data_6omo_residue ############################ # Computer software used # ############################ save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 6omo _Structure_validation_residue.Date_analyzed 2019-05-03 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 ' I' I ' 36' ' ' THR . . . . . . . . . . . . . 7.1 t . . . . . 0 CA--C 1.541 0.598 0 N-CA-C 113.616 0.969 . . . . 92.67 113.616 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 37' ' ' ALA . . . . . . . . . . . . . . . -77.23 154.76 32.71 Favored 'General case' 0 C--N 1.354 0.797 0 CA-C-N 118.132 0.424 . . . . 72.97 110.682 -179.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 38' ' ' CYS . . . . . . . . . . . . . 39.4 t -55.02 121.97 9.9 Favored 'General case' 0 C--N 1.348 0.51 0 C-N-CA 124.807 1.243 . . . . 68.39 111.594 178.618 175.25 65.207 75.801 103.239 2.045 106.441 70.968 178.459 1 1 . 1 . 001 ecloud orig full ' I' I ' 39' ' ' ARG . . . . . . . . . . . . . 31.3 ptt85 -157.44 170.17 23.05 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.065 0.946 . . . . 126.97 111.815 178.412 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 40' ' ' LYS . . . . . . . . . . . . . 24.4 ttpt -81.24 126.65 31.79 Favored 'General case' 0 C--N 1.345 0.4 0 C-N-CA 127.055 2.142 . . . . 91.61 109.655 175.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 41' ' ' HIS . . . . . . . . . . . . . 14.2 m80 -110.29 140.86 44.04 Favored 'General case' 0 C--O 1.218 -0.59 0 N-CA-C 106.716 -1.587 . . . . 70.69 106.716 176.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 42' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -74.06 140.43 45.35 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.073 0.463 . . . . 129.5 110.803 178.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 43' ' ' LEU . . . . . . . . . . . . . 19.6 tp -151.73 125.78 9.2 Favored 'General case' 0 CA--C 1.508 -0.646 0 N-CA-C 108.578 -0.897 . . . . 57.71 108.578 176.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 44' ' ' TYR . . . . . . . . . . . . . 80.0 t80 -105.87 121.43 44.06 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 106.934 -1.506 . . . . 61.75 106.934 178.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 45' ' ' VAL . . . . . . . . . . . . . 19.1 t -100.48 115.52 42.04 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 N-CA-C 107.86 -1.163 . . . . 57.8 107.86 179.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 46' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -105.1 132.08 51.78 Favored 'General case' 0 C--O 1.223 -0.33 0 N-CA-C 105.968 -1.864 . . . . 64.09 105.968 176.581 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' I' I ' 47' ' ' PHE . . . . . . . . . . . . . 44.7 m-85 -67.11 -19.92 65.7 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 115.379 1.622 . . . . 59.82 115.379 -177.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 48' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -68.93 -40.6 78.91 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.382 1.473 . . . . 107.07 111.544 178.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 49' ' ' ASP . . . . . . . . . . . . 0.297 98.5 m-20 -76.43 -22.27 54.87 Favored 'General case' 0 C--N 1.373 1.6 0 CA-C-N 118.863 0.756 . . . . 96.02 112.729 177.574 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' I' I ' 50' ' ' LEU . . . . . . . . . . . . . 1.4 tp -76.81 -28.03 55.42 Favored 'General case' 0 CA--C 1.569 1.705 0 C-N-CA 125.381 1.472 . . . . 69.02 107.898 174.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 51' ' ' GLY . . . . . . . . . . . . . . . 88.57 34.21 9.51 Favored Glycine 0 C--N 1.343 0.94 0 C-N-CA 124.917 1.246 . . . . 67.5 115.563 179.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 52' ' ' TRP . . . . . . . . . . . . . 27.2 m0 -115.64 2.67 13.79 Favored 'General case' 0 C--N 1.346 0.455 0 C-N-CA 126.103 1.761 . . . . 64.63 112.536 -175.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 53' ' ' GLN . . . . . . . . . . . . . 4.4 pm0 -46.75 -38.55 10.18 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 127.584 2.354 . . . . 83.92 116.554 -178.177 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 54' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.24 -59.54 3.96 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.19 0.996 . . . . 93.08 112.811 -179.057 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' I' I ' 55' ' ' TRP . . . . . . . . . . . . . 39.8 p-90 -75.98 -25.05 55.45 Favored 'General case' 0 CA--C 1.559 1.3 0 N-CA-C 116.327 1.973 . . . . 67.89 116.327 179.258 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 56' ' ' ILE . . . . . . . . . . . . 0.275 53.0 mt -88.19 114.74 27.24 Favored 'Isoleucine or valine' 0 C--N 1.351 0.641 0 CA-C-N 119.483 1.038 . . . . 62.06 109.393 177.803 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' I' I ' 57' ' ' ILE . . . . . . . . . . . . . 45.1 mt -81.91 -56.33 6.31 Favored 'Isoleucine or valine' 0 C--O 1.239 0.534 0 C-N-CA 122.699 0.4 . . . . 67.44 110.279 -177.409 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 58' ' ' ALA . . . . . . . . . . . . . . . -142.64 138.64 16.39 Favored Pre-proline 0 CA--C 1.543 0.693 0 C-N-CA 124.49 1.116 . . . . 62.79 110.464 -177.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 59' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -81.09 176.88 37.83 Favored 'Cis proline' 0 C--N 1.363 1.328 0 CA-C-N 119.82 0.971 . . . . 62.72 111.018 -6.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 60' ' ' LYS . . . . . . . . . . . . . 6.9 mmtm -88.84 -6.3 57.44 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-O 121.969 0.89 . . . . 80.6 110.723 -179.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 61' ' ' GLY . . . . . . . . . . . . . . . 178.07 177.53 46.88 Favored Glycine 0 C--N 1.316 -0.533 0 CA-C-N 114.649 -1.16 . . . . 59.14 110.334 178.318 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 62' ' ' TYR . . . . . . . . . . . . . 23.7 p90 -163.86 156.03 17.24 Favored 'General case' 0 C--O 1.245 0.838 0 C-N-CA 123.199 0.6 . . . . 68.25 112.141 179.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 63' ' ' ALA . . . . . . . . . . . . . . . -77.29 91.51 3.81 Favored 'General case' 0 C--N 1.357 0.909 0 O-C-N 124.512 1.132 . . . . 57.29 109.5 178.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 64' ' ' ALA . . . . . . . . . . . . . . . -97.04 112.62 24.31 Favored 'General case' 0 CA--C 1.48 -1.747 0 N-CA-C 101.05 -3.685 . . . . 72.12 101.05 178.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 65' ' ' ASN . . . . . 0.644 ' O ' ' NE2' ' J' ' 84' ' ' HIS . 65.2 m-80 -105.45 178.66 4.5 Favored 'General case' 0 C--N 1.318 -0.766 1 C-N-CA 110.556 -4.458 . . . . 64.4 107.582 -176.229 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' I' I ' 66' ' ' TYR . . . . . . . . . . . . 0.268 15.0 p90 -139.35 156.64 46.88 Favored 'General case' 0 CA--C 1.494 -1.182 0 C-N-CA 124.592 1.157 . . . . 69.51 110.89 -167.509 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' I' I ' 67' ' ' CYS . . . . . . . . . . . . . 73.6 m -104.55 133.61 49.13 Favored 'General case' 0 CA--C 1.496 -1.114 0 C-N-CA 125.088 1.355 . . . . 63.99 109.49 -179.846 -63.139 -62.049 -89.242 103.285 2.05 106.584 -82.641 -55.642 1 1 . 1 . 001 ecloud orig full ' I' I ' 68' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -150.6 154.18 37.06 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 116.03 -0.532 . . . . 74.86 109.98 175.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 69' ' ' GLY . . . . . . . . . . . . . . . 121.92 162.55 11.64 Favored Glycine 0 C--N 1.322 -0.22 0 N-CA-C 116.666 1.427 . . . . 63.37 116.666 -179.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 70' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -74.8 129.03 36.96 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 127.587 2.355 . . . . 122.55 112.276 -179.137 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 71' ' ' CYS . . . . . . . . . . . . . 12.6 m -97.54 99.83 11.24 Favored 'General case' 0 CA--C 1.517 -0.295 0 N-CA-C 104.328 -2.471 . . . . 67.99 104.328 174.868 -82.737 -74.334 -91.744 103.26 2.043 104.917 -80.477 -58.178 1 1 . 1 . 001 ecloud orig full ' I' I ' 72' ' ' SER . . . . . . . . . . . . . 33.1 p -151.28 170.51 19.33 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 115.365 -0.834 . . . . 71.13 109.043 -175.014 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 73' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -84.09 137.69 40.09 Favored Pre-proline 0 CA--C 1.54 0.57 0 N-CA-C 107.811 -1.181 . . . . 59.78 107.811 176.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 74' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -67.44 137.26 36.62 Favored 'Cis proline' 0 N--CA 1.477 0.5 0 N-CA-C 114.678 0.992 . . . . 63.06 114.678 1.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 75' ' ' LEU . . . . . . . . . . . . . 23.6 mt -94.73 113.25 25.0 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 103.257 -2.868 . . . . 67.38 103.257 174.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 76' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -70.24 141.66 52.44 Favored 'General case' 0 C--N 1.354 0.781 0 C-N-CA 124.11 0.964 . . . . 97.36 109.296 179.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 77' ' ' ALA . . . . . . . . . . . . . . . -56.5 -29.81 62.26 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.121 1.368 . . . . 78.59 113.769 -179.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 78' ' ' HIS . . . . . . . . . . . . . 46.0 m-70 -64.94 -30.8 71.81 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 124.012 0.925 . . . . 88.51 112.127 177.606 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 79' ' ' MET . . . . . . . . . . . . 0.442 52.3 mtt -52.7 -31.34 37.08 Favored 'General case' 0 C--N 1.371 1.501 0 C-N-CA 126.282 1.833 . . . . 91.37 109.154 178.813 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' I' I ' 80' ' ' ASN . . . . . . . . . . . . 0.387 15.5 m120 42.49 43.11 3.01 Favored 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 131.669 3.988 . . . . 112.67 116.995 -163.604 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' I' I ' 81' ' ' ALA . . . . . . . . . . . . . . . -46.1 136.41 6.8 Favored 'General case' 0 C--N 1.357 0.899 0 C-N-CA 127.722 2.409 . . . . 65.84 112.643 -179.111 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 82' ' ' THR . . . . . . . . . . . . . 44.9 p -79.26 171.6 14.96 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.727 -0.842 . . . . 56.0 108.727 178.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 83' ' ' ASN . . . . . . . . . . . . . 42.4 m-20 -63.97 -41.42 97.56 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 108.844 -0.798 . . . . 65.13 108.844 176.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 84' ' ' HIS . . . . . 0.547 ' NE2' ' O ' ' J' ' 65' ' ' ASN . 59.4 t-80 -55.45 -45.24 76.87 Favored 'General case' 0 C--N 1.358 0.938 0 C-N-CA 125.023 1.329 . . . . 47.04 112.803 175.155 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' I' I ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.18 -44.03 97.5 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.579 0.752 . . . . 50.01 110.909 -179.333 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 86' ' ' ILE . . . . . . . . . . . . . 59.0 mt -57.04 -52.39 56.6 Favored 'Isoleucine or valine' 0 C--N 1.356 0.872 0 C-N-CA 125.592 1.557 . . . . 48.4 109.473 176.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 87' ' ' VAL . . . . . . . . . . . . . 87.8 t -60.7 -40.67 85.59 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.181 0 CA-C-O 119.287 -0.387 . . . . 53.74 110.183 -179.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 88' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -67.31 -40.07 85.95 Favored 'General case' 0 CA--C 1.501 -0.935 0 N-CA-C 113.032 0.753 . . . . 59.37 113.032 -178.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 89' ' ' THR . . . . . . . . . . . . 0.462 0.3 OUTLIER -67.62 -28.59 67.87 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 119.198 -1.001 . . . . 58.93 110.929 176.317 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' I' I ' 90' ' ' LEU . . . . . . . . . . . . . 30.0 tp -72.56 -51.45 19.77 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.505 1.122 . . . . 59.72 110.179 175.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 91' ' ' VAL . . . . . . . . . . . . . 85.5 t -58.06 -38.75 69.12 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.181 0 C-N-CA 123.776 0.831 . . . . 60.36 111.696 176.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 92' ' ' HIS . . . . . . . . . . . . . 47.5 t60 -64.72 -40.31 95.12 Favored 'General case' 0 C--O 1.216 -0.669 0 CA-C-O 118.652 -0.689 . . . . 66.45 110.094 178.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 93' ' ' LEU . . . . . . . . . . . . . 1.1 mt -61.12 -25.71 67.17 Favored 'General case' 0 C--N 1.348 0.505 0 N-CA-C 113.886 1.069 . . . . 74.73 113.886 179.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 94' ' ' MET . . . . . . . . . . . . . 12.5 mtm -90.51 -44.03 9.85 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.677 1.191 . . . . 87.68 110.974 -179.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 95' ' ' ASN . . . . . . . . . . . . . 49.3 m-20 -123.31 69.33 40.76 Favored Pre-proline 0 C--N 1.357 0.915 0 C-N-CA 124.063 0.945 . . . . 124.36 111.08 178.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 96' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -57.51 -29.65 85.57 Favored 'Trans proline' 0 C--N 1.36 1.153 0 CA-C-N 120.438 1.192 . . . . 85.49 114.303 -178.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 97' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -50.86 -55.53 16.55 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 128.156 2.582 . . . . 133.08 112.485 179.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 98' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -93.93 -53.58 3.94 Favored 'General case' 0 C--N 1.356 0.876 0 N-CA-C 117.476 2.399 . . . . 112.22 117.476 -177.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 99' ' ' VAL . . . . . . . . . . . . . 15.3 t -90.23 121.72 68.3 Favored Pre-proline 0 C--N 1.364 1.232 0 C-N-CA 125.138 1.375 . . . . 74.32 113.777 -176.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 100' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_endo -84.75 167.32 11.43 Favored 'Trans proline' 0 C--N 1.35 0.611 0 N-CA-C 115.387 1.264 . . . . 60.33 115.387 -178.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 101' ' ' LYS . . . . . . . . . . . . . 19.0 mttp -61.39 145.45 90.73 Favored Pre-proline 0 CA--C 1.535 0.37 0 N-CA-C 107.152 -1.425 . . . . 112.22 107.152 173.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 102' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -67.31 170.01 14.26 Favored 'Trans proline' 0 CA--C 1.547 1.131 0 CA-C-N 120.504 1.216 . . . . 60.03 110.253 174.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 103' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -80.02 135.46 36.37 Favored 'General case' 0 CA--C 1.458 -2.588 0 C-N-CA 130.472 3.509 . . . . 68.22 116.977 -174.951 -119.809 -98.797 172.252 106.884 2.026 91.729 107.88 82.841 2 2 . 1 . 001 ecloud orig full ' I' I ' 104' ' ' CYS . . . . . . . . . . . . . 43.4 t -88.96 104.95 17.44 Favored 'General case' 0 CA--C 1.556 1.205 0 N-CA-C 105.809 -1.923 . . . . 63.8 105.809 170.117 178.459 70.968 75.801 106.441 2.045 103.239 65.207 175.25 1 1 . 1 . 001 ecloud orig full ' I' I ' 105' ' ' ALA . . . . . . . . . . . . . . . -136.11 165.9 32.17 Favored Pre-proline 0 N--CA 1.443 -0.779 0 N-CA-C 113.701 1.0 . . . . 56.44 113.701 -174.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 106' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -71.98 132.1 19.27 Favored 'Trans proline' 0 C--N 1.363 1.295 0 N-CA-C 113.991 0.727 . . . . 64.97 113.991 -178.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 107' ' ' THR . . . . . . . . . . . . . 41.7 p -99.65 -28.87 12.98 Favored 'General case' 0 C--N 1.345 0.372 0 C-N-CA 123.76 0.824 . . . . 73.54 111.156 177.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 108' ' ' LYS . . . . . . . . . . . . . 6.5 tptm -132.07 118.84 20.19 Favored 'General case' 0 C--O 1.241 0.643 0 C-N-CA 124.658 1.183 . . . . 122.5 108.65 179.273 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 109' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -114.37 157.36 22.94 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.375 -0.829 . . . . 65.51 109.044 177.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 110' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -122.1 152.04 40.27 Favored 'General case' 0 CA--C 1.513 -0.459 0 C-N-CA 125.019 1.327 . . . . 86.26 107.759 174.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 111' ' ' ALA . . . . . . . . . . . . . . . -91.94 158.36 16.31 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.691 -0.855 . . . . 60.4 108.691 176.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 112' ' ' ILE . . . . . . . . . . . . . 4.8 pt -132.13 143.65 39.44 Favored 'Isoleucine or valine' 0 C--O 1.244 0.768 0 C-N-CA 125.201 1.4 . . . . 63.33 109.626 171.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 113' ' ' SER . . . . . . . . . . . . . 3.2 m -90.95 133.21 35.45 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 107.513 -1.291 . . . . 71.52 107.513 176.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 114' ' ' VAL . . . . . . . . . . . . . 90.0 t -123.24 131.51 73.06 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.773 0 N-CA-C 108.662 -0.866 . . . . 55.71 108.662 -179.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 115' ' ' LEU . . . . . . . . . . . . . 18.8 tp -103.47 115.77 31.14 Favored 'General case' 0 C--O 1.239 0.544 0 N-CA-C 105.426 -2.064 . . . . 58.51 105.426 176.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 116' ' ' TYR . . . . . . . . . . . . . 36.3 p90 -142.95 162.08 36.43 Favored 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 117.957 -1.497 . . . . 61.74 113.339 -175.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 117' ' ' PHE . . . . . . . . . . . . . 16.4 m-85 -90.55 124.91 35.4 Favored 'General case' 0 C--N 1.344 0.334 0 C-N-CA 125.013 1.325 . . . . 68.88 108.018 174.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 118' ' ' ASP . . . . . . . . . . . . 0.268 9.9 t70 -63.77 168.38 5.02 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 130.983 3.713 . . . . 99.39 107.7 174.901 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -66.83 -16.28 64.18 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 122.736 0.415 . . . . 99.45 110.947 176.505 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 120' ' ' ASN . . . . . . . . . . . . . 11.9 m-20 -109.07 17.56 21.53 Favored 'General case' 0 C--N 1.359 0.993 0 C-N-CA 126.415 1.886 . . . . 104.94 113.918 -179.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 121' ' ' SER . . . . . . . . . . . . . 3.6 m 68.92 14.38 8.88 Favored 'General case' 0 C--N 1.357 0.897 0 C-N-CA 126.675 1.99 . . . . 87.47 115.542 -178.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 122' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -77.09 144.71 38.32 Favored 'General case' 0 C--N 1.354 0.786 0 N-CA-C 109.704 -0.48 . . . . 76.67 109.704 174.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 123' ' ' VAL . . . . . . . . . . . . . 8.2 t -93.34 114.51 30.2 Favored 'Isoleucine or valine' 0 C--N 1.356 0.858 0 N-CA-C 107.96 -1.126 . . . . 61.28 107.96 178.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 124' ' ' ILE . . . . . . . . . . . . . 17.4 mm -109.83 139.11 34.4 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.198 0 C-N-CA 124.003 0.921 . . . . 61.95 110.34 -177.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 125' ' ' LEU . . . . . . . . . . . . . 62.0 tp -118.79 92.26 3.76 Favored 'General case' 0 C--O 1.239 0.502 0 N-CA-C 108.555 -0.905 . . . . 65.17 108.555 174.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 126' ' ' LYS . . . . . . . . . . . . . 18.8 ttmt -103.81 137.46 41.79 Favored 'General case' 0 C--N 1.354 0.766 0 N-CA-C 113.435 0.902 . . . . 118.42 113.435 -178.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 127' ' ' LYS . . . . . . . . . . . . . 66.4 tttt -95.04 114.25 26.03 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 104.891 -2.263 . . . . 116.63 104.891 174.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 128' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -99.09 113.3 25.44 Favored 'General case' 0 CA--C 1.511 -0.548 0 N-CA-C 107.53 -1.285 . . . . 76.72 107.53 179.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 129' ' ' ARG . . . . . 0.408 ' O ' ' ND2' ' J' ' 83' ' ' ASN . 77.0 mtt180 -73.68 161.96 29.7 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.919 0.888 . . . . 149.02 110.157 178.742 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' I' I ' 130' ' ' ASN . . . . . . . . . . . . . 18.1 m-20 52.23 57.91 5.96 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 126.04 1.736 . . . . 66.57 113.383 177.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 131' ' ' MET . . . . . . . . . . . . . 5.9 tpt -116.93 -37.27 3.63 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 114.654 1.353 . . . . 59.71 114.654 -168.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 132' ' ' VAL . . . . . . . . . . . . . 78.6 t -115.9 126.76 73.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 124.733 1.213 . . . . 61.42 107.957 -179.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 133' ' ' VAL . . . . . . . . . . . . . 94.1 t -81.26 121.49 34.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 N-CA-C 107.009 -1.478 . . . . 63.75 107.009 178.189 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 134' ' ' ARG . . . . . . . . . . . . . 32.4 tpt180 -93.58 -40.89 10.04 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 123.215 0.606 . . . . 128.72 110.348 175.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 135' ' ' ALA . . . . . . . . . . . . . . . -147.33 144.98 29.16 Favored 'General case' 0 C--N 1.358 0.963 0 C-N-CA 123.54 0.736 . . . . 67.25 112.933 -179.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 136' ' ' CYS . . . . . . . . . . . . . 60.2 m -102.91 167.01 10.13 Favored 'General case' 0 C--N 1.35 0.605 0 C-N-CA 125.122 1.369 . . . . 67.99 113.39 176.935 -55.642 -82.641 -89.242 106.584 2.05 103.285 -62.049 -63.139 1 1 . 1 . 001 ecloud orig full ' I' I ' 137' ' ' GLY . . . . . . . . . . . . . . . -171.62 -177.25 41.18 Favored Glycine 0 CA--C 1.502 -0.734 0 CA-C-N 115.34 -0.845 . . . . 65.73 113.605 179.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 138' ' ' CYS . . . . . . . . . . . . . 68.5 m -115.24 131.16 57.02 Favored 'General case' 0 CA--C 1.51 -0.571 0 C-N-CA 124.157 0.983 . . . . 71.17 113.235 -178.343 -58.178 -80.477 -91.744 104.917 2.043 103.26 -74.334 -82.737 1 1 . 1 . 001 ecloud orig full ' I' I ' 139' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.255 1.382 0 C-N-CA 125.295 1.438 . . . . 120.86 111.336 178.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 36' ' ' THR . . . . . . . . . . . . 0.328 0.7 OUTLIER . . . . . 0 CA--C 1.563 1.446 0 N-CA-C 113.202 0.816 . . . . 90.07 113.202 . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' J' J ' 37' ' ' ALA . . . . . . . . . . . . . . . -76.08 166.95 22.74 Favored 'General case' 0 C--N 1.36 1.047 0 C-N-CA 122.97 0.508 . . . . 76.19 111.158 178.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 38' ' ' CYS . . . . . . . . . . . . . 42.2 t -59.61 111.96 1.62 Allowed 'General case' 0 C--N 1.354 0.787 0 C-N-CA 122.874 0.47 . . . . 66.26 111.162 177.973 175.945 51.942 80.315 105.716 2.049 107.735 62.566 -165.4 1 1 . 1 . 001 ecloud orig full ' J' J ' 39' ' ' ARG . . . . . . . . . . . . . 38.5 ptt180 -149.35 162.22 40.5 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 123.944 0.898 . . . . 122.55 112.731 179.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 40' ' ' LYS . . . . . . . . . . . . . 8.9 tttt -78.67 127.63 32.36 Favored 'General case' 0 C--N 1.346 0.43 0 C-N-CA 127.481 2.312 . . . . 92.5 107.848 174.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 41' ' ' HIS . . . . . . . . . . . . . 25.4 m80 -109.91 145.58 36.63 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 126.079 1.752 . . . . 74.11 109.315 176.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 42' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -69.99 135.77 49.74 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.028 0.931 . . . . 120.62 110.37 178.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 43' ' ' LEU . . . . . . . . . . . . . 36.9 tp -151.97 126.27 9.32 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 108.204 -1.035 . . . . 55.22 108.204 175.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 44' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -107.51 128.95 54.96 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 109.063 -0.717 . . . . 69.67 109.063 179.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 45' ' ' VAL . . . . . . . . . . . . . 92.2 t -114.32 118.83 59.69 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.263 0 N-CA-C 108.283 -1.006 . . . . 53.84 108.283 179.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 46' ' ' SER . . . . . . . . . . . . . 1.5 p -84.41 151.47 24.65 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 106.425 -1.695 . . . . 66.92 106.425 175.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 47' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -70.48 -10.96 60.53 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 113.88 1.067 . . . . 63.01 113.88 178.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 48' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -67.7 -34.51 77.03 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.652 0.781 . . . . 102.71 109.661 175.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 49' ' ' ASP . . . . . . . . . . . . . 41.4 m-20 -64.22 -25.37 68.04 Favored 'General case' 0 C--N 1.348 0.517 0 C-N-CA 125.856 1.662 . . . . 97.09 111.254 178.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 50' ' ' LEU . . . . . . . . . . . . . 3.5 mt -97.53 -7.9 30.32 Favored 'General case' 0 C--N 1.35 0.587 0 C-N-CA 125.689 1.595 . . . . 73.86 110.528 177.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 51' ' ' GLY . . . . . . . . . . . . . . . 66.75 32.53 81.54 Favored Glycine 0 C--N 1.334 0.459 0 N-CA-C 111.424 -0.67 . . . . 70.44 111.424 -176.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 52' ' ' TRP . . . . . . . . . . . . . 31.3 m0 -100.68 -9.37 21.92 Favored 'General case' 0 CA--C 1.515 -0.366 0 C-N-CA 123.523 0.729 . . . . 71.61 110.931 -179.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 53' ' ' GLN . . . . . . . . . . . . 0.339 10.9 pm0 -44.38 -41.92 6.51 Favored 'General case' 0 C--N 1.353 0.727 0 N-CA-C 118.482 2.771 . . . . 81.73 118.482 -175.809 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' J' J ' 54' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -72.89 -36.52 67.33 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 113.657 0.984 . . . . 98.17 113.657 -179.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 55' ' ' TRP . . . . . . . . . . . . . 28.9 t90 -63.85 -55.05 25.75 Favored 'General case' 0 CA--C 1.571 1.77 0 C-N-CA 128.263 2.625 . . . . 88.51 111.155 178.106 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 56' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -72.96 145.47 11.81 Favored 'Isoleucine or valine' 0 C--N 1.35 0.623 0 N-CA-C 120.36 3.467 . . . . 87.65 120.36 -173.57 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' J' J ' 57' ' ' ILE . . . . . . . . . . . . . 33.9 mt -107.9 -47.31 7.8 Favored 'Isoleucine or valine' 0 C--N 1.363 1.176 0 C-N-CA 126.939 2.096 . . . . 69.16 112.082 174.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 58' ' ' ALA . . . . . . . . . . . . . . . -156.47 141.68 12.42 Favored Pre-proline 0 C--N 1.349 0.575 0 N-CA-C 114.662 1.356 . . . . 59.9 114.662 176.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 59' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -80.7 179.78 27.76 Favored 'Cis proline' 0 C--N 1.348 0.519 0 O-C-N 121.826 0.382 . . . . 60.71 111.803 -6.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 60' ' ' LYS . . . . . . . . . . . . . 8.0 mptt -85.81 -9.65 56.7 Favored 'General case' 0 CA--C 1.554 1.126 0 CA-C-O 121.536 0.684 . . . . 97.06 110.405 179.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 61' ' ' GLY . . . . . . . . . . . . . . . 179.95 178.44 48.51 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 124.989 1.281 . . . . 52.96 110.184 -179.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 62' ' ' TYR . . . . . . . . . . . . . 15.5 p90 -152.53 162.2 41.54 Favored 'General case' 0 C--O 1.247 0.931 0 CA-C-O 121.064 0.459 . . . . 67.28 110.66 -177.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 63' ' ' ALA . . . . . . . . . . . . . . . -87.86 93.6 9.51 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 107.656 -1.238 . . . . 53.66 107.656 177.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 64' ' ' ALA . . . . . . . . . . . . . . . -84.24 130.6 34.81 Favored 'General case' 0 CA--C 1.49 -1.364 1 N-CA-C 97.903 -4.851 . . . . 61.26 97.903 172.763 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' J' J ' 65' ' ' ASN . . . . . 0.547 ' O ' ' NE2' ' I' ' 84' ' ' HIS 0.268 71.2 m-80 -121.4 179.03 4.56 Favored 'General case' 0 C--N 1.295 -1.774 1 C-N-CA 105.314 -6.554 . . . . 60.73 103.929 179.092 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' J' J ' 66' ' ' TYR . . . . . . . . . . . . 0.338 9.1 p90 -135.57 148.19 49.0 Favored 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 126.846 2.058 . . . . 69.27 111.733 -163.095 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' J' J ' 67' ' ' CYS . . . . . . . . . . . . . 70.7 m -98.91 127.73 44.9 Favored 'General case' 0 CA--C 1.487 -1.445 0 C-N-CA 125.714 1.606 . . . . 63.12 109.057 179.82 -62.513 -59.995 -85.322 99.632 2.06 108.941 -80.585 -60.416 1 1 . 1 . 001 ecloud orig full ' J' J ' 68' ' ' ASP . . . . . . . . . . . . . 12.2 t0 -147.83 155.15 41.34 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 123.732 0.645 . . . . 86.55 110.785 175.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 69' ' ' GLY . . . . . . . . . . . . . . . 131.03 157.67 8.95 Favored Glycine 0 C--O 1.235 0.21 0 N-CA-C 115.316 0.886 . . . . 67.71 115.316 -179.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 70' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.38 135.25 45.79 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 125.778 1.631 . . . . 118.12 108.86 177.863 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' J' J ' 71' ' ' CYS . . . . . . . . . . . . . 1.7 m -106.29 101.78 11.23 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 108.676 -0.861 . . . . 66.83 108.676 -179.837 -90.139 -77.301 -92.825 103.915 2.039 104.277 -77.134 -60.346 1 1 . 1 . 001 ecloud orig full ' J' J ' 72' ' ' SER . . . . . . . . . . . . . 23.0 p -155.83 165.91 35.07 Favored 'General case' 0 C--N 1.345 0.411 0 C-N-CA 123.869 0.867 . . . . 66.6 112.299 -178.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 73' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -51.94 139.19 33.24 Favored Pre-proline 0 CA--C 1.542 0.667 0 N-CA-C 114.166 1.173 . . . . 55.13 114.166 -179.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 74' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -76.69 148.19 88.26 Favored 'Cis proline' 0 CA--C 1.513 -0.573 0 CA-C-N 119.314 0.791 . . . . 56.1 113.175 5.59 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 75' ' ' LEU . . . . . . . . . . . . . 79.5 mt -132.83 135.94 45.95 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.563 -0.902 . . . . 57.94 108.563 179.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 76' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -118.47 121.34 40.06 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 109.805 -0.442 . . . . 68.67 109.805 -179.305 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 77' ' ' ALA . . . . . . . . . . . . . . . -72.51 -1.92 17.72 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 115.255 1.576 . . . . 73.18 115.255 -178.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 78' ' ' HIS . . . . . . . . . . . . . 67.9 m80 -121.03 13.46 11.33 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.844 1.257 . . . . 88.22 109.971 177.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 79' ' ' MET . . . . . . . . . . . . . 7.0 mtt -139.53 -60.59 0.55 Allowed 'General case' 0 C--N 1.349 0.586 0 N-CA-C 115.893 1.812 . . . . 92.54 115.893 -177.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 80' ' ' ASN . . . . . . . . . . . . . 36.2 p30 -135.16 17.56 3.44 Favored 'General case' 0 C--N 1.347 0.482 0 N-CA-C 115.882 1.808 . . . . 76.47 115.882 -173.514 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 81' ' ' ALA . . . . . . . . . . . . . . . -158.19 160.02 36.75 Favored 'General case' 0 CA--C 1.495 -1.17 0 CA-C-N 118.204 0.457 . . . . 54.48 110.711 -178.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 82' ' ' THR . . . . . . . . . . . . . 70.9 p -101.51 172.25 7.08 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 105.305 -2.109 . . . . 50.34 105.305 174.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 83' ' ' ASN . . . . . 0.408 ' ND2' ' O ' ' I' ' 129' ' ' ARG . 87.8 m-20 -66.86 -42.94 84.84 Favored 'General case' 0 CA--C 1.508 -0.662 0 C-N-CA 124.619 1.168 . . . . 61.34 108.002 176.748 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' J' J ' 84' ' ' HIS . . . . . 0.644 ' NE2' ' O ' ' I' ' 65' ' ' ASN . 61.0 t-80 -57.43 -44.09 84.37 Favored 'General case' 0 C--N 1.358 0.942 0 C-N-CA 123.98 0.912 . . . . 48.01 112.234 176.325 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' J' J ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.69 -37.68 87.41 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 118.815 -0.612 . . . . 47.36 110.728 178.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 86' ' ' ILE . . . . . . . . . . . . . 30.9 mt -64.63 -48.89 82.89 Favored 'Isoleucine or valine' 0 C--N 1.366 1.323 0 N-CA-C 109.012 -0.736 . . . . 48.15 109.012 177.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 87' ' ' VAL . . . . . . . . . . . . . 93.8 t -60.97 -43.62 96.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 C-N-CA 123.657 0.783 . . . . 47.37 112.193 177.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 88' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -65.09 -37.57 87.94 Favored 'General case' 0 CA--C 1.508 -0.647 0 CA-C-O 118.601 -0.714 . . . . 54.43 112.801 179.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 89' ' ' THR . . . . . . . . . . . . . 26.4 m -59.57 -42.88 93.48 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 108.107 -1.072 . . . . 56.06 108.107 175.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 90' ' ' LEU . . . . . . . . . . . . . 72.1 mt -63.13 -44.21 96.24 Favored 'General case' 0 C--N 1.363 1.159 0 N-CA-C 113.862 1.06 . . . . 55.26 113.862 177.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 91' ' ' VAL . . . . . . . . . . . . . 93.8 t -62.77 -45.86 97.79 Favored 'Isoleucine or valine' 0 C--N 1.342 0.256 0 C-N-CA 123.815 0.846 . . . . 62.39 109.13 176.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 92' ' ' HIS . . . . . . . . . . . . . 76.5 t60 -59.38 -41.49 89.49 Favored 'General case' 0 C--O 1.218 -0.588 0 CA-C-O 118.716 -0.659 . . . . 65.71 111.997 178.159 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 93' ' ' LEU . . . . . . . . . . . . . 84.2 mt -62.21 -39.34 92.43 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 119.131 0.878 . . . . 76.21 112.647 -179.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 94' ' ' MET . . . . . . . . . . . . . 39.0 mtm -73.33 -43.86 59.98 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.562 0.745 . . . . 93.27 112.298 177.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 95' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -128.56 76.04 78.92 Favored Pre-proline 0 CA--C 1.555 1.17 0 C-N-CA 124.088 0.955 . . . . 116.49 111.484 -177.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 96' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -66.51 -20.91 53.67 Favored 'Trans proline' 0 C--N 1.362 1.25 0 N-CA-C 114.553 0.943 . . . . 88.04 114.553 -177.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 97' ' ' GLU . . . . . . . . . . . . . 59.9 tt0 -58.06 -51.51 69.38 Favored 'General case' 0 C--N 1.345 0.379 0 C-N-CA 125.748 1.619 . . . . 146.17 114.7 -177.583 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 98' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -105.72 -31.37 8.91 Favored 'General case' 0 C--O 1.238 0.487 0 N-CA-C 118.68 2.845 . . . . 117.32 118.68 -174.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 99' ' ' VAL . . . . . . . . . . . . . 52.3 t -103.61 119.59 54.26 Favored Pre-proline 0 C--N 1.356 0.875 0 C-N-CA 122.859 0.464 . . . . 77.71 110.125 179.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 100' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -76.94 169.89 20.81 Favored 'Trans proline' 0 C--N 1.352 0.713 0 CA-C-O 121.57 0.571 . . . . 63.12 113.215 177.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 101' ' ' LYS . . . . . . . . . . . . . 70.7 mttt -64.83 158.39 69.79 Favored Pre-proline 0 CA--C 1.552 1.034 0 N-CA-C 107.598 -1.26 . . . . 103.53 107.598 173.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 102' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -68.13 172.51 10.87 Favored 'Trans proline' 0 C--N 1.36 1.166 0 CA-C-N 120.952 1.376 . . . . 60.3 108.591 172.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 103' ' ' CYS . . . . . . . . . . . . . 3.6 p -122.51 150.73 42.15 Favored 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 116.634 -2.026 . . . . 67.51 116.15 -177.008 82.841 107.88 172.252 91.729 2.026 106.884 -98.797 -119.809 1 1 . 1 . 001 ecloud orig full ' J' J ' 104' ' ' CYS . . . . . . . . . . . . . 12.2 t -74.24 107.79 6.63 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 126.222 1.809 . . . . 63.87 110.576 -177.605 -165.4 62.566 80.315 107.735 2.049 105.716 51.942 175.945 1 1 . 1 . 001 ecloud orig full ' J' J ' 105' ' ' ALA . . . . . . . . . . . . . . . -135.14 163.3 52.09 Favored Pre-proline 0 CA--C 1.557 1.216 0 C-N-CA 124.096 0.958 . . . . 50.68 112.401 -176.124 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 106' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -66.92 151.72 81.68 Favored 'Trans proline' 0 C--N 1.355 0.907 0 CA-C-N 121.361 1.522 . . . . 56.53 114.12 -176.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 107' ' ' THR . . . . . . . . . . . . . 23.1 p -113.62 -29.73 7.04 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 106.525 -1.657 . . . . 62.28 106.525 175.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 108' ' ' LYS . . . . . . . . . . . . . 1.6 mppt? -136.78 129.34 30.27 Favored 'General case' 0 C--N 1.355 0.842 0 C-N-CA 124.015 0.926 . . . . 119.82 110.529 177.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 109' ' ' LEU . . . . . . . . . . . . . 82.0 mt -121.93 137.68 54.7 Favored 'General case' 0 C--N 1.342 0.239 0 C-N-CA 125.965 1.706 . . . . 60.72 111.072 178.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 110' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -106.76 160.22 15.65 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 121.588 0.709 . . . . 84.74 112.824 175.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 111' ' ' ALA . . . . . . . . . . . . . . . -90.69 157.58 17.37 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.066 -0.97 . . . . 60.13 109.68 177.269 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 112' ' ' ILE . . . . . . . . . . . . 0.295 50.8 mm -123.45 142.2 40.98 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.663 0 N-CA-C 108.614 -0.884 . . . . 73.84 108.614 171.622 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' J' J ' 113' ' ' SER . . . . . . . . . . . . . 70.7 m -103.8 132.82 49.69 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 106.195 -1.78 . . . . 75.13 106.195 177.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 114' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -123.97 138.4 53.76 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 CA-C-N 115.268 -0.878 . . . . 59.06 109.977 -176.984 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' J' J ' 115' ' ' LEU . . . . . . . . . . . . . 14.0 tp -108.74 115.95 31.06 Favored 'General case' 0 CA--C 1.499 -0.997 0 N-CA-C 106.054 -1.832 . . . . 61.82 106.054 -179.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 116' ' ' TYR . . . . . . . . . . . . . 42.0 p90 -132.04 160.68 35.19 Favored 'General case' 0 CA--C 1.505 -0.785 0 N-CA-C 113.972 1.101 . . . . 75.63 113.972 -177.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 117' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -97.06 147.1 24.37 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 125.285 1.434 . . . . 90.52 109.928 176.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 118' ' ' ASP . . . . . . . . . . . . 0.251 1.0 OUTLIER -112.78 -169.74 1.54 Allowed 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 109.421 -0.585 . . . . 92.62 109.421 173.276 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' J' J ' 119' ' ' ASP . . . . . . . . . . . . . 56.5 m-20 -73.31 -34.27 65.63 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 114.497 1.295 . . . . 116.98 114.497 -178.374 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 120' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -78.92 0.9 25.53 Favored 'General case' 0 C--N 1.354 0.793 0 C-N-CA 124.054 0.942 . . . . 126.18 110.992 176.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 121' ' ' SER . . . . . . . . . . . . . 39.0 t 68.46 42.33 1.61 Allowed 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 127.643 2.377 . . . . 94.18 108.014 178.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 122' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -85.53 150.88 24.36 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 125.059 1.344 . . . . 85.99 108.303 171.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 123' ' ' VAL . . . . . . . . . . . . . 62.0 t -107.73 110.88 33.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 N-CA-C 103.822 -2.658 . . . . 61.02 103.822 175.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 124' ' ' ILE . . . . . . . . . . . . . 2.9 mp -106.77 142.84 18.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 124.22 1.008 . . . . 68.3 109.929 -179.333 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 125' ' ' LEU . . . . . . . . . . . . . 11.5 tp -113.8 109.22 18.2 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 106.183 -1.784 . . . . 68.64 106.183 173.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 126' ' ' LYS . . . . . . . . . . . . . 32.8 tttm -108.82 129.65 55.39 Favored 'General case' 0 C--N 1.358 0.973 0 N-CA-C 113.175 0.805 . . . . 113.1 113.175 -179.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 127' ' ' LYS . . . . . . . . . . . . . 31.4 tttt -93.23 121.76 34.93 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.716 1.206 . . . . 111.42 107.946 176.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 128' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -105.67 111.04 23.57 Favored 'General case' 0 CA--C 1.493 -1.23 0 N-CA-C 106.22 -1.77 . . . . 81.92 106.22 178.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 129' ' ' ARG . . . . . . . . . . . . . 4.7 mtt180 -77.44 155.83 31.52 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 123.588 0.755 . . . . 136.9 111.624 -179.021 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 130' ' ' ASN . . . . . . . . . . . . . 62.0 m-20 52.26 57.65 6.23 Favored 'General case' 0 CA--C 1.493 -1.244 0 C-N-CA 127.544 2.337 . . . . 60.31 110.973 176.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 131' ' ' MET . . . . . . . . . . . . . 4.5 tpt -115.68 -28.94 6.59 Favored 'General case' 0 N--CA 1.433 -1.283 0 N-CA-C 116.016 1.858 . . . . 56.2 116.016 -170.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 132' ' ' VAL . . . . . . . . . . . . . 85.1 t -122.45 138.79 51.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 126.084 1.753 . . . . 50.71 108.969 -177.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 133' ' ' VAL . . . . . . . . . . . . . 40.9 t -91.39 131.09 39.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 106.636 -1.616 . . . . 55.93 106.636 177.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 134' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -107.42 -46.07 3.94 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.976 1.711 . . . . 117.65 111.29 178.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 135' ' ' ALA . . . . . . . . . . . . . . . -141.75 140.5 33.1 Favored 'General case' 0 C--N 1.351 0.661 0 C-N-CA 124.179 0.992 . . . . 65.14 111.489 -178.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 136' ' ' CYS . . . . . . . . . . . . . 80.2 m -106.2 159.15 16.32 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 124.328 1.051 . . . . 68.45 111.748 177.357 -60.416 -80.585 -85.322 108.941 2.06 99.632 -59.995 -62.513 1 1 . 1 . 001 ecloud orig full ' J' J ' 137' ' ' GLY . . . . . . . . . . . . . . . -160.22 168.98 35.98 Favored Glycine 0 CA--C 1.509 -0.334 0 C-N-CA 124.236 0.922 . . . . 63.42 111.193 179.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 138' ' ' CYS . . . . . . . . . . . . . 80.6 m -94.49 125.73 39.32 Favored 'General case' 0 CA--C 1.487 -1.463 0 C-N-CA 124.11 0.964 . . . . 65.95 111.415 179.645 -60.346 -77.134 -92.825 104.277 2.039 103.915 -77.301 -90.139 1 1 . 1 . 001 ecloud orig full ' J' J ' 139' ' ' HIS . . . . . . . . . . . . . 46.6 m80 . . . . . 0 C--O 1.252 1.206 0 O-C-N 124.384 1.052 . . . . 81.69 113.068 -176.799 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I 1001 ' ' IPA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I 1002 ' ' IPA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I 1003 ' ' IPA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I 1004 ' ' IPA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I 1005 ' ' IPA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I 1006 ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J 1001 ' ' IPA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J 1002 ' ' PEG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J 1003 ' ' PEG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J 1004 ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J 1005 ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I 1101 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I 1102 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I 1103 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I 1104 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I 1105 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I 1106 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I 1107 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I 1108 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I 1109 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I 1110 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I 1111 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I 1112 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I 1113 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I 1114 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I 1115 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I 1116 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I 1117 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I 1118 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I 1119 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I 1120 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I 1121 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J 1101 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J 1102 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J 1103 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J 1104 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J 1105 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J 1106 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J 1107 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J 1108 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J 1109 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J 1110 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J 1111 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J 1112 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J 1113 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J 1114 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J 1115 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J 1116 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J 1117 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J 1118 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 36' ' ' THR . . . . . . . . . . . . . 7.1 t . . . . . 0 CA--C 1.541 0.598 0 N-CA-C 113.616 0.969 . . . . 92.67 113.616 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 37' ' ' ALA . . . . . . . . . . . . . . . -77.23 154.76 32.71 Favored 'General case' 0 C--N 1.354 0.797 0 CA-C-N 118.132 0.424 . . . . 72.97 110.682 -179.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 38' ' ' CYS . . . . . . . . . . . . . 39.4 t -55.02 121.97 9.9 Favored 'General case' 0 C--N 1.348 0.51 0 C-N-CA 124.807 1.243 . . . . 68.39 111.594 178.618 175.25 65.207 75.801 103.239 2.045 106.441 70.968 178.459 1 1 . 1 . 001 ecloud build full ' I' I ' 39' ' ' ARG . . . . . . . . . . . . . 31.3 ptt85 -157.44 170.17 23.05 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.065 0.946 . . . . 126.97 111.815 178.412 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 40' ' ' LYS . . . . . . . . . . . . . 24.4 ttpt -81.24 126.65 31.79 Favored 'General case' 0 C--N 1.345 0.4 0 C-N-CA 127.055 2.142 . . . . 91.61 109.655 175.535 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 41' ' ' HIS . . . . . . . . . . . . . 14.2 m80 -110.29 140.86 44.04 Favored 'General case' 0 C--O 1.218 -0.59 0 N-CA-C 106.716 -1.587 . . . . 70.69 106.716 176.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 42' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -74.06 140.43 45.35 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.073 0.463 . . . . 129.5 110.803 178.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 43' ' ' LEU . . . . . . . . . . . . . 19.6 tp -151.73 125.78 9.2 Favored 'General case' 0 CA--C 1.508 -0.646 0 N-CA-C 108.578 -0.897 . . . . 57.71 108.578 176.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 44' ' ' TYR . . . . . . . . . . . . . 80.0 t80 -105.87 121.43 44.06 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 106.934 -1.506 . . . . 61.75 106.934 178.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 45' ' ' VAL . . . . . . . . . . . . . 19.1 t -100.48 115.52 42.04 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 N-CA-C 107.86 -1.163 . . . . 57.8 107.86 179.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 46' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -105.1 132.08 51.78 Favored 'General case' 0 C--O 1.223 -0.33 0 N-CA-C 105.968 -1.864 . . . . 64.09 105.968 176.581 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 47' ' ' PHE . . . . . . . . . . . . . 44.7 m-85 -67.11 -19.92 65.7 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 115.379 1.622 . . . . 59.82 115.379 -177.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 48' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -68.93 -40.6 78.91 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.382 1.473 . . . . 107.07 111.544 178.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 49' ' ' ASP . . . . . . . . . . . . 0.297 98.5 m-20 -76.43 -22.27 54.87 Favored 'General case' 0 C--N 1.373 1.6 0 CA-C-N 118.863 0.756 . . . . 96.02 112.729 177.574 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 50' ' ' LEU . . . . . . . . . . . . . 1.4 tp -76.81 -28.03 55.42 Favored 'General case' 0 CA--C 1.569 1.705 0 C-N-CA 125.381 1.472 . . . . 69.02 107.898 174.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 51' ' ' GLY . . . . . . . . . . . . . . . 88.57 34.21 9.51 Favored Glycine 0 C--N 1.343 0.94 0 C-N-CA 124.917 1.246 . . . . 67.5 115.563 179.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 52' ' ' TRP . . . . . . . . . . . . . 27.2 m0 -115.64 2.67 13.79 Favored 'General case' 0 C--N 1.346 0.455 0 C-N-CA 126.103 1.761 . . . . 64.63 112.536 -175.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 53' ' ' GLN . . . . . . . . . . . . . 4.4 pm0 -46.75 -38.55 10.18 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 127.584 2.354 . . . . 83.92 116.554 -178.177 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 54' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.24 -59.54 3.96 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.19 0.996 . . . . 93.08 112.811 -179.057 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 55' ' ' TRP . . . . . . . . . . . . . 39.8 p-90 -75.98 -25.05 55.45 Favored 'General case' 0 CA--C 1.559 1.3 0 N-CA-C 116.327 1.973 . . . . 67.89 116.327 179.258 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 56' ' ' ILE . . . . . . . . . . . . 0.275 53.0 mt -88.19 114.74 27.24 Favored 'Isoleucine or valine' 0 C--N 1.351 0.641 0 CA-C-N 119.483 1.038 . . . . 62.06 109.393 177.803 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 57' ' ' ILE . . . . . . . . . . . . . 45.1 mt -81.91 -56.33 6.31 Favored 'Isoleucine or valine' 0 C--O 1.239 0.534 0 C-N-CA 122.699 0.4 . . . . 67.44 110.279 -177.409 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 58' ' ' ALA . . . . . . . . . . . . . . . -142.64 138.64 16.39 Favored Pre-proline 0 CA--C 1.543 0.693 0 C-N-CA 124.49 1.116 . . . . 62.79 110.464 -177.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 59' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -81.09 176.88 37.83 Favored 'Cis proline' 0 C--N 1.363 1.328 0 CA-C-N 119.82 0.971 . . . . 62.72 111.018 -6.85 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 60' ' ' LYS . . . . . . . . . . . . . 6.9 mmtm -88.84 -6.3 57.44 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-O 121.969 0.89 . . . . 80.6 110.723 -179.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 61' ' ' GLY . . . . . . . . . . . . . . . 178.07 177.53 46.88 Favored Glycine 0 C--N 1.316 -0.533 0 CA-C-N 114.649 -1.16 . . . . 59.14 110.334 178.318 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 62' ' ' TYR . . . . . 0.443 ' CE2' ' HB2' ' I' ' 64' ' ' ALA . 23.7 p90 -163.86 156.03 17.24 Favored 'General case' 0 C--O 1.245 0.838 0 C-N-CA 123.199 0.6 . . . . 68.25 112.141 179.845 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 63' ' ' ALA . . . . . . . . . . . . . . . -77.29 91.51 3.81 Favored 'General case' 0 C--N 1.357 0.909 0 O-C-N 124.512 1.132 . . . . 57.29 109.5 178.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 64' ' ' ALA . . . . . 0.443 ' HB2' ' CE2' ' I' ' 62' ' ' TYR . . . -97.04 112.62 24.31 Favored 'General case' 0 CA--C 1.48 -1.747 0 N-CA-C 101.05 -3.685 . . . . 72.12 101.05 178.649 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 65' ' ' ASN . . . . . 0.644 ' O ' ' NE2' ' J' ' 84' ' ' HIS . 65.2 m-80 -105.45 178.66 4.5 Favored 'General case' 0 C--N 1.318 -0.766 1 C-N-CA 110.556 -4.458 . . . . 64.4 107.582 -176.229 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' I' I ' 66' ' ' TYR . . . . . . . . . . . . 0.268 15.0 p90 -139.35 156.64 46.88 Favored 'General case' 0 CA--C 1.494 -1.182 0 C-N-CA 124.592 1.157 . . . . 69.51 110.89 -167.509 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 67' ' ' CYS . . . . . . . . . . . . . 73.6 m -104.55 133.61 49.13 Favored 'General case' 0 CA--C 1.496 -1.114 0 C-N-CA 125.088 1.355 . . . . 63.99 109.49 -179.846 -63.139 -62.049 -89.242 103.285 2.05 106.584 -82.641 -55.642 1 1 . 1 . 001 ecloud build full ' I' I ' 68' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -150.6 154.18 37.06 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 116.03 -0.532 . . . . 74.86 109.98 175.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 69' ' ' GLY . . . . . . . . . . . . . . . 121.92 162.55 11.64 Favored Glycine 0 C--N 1.322 -0.22 0 N-CA-C 116.666 1.427 . . . . 63.37 116.666 -179.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 70' ' ' GLU . . . . . 0.477 ' OE2' ' HE2' ' I' ' 101' ' ' LYS . 88.6 tt0 -74.8 129.03 36.96 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 127.587 2.355 . . . . 122.55 112.276 -179.137 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 71' ' ' CYS . . . . . . . . . . . . . 12.6 m -97.54 99.83 11.24 Favored 'General case' 0 CA--C 1.517 -0.295 0 N-CA-C 104.328 -2.471 . . . . 67.99 104.328 174.868 -82.737 -74.334 -91.744 103.26 2.043 104.917 -80.477 -58.178 1 1 . 1 . 001 ecloud build full ' I' I ' 72' ' ' SER . . . . . . . . . . . . . 33.1 p -151.28 170.51 19.33 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 115.365 -0.834 . . . . 71.13 109.043 -175.014 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 73' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -84.09 137.69 40.09 Favored Pre-proline 0 CA--C 1.54 0.57 0 N-CA-C 107.811 -1.181 . . . . 59.78 107.811 176.087 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 74' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -67.44 137.26 36.62 Favored 'Cis proline' 0 N--CA 1.477 0.5 0 N-CA-C 114.678 0.992 . . . . 63.06 114.678 1.481 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 75' ' ' LEU . . . . . . . . . . . . . 23.6 mt -94.73 113.25 25.0 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 103.257 -2.868 . . . . 67.38 103.257 174.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 76' ' ' ASN . . . . . 0.594 ' HB2' ' H11' ' I' 1005 ' ' IPA . 12.4 t-20 -70.24 141.66 52.44 Favored 'General case' 0 C--N 1.354 0.781 0 C-N-CA 124.11 0.964 . . . . 97.36 109.296 179.666 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 77' ' ' ALA . . . . . . . . . . . . . . . -56.5 -29.81 62.26 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.121 1.368 . . . . 78.59 113.769 -179.319 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 78' ' ' HIS . . . . . . . . . . . . . 46.0 m-70 -64.94 -30.8 71.81 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 124.012 0.925 . . . . 88.51 112.127 177.606 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 79' ' ' MET . . . . . . . . . . . . 0.442 52.3 mtt -52.7 -31.34 37.08 Favored 'General case' 0 C--N 1.371 1.501 0 C-N-CA 126.282 1.833 . . . . 91.37 109.154 178.813 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 80' ' ' ASN . . . . . . . . . . . . 0.387 15.5 m120 42.49 43.11 3.01 Favored 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 131.669 3.988 . . . . 112.67 116.995 -163.604 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 81' ' ' ALA . . . . . . . . . . . . . . . -46.1 136.41 6.8 Favored 'General case' 0 C--N 1.357 0.899 0 C-N-CA 127.722 2.409 . . . . 65.84 112.643 -179.111 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 82' ' ' THR . . . . . . . . . . . . . 44.9 p -79.26 171.6 14.96 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.727 -0.842 . . . . 56.0 108.727 178.347 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 83' ' ' ASN . . . . . . . . . . . . . 42.4 m-20 -63.97 -41.42 97.56 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 108.844 -0.798 . . . . 65.13 108.844 176.16 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 84' ' ' HIS . . . . . 0.547 ' NE2' ' O ' ' J' ' 65' ' ' ASN . 59.4 t-80 -55.45 -45.24 76.87 Favored 'General case' 0 C--N 1.358 0.938 0 C-N-CA 125.023 1.329 . . . . 47.04 112.803 175.155 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 85' ' ' ALA . . . . . 0.537 ' HB2' ' HA ' ' I' ' 139' ' ' HIS . . . -62.18 -44.03 97.5 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.579 0.752 . . . . 50.01 110.909 -179.333 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 86' ' ' ILE . . . . . . . . . . . . . 59.0 mt -57.04 -52.39 56.6 Favored 'Isoleucine or valine' 0 C--N 1.356 0.872 0 C-N-CA 125.592 1.557 . . . . 48.4 109.473 176.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 87' ' ' VAL . . . . . . . . . . . . . 87.8 t -60.7 -40.67 85.59 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.181 0 CA-C-O 119.287 -0.387 . . . . 53.74 110.183 -179.402 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 88' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -67.31 -40.07 85.95 Favored 'General case' 0 CA--C 1.501 -0.935 0 N-CA-C 113.032 0.753 . . . . 59.37 113.032 -178.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 89' ' ' THR . . . . . 0.484 HG22 ' O ' ' I' ' 85' ' ' ALA 0.462 0.3 OUTLIER -67.62 -28.59 67.87 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 119.198 -1.001 . . . . 58.93 110.929 176.317 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' I' I ' 90' ' ' LEU . . . . . . . . . . . . . 30.0 tp -72.56 -51.45 19.77 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.505 1.122 . . . . 59.72 110.179 175.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 91' ' ' VAL . . . . . . . . . . . . . 85.5 t -58.06 -38.75 69.12 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.181 0 C-N-CA 123.776 0.831 . . . . 60.36 111.696 176.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 92' ' ' HIS . . . . . . . . . . . . . 47.5 t60 -64.72 -40.31 95.12 Favored 'General case' 0 C--O 1.216 -0.669 0 CA-C-O 118.652 -0.689 . . . . 66.45 110.094 178.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 93' ' ' LEU . . . . . . . . . . . . . 1.1 mt -61.12 -25.71 67.17 Favored 'General case' 0 C--N 1.348 0.505 0 N-CA-C 113.886 1.069 . . . . 74.73 113.886 179.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 94' ' ' MET . . . . . . . . . . . . . 12.5 mtm -90.51 -44.03 9.85 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.677 1.191 . . . . 87.68 110.974 -179.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 95' ' ' ASN . . . . . . . . . . . . . 49.3 m-20 -123.31 69.33 40.76 Favored Pre-proline 0 C--N 1.357 0.915 0 C-N-CA 124.063 0.945 . . . . 124.36 111.08 178.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 96' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -57.51 -29.65 85.57 Favored 'Trans proline' 0 C--N 1.36 1.153 0 CA-C-N 120.438 1.192 . . . . 85.49 114.303 -178.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 97' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -50.86 -55.53 16.55 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 128.156 2.582 . . . . 133.08 112.485 179.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 98' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -93.93 -53.58 3.94 Favored 'General case' 0 C--N 1.356 0.876 0 N-CA-C 117.476 2.399 . . . . 112.22 117.476 -177.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 99' ' ' VAL . . . . . . . . . . . . . 15.3 t -90.23 121.72 68.3 Favored Pre-proline 0 C--N 1.364 1.232 0 C-N-CA 125.138 1.375 . . . . 74.32 113.777 -176.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 100' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_endo -84.75 167.32 11.43 Favored 'Trans proline' 0 C--N 1.35 0.611 0 N-CA-C 115.387 1.264 . . . . 60.33 115.387 -178.145 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 101' ' ' LYS . . . . . 0.477 ' HE2' ' OE2' ' I' ' 70' ' ' GLU . 19.0 mttp -61.39 145.45 90.73 Favored Pre-proline 0 CA--C 1.535 0.37 0 N-CA-C 107.152 -1.425 . . . . 112.22 107.152 173.834 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 102' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -67.31 170.01 14.26 Favored 'Trans proline' 0 CA--C 1.547 1.131 0 CA-C-N 120.504 1.216 . . . . 60.03 110.253 174.342 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 103' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -80.02 135.46 36.37 Favored 'General case' 0 CA--C 1.458 -2.588 0 C-N-CA 130.472 3.509 . . . . 68.22 116.977 -174.951 -119.809 -98.797 172.252 106.884 2.026 91.729 107.88 82.841 2 2 . 1 . 001 ecloud build full ' I' I ' 104' ' ' CYS . . . . . . . . . . . . . 43.4 t -88.96 104.95 17.44 Favored 'General case' 0 CA--C 1.556 1.205 0 N-CA-C 105.809 -1.923 . . . . 63.8 105.809 170.117 178.459 70.968 75.801 106.441 2.045 103.239 65.207 175.25 1 1 . 1 . 001 ecloud build full ' I' I ' 105' ' ' ALA . . . . . . . . . . . . . . . -136.11 165.9 32.17 Favored Pre-proline 0 N--CA 1.443 -0.779 0 N-CA-C 113.701 1.0 . . . . 56.44 113.701 -174.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 106' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -71.98 132.1 19.27 Favored 'Trans proline' 0 C--N 1.363 1.295 0 N-CA-C 113.991 0.727 . . . . 64.97 113.991 -178.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 107' ' ' THR . . . . . . . . . . . . . 41.7 p -99.65 -28.87 12.98 Favored 'General case' 0 C--N 1.345 0.372 0 C-N-CA 123.76 0.824 . . . . 73.54 111.156 177.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 108' ' ' LYS . . . . . . . . . . . . . 6.5 tptm -132.07 118.84 20.19 Favored 'General case' 0 C--O 1.241 0.643 0 C-N-CA 124.658 1.183 . . . . 122.5 108.65 179.273 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 109' ' ' LEU . . . . . 0.553 ' HB3' ' HA ' ' I' ' 130' ' ' ASN . 3.9 mm? -114.37 157.36 22.94 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.375 -0.829 . . . . 65.51 109.044 177.49 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 110' ' ' ASN . . . . . . . . . . . . . 47.4 m-20 -122.1 152.04 40.27 Favored 'General case' 0 CA--C 1.513 -0.459 0 C-N-CA 125.019 1.327 . . . . 86.26 107.759 174.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 111' ' ' ALA . . . . . . . . . . . . . . . -91.94 158.36 16.31 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.691 -0.855 . . . . 60.4 108.691 176.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 112' ' ' ILE . . . . . 0.629 HG12 ' HG2' ' I' ' 131' ' ' MET . 4.8 pt -132.13 143.65 39.44 Favored 'Isoleucine or valine' 0 C--O 1.244 0.768 0 C-N-CA 125.201 1.4 . . . . 63.33 109.626 171.754 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 113' ' ' SER . . . . . . . . . . . . . 3.2 m -90.95 133.21 35.45 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 107.513 -1.291 . . . . 71.52 107.513 176.598 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 114' ' ' VAL . . . . . . . . . . . . . 90.0 t -123.24 131.51 73.06 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.773 0 N-CA-C 108.662 -0.866 . . . . 55.71 108.662 -179.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 115' ' ' LEU . . . . . . . . . . . . . 18.8 tp -103.47 115.77 31.14 Favored 'General case' 0 C--O 1.239 0.544 0 N-CA-C 105.426 -2.064 . . . . 58.51 105.426 176.488 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 116' ' ' TYR . . . . . . . . . . . . . 36.3 p90 -142.95 162.08 36.43 Favored 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 117.957 -1.497 . . . . 61.74 113.339 -175.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 117' ' ' PHE . . . . . . . . . . . . . 16.4 m-85 -90.55 124.91 35.4 Favored 'General case' 0 C--N 1.344 0.334 0 C-N-CA 125.013 1.325 . . . . 68.88 108.018 174.368 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 118' ' ' ASP . . . . . . . . . . . . 0.268 9.9 t70 -63.77 168.38 5.02 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 130.983 3.713 . . . . 99.39 107.7 174.901 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -66.83 -16.28 64.18 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 122.736 0.415 . . . . 99.45 110.947 176.505 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 120' ' ' ASN . . . . . . . . . . . . . 11.9 m-20 -109.07 17.56 21.53 Favored 'General case' 0 C--N 1.359 0.993 0 C-N-CA 126.415 1.886 . . . . 104.94 113.918 -179.391 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 121' ' ' SER . . . . . . . . . . . . . 3.6 m 68.92 14.38 8.88 Favored 'General case' 0 C--N 1.357 0.897 0 C-N-CA 126.675 1.99 . . . . 87.47 115.542 -178.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 122' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -77.09 144.71 38.32 Favored 'General case' 0 C--N 1.354 0.786 0 N-CA-C 109.704 -0.48 . . . . 76.67 109.704 174.365 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 123' ' ' VAL . . . . . . . . . . . . . 8.2 t -93.34 114.51 30.2 Favored 'Isoleucine or valine' 0 C--N 1.356 0.858 0 N-CA-C 107.96 -1.126 . . . . 61.28 107.96 178.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 124' ' ' ILE . . . . . . . . . . . . . 17.4 mm -109.83 139.11 34.4 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.198 0 C-N-CA 124.003 0.921 . . . . 61.95 110.34 -177.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 125' ' ' LEU . . . . . . . . . . . . . 62.0 tp -118.79 92.26 3.76 Favored 'General case' 0 C--O 1.239 0.502 0 N-CA-C 108.555 -0.905 . . . . 65.17 108.555 174.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 126' ' ' LYS . . . . . . . . . . . . . 18.8 ttmt -103.81 137.46 41.79 Favored 'General case' 0 C--N 1.354 0.766 0 N-CA-C 113.435 0.902 . . . . 118.42 113.435 -178.657 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 127' ' ' LYS . . . . . . . . . . . . . 66.4 tttt -95.04 114.25 26.03 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 104.891 -2.263 . . . . 116.63 104.891 174.096 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 128' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -99.09 113.3 25.44 Favored 'General case' 0 CA--C 1.511 -0.548 0 N-CA-C 107.53 -1.285 . . . . 76.72 107.53 179.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 129' ' ' ARG . . . . . 0.461 ' H ' ' H11' ' I' 1001 ' ' IPA . 77.0 mtt180 -73.68 161.96 29.7 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.919 0.888 . . . . 149.02 110.157 178.742 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 130' ' ' ASN . . . . . 0.553 ' HA ' ' HB3' ' I' ' 109' ' ' LEU . 18.1 m-20 52.23 57.91 5.96 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 126.04 1.736 . . . . 66.57 113.383 177.954 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 131' ' ' MET . . . . . 0.629 ' HG2' HG12 ' I' ' 112' ' ' ILE . 5.9 tpt -116.93 -37.27 3.63 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 114.654 1.353 . . . . 59.71 114.654 -168.921 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 132' ' ' VAL . . . . . . . . . . . . . 78.6 t -115.9 126.76 73.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 124.733 1.213 . . . . 61.42 107.957 -179.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 133' ' ' VAL . . . . . . . . . . . . . 94.1 t -81.26 121.49 34.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 N-CA-C 107.009 -1.478 . . . . 63.75 107.009 178.189 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 134' ' ' ARG . . . . . . . . . . . . . 32.4 tpt180 -93.58 -40.89 10.04 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 123.215 0.606 . . . . 128.72 110.348 175.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 135' ' ' ALA . . . . . . . . . . . . . . . -147.33 144.98 29.16 Favored 'General case' 0 C--N 1.358 0.963 0 C-N-CA 123.54 0.736 . . . . 67.25 112.933 -179.255 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 136' ' ' CYS . . . . . . . . . . . . . 60.2 m -102.91 167.01 10.13 Favored 'General case' 0 C--N 1.35 0.605 0 C-N-CA 125.122 1.369 . . . . 67.99 113.39 176.935 -55.642 -82.641 -89.242 106.584 2.05 103.285 -62.049 -63.139 1 1 . 1 . 001 ecloud build full ' I' I ' 137' ' ' GLY . . . . . . . . . . . . . . . -171.62 -177.25 41.18 Favored Glycine 0 CA--C 1.502 -0.734 0 CA-C-N 115.34 -0.845 . . . . 65.73 113.605 179.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 138' ' ' CYS . . . . . . . . . . . . . 68.5 m -115.24 131.16 57.02 Favored 'General case' 0 CA--C 1.51 -0.571 0 C-N-CA 124.157 0.983 . . . . 71.17 113.235 -178.343 -58.178 -80.477 -91.744 104.917 2.043 103.26 -74.334 -82.737 1 1 . 1 . 001 ecloud build full ' I' I ' 139' ' ' HIS . . . . . 0.537 ' HA ' ' HB2' ' I' ' 85' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.255 1.382 0 C-N-CA 125.295 1.438 . . . . 120.86 111.336 178.097 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 36' ' ' THR . . . . . . . . . . . . 0.328 0.7 OUTLIER . . . . . 0 CA--C 1.563 1.446 0 N-CA-C 113.202 0.816 . . . . 90.07 113.202 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 37' ' ' ALA . . . . . . . . . . . . . . . -76.08 166.95 22.74 Favored 'General case' 0 C--N 1.36 1.047 0 C-N-CA 122.97 0.508 . . . . 76.19 111.158 178.85 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 38' ' ' CYS . . . . . . . . . . . . . 42.2 t -59.61 111.96 1.62 Allowed 'General case' 0 C--N 1.354 0.787 0 C-N-CA 122.874 0.47 . . . . 66.26 111.162 177.973 175.945 51.942 80.315 105.716 2.049 107.735 62.566 -165.4 1 1 . 1 . 001 ecloud build full ' J' J ' 39' ' ' ARG . . . . . . . . . . . . . 38.5 ptt180 -149.35 162.22 40.5 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 123.944 0.898 . . . . 122.55 112.731 179.75 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 40' ' ' LYS . . . . . . . . . . . . . 8.9 tttt -78.67 127.63 32.36 Favored 'General case' 0 C--N 1.346 0.43 0 C-N-CA 127.481 2.312 . . . . 92.5 107.848 174.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 41' ' ' HIS . . . . . . . . . . . . . 25.4 m80 -109.91 145.58 36.63 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 126.079 1.752 . . . . 74.11 109.315 176.276 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 42' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -69.99 135.77 49.74 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.028 0.931 . . . . 120.62 110.37 178.052 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 43' ' ' LEU . . . . . . . . . . . . . 36.9 tp -151.97 126.27 9.32 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 108.204 -1.035 . . . . 55.22 108.204 175.41 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 44' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -107.51 128.95 54.96 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 109.063 -0.717 . . . . 69.67 109.063 179.067 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 45' ' ' VAL . . . . . . . . . . . . . 92.2 t -114.32 118.83 59.69 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.263 0 N-CA-C 108.283 -1.006 . . . . 53.84 108.283 179.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 46' ' ' SER . . . . . . . . . . . . . 1.5 p -84.41 151.47 24.65 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 106.425 -1.695 . . . . 66.92 106.425 175.444 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 47' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -70.48 -10.96 60.53 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 113.88 1.067 . . . . 63.01 113.88 178.657 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 48' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -67.7 -34.51 77.03 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.652 0.781 . . . . 102.71 109.661 175.561 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 49' ' ' ASP . . . . . . . . . . . . . 41.4 m-20 -64.22 -25.37 68.04 Favored 'General case' 0 C--N 1.348 0.517 0 C-N-CA 125.856 1.662 . . . . 97.09 111.254 178.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 50' ' ' LEU . . . . . . . . . . . . . 3.5 mt -97.53 -7.9 30.32 Favored 'General case' 0 C--N 1.35 0.587 0 C-N-CA 125.689 1.595 . . . . 73.86 110.528 177.052 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 51' ' ' GLY . . . . . . . . . . . . . . . 66.75 32.53 81.54 Favored Glycine 0 C--N 1.334 0.459 0 N-CA-C 111.424 -0.67 . . . . 70.44 111.424 -176.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 52' ' ' TRP . . . . . . . . . . . . . 31.3 m0 -100.68 -9.37 21.92 Favored 'General case' 0 CA--C 1.515 -0.366 0 C-N-CA 123.523 0.729 . . . . 71.61 110.931 -179.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 53' ' ' GLN . . . . . . . . . . . . 0.339 10.9 pm0 -44.38 -41.92 6.51 Favored 'General case' 0 C--N 1.353 0.727 0 N-CA-C 118.482 2.771 . . . . 81.73 118.482 -175.809 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 54' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -72.89 -36.52 67.33 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 113.657 0.984 . . . . 98.17 113.657 -179.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 55' ' ' TRP . . . . . . . . . . . . . 28.9 t90 -63.85 -55.05 25.75 Favored 'General case' 0 CA--C 1.571 1.77 0 C-N-CA 128.263 2.625 . . . . 88.51 111.155 178.106 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 56' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -72.96 145.47 11.81 Favored 'Isoleucine or valine' 0 C--N 1.35 0.623 0 N-CA-C 120.36 3.467 . . . . 87.65 120.36 -173.57 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 57' ' ' ILE . . . . . . . . . . . . . 33.9 mt -107.9 -47.31 7.8 Favored 'Isoleucine or valine' 0 C--N 1.363 1.176 0 C-N-CA 126.939 2.096 . . . . 69.16 112.082 174.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 58' ' ' ALA . . . . . . . . . . . . . . . -156.47 141.68 12.42 Favored Pre-proline 0 C--N 1.349 0.575 0 N-CA-C 114.662 1.356 . . . . 59.9 114.662 176.798 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 59' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -80.7 179.78 27.76 Favored 'Cis proline' 0 C--N 1.348 0.519 0 O-C-N 121.826 0.382 . . . . 60.71 111.803 -6.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 60' ' ' LYS . . . . . . . . . . . . . 8.0 mptt -85.81 -9.65 56.7 Favored 'General case' 0 CA--C 1.554 1.126 0 CA-C-O 121.536 0.684 . . . . 97.06 110.405 179.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 61' ' ' GLY . . . . . . . . . . . . . . . 179.95 178.44 48.51 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 124.989 1.281 . . . . 52.96 110.184 -179.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 62' ' ' TYR . . . . . . . . . . . . . 15.5 p90 -152.53 162.2 41.54 Favored 'General case' 0 C--O 1.247 0.931 0 CA-C-O 121.064 0.459 . . . . 67.28 110.66 -177.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 63' ' ' ALA . . . . . . . . . . . . . . . -87.86 93.6 9.51 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 107.656 -1.238 . . . . 53.66 107.656 177.648 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 64' ' ' ALA . . . . . . . . . . . . . . . -84.24 130.6 34.81 Favored 'General case' 0 CA--C 1.49 -1.364 1 N-CA-C 97.903 -4.851 . . . . 61.26 97.903 172.763 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 65' ' ' ASN . . . . . 0.547 ' O ' ' NE2' ' I' ' 84' ' ' HIS 0.268 71.2 m-80 -121.4 179.03 4.56 Favored 'General case' 0 C--N 1.295 -1.774 1 C-N-CA 105.314 -6.554 . . . . 60.73 103.929 179.092 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' J' J ' 66' ' ' TYR . . . . . . . . . . . . 0.338 9.1 p90 -135.57 148.19 49.0 Favored 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 126.846 2.058 . . . . 69.27 111.733 -163.095 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 67' ' ' CYS . . . . . . . . . . . . . 70.7 m -98.91 127.73 44.9 Favored 'General case' 0 CA--C 1.487 -1.445 0 C-N-CA 125.714 1.606 . . . . 63.12 109.057 179.82 -62.513 -59.995 -85.322 99.632 2.06 108.941 -80.585 -60.416 1 1 . 1 . 001 ecloud build full ' J' J ' 68' ' ' ASP . . . . . . . . . . . . . 12.2 t0 -147.83 155.15 41.34 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 123.732 0.645 . . . . 86.55 110.785 175.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 69' ' ' GLY . . . . . . . . . . . . . . . 131.03 157.67 8.95 Favored Glycine 0 C--O 1.235 0.21 0 N-CA-C 115.316 0.886 . . . . 67.71 115.316 -179.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 70' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.38 135.25 45.79 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 125.778 1.631 . . . . 118.12 108.86 177.863 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 71' ' ' CYS . . . . . . . . . . . . . 1.7 m -106.29 101.78 11.23 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 108.676 -0.861 . . . . 66.83 108.676 -179.837 -90.139 -77.301 -92.825 103.915 2.039 104.277 -77.134 -60.346 1 1 . 1 . 001 ecloud build full ' J' J ' 72' ' ' SER . . . . . . . . . . . . . 23.0 p -155.83 165.91 35.07 Favored 'General case' 0 C--N 1.345 0.411 0 C-N-CA 123.869 0.867 . . . . 66.6 112.299 -178.714 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 73' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -51.94 139.19 33.24 Favored Pre-proline 0 CA--C 1.542 0.667 0 N-CA-C 114.166 1.173 . . . . 55.13 114.166 -179.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 74' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -76.69 148.19 88.26 Favored 'Cis proline' 0 CA--C 1.513 -0.573 0 CA-C-N 119.314 0.791 . . . . 56.1 113.175 5.59 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 75' ' ' LEU . . . . . . . . . . . . . 79.5 mt -132.83 135.94 45.95 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.563 -0.902 . . . . 57.94 108.563 179.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 76' ' ' ASN . . . . . 0.478 ' HB3' ' HB2' ' J' ' 79' ' ' MET . 22.0 t-20 -118.47 121.34 40.06 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 109.805 -0.442 . . . . 68.67 109.805 -179.305 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 77' ' ' ALA . . . . . . . . . . . . . . . -72.51 -1.92 17.72 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 115.255 1.576 . . . . 73.18 115.255 -178.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 78' ' ' HIS . . . . . . . . . . . . . 67.9 m80 -121.03 13.46 11.33 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.844 1.257 . . . . 88.22 109.971 177.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 79' ' ' MET . . . . . 0.478 ' HB2' ' HB3' ' J' ' 76' ' ' ASN . 7.0 mtt -139.53 -60.59 0.55 Allowed 'General case' 0 C--N 1.349 0.586 0 N-CA-C 115.893 1.812 . . . . 92.54 115.893 -177.576 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 80' ' ' ASN . . . . . . . . . . . . . 36.2 p30 -135.16 17.56 3.44 Favored 'General case' 0 C--N 1.347 0.482 0 N-CA-C 115.882 1.808 . . . . 76.47 115.882 -173.514 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 81' ' ' ALA . . . . . . . . . . . . . . . -158.19 160.02 36.75 Favored 'General case' 0 CA--C 1.495 -1.17 0 CA-C-N 118.204 0.457 . . . . 54.48 110.711 -178.279 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 82' ' ' THR . . . . . . . . . . . . . 70.9 p -101.51 172.25 7.08 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 105.305 -2.109 . . . . 50.34 105.305 174.312 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 83' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -66.86 -42.94 84.84 Favored 'General case' 0 CA--C 1.508 -0.662 0 C-N-CA 124.619 1.168 . . . . 61.34 108.002 176.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 84' ' ' HIS . . . . . 0.644 ' NE2' ' O ' ' I' ' 65' ' ' ASN . 61.0 t-80 -57.43 -44.09 84.37 Favored 'General case' 0 C--N 1.358 0.942 0 C-N-CA 123.98 0.912 . . . . 48.01 112.234 176.325 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.69 -37.68 87.41 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 118.815 -0.612 . . . . 47.36 110.728 178.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 86' ' ' ILE . . . . . . . . . . . . . 30.9 mt -64.63 -48.89 82.89 Favored 'Isoleucine or valine' 0 C--N 1.366 1.323 0 N-CA-C 109.012 -0.736 . . . . 48.15 109.012 177.378 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 87' ' ' VAL . . . . . . . . . . . . . 93.8 t -60.97 -43.62 96.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 C-N-CA 123.657 0.783 . . . . 47.37 112.193 177.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 88' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -65.09 -37.57 87.94 Favored 'General case' 0 CA--C 1.508 -0.647 0 CA-C-O 118.601 -0.714 . . . . 54.43 112.801 179.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 89' ' ' THR . . . . . . . . . . . . . 26.4 m -59.57 -42.88 93.48 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 108.107 -1.072 . . . . 56.06 108.107 175.121 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 90' ' ' LEU . . . . . . . . . . . . . 72.1 mt -63.13 -44.21 96.24 Favored 'General case' 0 C--N 1.363 1.159 0 N-CA-C 113.862 1.06 . . . . 55.26 113.862 177.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 91' ' ' VAL . . . . . . . . . . . . . 93.8 t -62.77 -45.86 97.79 Favored 'Isoleucine or valine' 0 C--N 1.342 0.256 0 C-N-CA 123.815 0.846 . . . . 62.39 109.13 176.383 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 92' ' ' HIS . . . . . . . . . . . . . 76.5 t60 -59.38 -41.49 89.49 Favored 'General case' 0 C--O 1.218 -0.588 0 CA-C-O 118.716 -0.659 . . . . 65.71 111.997 178.159 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 93' ' ' LEU . . . . . . . . . . . . . 84.2 mt -62.21 -39.34 92.43 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 119.131 0.878 . . . . 76.21 112.647 -179.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 94' ' ' MET . . . . . . . . . . . . . 39.0 mtm -73.33 -43.86 59.98 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.562 0.745 . . . . 93.27 112.298 177.145 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 95' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -128.56 76.04 78.92 Favored Pre-proline 0 CA--C 1.555 1.17 0 C-N-CA 124.088 0.955 . . . . 116.49 111.484 -177.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 96' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -66.51 -20.91 53.67 Favored 'Trans proline' 0 C--N 1.362 1.25 0 N-CA-C 114.553 0.943 . . . . 88.04 114.553 -177.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 97' ' ' GLU . . . . . . . . . . . . . 59.9 tt0 -58.06 -51.51 69.38 Favored 'General case' 0 C--N 1.345 0.379 0 C-N-CA 125.748 1.619 . . . . 146.17 114.7 -177.583 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 98' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -105.72 -31.37 8.91 Favored 'General case' 0 C--O 1.238 0.487 0 N-CA-C 118.68 2.845 . . . . 117.32 118.68 -174.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 99' ' ' VAL . . . . . . . . . . . . . 52.3 t -103.61 119.59 54.26 Favored Pre-proline 0 C--N 1.356 0.875 0 C-N-CA 122.859 0.464 . . . . 77.71 110.125 179.471 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 100' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -76.94 169.89 20.81 Favored 'Trans proline' 0 C--N 1.352 0.713 0 CA-C-O 121.57 0.571 . . . . 63.12 113.215 177.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 101' ' ' LYS . . . . . . . . . . . . . 70.7 mttt -64.83 158.39 69.79 Favored Pre-proline 0 CA--C 1.552 1.034 0 N-CA-C 107.598 -1.26 . . . . 103.53 107.598 173.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 102' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -68.13 172.51 10.87 Favored 'Trans proline' 0 C--N 1.36 1.166 0 CA-C-N 120.952 1.376 . . . . 60.3 108.591 172.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 103' ' ' CYS . . . . . . . . . . . . . 3.6 p -122.51 150.73 42.15 Favored 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 116.634 -2.026 . . . . 67.51 116.15 -177.008 82.841 107.88 172.252 91.729 2.026 106.884 -98.797 -119.809 1 1 . 1 . 001 ecloud build full ' J' J ' 104' ' ' CYS . . . . . . . . . . . . . 12.2 t -74.24 107.79 6.63 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 126.222 1.809 . . . . 63.87 110.576 -177.605 -165.4 62.566 80.315 107.735 2.049 105.716 51.942 175.945 1 1 . 1 . 001 ecloud build full ' J' J ' 105' ' ' ALA . . . . . . . . . . . . . . . -135.14 163.3 52.09 Favored Pre-proline 0 CA--C 1.557 1.216 0 C-N-CA 124.096 0.958 . . . . 50.68 112.401 -176.124 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 106' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -66.92 151.72 81.68 Favored 'Trans proline' 0 C--N 1.355 0.907 0 CA-C-N 121.361 1.522 . . . . 56.53 114.12 -176.516 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 107' ' ' THR . . . . . . . . . . . . . 23.1 p -113.62 -29.73 7.04 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 106.525 -1.657 . . . . 62.28 106.525 175.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 108' ' ' LYS . . . . . . . . . . . . . 1.6 mppt? -136.78 129.34 30.27 Favored 'General case' 0 C--N 1.355 0.842 0 C-N-CA 124.015 0.926 . . . . 119.82 110.529 177.612 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 109' ' ' LEU . . . . . 0.464 HD13 ' HB3' ' J' ' 130' ' ' ASN . 82.0 mt -121.93 137.68 54.7 Favored 'General case' 0 C--N 1.342 0.239 0 C-N-CA 125.965 1.706 . . . . 60.72 111.072 178.067 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 110' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -106.76 160.22 15.65 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 121.588 0.709 . . . . 84.74 112.824 175.472 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 111' ' ' ALA . . . . . . . . . . . . . . . -90.69 157.58 17.37 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.066 -0.97 . . . . 60.13 109.68 177.269 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 112' ' ' ILE . . . . . 0.506 HD11 HG21 ' J' ' 132' ' ' VAL 0.295 50.8 mm -123.45 142.2 40.98 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.663 0 N-CA-C 108.614 -0.884 . . . . 73.84 108.614 171.622 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' J' J ' 113' ' ' SER . . . . . . . . . . . . . 70.7 m -103.8 132.82 49.69 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 106.195 -1.78 . . . . 75.13 106.195 177.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 114' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -123.97 138.4 53.76 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 CA-C-N 115.268 -0.878 . . . . 59.06 109.977 -176.984 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 115' ' ' LEU . . . . . . . . . . . . . 14.0 tp -108.74 115.95 31.06 Favored 'General case' 0 CA--C 1.499 -0.997 0 N-CA-C 106.054 -1.832 . . . . 61.82 106.054 -179.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 116' ' ' TYR . . . . . 0.464 ' HE2' ' HB2' ' J' ' 126' ' ' LYS . 42.0 p90 -132.04 160.68 35.19 Favored 'General case' 0 CA--C 1.505 -0.785 0 N-CA-C 113.972 1.101 . . . . 75.63 113.972 -177.294 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 117' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -97.06 147.1 24.37 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 125.285 1.434 . . . . 90.52 109.928 176.069 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 118' ' ' ASP . . . . . . . . . . . . 0.251 1.0 OUTLIER -112.78 -169.74 1.54 Allowed 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 109.421 -0.585 . . . . 92.62 109.421 173.276 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' J' J ' 119' ' ' ASP . . . . . . . . . . . . . 56.5 m-20 -73.31 -34.27 65.63 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 114.497 1.295 . . . . 116.98 114.497 -178.374 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 120' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -78.92 0.9 25.53 Favored 'General case' 0 C--N 1.354 0.793 0 C-N-CA 124.054 0.942 . . . . 126.18 110.992 176.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 121' ' ' SER . . . . . . . . . . . . . 39.0 t 68.46 42.33 1.61 Allowed 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 127.643 2.377 . . . . 94.18 108.014 178.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 122' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -85.53 150.88 24.36 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 125.059 1.344 . . . . 85.99 108.303 171.279 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 123' ' ' VAL . . . . . . . . . . . . . 62.0 t -107.73 110.88 33.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 N-CA-C 103.822 -2.658 . . . . 61.02 103.822 175.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 124' ' ' ILE . . . . . . . . . . . . . 2.9 mp -106.77 142.84 18.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 124.22 1.008 . . . . 68.3 109.929 -179.333 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 125' ' ' LEU . . . . . . . . . . . . . 11.5 tp -113.8 109.22 18.2 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 106.183 -1.784 . . . . 68.64 106.183 173.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 126' ' ' LYS . . . . . 0.464 ' HB2' ' HE2' ' J' ' 116' ' ' TYR . 32.8 tttm -108.82 129.65 55.39 Favored 'General case' 0 C--N 1.358 0.973 0 N-CA-C 113.175 0.805 . . . . 113.1 113.175 -179.881 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 127' ' ' LYS . . . . . . . . . . . . . 31.4 tttt -93.23 121.76 34.93 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.716 1.206 . . . . 111.42 107.946 176.235 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 128' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -105.67 111.04 23.57 Favored 'General case' 0 CA--C 1.493 -1.23 0 N-CA-C 106.22 -1.77 . . . . 81.92 106.22 178.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 129' ' ' ARG . . . . . . . . . . . . . 4.7 mtt180 -77.44 155.83 31.52 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 123.588 0.755 . . . . 136.9 111.624 -179.021 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 130' ' ' ASN . . . . . 0.464 ' HB3' HD13 ' J' ' 109' ' ' LEU . 62.0 m-20 52.26 57.65 6.23 Favored 'General case' 0 CA--C 1.493 -1.244 0 C-N-CA 127.544 2.337 . . . . 60.31 110.973 176.437 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 131' ' ' MET . . . . . . . . . . . . . 4.5 tpt -115.68 -28.94 6.59 Favored 'General case' 0 N--CA 1.433 -1.283 0 N-CA-C 116.016 1.858 . . . . 56.2 116.016 -170.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 132' ' ' VAL . . . . . 0.506 HG21 HD11 ' J' ' 112' ' ' ILE . 85.1 t -122.45 138.79 51.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 126.084 1.753 . . . . 50.71 108.969 -177.584 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 133' ' ' VAL . . . . . . . . . . . . . 40.9 t -91.39 131.09 39.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 106.636 -1.616 . . . . 55.93 106.636 177.26 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 134' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -107.42 -46.07 3.94 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.976 1.711 . . . . 117.65 111.29 178.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 135' ' ' ALA . . . . . . . . . . . . . . . -141.75 140.5 33.1 Favored 'General case' 0 C--N 1.351 0.661 0 C-N-CA 124.179 0.992 . . . . 65.14 111.489 -178.669 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 136' ' ' CYS . . . . . . . . . . . . . 80.2 m -106.2 159.15 16.32 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 124.328 1.051 . . . . 68.45 111.748 177.357 -60.416 -80.585 -85.322 108.941 2.06 99.632 -59.995 -62.513 1 1 . 1 . 001 ecloud build full ' J' J ' 137' ' ' GLY . . . . . . . . . . . . . . . -160.22 168.98 35.98 Favored Glycine 0 CA--C 1.509 -0.334 0 C-N-CA 124.236 0.922 . . . . 63.42 111.193 179.567 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 138' ' ' CYS . . . . . . . . . . . . . 80.6 m -94.49 125.73 39.32 Favored 'General case' 0 CA--C 1.487 -1.463 0 C-N-CA 124.11 0.964 . . . . 65.95 111.415 179.645 -60.346 -77.134 -92.825 104.277 2.039 103.915 -77.301 -90.139 1 1 . 1 . 001 ecloud build full ' J' J ' 139' ' ' HIS . . . . . . . . . . . . . 46.6 m80 . . . . . 0 C--O 1.252 1.206 0 O-C-N 124.384 1.052 . . . . 81.69 113.068 -176.799 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I 1001 ' ' IPA . . . . . 0.461 ' H11' ' H ' ' I' ' 129' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I 1002 ' ' IPA . . . . . 0.577 ' H2 ' ' HA ' ' I' ' 112' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I 1003 ' ' IPA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I 1004 ' ' IPA . . . . . 0.417 ' H31' ' ND2' ' I' ' 76' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I 1005 ' ' IPA . . . . . 0.594 ' H11' ' HB2' ' I' ' 76' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I 1006 ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J 1001 ' ' IPA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J 1002 ' ' PEG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J 1003 ' ' PEG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J 1004 ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J 1005 ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I 1101 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I 1102 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I 1103 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I 1104 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I 1105 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I 1106 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I 1107 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I 1108 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I 1109 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I 1110 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I 1111 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I 1112 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I 1113 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I 1114 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I 1115 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I 1116 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I 1117 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I 1118 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I 1119 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I 1120 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I 1121 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J 1101 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J 1102 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J 1103 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J 1104 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J 1105 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J 1106 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J 1107 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J 1108 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J 1109 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J 1110 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J 1111 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J 1112 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J 1113 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J 1114 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J 1115 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J 1116 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J 1117 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J 1118 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 36' ' ' THR . . . . . . . . . . . . . 7.1 t . . . . . 0 CA--C 1.541 0.598 0 N-CA-C 113.616 0.969 . . . . 92.67 113.616 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 37' ' ' ALA . . . . . . . . . . . . . . . -77.23 154.76 32.71 Favored 'General case' 0 C--N 1.354 0.797 0 CA-C-N 118.132 0.424 . . . . 72.97 110.682 -179.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 38' ' ' CYS . . . . . . . . . . . . . 39.4 t -55.02 121.97 9.9 Favored 'General case' 0 C--N 1.348 0.51 0 C-N-CA 124.807 1.243 . . . . 68.39 111.594 178.618 175.25 65.207 75.801 103.239 2.045 106.441 70.968 178.459 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 39' ' ' ARG . . . . . . . . . . . . . 31.3 ptt85 -157.44 170.17 23.05 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.065 0.946 . . . . 126.97 111.815 178.412 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 40' ' ' LYS . . . . . . . . . . . . . 24.4 ttpt -81.24 126.65 31.79 Favored 'General case' 0 C--N 1.345 0.4 0 C-N-CA 127.055 2.142 . . . . 91.61 109.655 175.535 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 41' ' ' HIS . . . . . . . . . . . . . 14.2 m80 -110.29 140.86 44.04 Favored 'General case' 0 C--O 1.218 -0.59 0 N-CA-C 106.716 -1.587 . . . . 70.69 106.716 176.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 42' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -74.06 140.43 45.35 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.073 0.463 . . . . 129.5 110.803 178.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 43' ' ' LEU . . . . . . . . . . . . . 19.6 tp -151.73 125.78 9.2 Favored 'General case' 0 CA--C 1.508 -0.646 0 N-CA-C 108.578 -0.897 . . . . 57.71 108.578 176.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 44' ' ' TYR . . . . . . . . . . . . . 80.0 t80 -105.87 121.43 44.06 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 106.934 -1.506 . . . . 61.75 106.934 178.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 45' ' ' VAL . . . . . . . . . . . . . 19.1 t -100.48 115.52 42.04 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 N-CA-C 107.86 -1.163 . . . . 57.8 107.86 179.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 46' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -105.1 132.08 51.78 Favored 'General case' 0 C--O 1.223 -0.33 0 N-CA-C 105.968 -1.864 . . . . 64.09 105.968 176.581 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 47' ' ' PHE . . . . . . . . . . . . . 44.7 m-85 -67.11 -19.92 65.7 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 115.379 1.622 . . . . 59.82 115.379 -177.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 48' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -68.93 -40.6 78.91 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.382 1.473 . . . . 107.07 111.544 178.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 49' ' ' ASP . . . . . . . . . . . . 0.297 98.5 m-20 -76.43 -22.27 54.87 Favored 'General case' 0 C--N 1.373 1.6 0 CA-C-N 118.863 0.756 . . . . 96.02 112.729 177.574 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 50' ' ' LEU . . . . . . . . . . . . . 1.4 tp -76.81 -28.03 55.42 Favored 'General case' 0 CA--C 1.569 1.705 0 C-N-CA 125.381 1.472 . . . . 69.02 107.898 174.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 51' ' ' GLY . . . . . . . . . . . . . . . 88.57 34.21 9.51 Favored Glycine 0 C--N 1.343 0.94 0 C-N-CA 124.917 1.246 . . . . 67.5 115.563 179.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 52' ' ' TRP . . . . . . . . . . . . . 27.2 m0 -115.64 2.67 13.79 Favored 'General case' 0 C--N 1.346 0.455 0 C-N-CA 126.103 1.761 . . . . 64.63 112.536 -175.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 53' ' ' GLN . . . . . . . . . . . . . 4.4 pm0 -46.75 -38.55 10.18 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 127.584 2.354 . . . . 83.92 116.554 -178.177 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 54' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.24 -59.54 3.96 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.19 0.996 . . . . 93.08 112.811 -179.057 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 55' ' ' TRP . . . . . . . . . . . . . 39.8 p-90 -75.98 -25.05 55.45 Favored 'General case' 0 CA--C 1.559 1.3 0 N-CA-C 116.327 1.973 . . . . 67.89 116.327 179.258 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 56' ' ' ILE . . . . . . . . . . . . 0.275 53.0 mt -88.19 114.74 27.24 Favored 'Isoleucine or valine' 0 C--N 1.351 0.641 0 CA-C-N 119.483 1.038 . . . . 62.06 109.393 177.803 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 57' ' ' ILE . . . . . . . . . . . . . 45.1 mt -81.91 -56.33 6.31 Favored 'Isoleucine or valine' 0 C--O 1.239 0.534 0 C-N-CA 122.699 0.4 . . . . 67.44 110.279 -177.409 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 58' ' ' ALA . . . . . . . . . . . . . . . -142.64 138.64 16.39 Favored Pre-proline 0 CA--C 1.543 0.693 0 C-N-CA 124.49 1.116 . . . . 62.79 110.464 -177.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 59' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -81.09 176.88 37.83 Favored 'Cis proline' 0 C--N 1.363 1.328 0 CA-C-N 119.82 0.971 . . . . 62.72 111.018 -6.85 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 60' ' ' LYS . . . . . . . . . . . . . 6.9 mmtm -88.84 -6.3 57.44 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-O 121.969 0.89 . . . . 80.6 110.723 -179.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 61' ' ' GLY . . . . . . . . . . . . . . . 178.07 177.53 46.88 Favored Glycine 0 C--N 1.316 -0.533 0 CA-C-N 114.649 -1.16 . . . . 59.14 110.334 178.318 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 62' ' ' TYR . . . . . 0.443 ' CE2' ' HB2' ' I' ' 64' ' ' ALA . 23.7 p90 -163.86 156.03 17.24 Favored 'General case' 0 C--O 1.245 0.838 0 C-N-CA 123.199 0.6 . . . . 68.25 112.141 179.845 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 63' ' ' ALA . . . . . . . . . . . . . . . -77.29 91.51 3.81 Favored 'General case' 0 C--N 1.357 0.909 0 O-C-N 124.512 1.132 . . . . 57.29 109.5 178.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 64' ' ' ALA . . . . . 0.443 ' HB2' ' CE2' ' I' ' 62' ' ' TYR . . . -97.04 112.62 24.31 Favored 'General case' 0 CA--C 1.48 -1.747 0 N-CA-C 101.05 -3.685 . . . . 72.12 101.05 178.649 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 65' ' ' ASN . . . . . 0.644 ' O ' ' NE2' ' J' ' 84' ' ' HIS . 65.2 m-80 -105.45 178.66 4.5 Favored 'General case' 0 C--N 1.318 -0.766 1 C-N-CA 110.556 -4.458 . . . . 64.4 107.582 -176.229 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' I' I ' 66' ' ' TYR . . . . . . . . . . . . 0.268 15.0 p90 -139.35 156.64 46.88 Favored 'General case' 0 CA--C 1.494 -1.182 0 C-N-CA 124.592 1.157 . . . . 69.51 110.89 -167.509 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 67' ' ' CYS . . . . . . . . . . . . . 73.6 m -104.55 133.61 49.13 Favored 'General case' 0 CA--C 1.496 -1.114 0 C-N-CA 125.088 1.355 . . . . 63.99 109.49 -179.846 -63.139 -62.049 -89.242 103.285 2.05 106.584 -82.641 -55.642 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 68' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -150.6 154.18 37.06 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 116.03 -0.532 . . . . 74.86 109.98 175.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 69' ' ' GLY . . . . . . . . . . . . . . . 121.92 162.55 11.64 Favored Glycine 0 C--N 1.322 -0.22 0 N-CA-C 116.666 1.427 . . . . 63.37 116.666 -179.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 70' ' ' GLU . . . . . 0.477 ' OE2' ' HE2' ' I' ' 101' ' ' LYS . 88.6 tt0 -74.8 129.03 36.96 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 127.587 2.355 . . . . 122.55 112.276 -179.137 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 71' ' ' CYS . . . . . . . . . . . . . 12.6 m -97.54 99.83 11.24 Favored 'General case' 0 CA--C 1.517 -0.295 0 N-CA-C 104.328 -2.471 . . . . 67.99 104.328 174.868 -82.737 -74.334 -91.744 103.26 2.043 104.917 -80.477 -58.178 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 72' ' ' SER . . . . . . . . . . . . . 33.1 p -151.28 170.51 19.33 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 115.365 -0.834 . . . . 71.13 109.043 -175.014 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 73' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -84.09 137.69 40.09 Favored Pre-proline 0 CA--C 1.54 0.57 0 N-CA-C 107.811 -1.181 . . . . 59.78 107.811 176.087 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 74' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -67.44 137.26 36.62 Favored 'Cis proline' 0 N--CA 1.477 0.5 0 N-CA-C 114.678 0.992 . . . . 63.06 114.678 1.481 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 75' ' ' LEU . . . . . . . . . . . . . 23.6 mt -94.73 113.25 25.0 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 103.257 -2.868 . . . . 67.38 103.257 174.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 76' ' ' ASN . . . . . 0.594 ' HB2' ' H11' ' I' 1005 ' ' IPA . 12.4 t-20 -70.24 141.66 52.44 Favored 'General case' 0 C--N 1.354 0.781 0 C-N-CA 124.11 0.964 . . . . 97.36 109.296 179.666 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 77' ' ' ALA . . . . . . . . . . . . . . . -56.5 -29.81 62.26 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.121 1.368 . . . . 78.59 113.769 -179.319 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 78' ' ' HIS . . . . . . . . . . . . . 46.0 m-70 -64.94 -30.8 71.81 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 124.012 0.925 . . . . 88.51 112.127 177.606 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 79' ' ' MET . . . . . . . . . . . . 0.442 52.3 mtt -52.7 -31.34 37.08 Favored 'General case' 0 C--N 1.371 1.501 0 C-N-CA 126.282 1.833 . . . . 91.37 109.154 178.813 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 80' ' ' ASN . . . . . . . . . . . . 0.387 15.5 m120 42.49 43.11 3.01 Favored 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 131.669 3.988 . . . . 112.67 116.995 -163.604 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 81' ' ' ALA . . . . . . . . . . . . . . . -46.1 136.41 6.8 Favored 'General case' 0 C--N 1.357 0.899 0 C-N-CA 127.722 2.409 . . . . 65.84 112.643 -179.111 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 82' ' ' THR . . . . . . . . . . . . . 44.9 p -79.26 171.6 14.96 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.727 -0.842 . . . . 56.0 108.727 178.347 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 83' ' ' ASN . . . . . . . . . . . . . 42.4 m-20 -63.97 -41.42 97.56 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 108.844 -0.798 . . . . 65.13 108.844 176.16 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 84' ' ' HIS . . . . . 0.547 ' NE2' ' O ' ' J' ' 65' ' ' ASN . 59.4 t-80 -55.45 -45.24 76.87 Favored 'General case' 0 C--N 1.358 0.938 0 C-N-CA 125.023 1.329 . . . . 47.04 112.803 175.155 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 85' ' ' ALA . . . . . 0.537 ' HB2' ' HA ' ' I' ' 139' ' ' HIS . . . -62.18 -44.03 97.5 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.579 0.752 . . . . 50.01 110.909 -179.333 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 86' ' ' ILE . . . . . . . . . . . . . 59.0 mt -57.04 -52.39 56.6 Favored 'Isoleucine or valine' 0 C--N 1.356 0.872 0 C-N-CA 125.592 1.557 . . . . 48.4 109.473 176.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 87' ' ' VAL . . . . . . . . . . . . . 87.8 t -60.7 -40.67 85.59 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.181 0 CA-C-O 119.287 -0.387 . . . . 53.74 110.183 -179.402 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 88' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -67.31 -40.07 85.95 Favored 'General case' 0 CA--C 1.501 -0.935 0 N-CA-C 113.032 0.753 . . . . 59.37 113.032 -178.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 89' ' ' THR . . . . . 0.484 HG22 ' O ' ' I' ' 85' ' ' ALA 0.462 0.3 OUTLIER -67.62 -28.59 67.87 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 119.198 -1.001 . . . . 58.93 110.929 176.317 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' I' I ' 90' ' ' LEU . . . . . . . . . . . . . 30.0 tp -72.56 -51.45 19.77 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.505 1.122 . . . . 59.72 110.179 175.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 91' ' ' VAL . . . . . . . . . . . . . 85.5 t -58.06 -38.75 69.12 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.181 0 C-N-CA 123.776 0.831 . . . . 60.36 111.696 176.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 92' ' ' HIS . . . . . . . . . . . . . 47.5 t60 -64.72 -40.31 95.12 Favored 'General case' 0 C--O 1.216 -0.669 0 CA-C-O 118.652 -0.689 . . . . 66.45 110.094 178.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 93' ' ' LEU . . . . . . . . . . . . . 1.1 mt -61.12 -25.71 67.17 Favored 'General case' 0 C--N 1.348 0.505 0 N-CA-C 113.886 1.069 . . . . 74.73 113.886 179.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 94' ' ' MET . . . . . . . . . . . . . 12.5 mtm -90.51 -44.03 9.85 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.677 1.191 . . . . 87.68 110.974 -179.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 95' ' ' ASN . . . . . . . . . . . . . 49.3 m-20 -123.31 69.33 40.76 Favored Pre-proline 0 C--N 1.357 0.915 0 C-N-CA 124.063 0.945 . . . . 124.36 111.08 178.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 96' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -57.51 -29.65 85.57 Favored 'Trans proline' 0 C--N 1.36 1.153 0 CA-C-N 120.438 1.192 . . . . 85.49 114.303 -178.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 97' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -50.86 -55.53 16.55 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 128.156 2.582 . . . . 133.08 112.485 179.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 98' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -93.93 -53.58 3.94 Favored 'General case' 0 C--N 1.356 0.876 0 N-CA-C 117.476 2.399 . . . . 112.22 117.476 -177.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 99' ' ' VAL . . . . . . . . . . . . . 15.3 t -90.23 121.72 68.3 Favored Pre-proline 0 C--N 1.364 1.232 0 C-N-CA 125.138 1.375 . . . . 74.32 113.777 -176.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 100' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_endo -84.75 167.32 11.43 Favored 'Trans proline' 0 C--N 1.35 0.611 0 N-CA-C 115.387 1.264 . . . . 60.33 115.387 -178.145 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 101' ' ' LYS . . . . . 0.477 ' HE2' ' OE2' ' I' ' 70' ' ' GLU . 19.0 mttp -61.39 145.45 90.73 Favored Pre-proline 0 CA--C 1.535 0.37 0 N-CA-C 107.152 -1.425 . . . . 112.22 107.152 173.834 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 102' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -67.31 170.01 14.26 Favored 'Trans proline' 0 CA--C 1.547 1.131 0 CA-C-N 120.504 1.216 . . . . 60.03 110.253 174.342 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 103' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -80.02 135.46 36.37 Favored 'General case' 0 CA--C 1.458 -2.588 0 C-N-CA 130.472 3.509 . . . . 68.22 116.977 -174.951 -119.809 -98.797 172.252 106.884 2.026 91.729 107.88 82.841 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 104' ' ' CYS . . . . . . . . . . . . . 43.4 t -88.96 104.95 17.44 Favored 'General case' 0 CA--C 1.556 1.205 0 N-CA-C 105.809 -1.923 . . . . 63.8 105.809 170.117 178.459 70.968 75.801 106.441 2.045 103.239 65.207 175.25 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 105' ' ' ALA . . . . . . . . . . . . . . . -136.11 165.9 32.17 Favored Pre-proline 0 N--CA 1.443 -0.779 0 N-CA-C 113.701 1.0 . . . . 56.44 113.701 -174.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 106' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -71.98 132.1 19.27 Favored 'Trans proline' 0 C--N 1.363 1.295 0 N-CA-C 113.991 0.727 . . . . 64.97 113.991 -178.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 107' ' ' THR . . . . . . . . . . . . . 41.7 p -99.65 -28.87 12.98 Favored 'General case' 0 C--N 1.345 0.372 0 C-N-CA 123.76 0.824 . . . . 73.54 111.156 177.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 108' ' ' LYS . . . . . . . . . . . . . 6.5 tptm -132.07 118.84 20.19 Favored 'General case' 0 C--O 1.241 0.643 0 C-N-CA 124.658 1.183 . . . . 122.5 108.65 179.273 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 109' ' ' LEU . . . . . 0.553 ' HB3' ' HA ' ' I' ' 130' ' ' ASN . 3.9 mm? -114.37 157.36 22.94 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.375 -0.829 . . . . 65.51 109.044 177.49 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 110' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -122.1 152.04 40.27 Favored 'General case' 0 CA--C 1.513 -0.459 0 C-N-CA 125.019 1.327 . . . . 86.26 107.759 174.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 111' ' ' ALA . . . . . . . . . . . . . . . -91.94 158.36 16.31 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.691 -0.855 . . . . 60.4 108.691 176.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 112' ' ' ILE . . . . . 0.629 HG12 ' HG2' ' I' ' 131' ' ' MET . 4.8 pt -132.13 143.65 39.44 Favored 'Isoleucine or valine' 0 C--O 1.244 0.768 0 C-N-CA 125.201 1.4 . . . . 63.33 109.626 171.754 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 113' ' ' SER . . . . . . . . . . . . . 3.2 m -90.95 133.21 35.45 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 107.513 -1.291 . . . . 71.52 107.513 176.598 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 114' ' ' VAL . . . . . . . . . . . . . 90.0 t -123.24 131.51 73.06 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.773 0 N-CA-C 108.662 -0.866 . . . . 55.71 108.662 -179.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 115' ' ' LEU . . . . . . . . . . . . . 18.8 tp -103.47 115.77 31.14 Favored 'General case' 0 C--O 1.239 0.544 0 N-CA-C 105.426 -2.064 . . . . 58.51 105.426 176.488 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 116' ' ' TYR . . . . . . . . . . . . . 36.3 p90 -142.95 162.08 36.43 Favored 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 117.957 -1.497 . . . . 61.74 113.339 -175.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 117' ' ' PHE . . . . . . . . . . . . . 16.4 m-85 -90.55 124.91 35.4 Favored 'General case' 0 C--N 1.344 0.334 0 C-N-CA 125.013 1.325 . . . . 68.88 108.018 174.368 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 118' ' ' ASP . . . . . . . . . . . . 0.268 9.9 t70 -63.77 168.38 5.02 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 130.983 3.713 . . . . 99.39 107.7 174.901 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -66.83 -16.28 64.18 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 122.736 0.415 . . . . 99.45 110.947 176.505 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 120' ' ' ASN . . . . . . . . . . . . . 11.9 m-20 -109.07 17.56 21.53 Favored 'General case' 0 C--N 1.359 0.993 0 C-N-CA 126.415 1.886 . . . . 104.94 113.918 -179.391 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 121' ' ' SER . . . . . . . . . . . . . 3.6 m 68.92 14.38 8.88 Favored 'General case' 0 C--N 1.357 0.897 0 C-N-CA 126.675 1.99 . . . . 87.47 115.542 -178.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 122' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -77.09 144.71 38.32 Favored 'General case' 0 C--N 1.354 0.786 0 N-CA-C 109.704 -0.48 . . . . 76.67 109.704 174.365 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 123' ' ' VAL . . . . . . . . . . . . . 8.2 t -93.34 114.51 30.2 Favored 'Isoleucine or valine' 0 C--N 1.356 0.858 0 N-CA-C 107.96 -1.126 . . . . 61.28 107.96 178.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 124' ' ' ILE . . . . . . . . . . . . . 17.4 mm -109.83 139.11 34.4 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.198 0 C-N-CA 124.003 0.921 . . . . 61.95 110.34 -177.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 125' ' ' LEU . . . . . . . . . . . . . 62.0 tp -118.79 92.26 3.76 Favored 'General case' 0 C--O 1.239 0.502 0 N-CA-C 108.555 -0.905 . . . . 65.17 108.555 174.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 126' ' ' LYS . . . . . . . . . . . . . 18.8 ttmt -103.81 137.46 41.79 Favored 'General case' 0 C--N 1.354 0.766 0 N-CA-C 113.435 0.902 . . . . 118.42 113.435 -178.657 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 127' ' ' LYS . . . . . . . . . . . . . 66.4 tttt -95.04 114.25 26.03 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 104.891 -2.263 . . . . 116.63 104.891 174.096 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 128' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -99.09 113.3 25.44 Favored 'General case' 0 CA--C 1.511 -0.548 0 N-CA-C 107.53 -1.285 . . . . 76.72 107.53 179.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 129' ' ' ARG . . . . . 0.461 ' H ' ' H11' ' I' 1001 ' ' IPA . 77.0 mtt180 -73.68 161.96 29.7 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.919 0.888 . . . . 149.02 110.157 178.742 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 130' ' ' ASN . . . . . 0.553 ' HA ' ' HB3' ' I' ' 109' ' ' LEU . 18.1 m-20 52.23 57.91 5.96 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 126.04 1.736 . . . . 66.57 113.383 177.954 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 131' ' ' MET . . . . . 0.629 ' HG2' HG12 ' I' ' 112' ' ' ILE . 5.9 tpt -116.93 -37.27 3.63 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 114.654 1.353 . . . . 59.71 114.654 -168.921 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 132' ' ' VAL . . . . . . . . . . . . . 78.6 t -115.9 126.76 73.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 124.733 1.213 . . . . 61.42 107.957 -179.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 133' ' ' VAL . . . . . . . . . . . . . 94.1 t -81.26 121.49 34.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 N-CA-C 107.009 -1.478 . . . . 63.75 107.009 178.189 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 134' ' ' ARG . . . . . . . . . . . . . 32.4 tpt180 -93.58 -40.89 10.04 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 123.215 0.606 . . . . 128.72 110.348 175.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 135' ' ' ALA . . . . . . . . . . . . . . . -147.33 144.98 29.16 Favored 'General case' 0 C--N 1.358 0.963 0 C-N-CA 123.54 0.736 . . . . 67.25 112.933 -179.255 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 136' ' ' CYS . . . . . . . . . . . . . 60.2 m -102.91 167.01 10.13 Favored 'General case' 0 C--N 1.35 0.605 0 C-N-CA 125.122 1.369 . . . . 67.99 113.39 176.935 -55.642 -82.641 -89.242 106.584 2.05 103.285 -62.049 -63.139 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 137' ' ' GLY . . . . . . . . . . . . . . . -171.62 -177.25 41.18 Favored Glycine 0 CA--C 1.502 -0.734 0 CA-C-N 115.34 -0.845 . . . . 65.73 113.605 179.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 138' ' ' CYS . . . . . . . . . . . . . 68.5 m -115.24 131.16 57.02 Favored 'General case' 0 CA--C 1.51 -0.571 0 C-N-CA 124.157 0.983 . . . . 71.17 113.235 -178.343 -58.178 -80.477 -91.744 104.917 2.043 103.26 -74.334 -82.737 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 139' ' ' HIS . . . . . 0.537 ' HA ' ' HB2' ' I' ' 85' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.255 1.382 0 C-N-CA 125.295 1.438 . . . . 120.86 111.336 178.097 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 36' ' ' THR . . . . . . . . . . . . 0.328 0.7 OUTLIER . . . . . 0 CA--C 1.563 1.446 0 N-CA-C 113.202 0.816 . . . . 90.07 113.202 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 37' ' ' ALA . . . . . . . . . . . . . . . -76.08 166.95 22.74 Favored 'General case' 0 C--N 1.36 1.047 0 C-N-CA 122.97 0.508 . . . . 76.19 111.158 178.85 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 38' ' ' CYS . . . . . . . . . . . . . 42.2 t -59.61 111.96 1.62 Allowed 'General case' 0 C--N 1.354 0.787 0 C-N-CA 122.874 0.47 . . . . 66.26 111.162 177.973 175.945 51.942 80.315 105.716 2.049 107.735 62.566 -165.4 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 39' ' ' ARG . . . . . . . . . . . . . 38.5 ptt180 -149.35 162.22 40.5 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 123.944 0.898 . . . . 122.55 112.731 179.75 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 40' ' ' LYS . . . . . . . . . . . . . 8.9 tttt -78.67 127.63 32.36 Favored 'General case' 0 C--N 1.346 0.43 0 C-N-CA 127.481 2.312 . . . . 92.5 107.848 174.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 41' ' ' HIS . . . . . . . . . . . . . 25.4 m80 -109.91 145.58 36.63 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 126.079 1.752 . . . . 74.11 109.315 176.276 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 42' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -69.99 135.77 49.74 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.028 0.931 . . . . 120.62 110.37 178.052 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 43' ' ' LEU . . . . . . . . . . . . . 36.9 tp -151.97 126.27 9.32 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 108.204 -1.035 . . . . 55.22 108.204 175.41 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 44' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -107.51 128.95 54.96 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 109.063 -0.717 . . . . 69.67 109.063 179.067 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 45' ' ' VAL . . . . . . . . . . . . . 92.2 t -114.32 118.83 59.69 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.263 0 N-CA-C 108.283 -1.006 . . . . 53.84 108.283 179.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 46' ' ' SER . . . . . . . . . . . . . 1.5 p -84.41 151.47 24.65 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 106.425 -1.695 . . . . 66.92 106.425 175.444 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 47' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -70.48 -10.96 60.53 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 113.88 1.067 . . . . 63.01 113.88 178.657 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 48' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -67.7 -34.51 77.03 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.652 0.781 . . . . 102.71 109.661 175.561 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 49' ' ' ASP . . . . . . . . . . . . . 41.4 m-20 -64.22 -25.37 68.04 Favored 'General case' 0 C--N 1.348 0.517 0 C-N-CA 125.856 1.662 . . . . 97.09 111.254 178.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 50' ' ' LEU . . . . . . . . . . . . . 3.5 mt -97.53 -7.9 30.32 Favored 'General case' 0 C--N 1.35 0.587 0 C-N-CA 125.689 1.595 . . . . 73.86 110.528 177.052 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 51' ' ' GLY . . . . . . . . . . . . . . . 66.75 32.53 81.54 Favored Glycine 0 C--N 1.334 0.459 0 N-CA-C 111.424 -0.67 . . . . 70.44 111.424 -176.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 52' ' ' TRP . . . . . . . . . . . . . 31.3 m0 -100.68 -9.37 21.92 Favored 'General case' 0 CA--C 1.515 -0.366 0 C-N-CA 123.523 0.729 . . . . 71.61 110.931 -179.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 53' ' ' GLN . . . . . . . . . . . . 0.339 10.9 pm0 -44.38 -41.92 6.51 Favored 'General case' 0 C--N 1.353 0.727 0 N-CA-C 118.482 2.771 . . . . 81.73 118.482 -175.809 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 54' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -72.89 -36.52 67.33 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 113.657 0.984 . . . . 98.17 113.657 -179.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 55' ' ' TRP . . . . . . . . . . . . . 28.9 t90 -63.85 -55.05 25.75 Favored 'General case' 0 CA--C 1.571 1.77 0 C-N-CA 128.263 2.625 . . . . 88.51 111.155 178.106 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 56' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -72.96 145.47 11.81 Favored 'Isoleucine or valine' 0 C--N 1.35 0.623 0 N-CA-C 120.36 3.467 . . . . 87.65 120.36 -173.57 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 57' ' ' ILE . . . . . . . . . . . . . 33.9 mt -107.9 -47.31 7.8 Favored 'Isoleucine or valine' 0 C--N 1.363 1.176 0 C-N-CA 126.939 2.096 . . . . 69.16 112.082 174.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 58' ' ' ALA . . . . . . . . . . . . . . . -156.47 141.68 12.42 Favored Pre-proline 0 C--N 1.349 0.575 0 N-CA-C 114.662 1.356 . . . . 59.9 114.662 176.798 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 59' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -80.7 179.78 27.76 Favored 'Cis proline' 0 C--N 1.348 0.519 0 O-C-N 121.826 0.382 . . . . 60.71 111.803 -6.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 60' ' ' LYS . . . . . . . . . . . . . 8.0 mptt -85.81 -9.65 56.7 Favored 'General case' 0 CA--C 1.554 1.126 0 CA-C-O 121.536 0.684 . . . . 97.06 110.405 179.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 61' ' ' GLY . . . . . . . . . . . . . . . 179.95 178.44 48.51 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 124.989 1.281 . . . . 52.96 110.184 -179.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 62' ' ' TYR . . . . . . . . . . . . . 15.5 p90 -152.53 162.2 41.54 Favored 'General case' 0 C--O 1.247 0.931 0 CA-C-O 121.064 0.459 . . . . 67.28 110.66 -177.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 63' ' ' ALA . . . . . . . . . . . . . . . -87.86 93.6 9.51 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 107.656 -1.238 . . . . 53.66 107.656 177.648 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 64' ' ' ALA . . . . . . . . . . . . . . . -84.24 130.6 34.81 Favored 'General case' 0 CA--C 1.49 -1.364 1 N-CA-C 97.903 -4.851 . . . . 61.26 97.903 172.763 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 65' ' ' ASN . . . . . 0.547 ' O ' ' NE2' ' I' ' 84' ' ' HIS 0.268 71.2 m-80 -121.4 179.03 4.56 Favored 'General case' 0 C--N 1.295 -1.774 1 C-N-CA 105.314 -6.554 . . . . 60.73 103.929 179.092 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' J' J ' 66' ' ' TYR . . . . . . . . . . . . 0.338 9.1 p90 -135.57 148.19 49.0 Favored 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 126.846 2.058 . . . . 69.27 111.733 -163.095 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 67' ' ' CYS . . . . . . . . . . . . . 70.7 m -98.91 127.73 44.9 Favored 'General case' 0 CA--C 1.487 -1.445 0 C-N-CA 125.714 1.606 . . . . 63.12 109.057 179.82 -62.513 -59.995 -85.322 99.632 2.06 108.941 -80.585 -60.416 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 68' ' ' ASP . . . . . . . . . . . . . 12.2 t0 -147.83 155.15 41.34 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 123.732 0.645 . . . . 86.55 110.785 175.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 69' ' ' GLY . . . . . . . . . . . . . . . 131.03 157.67 8.95 Favored Glycine 0 C--O 1.235 0.21 0 N-CA-C 115.316 0.886 . . . . 67.71 115.316 -179.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 70' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.38 135.25 45.79 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 125.778 1.631 . . . . 118.12 108.86 177.863 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 71' ' ' CYS . . . . . . . . . . . . . 1.7 m -106.29 101.78 11.23 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 108.676 -0.861 . . . . 66.83 108.676 -179.837 -90.139 -77.301 -92.825 103.915 2.039 104.277 -77.134 -60.346 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 72' ' ' SER . . . . . . . . . . . . . 23.0 p -155.83 165.91 35.07 Favored 'General case' 0 C--N 1.345 0.411 0 C-N-CA 123.869 0.867 . . . . 66.6 112.299 -178.714 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 73' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -51.94 139.19 33.24 Favored Pre-proline 0 CA--C 1.542 0.667 0 N-CA-C 114.166 1.173 . . . . 55.13 114.166 -179.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 74' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -76.69 148.19 88.26 Favored 'Cis proline' 0 CA--C 1.513 -0.573 0 CA-C-N 119.314 0.791 . . . . 56.1 113.175 5.59 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 75' ' ' LEU . . . . . . . . . . . . . 79.5 mt -132.83 135.94 45.95 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.563 -0.902 . . . . 57.94 108.563 179.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 76' ' ' ASN . . . . . 0.478 ' HB3' ' HB2' ' J' ' 79' ' ' MET . 22.0 t-20 -118.47 121.34 40.06 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 109.805 -0.442 . . . . 68.67 109.805 -179.305 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 77' ' ' ALA . . . . . . . . . . . . . . . -72.51 -1.92 17.72 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 115.255 1.576 . . . . 73.18 115.255 -178.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 78' ' ' HIS . . . . . . . . . . . . . 67.9 m80 -121.03 13.46 11.33 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.844 1.257 . . . . 88.22 109.971 177.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 79' ' ' MET . . . . . 0.478 ' HB2' ' HB3' ' J' ' 76' ' ' ASN . 7.0 mtt -139.53 -60.59 0.55 Allowed 'General case' 0 C--N 1.349 0.586 0 N-CA-C 115.893 1.812 . . . . 92.54 115.893 -177.576 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 80' ' ' ASN . . . . . . . . . . . . . 36.2 p30 -135.16 17.56 3.44 Favored 'General case' 0 C--N 1.347 0.482 0 N-CA-C 115.882 1.808 . . . . 76.47 115.882 -173.514 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 81' ' ' ALA . . . . . . . . . . . . . . . -158.19 160.02 36.75 Favored 'General case' 0 CA--C 1.495 -1.17 0 CA-C-N 118.204 0.457 . . . . 54.48 110.711 -178.279 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 82' ' ' THR . . . . . . . . . . . . . 70.9 p -101.51 172.25 7.08 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 105.305 -2.109 . . . . 50.34 105.305 174.312 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 83' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -66.86 -42.94 84.84 Favored 'General case' 0 CA--C 1.508 -0.662 0 C-N-CA 124.619 1.168 . . . . 61.34 108.002 176.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 84' ' ' HIS . . . . . 0.644 ' NE2' ' O ' ' I' ' 65' ' ' ASN . 61.0 t-80 -57.43 -44.09 84.37 Favored 'General case' 0 C--N 1.358 0.942 0 C-N-CA 123.98 0.912 . . . . 48.01 112.234 176.325 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.69 -37.68 87.41 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 118.815 -0.612 . . . . 47.36 110.728 178.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 86' ' ' ILE . . . . . . . . . . . . . 30.9 mt -64.63 -48.89 82.89 Favored 'Isoleucine or valine' 0 C--N 1.366 1.323 0 N-CA-C 109.012 -0.736 . . . . 48.15 109.012 177.378 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 87' ' ' VAL . . . . . . . . . . . . . 93.8 t -60.97 -43.62 96.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 C-N-CA 123.657 0.783 . . . . 47.37 112.193 177.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 88' ' ' GLN . . . . . 0.609 HE21 ' CE1' ' J' ' 84' ' ' HIS . 5.4 tt0 -65.09 -37.57 87.94 Favored 'General case' 0 CA--C 1.508 -0.647 0 CA-C-O 118.601 -0.714 . . . . 54.43 112.801 179.151 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 89' ' ' THR . . . . . . . . . . . . . 26.4 m -59.57 -42.88 93.48 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 108.107 -1.072 . . . . 56.06 108.107 175.121 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 90' ' ' LEU . . . . . . . . . . . . . 72.1 mt -63.13 -44.21 96.24 Favored 'General case' 0 C--N 1.363 1.159 0 N-CA-C 113.862 1.06 . . . . 55.26 113.862 177.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 91' ' ' VAL . . . . . . . . . . . . . 93.8 t -62.77 -45.86 97.79 Favored 'Isoleucine or valine' 0 C--N 1.342 0.256 0 C-N-CA 123.815 0.846 . . . . 62.39 109.13 176.383 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 92' ' ' HIS . . . . . . . . . . . . . 76.5 t60 -59.38 -41.49 89.49 Favored 'General case' 0 C--O 1.218 -0.588 0 CA-C-O 118.716 -0.659 . . . . 65.71 111.997 178.159 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 93' ' ' LEU . . . . . . . . . . . . . 84.2 mt -62.21 -39.34 92.43 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 119.131 0.878 . . . . 76.21 112.647 -179.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 94' ' ' MET . . . . . . . . . . . . . 39.0 mtm -73.33 -43.86 59.98 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.562 0.745 . . . . 93.27 112.298 177.145 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 95' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -128.56 76.04 78.92 Favored Pre-proline 0 CA--C 1.555 1.17 0 C-N-CA 124.088 0.955 . . . . 116.49 111.484 -177.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 96' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -66.51 -20.91 53.67 Favored 'Trans proline' 0 C--N 1.362 1.25 0 N-CA-C 114.553 0.943 . . . . 88.04 114.553 -177.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 97' ' ' GLU . . . . . . . . . . . . . 59.9 tt0 -58.06 -51.51 69.38 Favored 'General case' 0 C--N 1.345 0.379 0 C-N-CA 125.748 1.619 . . . . 146.17 114.7 -177.583 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 98' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -105.72 -31.37 8.91 Favored 'General case' 0 C--O 1.238 0.487 0 N-CA-C 118.68 2.845 . . . . 117.32 118.68 -174.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 99' ' ' VAL . . . . . . . . . . . . . 52.3 t -103.61 119.59 54.26 Favored Pre-proline 0 C--N 1.356 0.875 0 C-N-CA 122.859 0.464 . . . . 77.71 110.125 179.471 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 100' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -76.94 169.89 20.81 Favored 'Trans proline' 0 C--N 1.352 0.713 0 CA-C-O 121.57 0.571 . . . . 63.12 113.215 177.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 101' ' ' LYS . . . . . . . . . . . . . 70.7 mttt -64.83 158.39 69.79 Favored Pre-proline 0 CA--C 1.552 1.034 0 N-CA-C 107.598 -1.26 . . . . 103.53 107.598 173.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 102' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -68.13 172.51 10.87 Favored 'Trans proline' 0 C--N 1.36 1.166 0 CA-C-N 120.952 1.376 . . . . 60.3 108.591 172.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 103' ' ' CYS . . . . . . . . . . . . . 3.6 p -122.51 150.73 42.15 Favored 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 116.634 -2.026 . . . . 67.51 116.15 -177.008 82.841 107.88 172.252 91.729 2.026 106.884 -98.797 -119.809 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 104' ' ' CYS . . . . . . . . . . . . . 12.2 t -74.24 107.79 6.63 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 126.222 1.809 . . . . 63.87 110.576 -177.605 -165.4 62.566 80.315 107.735 2.049 105.716 51.942 175.945 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 105' ' ' ALA . . . . . . . . . . . . . . . -135.14 163.3 52.09 Favored Pre-proline 0 CA--C 1.557 1.216 0 C-N-CA 124.096 0.958 . . . . 50.68 112.401 -176.124 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 106' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -66.92 151.72 81.68 Favored 'Trans proline' 0 C--N 1.355 0.907 0 CA-C-N 121.361 1.522 . . . . 56.53 114.12 -176.516 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 107' ' ' THR . . . . . . . . . . . . . 23.1 p -113.62 -29.73 7.04 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 106.525 -1.657 . . . . 62.28 106.525 175.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 108' ' ' LYS . . . . . . . . . . . . . 1.6 mppt? -136.78 129.34 30.27 Favored 'General case' 0 C--N 1.355 0.842 0 C-N-CA 124.015 0.926 . . . . 119.82 110.529 177.612 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 109' ' ' LEU . . . . . 0.464 HD13 ' HB3' ' J' ' 130' ' ' ASN . 82.0 mt -121.93 137.68 54.7 Favored 'General case' 0 C--N 1.342 0.239 0 C-N-CA 125.965 1.706 . . . . 60.72 111.072 178.067 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 110' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -106.76 160.22 15.65 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 121.588 0.709 . . . . 84.74 112.824 175.472 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 111' ' ' ALA . . . . . . . . . . . . . . . -90.69 157.58 17.37 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.066 -0.97 . . . . 60.13 109.68 177.269 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 112' ' ' ILE . . . . . 0.506 HD11 HG21 ' J' ' 132' ' ' VAL 0.295 50.8 mm -123.45 142.2 40.98 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.663 0 N-CA-C 108.614 -0.884 . . . . 73.84 108.614 171.622 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' J' J ' 113' ' ' SER . . . . . . . . . . . . . 70.7 m -103.8 132.82 49.69 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 106.195 -1.78 . . . . 75.13 106.195 177.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 114' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -123.97 138.4 53.76 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 CA-C-N 115.268 -0.878 . . . . 59.06 109.977 -176.984 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 115' ' ' LEU . . . . . . . . . . . . . 14.0 tp -108.74 115.95 31.06 Favored 'General case' 0 CA--C 1.499 -0.997 0 N-CA-C 106.054 -1.832 . . . . 61.82 106.054 -179.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 116' ' ' TYR . . . . . 0.464 ' HE2' ' HB2' ' J' ' 126' ' ' LYS . 42.0 p90 -132.04 160.68 35.19 Favored 'General case' 0 CA--C 1.505 -0.785 0 N-CA-C 113.972 1.101 . . . . 75.63 113.972 -177.294 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 117' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -97.06 147.1 24.37 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 125.285 1.434 . . . . 90.52 109.928 176.069 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 118' ' ' ASP . . . . . . . . . . . . 0.251 1.0 OUTLIER -112.78 -169.74 1.54 Allowed 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 109.421 -0.585 . . . . 92.62 109.421 173.276 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' J' J ' 119' ' ' ASP . . . . . . . . . . . . . 56.5 m-20 -73.31 -34.27 65.63 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 114.497 1.295 . . . . 116.98 114.497 -178.374 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 120' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -78.92 0.9 25.53 Favored 'General case' 0 C--N 1.354 0.793 0 C-N-CA 124.054 0.942 . . . . 126.18 110.992 176.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 121' ' ' SER . . . . . . . . . . . . . 39.0 t 68.46 42.33 1.61 Allowed 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 127.643 2.377 . . . . 94.18 108.014 178.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 122' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -85.53 150.88 24.36 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 125.059 1.344 . . . . 85.99 108.303 171.279 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 123' ' ' VAL . . . . . . . . . . . . . 62.0 t -107.73 110.88 33.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 N-CA-C 103.822 -2.658 . . . . 61.02 103.822 175.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 124' ' ' ILE . . . . . . . . . . . . . 2.9 mp -106.77 142.84 18.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 124.22 1.008 . . . . 68.3 109.929 -179.333 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 125' ' ' LEU . . . . . . . . . . . . . 11.5 tp -113.8 109.22 18.2 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 106.183 -1.784 . . . . 68.64 106.183 173.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 126' ' ' LYS . . . . . 0.464 ' HB2' ' HE2' ' J' ' 116' ' ' TYR . 32.8 tttm -108.82 129.65 55.39 Favored 'General case' 0 C--N 1.358 0.973 0 N-CA-C 113.175 0.805 . . . . 113.1 113.175 -179.881 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 127' ' ' LYS . . . . . . . . . . . . . 31.4 tttt -93.23 121.76 34.93 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.716 1.206 . . . . 111.42 107.946 176.235 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 128' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -105.67 111.04 23.57 Favored 'General case' 0 CA--C 1.493 -1.23 0 N-CA-C 106.22 -1.77 . . . . 81.92 106.22 178.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 129' ' ' ARG . . . . . . . . . . . . . 4.7 mtt180 -77.44 155.83 31.52 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 123.588 0.755 . . . . 136.9 111.624 -179.021 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 130' ' ' ASN . . . . . 0.464 ' HB3' HD13 ' J' ' 109' ' ' LEU . 62.0 m-20 52.26 57.65 6.23 Favored 'General case' 0 CA--C 1.493 -1.244 0 C-N-CA 127.544 2.337 . . . . 60.31 110.973 176.437 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 131' ' ' MET . . . . . . . . . . . . . 4.5 tpt -115.68 -28.94 6.59 Favored 'General case' 0 N--CA 1.433 -1.283 0 N-CA-C 116.016 1.858 . . . . 56.2 116.016 -170.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 132' ' ' VAL . . . . . 0.506 HG21 HD11 ' J' ' 112' ' ' ILE . 85.1 t -122.45 138.79 51.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 126.084 1.753 . . . . 50.71 108.969 -177.584 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 133' ' ' VAL . . . . . . . . . . . . . 40.9 t -91.39 131.09 39.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 106.636 -1.616 . . . . 55.93 106.636 177.26 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 134' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -107.42 -46.07 3.94 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.976 1.711 . . . . 117.65 111.29 178.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 135' ' ' ALA . . . . . . . . . . . . . . . -141.75 140.5 33.1 Favored 'General case' 0 C--N 1.351 0.661 0 C-N-CA 124.179 0.992 . . . . 65.14 111.489 -178.669 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 136' ' ' CYS . . . . . . . . . . . . . 80.2 m -106.2 159.15 16.32 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 124.328 1.051 . . . . 68.45 111.748 177.357 -60.416 -80.585 -85.322 108.941 2.06 99.632 -59.995 -62.513 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 137' ' ' GLY . . . . . . . . . . . . . . . -160.22 168.98 35.98 Favored Glycine 0 CA--C 1.509 -0.334 0 C-N-CA 124.236 0.922 . . . . 63.42 111.193 179.567 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 138' ' ' CYS . . . . . . . . . . . . . 80.6 m -94.49 125.73 39.32 Favored 'General case' 0 CA--C 1.487 -1.463 0 C-N-CA 124.11 0.964 . . . . 65.95 111.415 179.645 -60.346 -77.134 -92.825 104.277 2.039 103.915 -77.301 -90.139 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 139' ' ' HIS . . . . . . . . . . . . . 46.6 m80 . . . . . 0 C--O 1.252 1.206 0 O-C-N 124.384 1.052 . . . . 81.69 113.068 -176.799 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I 1001 ' ' IPA . . . . . 0.461 ' H11' ' H ' ' I' ' 129' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I 1002 ' ' IPA . . . . . 0.577 ' H2 ' ' HA ' ' I' ' 112' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I 1003 ' ' IPA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I 1004 ' ' IPA . . . . . 0.417 ' H31' ' ND2' ' I' ' 76' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I 1005 ' ' IPA . . . . . 0.594 ' H11' ' HB2' ' I' ' 76' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I 1006 ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J 1001 ' ' IPA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J 1002 ' ' PEG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J 1003 ' ' PEG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J 1004 ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J 1005 ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I 1101 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I 1102 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I 1103 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I 1104 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I 1105 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I 1106 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I 1107 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I 1108 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I 1109 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I 1110 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I 1111 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I 1112 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I 1113 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I 1114 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I 1115 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I 1116 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I 1117 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I 1118 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I 1119 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I 1120 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I 1121 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J 1101 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J 1102 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J 1103 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J 1104 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J 1105 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J 1106 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J 1107 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J 1108 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J 1109 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J 1110 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J 1111 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J 1112 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J 1113 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J 1114 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J 1115 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J 1116 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J 1117 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J 1118 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_