.4 -36.29 76.59 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 115.17 1.544 . . . . 0.0 115.17 177.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . . . -68.05 -36.75 80.39 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 179.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 518' ' ' ILE . . . . . . . . . . . . . . . -61.55 -44.64 98.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 O-C-N 121.384 -0.823 . . . . 0.0 111.52 171.049 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . . . -63.41 -45.81 97.02 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-N 119.671 1.123 . . . . 0.0 110.714 178.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . . . -64.23 -39.35 93.79 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.454 -0.779 . . . . 0.0 112.345 179.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 521' ' ' ASN . . . . . . . . . . . . . . . -77.68 -25.72 49.71 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 114.749 1.388 . . . . 0.0 114.749 175.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . . . -69.54 -37.34 77.03 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 119.616 1.098 . . . . 0.0 111.698 170.131 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . . . -67.65 -29.76 46.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 CA-C-O 118.307 -0.854 . . . . 0.0 111.473 167.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 524' ' ' THR . . . . . . . . . . . . . . . -60.02 -44.69 94.44 Favored 'General case' 0 N--CA 1.483 1.193 0 O-C-N 119.281 -2.137 . . . . 0.0 115.642 161.38 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . . . -62.97 -45.5 98.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-O 117.846 -1.073 . . . . 0.0 111.339 179.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . . . -74.84 -25.17 18.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 CA-C-N 119.82 1.191 . . . . 0.0 112.918 177.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 527' ' ' GLN . . . . . . . . . . . . . . . -71.68 -38.9 70.56 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 120.364 1.438 . . . . 0.0 111.97 169.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . . . -68.14 -39.89 82.54 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 121.062 -1.024 . . . . 0.0 112.884 171.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 529' ' ' GLN . . . . . . . . . . . . . . . -69.19 -14.93 63.26 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 117.422 -1.275 . . . . 0.0 113.842 171.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 530' ' ' LEU . . . . . . . . . . . . . . . -90.52 -35.26 15.18 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 119.935 1.243 . . . . 0.0 114.162 168.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 531' ' ' ILE . . . . . . . . . . . . . . . -64.2 -24.87 36.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 O-C-N 120.818 -1.177 . . . . 0.0 110.131 167.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.528 0 N-CA-C 115.78 1.771 . . . . 0.0 115.78 160.934 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' Z' Z ' 11' ' ' MET . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.805 0 N-CA-C 111.222 0.082 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' Z' Z ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.39 -53.41 43.69 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 125.228 1.411 . . . . 0.0 110.139 176.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.72 -26.5 63.97 Favored 'General case' 0 CA--C 1.493 -1.247 0 C-N-CA 126.835 2.054 . . . . 0.0 113.994 172.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 14' ' ' ALA . . . . . . . . . . . . . . . -87.62 -22.93 24.45 Favored 'General case' 0 CA--C 1.499 -0.992 0 CA-C-N 119.158 0.89 . . . . 0.0 109.957 -175.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 15' ' ' VAL . . . . . . . . . . . . . . . -83.22 -30.04 8.14 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.025 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 174.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 16' ' ' MET . . . . . . . . . . . . . . . -76.75 -77.11 0.15 Allowed 'General case' 0 CA--C 1.491 -1.326 0 C-N-CA 124.217 1.007 . . . . 0.0 108.535 -178.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 17' ' ' MET . . . . . . . . . . . . . . . -81.31 -5.51 57.9 Favored 'General case' 0 CA--C 1.493 -1.216 0 C-N-CA 119.804 -0.759 . . . . 0.0 112.915 -172.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 18' ' ' GLY . . . . . . . . . . . . . . . -67.63 -52.1 32.03 Favored Glycine 0 C--N 1.345 1.06 0 N-CA-C 109.785 -1.326 . . . . 0.0 109.785 165.676 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 19' ' ' LEU . . . . . . . . . . . . . . . -64.37 -58.07 7.53 Favored 'General case' 0 C--N 1.358 0.948 0 C-N-CA 124.33 1.052 . . . . 0.0 111.839 -174.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 20' ' ' ALA . . . . . . . . . . . . . . . -77.61 -47.52 19.12 Favored 'General case' 0 CA--C 1.48 -1.722 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -170.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.72 -24.68 51.18 Favored 'General case' 0 C--N 1.355 0.806 0 N-CA-C 115.729 1.752 . . . . 0.0 115.729 178.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 22' ' ' ILE . . . . . . . . . . . . . . . -81.95 -32.82 11.37 Favored 'Isoleucine or valine' 0 C--N 1.364 1.211 0 CA-C-N 119.14 0.882 . . . . 0.0 111.557 172.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 23' ' ' GLY . . . . . . . . . . . . . . . -67.25 -35.37 87.97 Favored Glycine 0 C--N 1.352 1.441 0 C-N-CA 125.103 1.335 . . . . 0.0 111.159 178.204 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.41 -53.23 60.54 Favored 'General case' 0 CA--C 1.485 -1.549 0 C-N-CA 128.29 2.636 . . . . 0.0 110.061 166.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.92 -46.01 90.76 Favored 'General case' 0 C--N 1.355 0.844 0 C-N-CA 123.718 0.807 . . . . 0.0 112.025 -170.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 26' ' ' ILE . . . . . . . . . . . . . . . -71.29 -22.07 22.17 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.286 0 N-CA-C 114.604 1.335 . . . . 0.0 114.604 178.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 27' ' ' GLY . . . . . . . . . . . . . . . -91.4 -32.04 9.1 Favored Glycine 0 CA--C 1.473 -2.581 0 CA-C-N 119.943 1.247 . . . . 0.0 112.249 -174.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 28' ' ' ILE . . . . . . . . . . . . . . . -58.9 -36.97 64.22 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.2 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 165.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 29' ' ' GLY . . . . . . . . . . . . . . . -76.09 -51.24 7.01 Favored Glycine 0 N--CA 1.412 -2.926 0 N-CA-C 109.211 -1.556 . . . . 0.0 109.211 -173.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 30' ' ' ILE . . . . . . . . . . . . . . . -66.3 -66.72 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.494 -1.184 0 C-N-CA 124.34 1.056 . . . . 0.0 112.479 -178.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 31' ' ' LEU . . . . . . . . . . . . . . . -64.74 -58.44 6.24 Favored 'General case' 0 N--CA 1.427 -1.611 0 C-N-CA 125.946 1.698 . . . . 0.0 109.397 -173.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 32' ' ' GLY . . . . . . . . . . . . . . . -65.13 -16.65 62.51 Favored Glycine 0 C--N 1.354 1.531 0 CA-C-N 119.274 0.943 . . . . 0.0 114.07 -179.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.363 2.069 0 CA-C-N 118.805 1.302 . . . . 0.0 110.554 174.689 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.263 0 CA-C-O 117.254 -1.355 . . . . 0.0 110.527 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . . . -58.28 -41.34 84.14 Favored 'General case' 0 C--O 1.21 -1.013 0 O-C-N 124.14 0.9 . . . . 0.0 113.072 178.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . . . -65.79 -36.03 82.36 Favored 'General case' 0 CA--C 1.509 -0.602 0 O-C-N 120.506 -1.371 . . . . 0.0 113.176 177.059 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . . . -64.07 -45.84 86.96 Favored 'General case' 0 N--CA 1.437 -1.086 0 C-N-CA 119.369 -0.933 . . . . 0.0 111.227 173.318 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . . . -54.36 -23.46 10.53 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.596 0 O-C-N 124.396 1.06 . . . . 0.0 113.629 170.393 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . . . -90.16 -14.85 8.84 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.844 0 CA-C-O 123.93 1.824 . . . . 0.0 114.498 176.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -85.59 -46.83 10.43 Favored 'General case' 0 C--N 1.314 -0.95 0 O-C-N 118.946 -2.346 . . . . 0.0 113.035 172.361 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . . . -56.91 -45.89 82.33 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.551 -1.343 . . . . 0.0 113.928 176.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . . . -59.06 -44.97 91.89 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 -179.232 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . . . -64.37 -39.76 94.5 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 123.19 0.596 . . . . 0.0 111.451 -175.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . . . -58.06 -52.08 62.9 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.297 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.982 168.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . . . -58.43 -43.3 88.68 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 119.551 1.068 . . . . 0.0 112.971 179.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . . . -56.79 -47.32 80.48 Favored 'General case' 0 CA--C 1.506 -0.727 0 N-CA-C 115.248 1.573 . . . . 0.0 115.248 171.592 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . . . -55.29 -57.85 10.13 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-O 117.164 -1.398 . . . . 0.0 107.728 172.885 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . . . -50.8 -43.86 25.39 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 CA-C-N 120.132 1.333 . . . . 0.0 111.972 -174.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . . . -61.22 -43.21 99.24 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 176.606 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . . . -57.06 -45.47 83.23 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 118.964 0.802 . . . . 0.0 112.648 172.31 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.85 -44.82 86.78 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-O 118.565 -0.731 . . . . 0.0 111.771 178.598 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . . . . . . . . 0 C--O 1.19 -2.054 0 C-N-CA 124.4 1.08 . . . . 0.0 113.447 178.588 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 352' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.112 0 N-CA-C 112.557 -0.217 . . . . 0.0 112.557 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 353' ' ' ASN . . . . . . . . . . . . . . . -51.27 -43.89 61.68 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 114.694 1.368 . . . . 0.0 114.694 -172.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 354' ' ' TRP . . . . . . . . . . . . . . . -57.61 -31.44 66.22 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 174.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 355' ' ' GLY . . . . . . . . . . . . . . . -74.45 -43.5 30.41 Favored Glycine 0 C--N 1.333 0.38 0 O-C-N 121.394 -0.816 . . . . 0.0 114.469 171.153 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 356' ' ' PHE . . . . . . . . . . . . . . . -60.12 -30.02 69.01 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 114.68 1.363 . . . . 0.0 114.68 175.112 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 357' ' ' SER . . . . . . . . . . . . . . . -62.29 -45.98 90.84 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 166.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 358' ' ' ILE . . . . . . . . . . . . . . . -65.16 -32.46 58.35 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 O-C-N 121.093 -1.004 . . . . 0.0 112.728 177.222 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 359' ' ' ILE . . . . . . . . . . . . . . . -61.58 -43.32 96.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 123.376 0.67 . . . . 0.0 110.754 169.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 360' ' ' ILE . . . . . . . . . . . . . . . -70.4 -42.64 78.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 O-C-N 121.243 -0.911 . . . . 0.0 112.302 -179.789 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 361' ' ' ILE . . . . . . . . . . . . . . . -60.51 -39.22 80.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 CA-C-N 118.92 0.782 . . . . 0.0 111.152 175.417 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 362' ' ' THR . . . . . . . . . . . . . . . -60.37 -42.28 95.49 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.597 0.759 . . . . 0.0 111.254 173.228 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 363' ' ' PHE . . . . . . . . . . . . . . . -62.81 -39.47 94.37 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 117.767 2.506 . . . . 0.0 117.767 173.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 364' ' ' ILE . . . . . . . . . . . . . . . -60.84 -42.05 91.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 123.013 0.525 . . . . 0.0 110.588 173.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 365' ' ' VAL . . . . . . . . . . . . . . . -67.4 -43.65 87.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 C-N-CA 123.952 0.901 . . . . 0.0 111.795 176.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 366' ' ' ARG . . . . . . . . . . . . . . . -61.94 -31.66 72.01 Favored 'General case' 0 N--CA 1.479 0.986 0 O-C-N 120.958 -1.089 . . . . 0.0 113.412 172.137 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 367' ' ' GLY . . . . . . . . . . . . . . . -72.35 -32.87 61.98 Favored Glycine 0 CA--C 1.53 1.0 0 C-N-CA 125.499 1.523 . . . . 0.0 114.266 178.366 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 368' ' ' ILE . . . . . . . . . . . . . . . -64.23 -31.3 52.88 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 CA-C-N 118.685 1.242 . . . . 0.0 111.239 173.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 369' ' ' MET . . . . . . . . . . . . . . . -74.2 -10.26 59.43 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 114.573 1.323 . . . . 0.0 114.573 176.064 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 370' ' ' TYR . . . . . . . . . . . . . . . -71.5 -78.37 0.06 OUTLIER Pre-proline 0 CA--C 1.548 0.87 0 N-CA-C 119.45 3.13 . . . . 0.0 119.45 -153.521 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 371' ' ' PRO . . . . . . . . . . . . . . . . . . . . 0 C--N 1.352 0.731 0 CA-C-N 121.768 1.667 . . . . 0.0 112.857 177.562 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 419' ' ' PRO . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.708 0 N-CA-C 113.727 0.626 . . . . 0.0 113.727 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 420' ' ' LEU . . . . . . . . . . . . . . . -57.66 -43.96 85.33 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.103 1.761 . . . . 0.0 113.657 -178.205 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . -69.82 -21.91 76.76 Favored Glycine 0 CA--C 1.531 1.087 0 CA-C-O 119.414 -0.659 . . . . 0.0 113.73 -175.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . -88.35 -40.22 6.54 Favored Glycine 0 CA--C 1.532 1.113 0 CA-C-N 117.84 0.82 . . . . 0.0 112.765 163.418 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 423' ' ' CYS . . . . . . . . . . . . . . . -55.28 -40.68 71.31 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.863 1.665 . . . . 0.0 115.374 -178.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 424' ' ' PHE . . . . . . . . . . . . . . . -72.98 -44.11 8.11 Favored Pre-proline 0 CA--C 1.541 0.622 0 CA-C-N 120.445 1.475 . . . . 0.0 114.304 179.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 425' ' ' PRO . . . . . . . . . . . . . . . -56.96 -41.24 77.41 Favored 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 122.714 2.276 . . . . 0.0 114.071 164.682 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . . . -70.8 -37.92 73.3 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -179.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 427' ' ' LEU . . . . . . . . . . . . . . . -64.27 -47.88 77.84 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.403 1.001 . . . . 0.0 110.504 170.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 428' ' ' ILE . . . . . . . . . . . . . . . -62.74 -32.09 54.48 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 C-N-CA 123.968 0.907 . . . . 0.0 112.591 -179.17 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 429' ' ' GLN . . . . . . . . . . . . . . . -58.07 -30.63 66.36 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.572 1.149 . . . . 0.0 112.088 176.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 430' ' ' MET . . . . . . . . . . . . . . . -72.51 -57.31 3.48 Favored Pre-proline 0 CA--C 1.543 0.678 0 N-CA-C 115.172 1.545 . . . . 0.0 115.172 -178.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . . . -58.51 -32.15 95.87 Favored 'Trans proline' 0 C--N 1.353 0.766 0 CA-C-N 122.078 1.778 . . . . 0.0 113.423 177.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 432' ' ' ILE . . . . . . . . . . . . . . . -75.66 -40.42 40.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 CA-C-O 116.764 -1.588 . . . . 0.0 112.611 176.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 433' ' ' PHE . . . . . . . . . . . . . . . -68.65 -30.99 69.81 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 122.467 2.394 . . . . 0.0 113.069 175.536 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 434' ' ' LEU . . . . . . . . . . . . . . . -64.7 -49.29 71.47 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.461 0.704 . . . . 0.0 110.862 172.714 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -61.98 -42.99 99.75 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 118.457 0.571 . . . . 0.0 112.346 177.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . . . -57.63 -51.25 70.28 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.864 0.866 . . . . 0.0 112.83 175.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 437' ' ' TYR . . . . . . . . . . . . . . . -108.89 -5.56 16.12 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 115.654 1.724 . . . . 0.0 115.654 -160.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 438' ' ' TYR . . . . . . . . . . . . . . . -66.91 -43.96 82.0 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.581 0.752 . . . . 0.0 111.6 150.827 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 439' ' ' MET . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.456 0 C-N-CA 124.215 1.006 . . . . 0.0 111.701 -179.913 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 465' ' ' TYR . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.323 0 N-CA-C 116.05 1.87 . . . . 0.0 116.05 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . . . -81.34 -33.63 12.76 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -170.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . . . -70.48 -37.25 6.61 Favored Pre-proline 0 CA--C 1.548 0.899 0 CA-C-O 117.31 -1.328 . . . . 0.0 112.592 177.662 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 468' ' ' PRO . . . . . . . . . . . . . . . -59.94 -34.88 94.97 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 122.73 2.286 . . . . 0.0 115.283 165.204 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . . . -64.33 -48.77 83.95 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 CA-C-N 120.343 1.429 . . . . 0.0 111.099 171.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 470' ' ' LEU . . . . . . . . . . . . . . . -61.15 -42.05 97.85 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.126 0.57 . . . . 0.0 111.525 -179.269 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 471' ' ' MET . . . . . . . . . . . . . . . -73.15 -30.86 63.9 Favored 'General case' 0 CA--C 1.539 0.524 0 O-C-N 121.462 -0.773 . . . . 0.0 113.079 175.102 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . -68.6 -39.93 86.26 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 124.693 1.14 . . . . 0.0 113.913 174.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 473' ' ' VAL . . . . . . . . . . . . . . . -68.39 -39.84 81.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 O-C-N 121.223 -1.163 . . . . 0.0 110.485 171.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . . . -56.74 -41.08 76.9 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 113.952 1.093 . . . . 0.0 113.952 168.093 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 475' ' ' MET . . . . . . . . . . . . . . . -69.29 -38.17 78.19 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.584 1.154 . . . . 0.0 113.053 175.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . . . -63.23 -33.58 75.81 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 116.1 1.889 . . . . 0.0 116.1 174.056 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . . . -67.98 -39.33 83.34 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 168.219 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . . . -66.75 -37.39 79.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 124.052 0.941 . . . . 0.0 111.509 176.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 479' ' ' GLN . . . . . . . . . . . . . . . -72.82 -41.18 65.17 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.565 1.546 . . . . 0.0 112.731 176.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.574 0 C-N-CA 124.784 1.234 . . . . 0.0 111.006 -177.101 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 494' ' ' ILE . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.564 0 CA-C-O 118.179 -0.915 . . . . 0.0 113.167 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 495' ' ' MET . . . . . . . . . . . . . . . -68.05 -26.22 65.75 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 114.821 1.415 . . . . 0.0 114.821 -171.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 496' ' ' THR . . . . . . . . . . . . . . . -84.07 -36.45 23.03 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 115.579 1.696 . . . . 0.0 115.579 163.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . . . -64.97 -34.1 77.63 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 115.694 1.739 . . . . 0.0 115.694 -175.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 498' ' ' MET . . . . . . . . . . . . . . . -72.12 -43.2 10.13 Favored Pre-proline 0 N--CA 1.474 0.743 0 CA-C-O 117.239 -1.362 . . . . 0.0 113.966 173.363 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 499' ' ' PRO . . . . . . . . . . . . . . . -57.5 -31.48 91.58 Favored 'Trans proline' 0 C--N 1.351 0.692 0 C-N-CA 123.159 2.573 . . . . 0.0 115.305 164.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . . . -71.5 -42.2 72.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 CA-C-O 117.516 -1.231 . . . . 0.0 111.057 172.422 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 501' ' ' ILE . . . . . . . . . . . . . . . -63.19 -39.51 85.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 CA-C-N 120.871 1.669 . . . . 0.0 111.721 173.656 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . . . -60.86 -39.65 89.93 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 121.507 -0.745 . . . . 0.0 112.697 171.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 503' ' ' THR . . . . . . . . . . . . . . . -61.36 -45.53 93.99 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 117.476 -1.25 . . . . 0.0 111.639 171.8 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 504' ' ' VAL . . . . . . . . . . . . . . . -61.82 -42.48 94.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 CA-C-N 119.772 1.169 . . . . 0.0 112.648 178.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . . . -57.71 -36.97 72.71 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 170.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 506' ' ' PHE . . . . . . . . . . . . . . . -77.09 -21.96 53.54 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.287 0.635 . . . . 0.0 112.675 -178.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . . . -68.37 -32.78 73.11 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.119 -0.988 . . . . 0.0 112.482 169.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 508' ' ' TRP . . . . . . . . . . . . . . . -82.29 -29.96 30.85 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.21 1.404 . . . . 0.0 113.073 176.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 509' ' ' PHE . . . . . . . . . . . . . . . -121.41 52.25 3.06 Favored Pre-proline 0 CA--C 1.556 1.189 0 N-CA-C 115.756 1.761 . . . . 0.0 115.756 -178.582 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 510' ' ' PRO . . . . . . . . . . . . . . . -56.82 123.25 13.4 Favored 'Trans proline' 0 C--N 1.356 0.921 0 CA-C-N 122.15 1.804 . . . . 0.0 112.94 177.171 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 511' ' ' SER . . . . . . . . . . . . . . . -154.4 152.33 30.06 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.022 1.329 . . . . 0.0 110.52 179.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . 117.8 -179.45 17.2 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 124.852 1.215 . . . . 0.0 114.152 -172.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . . . -125.48 137.03 53.95 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 125.267 1.427 . . . . 0.0 109.564 179.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . . . -53.58 -50.35 50.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 124.663 1.185 . . . . 0.0 113.076 -164.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . . . -58.59 -47.1 85.43 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.895 0.771 . . . . 0.0 112.261 -178.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 516' ' ' TYR . . . . . . . . . . . . . . . -69.4 -36.29 76.59 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 115.17 1.544 . . . . 0.0 115.17 177.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . . . -68.05 -36.75 80.39 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 179.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 518' ' ' ILE . . . . . . . . . . . . . . . -61.55 -44.64 98.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 O-C-N 121.384 -0.823 . . . . 0.0 111.52 171.049 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . . . -63.41 -45.81 97.02 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-N 119.671 1.123 . . . . 0.0 110.714 178.194 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . . . -64.23 -39.35 93.79 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.454 -0.779 . . . . 0.0 112.345 179.082 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 521' ' ' ASN . . . . . . . . . . . . . . . -77.68 -25.72 49.71 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 114.749 1.388 . . . . 0.0 114.749 175.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . . . -69.54 -37.34 77.03 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 119.616 1.098 . . . . 0.0 111.698 170.131 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . . . -67.65 -29.76 46.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 CA-C-O 118.307 -0.854 . . . . 0.0 111.473 167.312 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 524' ' ' THR . . . . . . . . . . . . . . . -60.02 -44.69 94.44 Favored 'General case' 0 N--CA 1.483 1.193 0 O-C-N 119.281 -2.137 . . . . 0.0 115.642 161.38 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . . . -62.97 -45.5 98.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-O 117.846 -1.073 . . . . 0.0 111.339 179.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . . . -74.84 -25.17 18.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 CA-C-N 119.82 1.191 . . . . 0.0 112.918 177.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 527' ' ' GLN . . . . . . . . . . . . . . . -71.68 -38.9 70.56 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 120.364 1.438 . . . . 0.0 111.97 169.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . . . -68.14 -39.89 82.54 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 121.062 -1.024 . . . . 0.0 112.884 171.9 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 529' ' ' GLN . . . . . . . . . . . . . . . -69.19 -14.93 63.26 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 117.422 -1.275 . . . . 0.0 113.842 171.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 530' ' ' LEU . . . . . . . . . . . . . . . -90.52 -35.26 15.18 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 119.935 1.243 . . . . 0.0 114.162 168.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 531' ' ' ILE . . . . . . . . . . . . . . . -64.2 -24.87 36.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 O-C-N 120.818 -1.177 . . . . 0.0 110.131 167.104 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.528 0 N-CA-C 115.78 1.771 . . . . 0.0 115.78 160.934 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' Z' Z ' 11' ' ' MET . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.805 0 N-CA-C 111.222 0.082 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' Z' Z ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.39 -53.41 43.69 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 125.228 1.411 . . . . 0.0 110.139 176.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Z' Z ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.72 -26.5 63.97 Favored 'General case' 0 CA--C 1.493 -1.247 0 C-N-CA 126.835 2.054 . . . . 0.0 113.994 172.232 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Z' Z ' 14' ' ' ALA . . . . . . . . . . . . . . . -87.62 -22.93 24.45 Favored 'General case' 0 CA--C 1.499 -0.992 0 CA-C-N 119.158 0.89 . . . . 0.0 109.957 -175.178 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Z' Z ' 15' ' ' VAL . . . . . . . . . . . . . . . -83.22 -30.04 8.14 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.025 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 174.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Z' Z ' 16' ' ' MET . . . . . . . . . . . . . . . -76.75 -77.11 0.15 Allowed 'General case' 0 CA--C 1.491 -1.326 0 C-N-CA 124.217 1.007 . . . . 0.0 108.535 -178.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Z' Z ' 17' ' ' MET . . . . . . . . . . . . . . . -81.31 -5.51 57.9 Favored 'General case' 0 CA--C 1.493 -1.216 0 C-N-CA 119.804 -0.759 . . . . 0.0 112.915 -172.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Z' Z ' 18' ' ' GLY . . . . . . . . . . . . . . . -67.63 -52.1 32.03 Favored Glycine 0 C--N 1.345 1.06 0 N-CA-C 109.785 -1.326 . . . . 0.0 109.785 165.676 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Z' Z ' 19' ' ' LEU . . . . . . . . . . . . . . . -64.37 -58.07 7.53 Favored 'General case' 0 C--N 1.358 0.948 0 C-N-CA 124.33 1.052 . . . . 0.0 111.839 -174.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Z' Z ' 20' ' ' ALA . . . . . . . . . . . . . . . -77.61 -47.52 19.12 Favored 'General case' 0 CA--C 1.48 -1.722 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -170.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Z' Z ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.72 -24.68 51.18 Favored 'General case' 0 C--N 1.355 0.806 0 N-CA-C 115.729 1.752 . . . . 0.0 115.729 178.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Z' Z ' 22' ' ' ILE . . . . . . . . . . . . . . . -81.95 -32.82 11.37 Favored 'Isoleucine or valine' 0 C--N 1.364 1.211 0 CA-C-N 119.14 0.882 . . . . 0.0 111.557 172.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Z' Z ' 23' ' ' GLY . . . . . . . . . . . . . . . -67.25 -35.37 87.97 Favored Glycine 0 C--N 1.352 1.441 0 C-N-CA 125.103 1.335 . . . . 0.0 111.159 178.204 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Z' Z ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.41 -53.23 60.54 Favored 'General case' 0 CA--C 1.485 -1.549 0 C-N-CA 128.29 2.636 . . . . 0.0 110.061 166.251 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Z' Z ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.92 -46.01 90.76 Favored 'General case' 0 C--N 1.355 0.844 0 C-N-CA 123.718 0.807 . . . . 0.0 112.025 -170.567 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Z' Z ' 26' ' ' ILE . . . . . . . . . . . . . . . -71.29 -22.07 22.17 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.286 0 N-CA-C 114.604 1.335 . . . . 0.0 114.604 178.044 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Z' Z ' 27' ' ' GLY . . . . . . . . . . . . . . . -91.4 -32.04 9.1 Favored Glycine 0 CA--C 1.473 -2.581 0 CA-C-N 119.943 1.247 . . . . 0.0 112.249 -174.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Z' Z ' 28' ' ' ILE . . . . . . . . . . . . . . . -58.9 -36.97 64.22 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.2 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 165.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Z' Z ' 29' ' ' GLY . . . . . . . . . . . . . . . -76.09 -51.24 7.01 Favored Glycine 0 N--CA 1.412 -2.926 0 N-CA-C 109.211 -1.556 . . . . 0.0 109.211 -173.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Z' Z ' 30' ' ' ILE . . . . . . . . . . . . . . . -66.3 -66.72 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.494 -1.184 0 C-N-CA 124.34 1.056 . . . . 0.0 112.479 -178.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Z' Z ' 31' ' ' LEU . . . . . . . . . . . . . . . -64.74 -58.44 6.24 Favored 'General case' 0 N--CA 1.427 -1.611 0 C-N-CA 125.946 1.698 . . . . 0.0 109.397 -173.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Z' Z ' 32' ' ' GLY . . . . . . . . . . . . . . . -65.13 -16.65 62.51 Favored Glycine 0 C--N 1.354 1.531 0 CA-C-N 119.274 0.943 . . . . 0.0 114.07 -179.147 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Z' Z ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.363 2.069 0 CA-C-N 118.805 1.302 . . . . 0.0 110.554 174.689 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.263 0 CA-C-O 117.254 -1.355 . . . . 0.0 110.527 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . . . -58.28 -41.34 84.14 Favored 'General case' 0 C--O 1.21 -1.013 0 O-C-N 124.14 0.9 . . . . 0.0 113.072 178.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . . . -65.79 -36.03 82.36 Favored 'General case' 0 CA--C 1.509 -0.602 0 O-C-N 120.506 -1.371 . . . . 0.0 113.176 177.059 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . . . -64.07 -45.84 86.96 Favored 'General case' 0 N--CA 1.437 -1.086 0 C-N-CA 119.369 -0.933 . . . . 0.0 111.227 173.318 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . . . -54.36 -23.46 10.53 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.596 0 O-C-N 124.396 1.06 . . . . 0.0 113.629 170.393 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . . . -90.16 -14.85 8.84 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.844 0 CA-C-O 123.93 1.824 . . . . 0.0 114.498 176.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -85.59 -46.83 10.43 Favored 'General case' 0 C--N 1.314 -0.95 0 O-C-N 118.946 -2.346 . . . . 0.0 113.035 172.361 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . . . -56.91 -45.89 82.33 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.551 -1.343 . . . . 0.0 113.928 176.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . . . -59.06 -44.97 91.89 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 -179.232 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . . . -64.37 -39.76 94.5 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 123.19 0.596 . . . . 0.0 111.451 -175.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . . . -58.06 -52.08 62.9 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.297 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.982 168.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . . . -58.43 -43.3 88.68 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 119.551 1.068 . . . . 0.0 112.971 179.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . . . -56.79 -47.32 80.48 Favored 'General case' 0 CA--C 1.506 -0.727 0 N-CA-C 115.248 1.573 . . . . 0.0 115.248 171.592 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . . . -55.29 -57.85 10.13 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-O 117.164 -1.398 . . . . 0.0 107.728 172.885 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . . . -50.8 -43.86 25.39 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 CA-C-N 120.132 1.333 . . . . 0.0 111.972 -174.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . . . -61.22 -43.21 99.24 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 176.606 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . . . -57.06 -45.47 83.23 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 118.964 0.802 . . . . 0.0 112.648 172.31 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.85 -44.82 86.78 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-O 118.565 -0.731 . . . . 0.0 111.771 178.598 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . . . . . . . . 0 C--O 1.19 -2.054 0 C-N-CA 124.4 1.08 . . . . 0.0 113.447 178.588 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 352' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.112 0 N-CA-C 112.557 -0.217 . . . . 0.0 112.557 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 353' ' ' ASN . . . . . . . . . . . . . . . -51.27 -43.89 61.68 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 114.694 1.368 . . . . 0.0 114.694 -172.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 354' ' ' TRP . . . . . . . . . . . . . . . -57.61 -31.44 66.22 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 174.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 355' ' ' GLY . . . . . . . . . . . . . . . -74.45 -43.5 30.41 Favored Glycine 0 C--N 1.333 0.38 0 O-C-N 121.394 -0.816 . . . . 0.0 114.469 171.153 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 356' ' ' PHE . . . . . . . . . . . . . . . -60.12 -30.02 69.01 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 114.68 1.363 . . . . 0.0 114.68 175.112 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 357' ' ' SER . . . . . . . . . . . . . . . -62.29 -45.98 90.84 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 166.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 358' ' ' ILE . . . . . . . . . . . . . . . -65.16 -32.46 58.35 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 O-C-N 121.093 -1.004 . . . . 0.0 112.728 177.222 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 359' ' ' ILE . . . . . . . . . . . . . . . -61.58 -43.32 96.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 123.376 0.67 . . . . 0.0 110.754 169.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 360' ' ' ILE . . . . . . . . . . . . . . . -70.4 -42.64 78.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 O-C-N 121.243 -0.911 . . . . 0.0 112.302 -179.789 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 361' ' ' ILE . . . . . . . . . . . . . . . -60.51 -39.22 80.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 CA-C-N 118.92 0.782 . . . . 0.0 111.152 175.417 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 362' ' ' THR . . . . . . . . . . . . . . . -60.37 -42.28 95.49 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.597 0.759 . . . . 0.0 111.254 173.228 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 363' ' ' PHE . . . . . . . . . . . . . . . -62.81 -39.47 94.37 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 117.767 2.506 . . . . 0.0 117.767 173.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 364' ' ' ILE . . . . . . . . . . . . . . . -60.84 -42.05 91.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 123.013 0.525 . . . . 0.0 110.588 173.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 365' ' ' VAL . . . . . . . . . . . . . . . -67.4 -43.65 87.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 C-N-CA 123.952 0.901 . . . . 0.0 111.795 176.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 366' ' ' ARG . . . . . . . . . . . . . . . -61.94 -31.66 72.01 Favored 'General case' 0 N--CA 1.479 0.986 0 O-C-N 120.958 -1.089 . . . . 0.0 113.412 172.137 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 367' ' ' GLY . . . . . . . . . . . . . . . -72.35 -32.87 61.98 Favored Glycine 0 CA--C 1.53 1.0 0 C-N-CA 125.499 1.523 . . . . 0.0 114.266 178.366 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 368' ' ' ILE . . . . . . . . . . . . . . . -64.23 -31.3 52.88 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 CA-C-N 118.685 1.242 . . . . 0.0 111.239 173.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 369' ' ' MET . . . . . . . . . . . . . . . -74.2 -10.26 59.43 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 114.573 1.323 . . . . 0.0 114.573 176.064 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 370' ' ' TYR . . . . . . . . . . . . . . . -71.5 -78.37 0.06 OUTLIER Pre-proline 0 CA--C 1.548 0.87 0 N-CA-C 119.45 3.13 . . . . 0.0 119.45 -153.521 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 371' ' ' PRO . . . . . . . . . . . . . . . . . . . . 0 C--N 1.352 0.731 0 CA-C-N 121.768 1.667 . . . . 0.0 112.857 177.562 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 419' ' ' PRO . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.708 0 N-CA-C 113.727 0.626 . . . . 0.0 113.727 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 420' ' ' LEU . . . . . . . . . . . . . . . -57.66 -43.96 85.33 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.103 1.761 . . . . 0.0 113.657 -178.205 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . -69.82 -21.91 76.76 Favored Glycine 0 CA--C 1.531 1.087 0 CA-C-O 119.414 -0.659 . . . . 0.0 113.73 -175.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . -88.35 -40.22 6.54 Favored Glycine 0 CA--C 1.532 1.113 0 CA-C-N 117.84 0.82 . . . . 0.0 112.765 163.418 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 423' ' ' CYS . . . . . . . . . . . . . . . -55.28 -40.68 71.31 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.863 1.665 . . . . 0.0 115.374 -178.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 424' ' ' PHE . . . . . . . . . . . . . . . -72.98 -44.11 8.11 Favored Pre-proline 0 CA--C 1.541 0.622 0 CA-C-N 120.445 1.475 . . . . 0.0 114.304 179.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 425' ' ' PRO . . . . . . . . . . . . . . . -56.96 -41.24 77.41 Favored 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 122.714 2.276 . . . . 0.0 114.071 164.682 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . . . -70.8 -37.92 73.3 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -179.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 427' ' ' LEU . . . . . . . . . . . . . . . -64.27 -47.88 77.84 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.403 1.001 . . . . 0.0 110.504 170.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 428' ' ' ILE . . . . . . . . . . . . . . . -62.74 -32.09 54.48 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 C-N-CA 123.968 0.907 . . . . 0.0 112.591 -179.17 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 429' ' ' GLN . . . . . . . . . . . . . . . -58.07 -30.63 66.36 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.572 1.149 . . . . 0.0 112.088 176.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 430' ' ' MET . . . . . . . . . . . . . . . -72.51 -57.31 3.48 Favored Pre-proline 0 CA--C 1.543 0.678 0 N-CA-C 115.172 1.545 . . . . 0.0 115.172 -178.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . . . -58.51 -32.15 95.87 Favored 'Trans proline' 0 C--N 1.353 0.766 0 CA-C-N 122.078 1.778 . . . . 0.0 113.423 177.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 432' ' ' ILE . . . . . . . . . . . . . . . -75.66 -40.42 40.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 CA-C-O 116.764 -1.588 . . . . 0.0 112.611 176.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 433' ' ' PHE . . . . . . . . . . . . . . . -68.65 -30.99 69.81 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 122.467 2.394 . . . . 0.0 113.069 175.536 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 434' ' ' LEU . . . . . . . . . . . . . . . -64.7 -49.29 71.47 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.461 0.704 . . . . 0.0 110.862 172.714 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -61.98 -42.99 99.75 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 118.457 0.571 . . . . 0.0 112.346 177.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . . . -57.63 -51.25 70.28 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.864 0.866 . . . . 0.0 112.83 175.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 437' ' ' TYR . . . . . . . . . . . . . . . -108.89 -5.56 16.12 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 115.654 1.724 . . . . 0.0 115.654 -160.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 438' ' ' TYR . . . . . . . . . . . . . . . -66.91 -43.96 82.0 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.581 0.752 . . . . 0.0 111.6 150.827 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 439' ' ' MET . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.456 0 C-N-CA 124.215 1.006 . . . . 0.0 111.701 -179.913 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 465' ' ' TYR . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.323 0 N-CA-C 116.05 1.87 . . . . 0.0 116.05 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . . . -81.34 -33.63 12.76 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -170.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . . . -70.48 -37.25 6.61 Favored Pre-proline 0 CA--C 1.548 0.899 0 CA-C-O 117.31 -1.328 . . . . 0.0 112.592 177.662 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 468' ' ' PRO . . . . . . . . . . . . . . . -59.94 -34.88 94.97 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 122.73 2.286 . . . . 0.0 115.283 165.204 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . . . -64.33 -48.77 83.95 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 CA-C-N 120.343 1.429 . . . . 0.0 111.099 171.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 470' ' ' LEU . . . . . . . . . . . . . . . -61.15 -42.05 97.85 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.126 0.57 . . . . 0.0 111.525 -179.269 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 471' ' ' MET . . . . . . . . . . . . . . . -73.15 -30.86 63.9 Favored 'General case' 0 CA--C 1.539 0.524 0 O-C-N 121.462 -0.773 . . . . 0.0 113.079 175.102 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . -68.6 -39.93 86.26 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 124.693 1.14 . . . . 0.0 113.913 174.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 473' ' ' VAL . . . . . . . . . . . . . . . -68.39 -39.84 81.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 O-C-N 121.223 -1.163 . . . . 0.0 110.485 171.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . . . -56.74 -41.08 76.9 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 113.952 1.093 . . . . 0.0 113.952 168.093 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 475' ' ' MET . . . . . . . . . . . . . . . -69.29 -38.17 78.19 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.584 1.154 . . . . 0.0 113.053 175.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . . . -63.23 -33.58 75.81 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 116.1 1.889 . . . . 0.0 116.1 174.056 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . . . -67.98 -39.33 83.34 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 168.219 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . . . -66.75 -37.39 79.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 124.052 0.941 . . . . 0.0 111.509 176.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 479' ' ' GLN . . . . . . . . . . . . . . . -72.82 -41.18 65.17 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.565 1.546 . . . . 0.0 112.731 176.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.574 0 C-N-CA 124.784 1.234 . . . . 0.0 111.006 -177.101 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 494' ' ' ILE . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.564 0 CA-C-O 118.179 -0.915 . . . . 0.0 113.167 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 495' ' ' MET . . . . . . . . . . . . . . . -68.05 -26.22 65.75 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 114.821 1.415 . . . . 0.0 114.821 -171.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 496' ' ' THR . . . . . . . . . . . . . . . -84.07 -36.45 23.03 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 115.579 1.696 . . . . 0.0 115.579 163.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . . . -64.97 -34.1 77.63 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 115.694 1.739 . . . . 0.0 115.694 -175.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 498' ' ' MET . . . . . . . . . . . . . . . -72.12 -43.2 10.13 Favored Pre-proline 0 N--CA 1.474 0.743 0 CA-C-O 117.239 -1.362 . . . . 0.0 113.966 173.363 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 499' ' ' PRO . . . . . . . . . . . . . . . -57.5 -31.48 91.58 Favored 'Trans proline' 0 C--N 1.351 0.692 0 C-N-CA 123.159 2.573 . . . . 0.0 115.305 164.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . . . -71.5 -42.2 72.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 CA-C-O 117.516 -1.231 . . . . 0.0 111.057 172.422 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 501' ' ' ILE . . . . . . . . . . . . . . . -63.19 -39.51 85.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 CA-C-N 120.871 1.669 . . . . 0.0 111.721 173.656 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . . . -60.86 -39.65 89.93 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 121.507 -0.745 . . . . 0.0 112.697 171.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 503' ' ' THR . . . . . . . . . . . . . . . -61.36 -45.53 93.99 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 117.476 -1.25 . . . . 0.0 111.639 171.8 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 504' ' ' VAL . . . . . . . . . . . . . . . -61.82 -42.48 94.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 CA-C-N 119.772 1.169 . . . . 0.0 112.648 178.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . . . -57.71 -36.97 72.71 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 170.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 506' ' ' PHE . . . . . . . . . . . . . . . -77.09 -21.96 53.54 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.287 0.635 . . . . 0.0 112.675 -178.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . . . -68.37 -32.78 73.11 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.119 -0.988 . . . . 0.0 112.482 169.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 508' ' ' TRP . . . . . . . . . . . . . . . -82.29 -29.96 30.85 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.21 1.404 . . . . 0.0 113.073 176.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 509' ' ' PHE . . . . . . . . . . . . . . . -121.41 52.25 3.06 Favored Pre-proline 0 CA--C 1.556 1.189 0 N-CA-C 115.756 1.761 . . . . 0.0 115.756 -178.582 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 510' ' ' PRO . . . . . . . . . . . . . . . -56.82 123.25 13.4 Favored 'Trans proline' 0 C--N 1.356 0.921 0 CA-C-N 122.15 1.804 . . . . 0.0 112.94 177.171 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 511' ' ' SER . . . . . . . . . . . . . . . -154.4 152.33 30.06 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.022 1.329 . . . . 0.0 110.52 179.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . 117.8 -179.45 17.2 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 124.852 1.215 . . . . 0.0 114.152 -172.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . . . -125.48 137.03 53.95 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 125.267 1.427 . . . . 0.0 109.564 179.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . . . -53.58 -50.35 50.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 124.663 1.185 . . . . 0.0 113.076 -164.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . . . -58.59 -47.1 85.43 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.895 0.771 . . . . 0.0 112.261 -178.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 516' ' ' TYR . . . . . . . . . . . . . . . -69.4 -36.29 76.59 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 115.17 1.544 . . . . 0.0 115.17 177.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . . . -68.05 -36.75 80.39 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 179.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 518' ' ' ILE . . . . . . . . . . . . . . . -61.55 -44.64 98.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 O-C-N 121.384 -0.823 . . . . 0.0 111.52 171.049 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . . . -63.41 -45.81 97.02 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-N 119.671 1.123 . . . . 0.0 110.714 178.194 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . . . -64.23 -39.35 93.79 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.454 -0.779 . . . . 0.0 112.345 179.082 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 521' ' ' ASN . . . . . . . . . . . . . . . -77.68 -25.72 49.71 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 114.749 1.388 . . . . 0.0 114.749 175.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . . . -69.54 -37.34 77.03 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 119.616 1.098 . . . . 0.0 111.698 170.131 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . . . -67.65 -29.76 46.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 CA-C-O 118.307 -0.854 . . . . 0.0 111.473 167.312 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 524' ' ' THR . . . . . . . . . . . . . . . -60.02 -44.69 94.44 Favored 'General case' 0 N--CA 1.483 1.193 0 O-C-N 119.281 -2.137 . . . . 0.0 115.642 161.38 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . . . -62.97 -45.5 98.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-O 117.846 -1.073 . . . . 0.0 111.339 179.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . . . -74.84 -25.17 18.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 CA-C-N 119.82 1.191 . . . . 0.0 112.918 177.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 527' ' ' GLN . . . . . . . . . . . . . . . -71.68 -38.9 70.56 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 120.364 1.438 . . . . 0.0 111.97 169.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . . . -68.14 -39.89 82.54 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 121.062 -1.024 . . . . 0.0 112.884 171.9 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 529' ' ' GLN . . . . . . . . . . . . . . . -69.19 -14.93 63.26 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 117.422 -1.275 . . . . 0.0 113.842 171.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 530' ' ' LEU . . . . . . . . . . . . . . . -90.52 -35.26 15.18 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 119.935 1.243 . . . . 0.0 114.162 168.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 531' ' ' ILE . . . . . . . . . . . . . . . -64.2 -24.87 36.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 O-C-N 120.818 -1.177 . . . . 0.0 110.131 167.104 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.528 0 N-CA-C 115.78 1.771 . . . . 0.0 115.78 160.934 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' Z' Z ' 11' ' ' MET . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.805 0 N-CA-C 111.222 0.082 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' Z' Z ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.39 -53.41 43.69 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 125.228 1.411 . . . . 0.0 110.139 176.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Z' Z ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.72 -26.5 63.97 Favored 'General case' 0 CA--C 1.493 -1.247 0 C-N-CA 126.835 2.054 . . . . 0.0 113.994 172.232 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Z' Z ' 14' ' ' ALA . . . . . . . . . . . . . . . -87.62 -22.93 24.45 Favored 'General case' 0 CA--C 1.499 -0.992 0 CA-C-N 119.158 0.89 . . . . 0.0 109.957 -175.178 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Z' Z ' 15' ' ' VAL . . . . . . . . . . . . . . . -83.22 -30.04 8.14 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.025 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 174.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Z' Z ' 16' ' ' MET . . . . . . . . . . . . . . . -76.75 -77.11 0.15 Allowed 'General case' 0 CA--C 1.491 -1.326 0 C-N-CA 124.217 1.007 . . . . 0.0 108.535 -178.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Z' Z ' 17' ' ' MET . . . . . . . . . . . . . . . -81.31 -5.51 57.9 Favored 'General case' 0 CA--C 1.493 -1.216 0 C-N-CA 119.804 -0.759 . . . . 0.0 112.915 -172.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Z' Z ' 18' ' ' GLY . . . . . . . . . . . . . . . -67.63 -52.1 32.03 Favored Glycine 0 C--N 1.345 1.06 0 N-CA-C 109.785 -1.326 . . . . 0.0 109.785 165.676 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Z' Z ' 19' ' ' LEU . . . . . . . . . . . . . . . -64.37 -58.07 7.53 Favored 'General case' 0 C--N 1.358 0.948 0 C-N-CA 124.33 1.052 . . . . 0.0 111.839 -174.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Z' Z ' 20' ' ' ALA . . . . . . . . . . . . . . . -77.61 -47.52 19.12 Favored 'General case' 0 CA--C 1.48 -1.722 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -170.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Z' Z ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.72 -24.68 51.18 Favored 'General case' 0 C--N 1.355 0.806 0 N-CA-C 115.729 1.752 . . . . 0.0 115.729 178.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Z' Z ' 22' ' ' ILE . . . . . . . . . . . . . . . -81.95 -32.82 11.37 Favored 'Isoleucine or valine' 0 C--N 1.364 1.211 0 CA-C-N 119.14 0.882 . . . . 0.0 111.557 172.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Z' Z ' 23' ' ' GLY . . . . . . . . . . . . . . . -67.25 -35.37 87.97 Favored Glycine 0 C--N 1.352 1.441 0 C-N-CA 125.103 1.335 . . . . 0.0 111.159 178.204 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Z' Z ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.41 -53.23 60.54 Favored 'General case' 0 CA--C 1.485 -1.549 0 C-N-CA 128.29 2.636 . . . . 0.0 110.061 166.251 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Z' Z ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.92 -46.01 90.76 Favored 'General case' 0 C--N 1.355 0.844 0 C-N-CA 123.718 0.807 . . . . 0.0 112.025 -170.567 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Z' Z ' 26' ' ' ILE . . . . . . . . . . . . . . . -71.29 -22.07 22.17 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.286 0 N-CA-C 114.604 1.335 . . . . 0.0 114.604 178.044 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Z' Z ' 27' ' ' GLY . . . . . . . . . . . . . . . -91.4 -32.04 9.1 Favored Glycine 0 CA--C 1.473 -2.581 0 CA-C-N 119.943 1.247 . . . . 0.0 112.249 -174.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Z' Z ' 28' ' ' ILE . . . . . . . . . . . . . . . -58.9 -36.97 64.22 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.2 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 165.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Z' Z ' 29' ' ' GLY . . . . . . . . . . . . . . . -76.09 -51.24 7.01 Favored Glycine 0 N--CA 1.412 -2.926 0 N-CA-C 109.211 -1.556 . . . . 0.0 109.211 -173.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Z' Z ' 30' ' ' ILE . . . . . . . . . . . . . . . -66.3 -66.72 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.494 -1.184 0 C-N-CA 124.34 1.056 . . . . 0.0 112.479 -178.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Z' Z ' 31' ' ' LEU . . . . . . . . . . . . . . . -64.74 -58.44 6.24 Favored 'General case' 0 N--CA 1.427 -1.611 0 C-N-CA 125.946 1.698 . . . . 0.0 109.397 -173.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Z' Z ' 32' ' ' GLY . . . . . . . . . . . . . . . -65.13 -16.65 62.51 Favored Glycine 0 C--N 1.354 1.531 0 CA-C-N 119.274 0.943 . . . . 0.0 114.07 -179.147 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Z' Z ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.363 2.069 0 CA-C-N 118.805 1.302 . . . . 0.0 110.554 174.689 . . . . . . . . 0 0 . 1 stop_ save_