data_3bkd_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 3bkd _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 81.3 p . . . . . 0 N--CA 1.485 1.322 0 N-CA-C 109.79 -0.448 . . . . 33.039999999999999 109.79 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m -110.15 164.18 12.89 Favored 'General case' 0 C--O 1.239 0.511 0 N-CA-C 109.096 -0.705 . . . . 30.800000000000001 109.096 178.102 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -60.58 142.93 90.93 Favored Pre-proline 0 N--CA 1.471 0.609 0 N-CA-C 109.073 -0.714 . . . . 33.43 109.073 173.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -53.95 -34.46 76.77 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 121.216 1.278 . . . . 29.120000000000001 113.332 -178.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.1 tt -69.21 -34.38 74.8 Favored 'General case' 0 C--O 1.242 0.684 0 CA-C-O 121.036 0.446 . . . . 31.190000000000001 112.024 179.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 75.8 t -71.0 -39.25 74.84 Favored 'Isoleucine or valine' 0 C--O 1.239 0.514 0 N-CA-C 109.247 -0.649 . . . . 24.059999999999999 109.247 177.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 33.7 t -59.01 -45.03 92.51 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 N-CA-C 112.509 0.559 . . . . 23.16 112.509 171.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.39 -39.98 95.97 Favored 'General case' 0 C--O 1.207 -1.167 0 N-CA-C 112.806 0.669 . . . . 22.370000000000001 112.806 178.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.31 -38.0 89.49 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 123.484 0.714 . . . . 20.879999999999999 110.336 179.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 74.9 m -67.95 -45.97 72.75 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 113.624 0.972 . . . . 22.260000000000002 113.624 178.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 81.7 mt -57.18 -45.16 84.49 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 C-N-CA 122.573 0.349 . . . . 23.84 111.546 172.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' MSE . . . . . . . . . . . . . 4.3 ttm -53.48 -45.48 69.61 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 112.878 0.696 . . . . 37.149999999999999 112.878 171.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.23 -39.92 97.5 Favored Glycine 0 N--CA 1.47 0.954 0 N-CA-C 111.681 -0.567 . . . . 25.039999999999999 111.681 177.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 20.7 mt -66.22 -44.58 91.3 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 O-C-N 122.485 -0.421 . . . . 21.93 110.699 177.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 48.5 tp -57.83 -42.44 84.36 Favored 'General case' 0 C--O 1.24 0.562 0 C-N-CA 120.343 -0.543 . . . . 20.52 111.988 173.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' HIS . . . . . 0.58 ' CE1' ' O2 ' ' A' ' 302' ' ' BOG . 22.4 t-160 -57.76 -47.14 83.36 Favored 'General case' 0 C--O 1.242 0.688 0 CA-C-N 116.554 -0.294 . . . . 26.359999999999999 111.409 178.861 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 62.1 tp -57.68 -50.02 74.57 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 112.648 0.61 . . . . 22.719999999999999 112.648 175.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 78.8 mt -51.53 -48.06 35.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 N-CA-C 113.243 0.831 . . . . 20.760000000000002 113.243 176.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 85.5 mt -63.69 -37.06 85.94 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 120.742 -0.383 . . . . 20.420000000000002 111.861 179.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 90.2 t90 -65.83 -42.54 90.42 Favored 'General case' 0 C--O 1.244 0.764 0 CA-C-N 116.354 -0.384 . . . . 29.640000000000001 110.835 177.663 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 92.0 mt -61.78 -50.3 80.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 O-C-N 123.421 0.45 . . . . 26.030000000000001 111.382 177.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 77.9 mt -58.52 -41.53 85.67 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 112.179 0.437 . . . . 29.850000000000001 112.179 179.113 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -58.25 -43.02 87.65 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.073 0.768 . . . . 35.590000000000003 113.073 173.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 27.8 mmt180 -69.64 -37.22 76.69 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 120.876 -0.329 . . . . 46.210000000000001 111.256 -177.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 65.6 mt -67.24 -38.42 85.16 Favored 'General case' 0 C--N 1.329 -0.283 0 O-C-N 123.649 0.593 . . . . 37.799999999999997 112.462 177.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.268 -2.959 0 O-C-N 117.767 -3.083 . . . . 37.850000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 87.1 p . . . . . 0 N--CA 1.482 1.127 0 N-CA-C 109.192 -0.67 . . . . 30.84 109.192 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 66.6 m -78.34 149.48 33.43 Favored 'General case' 0 C--O 1.237 0.43 0 N-CA-C 112.281 0.474 . . . . 28.359999999999999 112.281 -175.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -59.94 142.19 89.06 Favored Pre-proline 0 N--CA 1.479 0.998 0 C-N-CA 123.374 0.67 . . . . 31.579999999999998 109.415 172.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_exo -51.13 -34.71 48.92 Favored 'Trans proline' 0 C--N 1.348 0.549 0 O-C-N 122.992 0.996 . . . . 28.510000000000002 114.637 178.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 1.2 pp -71.92 -24.51 61.65 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 118.328 -1.349 . . . . 31.68 113.507 -178.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' VAL . . . . . . . . . . . . . 55.8 t -77.9 -41.42 27.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 N-CA-C 109.002 -0.74 . . . . 25.25 109.002 -179.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 47.0 t -52.02 -48.64 40.78 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.981 0 CA-C-O 121.53 0.681 . . . . 24.789999999999999 111.307 169.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.19 -49.32 77.63 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 115.524 -0.762 . . . . 24.77 110.806 -179.116 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.58 -38.65 88.33 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-O 119.281 -0.39 . . . . 25.5 111.346 178.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 54.3 m -66.24 -46.39 77.32 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 109.583 -0.525 . . . . 27.370000000000001 109.583 178.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' ILE . . . . . . . . . . . . . 76.9 mt -56.64 -47.09 82.83 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 CA-C-O 117.887 -1.054 . . . . 29.739999999999998 111.442 174.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' MSE . . . . . . . . . . . . 0.326 0.0 OUTLIER -58.8 -34.73 71.82 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 118.011 -1.476 . . . . 40.869999999999997 113.18 175.473 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.63 -46.72 89.19 Favored Glycine 0 C--N 1.333 0.373 0 O-C-N 123.293 0.37 . . . . 28.879999999999999 113.166 178.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' ILE . . . . . . . . . . . . . 89.4 mt -61.24 -45.01 99.44 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 N-CA-C 111.974 0.361 . . . . 26.739999999999998 111.974 175.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 31.0 tp -59.23 -45.2 91.77 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 112.546 0.573 . . . . 29.68 112.546 177.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -53.24 -50.03 65.61 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 123.276 0.36 . . . . 31.530000000000001 111.15 175.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 46.8 tp -58.13 -49.96 75.16 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 121.504 0.669 . . . . 26.91 112.541 177.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' ILE . . . . . . . . . . . . . 89.0 mt -57.64 -44.38 85.33 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 CA-C-N 115.787 -0.642 . . . . 25.370000000000001 111.896 -179.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 78.9 mt -62.15 -48.11 81.56 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.884 0.373 . . . . 26.379999999999999 111.221 179.435 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' TRP . . . . . . . . . . . . . 89.5 t90 -54.44 -45.43 73.07 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 115.545 -0.752 . . . . 33.840000000000003 111.879 177.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' ILE . . . . . . . . . . . . . 97.1 mt -60.31 -51.39 73.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 N-CA-C 112.834 0.679 . . . . 28.359999999999999 112.834 175.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 80.2 mt -59.21 -41.36 88.42 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 112.912 0.708 . . . . 30.289999999999999 112.912 178.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -58.57 -42.51 88.11 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 124.235 1.014 . . . . 35.560000000000002 110.275 178.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 14.6 tpp180 -76.83 -20.72 56.02 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 114.49 1.293 . . . . 48.030000000000001 114.49 -174.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 95.3 mt -77.87 -29.83 50.58 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.116 0.484 . . . . 36.189999999999998 110.538 177.828 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.264 -3.112 0 O-C-N 120.22 -1.55 . . . . 37.259999999999998 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 22' ' ' SER . . . . . . . . . . . . . 92.7 p . . . . . 0 N--CA 1.482 1.135 0 N-CA-C 108.07 -1.085 . . . . 28.32 108.07 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 23' ' ' SER . . . . . . . . . . . . . 66.1 m -109.96 149.5 29.85 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 109.388 -0.597 . . . . 25.91 109.388 179.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -70.97 152.64 94.94 Favored Pre-proline 0 N--CA 1.475 0.788 0 N-CA-C 109.985 -0.376 . . . . 30.109999999999999 109.985 -178.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 25' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -48.97 -42.09 38.72 Favored 'Trans proline' 0 CA--C 1.548 1.202 0 C-N-CA 123.004 2.469 . . . . 26.02 115.975 179.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 89.4 mt -66.66 -29.88 70.01 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 113.876 1.065 . . . . 22.850000000000001 113.876 177.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 27' ' ' VAL . . . . . . . . . . . . . 91.1 t -76.46 -39.82 33.88 Favored 'Isoleucine or valine' 0 C--O 1.252 1.212 0 CA-C-O 121.79 0.805 . . . . 21.609999999999999 109.634 -179.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 28' ' ' VAL . . . . . . . . . . . . . 60.8 t -61.98 -47.51 92.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 115.897 -0.592 . . . . 21.739999999999998 110.576 172.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.45 -44.82 80.85 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 112.312 0.486 . . . . 22.219999999999999 112.312 176.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.28 -34.99 78.56 Favored 'General case' 0 CA--C 1.51 -0.58 0 O-C-N 122.06 -0.4 . . . . 23.539999999999999 110.423 -177.786 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 31' ' ' SER . . . . . . . . . . . . . 67.8 m -69.68 -40.39 76.42 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 123.441 0.463 . . . . 22.050000000000001 110.37 179.349 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 91.1 mt -62.46 -41.47 91.99 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 CA-C-O 121.346 0.593 . . . . 23.02 109.552 176.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 33' ' ' MSE . . . . . . . . . . . . . 84.4 mmm -66.94 -35.7 80.57 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 113.115 0.783 . . . . 35.710000000000001 113.115 178.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.97 -42.08 98.39 Favored Glycine 0 N--CA 1.471 1.006 0 N-CA-C 110.218 -1.153 . . . . 23.390000000000001 110.218 174.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 35' ' ' ILE . . . . . . . . . . . . . 76.4 mt -64.84 -44.24 96.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 O-C-N 122.589 -0.359 . . . . 25.059999999999999 110.374 177.036 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 53.4 tp -53.86 -49.72 67.85 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.996 -0.44 . . . . 21.050000000000001 111.526 174.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 37' ' ' HIS . . . . . . . . . . . . . 63.6 t60 -54.09 -48.94 70.15 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.305 0.642 . . . . 29.23 112.14 177.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 49.1 tp -55.32 -48.1 74.65 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.697 0.629 . . . . 21.949999999999999 112.697 174.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 39' ' ' ILE . . . . . . . . . . . . . 46.1 mt -65.37 -41.98 92.51 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 CA-C-O 121.186 0.517 . . . . 20.760000000000002 112.001 -178.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 40' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.9 -44.53 91.24 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.362 0.875 . . . . 20.640000000000001 113.362 174.965 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 41' ' ' TRP . . . . . . . . . . . . . 91.0 t90 -60.01 -44.1 94.81 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 112.861 0.689 . . . . 28.530000000000001 112.861 175.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 42' ' ' ILE . . . . . . . . . . . . . 61.4 mt -62.96 -49.48 83.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 CA-C-N 116.867 -0.151 . . . . 25.18 110.997 177.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 81.8 mt -62.71 -38.58 91.02 Favored 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 111.916 0.339 . . . . 24.84 111.916 -179.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 44' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -53.17 -43.81 67.36 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 117.69 0.223 . . . . 31.98 111.267 174.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 52.4 mtp85 -75.16 -23.49 57.76 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 114.382 1.252 . . . . 34.189999999999998 114.382 -177.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 46' ' ' LEU . . . . . . . . . . . . . 55.4 mt -70.2 -26.42 63.87 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 113.117 0.784 . . . . 32.869999999999997 113.117 178.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 47' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.262 -3.197 0 O-C-N 121.007 -1.058 . . . . 32.909999999999997 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 22' ' ' SER . . . . . . . . . . . . . 98.3 p . . . . . 0 N--CA 1.481 1.08 0 N-CA-C 110.247 -0.279 . . . . 30.579999999999998 110.247 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 23' ' ' SER . . . . . . . . . . . . . 73.3 m -74.75 141.86 44.38 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 114.284 1.216 . . . . 28.48 114.284 -170.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -56.5 139.06 75.47 Favored Pre-proline 0 CA--C 1.545 0.771 0 CA-C-N 114.645 -1.161 . . . . 32.609999999999999 109.754 173.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 25' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_endo -52.92 -30.09 46.56 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 N-CA-C 114.918 1.084 . . . . 27.57 114.918 178.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 63.3 mt -72.31 -34.09 67.85 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 117.654 0.207 . . . . 25.199999999999999 110.743 -179.285 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 27' ' ' VAL . . . . . . . . . . . . . 61.7 t -70.47 -43.51 77.95 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 CA-C-N 116.386 -0.37 . . . . 24.059999999999999 110.297 177.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 28' ' ' VAL . . . . . . . . . . . . . 87.7 t -57.76 -44.52 86.1 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 N-CA-C 109.133 -0.691 . . . . 23.170000000000002 109.133 175.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.39 -47.56 72.94 Favored 'General case' 0 CA--C 1.506 -0.727 0 O-C-N 122.339 -0.226 . . . . 23.359999999999999 110.499 -176.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.94 -30.42 70.9 Favored 'General case' 0 CA--C 1.551 0.991 0 N-CA-C 113.025 0.75 . . . . 23.149999999999999 113.025 177.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 31' ' ' SER . . . . . . . . . . . . . 49.1 m -68.3 -43.88 76.68 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 112.425 0.528 . . . . 24.670000000000002 112.425 176.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 32' ' ' ILE . . . . . . . . . . . . . 71.0 mt -59.65 -44.73 94.14 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 CA-C-N 116.435 -0.348 . . . . 26.43 110.352 177.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 33' ' ' MSE . . . . . . . . . . . . . 16.2 mmt -59.99 -41.5 92.17 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 112.567 0.58 . . . . 45.359999999999999 112.567 173.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 34' ' ' GLY . . . . . . . . . . . . . . . -73.2 -31.92 60.92 Favored Glycine 0 N--CA 1.466 0.684 0 O-C-N 122.125 -0.36 . . . . 32.960000000000001 112.656 -176.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 35' ' ' ILE . . . . . . . . . . . . . 45.8 mt -58.98 -59.08 4.28 Favored 'Isoleucine or valine' 0 C--O 1.241 0.629 0 C-N-CA 123.254 0.622 . . . . 32.68 110.156 171.093 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 1.9 mp -46.95 -57.32 5.09 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-O 121.108 0.48 . . . . 36.509999999999998 112.183 172.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 37' ' ' HIS . . . . . . . . . . . . . 63.0 t60 -51.76 -45.07 63.57 Favored 'General case' 0 CA--C 1.555 1.168 0 N-CA-C 116.0 1.852 . . . . 36.140000000000001 116.0 -178.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 81.9 mt -76.66 -26.31 54.68 Favored 'General case' 0 C--O 1.243 0.743 0 CA-C-O 120.724 0.297 . . . . 32.100000000000001 111.773 -179.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 39' ' ' ILE . . . . . . . . . . . . . 32.4 mt -61.47 -48.69 87.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 C-N-CA 120.424 -0.51 . . . . 32.07 110.391 170.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 40' ' ' LEU . . . . . . . . . . . . . 41.0 mt -65.01 -37.48 87.79 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 112.042 0.386 . . . . 31.859999999999999 112.042 177.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 41' ' ' TRP . . . . . . . . . . . . . 83.0 t90 -61.15 -55.48 31.84 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 110.069 -0.345 . . . . 35.079999999999998 110.069 178.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 42' ' ' ILE . . . . . . . . . . . . . 47.3 mt -55.45 -42.71 68.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 N-CA-C 112.303 0.482 . . . . 35.149999999999999 112.303 179.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 11.5 mt -58.29 -44.13 88.37 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 112.669 0.618 . . . . 36.670000000000002 112.669 176.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 44' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -59.52 -39.23 83.21 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.617 0.767 . . . . 41.990000000000002 111.638 174.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 45' ' ' ARG . . . . . . . . . . . . . 47.0 tpt85 -70.53 -18.64 62.94 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 113.727 1.01 . . . . 36.609999999999999 113.727 -173.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 46' ' ' LEU . . . . . . . . . . . . . 54.9 mt -73.51 -27.54 61.42 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 112.142 0.423 . . . . 36.899999999999999 112.142 -178.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 47' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.26 -3.308 1 O-C-N 113.161 -5.962 . . . . 38.359999999999999 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 22' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 N--CA 1.496 1.833 0 CA-C-O 120.363 0.125 . . . . 38.5 111.211 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 23' ' ' SER . . . . . . . . . . . . . 18.5 m -128.26 150.48 50.03 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 105.385 -2.08 . . . . 33.100000000000001 105.385 157.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 24' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -67.87 142.03 95.19 Favored Pre-proline 0 N--CA 1.469 0.523 0 CA-C-O 119.507 -0.282 . . . . 34.670000000000002 110.649 178.36 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 25' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo -41.63 -46.42 6.26 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.856 2.37 . . . . 29.129999999999999 113.563 178.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 26' ' ' LEU . . . . . . . . . . . . . 11.4 tp -61.27 -39.04 88.91 Favored 'General case' 0 C--O 1.251 1.132 0 C-N-CA 125.184 1.394 . . . . 31.710000000000001 113.274 -178.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 27' ' ' VAL . . . . . . . . . . . . . 66.0 t -70.73 -43.21 77.52 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 CA-C-N 115.604 -0.725 . . . . 25.949999999999999 111.69 175.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 28' ' ' VAL . . . . . . . . . . . . . 48.0 t -55.46 -44.3 75.49 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 CA-C-O 120.52 0.2 . . . . 24.300000000000001 111.498 168.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.48 -43.89 88.79 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 112.478 0.547 . . . . 25.359999999999999 112.478 -178.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.16 -36.48 77.65 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 112.323 0.49 . . . . 24.620000000000001 112.323 174.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 31' ' ' SER . . . . . . . . . . . . . 50.4 m -68.52 -39.56 81.13 Favored 'General case' 0 C--N 1.33 -0.261 0 O-C-N 122.209 -0.307 . . . . 24.27 111.687 178.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 32' ' ' ILE . . . . . . . . . . . . . 55.0 mt -65.45 -43.12 94.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 120.545 -0.462 . . . . 24.18 110.799 178.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 33' ' ' MSE . . . . . . . . . . . . . 22.9 ttp -52.82 -46.97 67.95 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.402 0.681 . . . . 30.850000000000001 110.832 172.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.66 -47.39 91.45 Favored Glycine 0 N--CA 1.466 0.685 0 N-CA-C 111.702 -0.559 . . . . 25.190000000000001 111.702 -179.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 35' ' ' ILE . . . . . . . . . . . . . 68.9 mt -62.29 -46.18 97.03 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 N-CA-C 112.244 0.461 . . . . 24.780000000000001 112.244 177.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 36' ' ' LEU . . . . . . . . . . . . . 38.0 tp -55.88 -44.9 78.6 Favored 'General case' 0 C--O 1.246 0.882 0 N-CA-C 112.976 0.732 . . . . 24.82 112.976 170.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 37' ' ' HIS . . . . . . . . . . . . . 18.6 t-160 -52.87 -50.77 63.17 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 116.273 -0.421 . . . . 33.479999999999997 111.108 175.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 38' ' ' LEU . . . . . . . . . . . . . 59.2 tp -59.62 -44.31 93.5 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 113.706 1.002 . . . . 29.52 113.706 175.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 39' ' ' ILE . . . . . . . . . . . . . 85.8 mt -58.2 -48.67 84.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 CA-C-O 121.264 0.554 . . . . 27.260000000000002 110.213 178.688 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 40' ' ' LEU . . . . . . . . . . . . . 75.4 mt -61.61 -40.5 95.06 Favored 'General case' 0 C--O 1.221 -0.417 0 N-CA-C 112.678 0.621 . . . . 28.920000000000002 112.678 -178.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 41' ' ' TRP . . . . . . . . . . . . . 88.8 t90 -64.13 -47.86 78.3 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 110.069 -0.345 . . . . 37.479999999999997 110.069 179.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 42' ' ' ILE . . . . . . . . . . . . . 95.6 mt -55.38 -48.2 77.18 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 O-C-N 123.423 0.452 . . . . 34.549999999999997 111.155 176.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 43' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.65 -42.49 92.9 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.238 -0.437 . . . . 37.43 111.987 178.013 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 44' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -59.09 -44.92 91.97 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 120.689 -0.405 . . . . 44.350000000000001 111.703 178.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 45' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -71.51 -28.79 64.15 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 114.511 1.3 . . . . 53.149999999999999 114.511 -177.472 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 46' ' ' LEU . . . . . . . . . . . . . 74.1 mt -73.78 -20.19 60.55 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 121.14 -0.224 . . . . 43.229999999999997 110.494 176.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 47' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.268 -2.966 0 O-C-N 116.72 -3.737 . . . . 42.579999999999998 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 22' ' ' SER . . . . . . . . . . . . . 60.1 p . . . . . 0 N--CA 1.488 1.46 0 CA-C-O 120.875 0.369 . . . . 35.909999999999997 110.389 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 23' ' ' SER . . . . . . . . . . . . . 72.8 m -77.32 146.84 36.53 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.628 0.603 . . . . 32.909999999999997 112.628 -176.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 24' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -61.55 137.38 94.81 Favored Pre-proline 0 N--CA 1.476 0.866 0 C-N-CA 123.115 0.566 . . . . 32.799999999999997 111.06 171.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 25' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_exo -42.31 -42.64 7.74 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 124.111 3.208 . . . . 29.77 113.084 174.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 26' ' ' LEU . . . . . . . . . . . . . 1.4 tp -62.38 -40.46 96.55 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 123.057 0.543 . . . . 30.48 112.438 179.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 27' ' ' VAL . . . . . . . . . . . . . 82.4 t -67.93 -49.6 67.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.594 -0.73 . . . . 26.870000000000001 111.12 174.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 28' ' ' VAL . . . . . . . . . . . . . 29.8 t -48.63 -52.94 7.83 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 122.518 0.327 . . . . 26.949999999999999 110.837 171.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.73 -44.31 81.54 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 113.676 0.991 . . . . 25.93 113.676 178.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 30' ' ' ALA . . . . . . . . . . . . . . . -65.74 -35.45 80.75 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 113.351 0.871 . . . . 25.0 113.351 177.36 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 31' ' ' SER . . . . . . . . . . . . . 50.8 m -67.79 -42.79 81.1 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 121.233 -0.187 . . . . 25.59 111.44 176.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 32' ' ' ILE . . . . . . . . . . . . . 74.5 mt -58.58 -48.55 85.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 121.11 -0.236 . . . . 29.460000000000001 110.616 175.184 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 33' ' ' MSE . . . . . . . . . . . . . 10.6 ttm -50.51 -44.68 56.21 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 113.063 0.764 . . . . 37.759999999999998 113.063 173.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.98 -45.1 94.87 Favored Glycine 0 N--CA 1.466 0.667 0 C-N-CA 121.43 -0.414 . . . . 30.129999999999999 112.322 178.38 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 35' ' ' ILE . . . . . . . . . . . . . 98.2 mt -63.6 -44.95 98.76 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 0 C-N-CA 122.818 0.447 . . . . 27.789999999999999 111.221 -179.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 36' ' ' LEU . . . . . . . . . . . . . 47.0 tp -62.2 -40.72 97.01 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 121.141 -0.224 . . . . 30.350000000000001 111.546 177.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 37' ' ' HIS . . . . . . . . . . . . . 16.4 t-80 -61.22 -45.24 95.38 Favored 'General case' 0 C--O 1.243 0.729 0 O-C-N 123.393 0.433 . . . . 35.670000000000002 110.979 -178.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 38' ' ' LEU . . . . . . . . . . . . . 31.5 tp -57.77 -45.57 85.76 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 120.666 -0.414 . . . . 25.949999999999999 111.932 175.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 39' ' ' ILE . . . . . . . . . . . . . 96.4 mt -63.29 -39.57 85.78 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 CA-C-N 116.44 -0.345 . . . . 25.050000000000001 111.824 -179.496 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 40' ' ' LEU . . . . . . . . . . . . . 48.4 mt -67.04 -43.48 82.64 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 120.791 0.329 . . . . 24.190000000000001 111.177 178.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 41' ' ' TRP . . . . . . . . . . . . . 89.9 t90 -59.33 -43.9 92.68 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.832 -0.622 . . . . 32.340000000000003 111.98 176.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 42' ' ' ILE . . . . . . . . . . . . . 84.2 mt -62.97 -48.01 90.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 109.994 -0.373 . . . . 25.390000000000001 109.994 177.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 43' ' ' LEU . . . . . . . . . . . . . 86.5 mt -60.62 -41.24 94.43 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 123.427 0.455 . . . . 26.59 110.302 -178.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 44' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -61.76 -42.86 99.52 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 112.425 0.528 . . . . 32.390000000000001 112.425 177.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 45' ' ' ARG . . . . . . . . . . . . . 12.1 mmt180 -63.74 -33.57 75.94 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 114.114 1.153 . . . . 43.219999999999999 114.114 178.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 46' ' ' LEU . . . . . . . . . . . . . 78.6 mt -68.66 -4.87 17.19 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.599 0.238 . . . . 33.649999999999999 110.811 -179.166 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 47' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.266 -3.06 2 O-C-N 109.996 -7.94 . . . . 35.520000000000003 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 22' ' ' SER . . . . . . . . . . . . . 1.1 p . . . . . 0 N--CA 1.486 1.369 0 N-CA-C 109.382 -0.599 . . . . 34.149999999999999 109.382 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 23' ' ' SER . . . . . . . . . . . . . 48.8 m -63.14 144.28 57.05 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 123.575 0.547 . . . . 29.420000000000002 111.918 -170.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 24' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -64.52 151.84 90.75 Favored Pre-proline 0 CA--C 1.534 0.328 0 N-CA-C 108.898 -0.778 . . . . 31.789999999999999 108.898 179.298 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 25' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -51.06 -41.59 56.4 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 122.042 1.828 . . . . 25.469999999999999 115.119 174.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 26' ' ' LEU . . . . . . . . . . . . . 69.4 mt -65.81 -32.58 74.19 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 112.759 0.652 . . . . 23.329999999999998 112.759 179.607 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 27' ' ' VAL . . . . . . . . . . . . . 59.5 t -70.01 -46.34 73.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 CA-C-N 115.767 -0.651 . . . . 23.260000000000002 110.087 177.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 28' ' ' VAL . . . . . . . . . . . . . 90.4 t -58.44 -46.56 89.47 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 CA-C-N 116.861 -0.154 . . . . 22.460000000000001 110.691 173.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.73 -42.5 88.9 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 113.967 1.099 . . . . 22.629999999999999 113.967 178.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.18 -35.21 79.18 Favored 'General case' 0 CA--C 1.506 -0.716 0 C-N-CA 120.938 -0.305 . . . . 23.890000000000001 110.362 -179.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 31' ' ' SER . . . . . . . . . . . . . 75.0 m -68.63 -40.46 80.3 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 123.746 0.654 . . . . 25.25 111.011 -179.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 32' ' ' ILE . . . . . . . . . . . . . 83.6 mt -64.79 -43.22 96.47 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.003 0 CA-C-N 116.398 -0.365 . . . . 22.34 110.537 175.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 33' ' ' MSE . . . . . . . . . . . . . 88.5 mtp -66.43 -32.06 73.2 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 113.129 0.788 . . . . 31.84 113.129 179.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 34' ' ' GLY . . . . . . . . . . . . . . . -65.16 -44.56 93.8 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 111.537 -0.625 . . . . 23.530000000000001 111.537 172.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 35' ' ' ILE . . . . . . . . . . . . . 97.5 mt -61.96 -41.59 91.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 O-C-N 122.282 -0.54 . . . . 23.890000000000001 112.419 172.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 36' ' ' LEU . . . . . . . . . . . . . 39.8 tp -59.87 -44.72 94.0 Favored 'General case' 0 N--CA 1.45 -0.452 0 O-C-N 121.861 -0.524 . . . . 22.050000000000001 110.767 176.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 37' ' ' HIS . . . . . . . . . . . . . 77.1 t60 -58.22 -45.36 87.81 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.157 0.799 . . . . 28.850000000000001 113.157 177.417 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 38' ' ' LEU . . . . . . . . . . . . . 13.1 tp -59.62 -47.1 86.91 Favored 'General case' 0 C--O 1.222 -0.394 0 C-N-CA 120.107 -0.637 . . . . 22.09 110.043 179.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 39' ' ' ILE . . . . . . . . . . . . . 59.2 mt -65.11 -39.11 84.49 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 N-CA-C 113.318 0.858 . . . . 23.170000000000002 113.318 178.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 40' ' ' LEU . . . . . . . . . . . . . 79.0 mt -65.95 -36.7 84.07 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 119.385 -0.926 . . . . 19.949999999999999 111.635 175.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 41' ' ' TRP . . . . . . . . . . . . . 81.8 t90 -61.32 -46.0 92.08 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 112.498 0.555 . . . . 28.09 112.498 175.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 42' ' ' ILE . . . . . . . . . . . . . 95.6 mt -62.4 -51.81 67.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-N 116.607 -0.27 . . . . 23.989999999999998 111.344 177.409 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 43' ' ' LEU . . . . . . . . . . . . . 84.2 mt -60.65 -38.26 84.23 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 112.204 0.446 . . . . 25.829999999999998 112.204 -179.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 44' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -53.06 -43.23 66.53 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 122.781 0.432 . . . . 31.239999999999998 111.772 172.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 45' ' ' ARG . . . . . . . . . . . . . 63.0 mtp85 -74.84 -27.76 60.41 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 113.704 1.002 . . . . 33.619999999999997 113.704 -178.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 46' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.74 -40.18 96.1 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 116.134 -0.484 . . . . 31.609999999999999 112.112 176.084 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' G' G ' 47' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.268 -2.967 0 O-C-N 126.342 2.276 . . . . 33.030000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 22' ' ' SER . . . . . . . . . . . . . 13.6 p . . . . . 0 N--CA 1.495 1.785 0 N-CA-C 109.265 -0.643 . . . . 36.060000000000002 109.265 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 23' ' ' SER . . . . . . . . . . . . . 70.3 m -67.64 149.66 49.77 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 112.935 0.717 . . . . 30.600000000000001 112.935 -174.247 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 24' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -62.27 136.28 95.5 Favored Pre-proline 0 N--CA 1.471 0.596 0 N-CA-C 107.92 -1.141 . . . . 31.949999999999999 107.92 172.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 25' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -58.38 -26.27 76.77 Favored 'Trans proline' 0 CA--C 1.543 0.949 0 N-CA-C 115.262 1.216 . . . . 27.710000000000001 115.262 -178.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 26' ' ' LEU . . . . . . . . . . . . . 41.3 mt -66.74 -31.31 71.87 Favored 'General case' 0 C--O 1.243 0.763 0 CA-C-O 121.684 0.754 . . . . 26.010000000000002 112.381 172.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 27' ' ' VAL . . . . . . . . . . . . . 93.6 t -76.77 -42.02 33.38 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 CA-C-N 115.131 -0.94 . . . . 25.440000000000001 110.232 -177.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 28' ' ' VAL . . . . . . . . . . . . . 67.2 t -59.48 -44.13 92.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 C-N-CA 122.523 0.329 . . . . 23.350000000000001 111.409 173.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.19 -48.09 71.81 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 122.725 0.41 . . . . 23.23 111.279 -178.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.28 -41.23 88.42 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 112.369 0.507 . . . . 23.309999999999999 112.369 173.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 31' ' ' SER . . . . . . . . . . . . . 49.1 m -60.38 -40.56 91.3 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.947 0.721 . . . . 24.699999999999999 112.947 177.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 32' ' ' ILE . . . . . . . . . . . . . 91.3 mt -64.24 -40.82 90.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 O-C-N 121.873 -0.517 . . . . 25.370000000000001 111.42 177.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 33' ' ' MSE . . . . . . . . . . . . . 48.1 mtt -63.88 -41.29 97.77 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 122.766 0.426 . . . . 31.0 111.824 174.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.93 -41.35 98.72 Favored Glycine 0 N--CA 1.466 0.657 0 N-CA-C 111.086 -0.805 . . . . 28.329999999999998 111.086 179.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 35' ' ' ILE . . . . . . . . . . . . . 98.2 mt -59.23 -55.85 20.9 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.954 0 C-N-CA 123.463 0.705 . . . . 28.210000000000001 112.445 176.186 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 36' ' ' LEU . . . . . . . . . . . . . 30.8 tp -51.77 -48.36 63.79 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 112.333 0.494 . . . . 31.41 112.333 172.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 37' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -56.97 -48.11 79.15 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 113.47 0.915 . . . . 34.32 113.47 177.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 38' ' ' LEU . . . . . . . . . . . . . 61.9 mt -69.65 -34.26 73.76 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 116.273 -0.422 . . . . 30.07 111.755 -177.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 39' ' ' ILE . . . . . . . . . . . . . 43.6 mt -58.84 -47.9 87.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 N-CA-C 112.243 0.46 . . . . 29.210000000000001 112.243 172.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 40' ' ' LEU . . . . . . . . . . . . . 67.2 mt -63.99 -37.84 88.9 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.792 -0.185 . . . . 31.359999999999999 110.827 177.494 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 41' ' ' TRP . . . . . . . . . . . . . 86.1 t90 -62.45 -45.92 90.86 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 123.552 0.533 . . . . 32.340000000000003 110.713 179.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 42' ' ' ILE . . . . . . . . . . . . . 51.2 mt -64.54 -46.17 93.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 C-N-CA 123.264 0.626 . . . . 32.939999999999998 112.347 -179.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 43' ' ' LEU . . . . . . . . . . . . . 80.9 mt -55.51 -45.69 77.09 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.908 0.385 . . . . 36.579999999999998 111.887 177.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 44' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -62.48 -36.68 83.25 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 112.871 0.693 . . . . 40.909999999999997 112.871 176.695 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 45' ' ' ARG . . . . . . . . . . . . . 49.3 tpt85 -73.53 -17.34 61.22 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 112.627 0.603 . . . . 35.399999999999999 112.627 -176.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.15 -42.32 93.9 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 113.0 0.741 . . . . 38.039999999999999 113.0 179.779 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 47' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.262 -3.219 0 O-C-N 120.985 -1.072 . . . . 36.68 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' BOG . . . . . 0.58 ' O2 ' ' CE1' ' A' ' 37' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 401' ' ' PEG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 803' ' ' PEG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 301' ' ' BOG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 402' ' ' PEG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 403' ' ' PEG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 303' ' ' BOG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 501' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 702' ' ' BOG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 801' ' ' PEG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 802' ' ' PEG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 701' ' ' BOG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 703' ' ' BOG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 804' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 805' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 806' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 807' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 808' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 809' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 48' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 49' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 50' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 51' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 52' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 53' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 54' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 803' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 804' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 805' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 806' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 807' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 808' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 48' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 49' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 50' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 704' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 705' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 706' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 707' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 48' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 49' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 50' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 51' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 52' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 81.3 p . . . . . 0 N--CA 1.485 1.322 0 N-CA-C 109.79 -0.448 . . . . 33.04 109.79 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m -110.15 164.18 12.89 Favored 'General case' 0 C--O 1.239 0.511 0 N-CA-C 109.096 -0.705 . . . . 30.8 109.096 178.102 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -60.58 142.93 90.93 Favored Pre-proline 0 N--CA 1.471 0.609 0 N-CA-C 109.073 -0.714 . . . . 33.43 109.073 173.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -53.95 -34.46 76.77 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 121.216 1.278 . . . . 29.12 113.332 -178.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.1 tt -69.21 -34.38 74.8 Favored 'General case' 0 C--O 1.242 0.684 0 CA-C-O 121.036 0.446 . . . . 31.19 112.024 179.05 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 75.8 t -71.0 -39.25 74.84 Favored 'Isoleucine or valine' 0 C--O 1.239 0.514 0 N-CA-C 109.247 -0.649 . . . . 24.06 109.247 177.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 33.7 t -59.01 -45.03 92.51 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 N-CA-C 112.509 0.559 . . . . 23.16 112.509 171.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.39 -39.98 95.97 Favored 'General case' 0 C--O 1.207 -1.167 0 N-CA-C 112.806 0.669 . . . . 22.37 112.806 178.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.31 -38.0 89.49 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 123.484 0.714 . . . . 20.88 110.336 179.461 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 74.9 m -67.95 -45.97 72.75 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 113.624 0.972 . . . . 22.26 113.624 178.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 81.7 mt -57.18 -45.16 84.49 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 C-N-CA 122.573 0.349 . . . . 23.84 111.546 172.714 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' MSE . . . . . . . . . . . . . 4.3 ttm -53.48 -45.48 69.61 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 112.878 0.696 . . . . 37.15 112.878 171.588 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.23 -39.92 97.5 Favored Glycine 0 N--CA 1.47 0.954 0 N-CA-C 111.681 -0.567 . . . . 25.04 111.681 177.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 20.7 mt -66.22 -44.58 91.3 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 O-C-N 122.485 -0.421 . . . . 21.93 110.699 177.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 48.5 tp -57.83 -42.44 84.36 Favored 'General case' 0 C--O 1.24 0.562 0 C-N-CA 120.343 -0.543 . . . . 20.52 111.988 173.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' HIS . . . . . 0.58 ' CE1' ' O2 ' ' A' ' 302' ' ' BOG . 22.4 t-160 -57.76 -47.14 83.36 Favored 'General case' 0 C--O 1.242 0.688 0 CA-C-N 116.554 -0.294 . . . . 26.36 111.409 178.861 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' LEU . . . . . 0.403 ' HB2' ' HE3' ' D' ' 33' ' ' MSE . 62.1 tp -57.68 -50.02 74.57 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 112.648 0.61 . . . . 22.72 112.648 175.017 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 78.8 mt -51.53 -48.06 35.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 N-CA-C 113.243 0.831 . . . . 20.76 113.243 176.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 85.5 mt -63.69 -37.06 85.94 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 120.742 -0.383 . . . . 20.42 111.861 179.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 90.2 t90 -65.83 -42.54 90.42 Favored 'General case' 0 C--O 1.244 0.764 0 CA-C-N 116.354 -0.384 . . . . 29.64 110.835 177.663 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 92.0 mt -61.78 -50.3 80.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 O-C-N 123.421 0.45 . . . . 26.03 111.382 177.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 77.9 mt -58.52 -41.53 85.67 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 112.179 0.437 . . . . 29.85 112.179 179.113 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -58.25 -43.02 87.65 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.073 0.768 . . . . 35.59 113.073 173.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 27.8 mmt180 -69.64 -37.22 76.69 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 120.876 -0.329 . . . . 46.21 111.256 -177.363 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 65.6 mt -67.24 -38.42 85.16 Favored 'General case' 0 C--N 1.329 -0.283 0 O-C-N 123.649 0.593 . . . . 37.8 112.462 177.087 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.268 -2.959 0 O-C-N 117.767 -3.083 . . . . 37.85 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 87.1 p . . . . . 0 N--CA 1.482 1.127 0 N-CA-C 109.192 -0.67 . . . . 30.84 109.192 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 66.6 m -78.34 149.48 33.43 Favored 'General case' 0 C--O 1.237 0.43 0 N-CA-C 112.281 0.474 . . . . 28.36 112.281 -175.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -59.94 142.19 89.06 Favored Pre-proline 0 N--CA 1.479 0.998 0 C-N-CA 123.374 0.67 . . . . 31.58 109.415 172.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_exo -51.13 -34.71 48.92 Favored 'Trans proline' 0 C--N 1.348 0.549 0 O-C-N 122.992 0.996 . . . . 28.51 114.637 178.082 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 1.2 pp -71.92 -24.51 61.65 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 118.328 -1.349 . . . . 31.68 113.507 -178.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' VAL . . . . . . . . . . . . . 55.8 t -77.9 -41.42 27.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 N-CA-C 109.002 -0.74 . . . . 25.25 109.002 -179.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 47.0 t -52.02 -48.64 40.78 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.981 0 CA-C-O 121.53 0.681 . . . . 24.79 111.307 169.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.19 -49.32 77.63 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 115.524 -0.762 . . . . 24.77 110.806 -179.116 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' ALA . . . . . 0.412 ' HA ' ' HG3' ' B' ' 33' ' ' MSE . . . -61.58 -38.65 88.33 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-O 119.281 -0.39 . . . . 25.5 111.346 178.597 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 54.3 m -66.24 -46.39 77.32 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 109.583 -0.525 . . . . 27.37 109.583 178.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' ILE . . . . . . . . . . . . . 76.9 mt -56.64 -47.09 82.83 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 CA-C-O 117.887 -1.054 . . . . 29.74 111.442 174.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' MSE . . . . . 0.444 ' HE3' HG12 ' C' ' 35' ' ' ILE 0.326 0.0 OUTLIER -58.8 -34.73 71.82 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 118.011 -1.476 . . . . 40.87 113.18 175.473 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.63 -46.72 89.19 Favored Glycine 0 C--N 1.333 0.373 0 O-C-N 123.293 0.37 . . . . 28.88 113.166 178.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' ILE . . . . . . . . . . . . . 89.4 mt -61.24 -45.01 99.44 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 N-CA-C 111.974 0.361 . . . . 26.74 111.974 175.255 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 31.0 tp -59.23 -45.2 91.77 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 112.546 0.573 . . . . 29.68 112.546 177.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' HIS . . . . . 0.407 ' HB2' H6'2 ' B' ' 301' ' ' BOG . 23.7 t-160 -53.24 -50.03 65.61 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 123.276 0.36 . . . . 31.53 111.15 175.48 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 46.8 tp -58.13 -49.96 75.16 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 121.504 0.669 . . . . 26.91 112.541 177.402 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' ILE . . . . . . . . . . . . . 89.0 mt -57.64 -44.38 85.33 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 CA-C-N 115.787 -0.642 . . . . 25.37 111.896 -179.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 78.9 mt -62.15 -48.11 81.56 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.884 0.373 . . . . 26.38 111.221 179.435 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' TRP . . . . . . . . . . . . . 89.5 t90 -54.44 -45.43 73.07 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 115.545 -0.752 . . . . 33.84 111.879 177.634 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' ILE . . . . . . . . . . . . . 97.1 mt -60.31 -51.39 73.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 N-CA-C 112.834 0.679 . . . . 28.36 112.834 175.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 80.2 mt -59.21 -41.36 88.42 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 112.912 0.708 . . . . 30.29 112.912 178.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -58.57 -42.51 88.11 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 124.235 1.014 . . . . 35.56 110.275 178.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 14.6 tpp180 -76.83 -20.72 56.02 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 114.49 1.293 . . . . 48.03 114.49 -174.446 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 95.3 mt -77.87 -29.83 50.58 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.116 0.484 . . . . 36.19 110.538 177.828 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.264 -3.112 0 O-C-N 120.22 -1.55 . . . . 37.26 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 22' ' ' SER . . . . . . . . . . . . . 92.7 p . . . . . 0 N--CA 1.482 1.135 0 N-CA-C 108.07 -1.085 . . . . 28.32 108.07 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 23' ' ' SER . . . . . . . . . . . . . 66.1 m -109.96 149.5 29.85 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 109.388 -0.597 . . . . 25.91 109.388 179.44 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -70.97 152.64 94.94 Favored Pre-proline 0 N--CA 1.475 0.788 0 N-CA-C 109.985 -0.376 . . . . 30.11 109.985 -178.353 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 25' ' ' PRO . . . . . 0.429 ' HG3' ' H5 ' ' C' ' 303' ' ' BOG . 88.6 Cg_exo -48.97 -42.09 38.72 Favored 'Trans proline' 0 CA--C 1.548 1.202 0 C-N-CA 123.004 2.469 . . . . 26.02 115.975 179.319 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 89.4 mt -66.66 -29.88 70.01 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 113.876 1.065 . . . . 22.85 113.876 177.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 27' ' ' VAL . . . . . . . . . . . . . 91.1 t -76.46 -39.82 33.88 Favored 'Isoleucine or valine' 0 C--O 1.252 1.212 0 CA-C-O 121.79 0.805 . . . . 21.61 109.634 -179.926 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 28' ' ' VAL . . . . . . . . . . . . . 60.8 t -61.98 -47.51 92.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 115.897 -0.592 . . . . 21.74 110.576 172.344 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.45 -44.82 80.85 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 112.312 0.486 . . . . 22.22 112.312 176.26 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.28 -34.99 78.56 Favored 'General case' 0 CA--C 1.51 -0.58 0 O-C-N 122.06 -0.4 . . . . 23.54 110.423 -177.786 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 31' ' ' SER . . . . . . . . . . . . . 67.8 m -69.68 -40.39 76.42 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 123.441 0.463 . . . . 22.05 110.37 179.349 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 91.1 mt -62.46 -41.47 91.99 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 CA-C-O 121.346 0.593 . . . . 23.02 109.552 176.069 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 33' ' ' MSE . . . . . . . . . . . . . 84.4 mmm -66.94 -35.7 80.57 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 113.115 0.783 . . . . 35.71 113.115 178.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.97 -42.08 98.39 Favored Glycine 0 N--CA 1.471 1.006 0 N-CA-C 110.218 -1.153 . . . . 23.39 110.218 174.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 35' ' ' ILE . . . . . 0.444 HG12 ' HE3' ' B' ' 33' ' ' MSE . 76.4 mt -64.84 -44.24 96.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 O-C-N 122.589 -0.359 . . . . 25.06 110.374 177.036 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 53.4 tp -53.86 -49.72 67.85 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.996 -0.44 . . . . 21.05 111.526 174.552 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 37' ' ' HIS . . . . . 0.408 ' NE2' H1'1 ' B' ' 301' ' ' BOG . 63.6 t60 -54.09 -48.94 70.15 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.305 0.642 . . . . 29.23 112.14 177.295 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 49.1 tp -55.32 -48.1 74.65 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.697 0.629 . . . . 21.95 112.697 174.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 39' ' ' ILE . . . . . . . . . . . . . 46.1 mt -65.37 -41.98 92.51 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 CA-C-O 121.186 0.517 . . . . 20.76 112.001 -178.679 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 40' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.9 -44.53 91.24 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.362 0.875 . . . . 20.64 113.362 174.965 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 41' ' ' TRP . . . . . . . . . . . . . 91.0 t90 -60.01 -44.1 94.81 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 112.861 0.689 . . . . 28.53 112.861 175.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 42' ' ' ILE . . . . . . . . . . . . . 61.4 mt -62.96 -49.48 83.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 CA-C-N 116.867 -0.151 . . . . 25.18 110.997 177.756 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 81.8 mt -62.71 -38.58 91.02 Favored 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 111.916 0.339 . . . . 24.84 111.916 -179.809 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 44' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -53.17 -43.81 67.36 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 117.69 0.223 . . . . 31.98 111.267 174.398 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 52.4 mtp85 -75.16 -23.49 57.76 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 114.382 1.252 . . . . 34.19 114.382 -177.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 46' ' ' LEU . . . . . . . . . . . . . 55.4 mt -70.2 -26.42 63.87 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 113.117 0.784 . . . . 32.87 113.117 178.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 47' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.262 -3.197 0 O-C-N 121.007 -1.058 . . . . 32.91 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 22' ' ' SER . . . . . . . . . . . . . 98.3 p . . . . . 0 N--CA 1.481 1.08 0 N-CA-C 110.247 -0.279 . . . . 30.58 110.247 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 23' ' ' SER . . . . . . . . . . . . . 73.3 m -74.75 141.86 44.38 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 114.284 1.216 . . . . 28.48 114.284 -170.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -56.5 139.06 75.47 Favored Pre-proline 0 CA--C 1.545 0.771 0 CA-C-N 114.645 -1.161 . . . . 32.61 109.754 173.999 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 25' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_endo -52.92 -30.09 46.56 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 N-CA-C 114.918 1.084 . . . . 27.57 114.918 178.309 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 63.3 mt -72.31 -34.09 67.85 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 117.654 0.207 . . . . 25.2 110.743 -179.285 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 27' ' ' VAL . . . . . . . . . . . . . 61.7 t -70.47 -43.51 77.95 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 CA-C-N 116.386 -0.37 . . . . 24.06 110.297 177.619 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 28' ' ' VAL . . . . . . . . . . . . . 87.7 t -57.76 -44.52 86.1 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 N-CA-C 109.133 -0.691 . . . . 23.17 109.133 175.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.39 -47.56 72.94 Favored 'General case' 0 CA--C 1.506 -0.727 0 O-C-N 122.339 -0.226 . . . . 23.36 110.499 -176.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.94 -30.42 70.9 Favored 'General case' 0 CA--C 1.551 0.991 0 N-CA-C 113.025 0.75 . . . . 23.15 113.025 177.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 31' ' ' SER . . . . . . . . . . . . . 49.1 m -68.3 -43.88 76.68 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 112.425 0.528 . . . . 24.67 112.425 176.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 32' ' ' ILE . . . . . 0.466 ' O ' HD12 ' D' ' 36' ' ' LEU . 71.0 mt -59.65 -44.73 94.14 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 CA-C-N 116.435 -0.348 . . . . 26.43 110.352 177.734 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 33' ' ' MSE . . . . . 0.482 ' HE2' H3'2 ' A' ' 302' ' ' BOG . 16.2 mmt -59.99 -41.5 92.17 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 112.567 0.58 . . . . 45.36 112.567 173.169 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 34' ' ' GLY . . . . . . . . . . . . . . . -73.2 -31.92 60.92 Favored Glycine 0 N--CA 1.466 0.684 0 O-C-N 122.125 -0.36 . . . . 32.96 112.656 -176.648 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 35' ' ' ILE . . . . . . . . . . . . . 45.8 mt -58.98 -59.08 4.28 Favored 'Isoleucine or valine' 0 C--O 1.241 0.629 0 C-N-CA 123.254 0.622 . . . . 32.68 110.156 171.093 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 36' ' ' LEU . . . . . 0.466 HD12 ' O ' ' D' ' 32' ' ' ILE . 1.9 mp -46.95 -57.32 5.09 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-O 121.108 0.48 . . . . 36.51 112.183 172.73 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 37' ' ' HIS . . . . . 0.417 ' CE1' ' H5 ' ' A' ' 302' ' ' BOG . 63.0 t60 -51.76 -45.07 63.57 Favored 'General case' 0 CA--C 1.555 1.168 0 N-CA-C 116.0 1.852 . . . . 36.14 116.0 -178.874 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 81.9 mt -76.66 -26.31 54.68 Favored 'General case' 0 C--O 1.243 0.743 0 CA-C-O 120.724 0.297 . . . . 32.1 111.773 -179.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 39' ' ' ILE . . . . . . . . . . . . . 32.4 mt -61.47 -48.69 87.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 C-N-CA 120.424 -0.51 . . . . 32.07 110.391 170.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 40' ' ' LEU . . . . . . . . . . . . . 41.0 mt -65.01 -37.48 87.79 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 112.042 0.386 . . . . 31.86 112.042 177.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 41' ' ' TRP . . . . . . . . . . . . . 83.0 t90 -61.15 -55.48 31.84 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 110.069 -0.345 . . . . 35.08 110.069 178.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 42' ' ' ILE . . . . . . . . . . . . . 47.3 mt -55.45 -42.71 68.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 N-CA-C 112.303 0.482 . . . . 35.15 112.303 179.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 11.5 mt -58.29 -44.13 88.37 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 112.669 0.618 . . . . 36.67 112.669 176.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 44' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -59.52 -39.23 83.21 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.617 0.767 . . . . 41.99 111.638 174.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 45' ' ' ARG . . . . . . . . . . . . . 47.0 tpt85 -70.53 -18.64 62.94 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 113.727 1.01 . . . . 36.61 113.727 -173.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 46' ' ' LEU . . . . . . . . . . . . . 54.9 mt -73.51 -27.54 61.42 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 112.142 0.423 . . . . 36.9 112.142 -178.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 47' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.26 -3.308 1 O-C-N 113.161 -5.962 . . . . 38.36 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 22' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 N--CA 1.496 1.833 0 CA-C-O 120.363 0.125 . . . . 38.5 111.211 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 23' ' ' SER . . . . . . . . . . . . . 18.5 m -128.26 150.48 50.03 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 105.385 -2.08 . . . . 33.1 105.385 157.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 24' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -67.87 142.03 95.19 Favored Pre-proline 0 N--CA 1.469 0.523 0 CA-C-O 119.507 -0.282 . . . . 34.67 110.649 178.36 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 25' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo -41.63 -46.42 6.26 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.856 2.37 . . . . 29.13 113.563 178.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 26' ' ' LEU . . . . . . . . . . . . . 11.4 tp -61.27 -39.04 88.91 Favored 'General case' 0 C--O 1.251 1.132 0 C-N-CA 125.184 1.394 . . . . 31.71 113.274 -178.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 27' ' ' VAL . . . . . . . . . . . . . 66.0 t -70.73 -43.21 77.52 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 CA-C-N 115.604 -0.725 . . . . 25.95 111.69 175.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 28' ' ' VAL . . . . . . . . . . . . . 48.0 t -55.46 -44.3 75.49 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 CA-C-O 120.52 0.2 . . . . 24.3 111.498 168.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.48 -43.89 88.79 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 112.478 0.547 . . . . 25.36 112.478 -178.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.16 -36.48 77.65 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 112.323 0.49 . . . . 24.62 112.323 174.518 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 31' ' ' SER . . . . . . . . . . . . . 50.4 m -68.52 -39.56 81.13 Favored 'General case' 0 C--N 1.33 -0.261 0 O-C-N 122.209 -0.307 . . . . 24.27 111.687 178.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 32' ' ' ILE . . . . . . . . . . . . . 55.0 mt -65.45 -43.12 94.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 120.545 -0.462 . . . . 24.18 110.799 178.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 33' ' ' MSE . . . . . . . . . . . . . 22.9 ttp -52.82 -46.97 67.95 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.402 0.681 . . . . 30.85 110.832 172.673 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.66 -47.39 91.45 Favored Glycine 0 N--CA 1.466 0.685 0 N-CA-C 111.702 -0.559 . . . . 25.19 111.702 -179.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 35' ' ' ILE . . . . . . . . . . . . . 68.9 mt -62.29 -46.18 97.03 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 N-CA-C 112.244 0.461 . . . . 24.78 112.244 177.763 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 36' ' ' LEU . . . . . . . . . . . . . 38.0 tp -55.88 -44.9 78.6 Favored 'General case' 0 C--O 1.246 0.882 0 N-CA-C 112.976 0.732 . . . . 24.82 112.976 170.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 37' ' ' HIS . . . . . . . . . . . . . 18.6 t-160 -52.87 -50.77 63.17 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 116.273 -0.421 . . . . 33.48 111.108 175.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 38' ' ' LEU . . . . . . . . . . . . . 59.2 tp -59.62 -44.31 93.5 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 113.706 1.002 . . . . 29.52 113.706 175.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 39' ' ' ILE . . . . . . . . . . . . . 85.8 mt -58.2 -48.67 84.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 CA-C-O 121.264 0.554 . . . . 27.26 110.213 178.688 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 40' ' ' LEU . . . . . . . . . . . . . 75.4 mt -61.61 -40.5 95.06 Favored 'General case' 0 C--O 1.221 -0.417 0 N-CA-C 112.678 0.621 . . . . 28.92 112.678 -178.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 41' ' ' TRP . . . . . . . . . . . . . 88.8 t90 -64.13 -47.86 78.3 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 110.069 -0.345 . . . . 37.48 110.069 179.007 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 42' ' ' ILE . . . . . . . . . . . . . 95.6 mt -55.38 -48.2 77.18 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 O-C-N 123.423 0.452 . . . . 34.55 111.155 176.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 43' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.65 -42.49 92.9 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.238 -0.437 . . . . 37.43 111.987 178.013 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 44' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -59.09 -44.92 91.97 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 120.689 -0.405 . . . . 44.35 111.703 178.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 45' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -71.51 -28.79 64.15 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 114.511 1.3 . . . . 53.15 114.511 -177.472 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 46' ' ' LEU . . . . . . . . . . . . . 74.1 mt -73.78 -20.19 60.55 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 121.14 -0.224 . . . . 43.23 110.494 176.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 47' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.268 -2.966 0 O-C-N 116.72 -3.737 . . . . 42.58 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 22' ' ' SER . . . . . . . . . . . . . 60.1 p . . . . . 0 N--CA 1.488 1.46 0 CA-C-O 120.875 0.369 . . . . 35.91 110.389 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 23' ' ' SER . . . . . . . . . . . . . 72.8 m -77.32 146.84 36.53 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.628 0.603 . . . . 32.91 112.628 -176.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 24' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -61.55 137.38 94.81 Favored Pre-proline 0 N--CA 1.476 0.866 0 C-N-CA 123.115 0.566 . . . . 32.8 111.06 171.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 25' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_exo -42.31 -42.64 7.74 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 124.111 3.208 . . . . 29.77 113.084 174.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 26' ' ' LEU . . . . . . . . . . . . . 1.4 tp -62.38 -40.46 96.55 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 123.057 0.543 . . . . 30.48 112.438 179.993 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 27' ' ' VAL . . . . . . . . . . . . . 82.4 t -67.93 -49.6 67.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.594 -0.73 . . . . 26.87 111.12 174.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 28' ' ' VAL . . . . . . . . . . . . . 29.8 t -48.63 -52.94 7.83 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 122.518 0.327 . . . . 26.95 110.837 171.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 29' ' ' ALA . . . . . 0.499 ' O ' ' HG3' ' F' ' 33' ' ' MSE . . . -56.73 -44.31 81.54 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 113.676 0.991 . . . . 25.93 113.676 178.513 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 30' ' ' ALA . . . . . . . . . . . . . . . -65.74 -35.45 80.75 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 113.351 0.871 . . . . 25.0 113.351 177.36 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 31' ' ' SER . . . . . . . . . . . . . 50.8 m -67.79 -42.79 81.1 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 121.233 -0.187 . . . . 25.59 111.44 176.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 32' ' ' ILE . . . . . . . . . . . . . 74.5 mt -58.58 -48.55 85.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 121.11 -0.236 . . . . 29.46 110.616 175.184 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 33' ' ' MSE . . . . . 0.534 ' HE1' HG12 ' G' ' 35' ' ' ILE . 10.6 ttm -50.51 -44.68 56.21 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 113.063 0.764 . . . . 37.76 113.063 173.039 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.98 -45.1 94.87 Favored Glycine 0 N--CA 1.466 0.667 0 C-N-CA 121.43 -0.414 . . . . 30.13 112.322 178.38 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 35' ' ' ILE . . . . . . . . . . . . . 98.2 mt -63.6 -44.95 98.76 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 0 C-N-CA 122.818 0.447 . . . . 27.79 111.221 -179.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 36' ' ' LEU . . . . . 0.506 HD23 H6'1 ' G' ' 701' ' ' BOG . 47.0 tp -62.2 -40.72 97.01 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 121.141 -0.224 . . . . 30.35 111.546 177.586 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 37' ' ' HIS . . . . . . . . . . . . . 16.4 t-80 -61.22 -45.24 95.38 Favored 'General case' 0 C--O 1.243 0.729 0 O-C-N 123.393 0.433 . . . . 35.67 110.979 -178.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 38' ' ' LEU . . . . . . . . . . . . . 31.5 tp -57.77 -45.57 85.76 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 120.666 -0.414 . . . . 25.95 111.932 175.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 39' ' ' ILE . . . . . . . . . . . . . 96.4 mt -63.29 -39.57 85.78 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 CA-C-N 116.44 -0.345 . . . . 25.05 111.824 -179.496 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 40' ' ' LEU . . . . . . . . . . . . . 48.4 mt -67.04 -43.48 82.64 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 120.791 0.329 . . . . 24.19 111.177 178.205 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 41' ' ' TRP . . . . . . . . . . . . . 89.9 t90 -59.33 -43.9 92.68 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.832 -0.622 . . . . 32.34 111.98 176.156 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 42' ' ' ILE . . . . . . . . . . . . . 84.2 mt -62.97 -48.01 90.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 109.994 -0.373 . . . . 25.39 109.994 177.8 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 43' ' ' LEU . . . . . . . . . . . . . 86.5 mt -60.62 -41.24 94.43 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 123.427 0.455 . . . . 26.59 110.302 -178.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 44' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -61.76 -42.86 99.52 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 112.425 0.528 . . . . 32.39 112.425 177.485 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 45' ' ' ARG . . . . . . . . . . . . . 12.1 mmt180 -63.74 -33.57 75.94 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 114.114 1.153 . . . . 43.22 114.114 178.567 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 46' ' ' LEU . . . . . . . . . . . . . 78.6 mt -68.66 -4.87 17.19 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.599 0.238 . . . . 33.65 110.811 -179.166 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 47' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.266 -3.06 2 O-C-N 109.996 -7.94 . . . . 35.52 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 22' ' ' SER . . . . . . . . . . . . . 1.1 p . . . . . 0 N--CA 1.486 1.369 0 N-CA-C 109.382 -0.599 . . . . 34.15 109.382 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' G' G ' 23' ' ' SER . . . . . . . . . . . . . 48.8 m -63.14 144.28 57.05 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 123.575 0.547 . . . . 29.42 111.918 -170.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 24' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -64.52 151.84 90.75 Favored Pre-proline 0 CA--C 1.534 0.328 0 N-CA-C 108.898 -0.778 . . . . 31.79 108.898 179.298 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 25' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -51.06 -41.59 56.4 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 122.042 1.828 . . . . 25.47 115.119 174.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 26' ' ' LEU . . . . . . . . . . . . . 69.4 mt -65.81 -32.58 74.19 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 112.759 0.652 . . . . 23.33 112.759 179.607 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 27' ' ' VAL . . . . . . . . . . . . . 59.5 t -70.01 -46.34 73.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 CA-C-N 115.767 -0.651 . . . . 23.26 110.087 177.107 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 28' ' ' VAL . . . . . . . . . . . . . 90.4 t -58.44 -46.56 89.47 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 CA-C-N 116.861 -0.154 . . . . 22.46 110.691 173.75 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.73 -42.5 88.9 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 113.967 1.099 . . . . 22.63 113.967 178.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.18 -35.21 79.18 Favored 'General case' 0 CA--C 1.506 -0.716 0 C-N-CA 120.938 -0.305 . . . . 23.89 110.362 -179.297 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 31' ' ' SER . . . . . . . . . . . . . 75.0 m -68.63 -40.46 80.3 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 123.746 0.654 . . . . 25.25 111.011 -179.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 32' ' ' ILE . . . . . . . . . . . . . 83.6 mt -64.79 -43.22 96.47 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.003 0 CA-C-N 116.398 -0.365 . . . . 22.34 110.537 175.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 33' ' ' MSE . . . . . 0.444 ' HE1' HG13 ' H' ' 39' ' ' ILE . 88.5 mtp -66.43 -32.06 73.2 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 113.129 0.788 . . . . 31.84 113.129 179.518 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 34' ' ' GLY . . . . . . . . . . . . . . . -65.16 -44.56 93.8 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 111.537 -0.625 . . . . 23.53 111.537 172.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 35' ' ' ILE . . . . . 0.534 HG12 ' HE1' ' F' ' 33' ' ' MSE . 97.5 mt -61.96 -41.59 91.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 O-C-N 122.282 -0.54 . . . . 23.89 112.419 172.376 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 36' ' ' LEU . . . . . . . . . . . . . 39.8 tp -59.87 -44.72 94.0 Favored 'General case' 0 N--CA 1.45 -0.452 0 O-C-N 121.861 -0.524 . . . . 22.05 110.767 176.464 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 37' ' ' HIS . . . . . . . . . . . . . 77.1 t60 -58.22 -45.36 87.81 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.157 0.799 . . . . 28.85 113.157 177.417 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 38' ' ' LEU . . . . . . . . . . . . . 13.1 tp -59.62 -47.1 86.91 Favored 'General case' 0 C--O 1.222 -0.394 0 C-N-CA 120.107 -0.637 . . . . 22.09 110.043 179.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 39' ' ' ILE . . . . . . . . . . . . . 59.2 mt -65.11 -39.11 84.49 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 N-CA-C 113.318 0.858 . . . . 23.17 113.318 178.391 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 40' ' ' LEU . . . . . . . . . . . . . 79.0 mt -65.95 -36.7 84.07 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 119.385 -0.926 . . . . 19.95 111.635 175.706 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 41' ' ' TRP . . . . . 0.615 ' CD1' ' H3 ' ' G' ' 701' ' ' BOG . 81.8 t90 -61.32 -46.0 92.08 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 112.498 0.555 . . . . 28.09 112.498 175.081 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 42' ' ' ILE . . . . . . . . . . . . . 95.6 mt -62.4 -51.81 67.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-N 116.607 -0.27 . . . . 23.99 111.344 177.409 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 43' ' ' LEU . . . . . . . . . . . . . 84.2 mt -60.65 -38.26 84.23 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 112.204 0.446 . . . . 25.83 112.204 -179.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 44' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -53.06 -43.23 66.53 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 122.781 0.432 . . . . 31.24 111.772 172.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 45' ' ' ARG . . . . . . . . . . . . . 63.0 mtp85 -74.84 -27.76 60.41 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 113.704 1.002 . . . . 33.62 113.704 -178.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 46' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.74 -40.18 96.1 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 116.134 -0.484 . . . . 31.61 112.112 176.084 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 47' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.268 -2.967 0 O-C-N 126.342 2.276 . . . . 33.03 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 22' ' ' SER . . . . . . . . . . . . . 13.6 p . . . . . 0 N--CA 1.495 1.785 0 N-CA-C 109.265 -0.643 . . . . 36.06 109.265 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 23' ' ' SER . . . . . . . . . . . . . 70.3 m -67.64 149.66 49.77 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 112.935 0.717 . . . . 30.6 112.935 -174.247 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 24' ' ' ASP . . . . . 0.401 ' HB3' HG23 ' H' ' 27' ' ' VAL . 11.4 t70 -62.27 136.28 95.5 Favored Pre-proline 0 N--CA 1.471 0.596 0 N-CA-C 107.92 -1.141 . . . . 31.95 107.92 172.97 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 25' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -58.38 -26.27 76.77 Favored 'Trans proline' 0 CA--C 1.543 0.949 0 N-CA-C 115.262 1.216 . . . . 27.71 115.262 -178.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 26' ' ' LEU . . . . . . . . . . . . . 41.3 mt -66.74 -31.31 71.87 Favored 'General case' 0 C--O 1.243 0.763 0 CA-C-O 121.684 0.754 . . . . 26.01 112.381 172.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 27' ' ' VAL . . . . . 0.401 HG23 ' HB3' ' H' ' 24' ' ' ASP . 93.6 t -76.77 -42.02 33.38 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 CA-C-N 115.131 -0.94 . . . . 25.44 110.232 -177.538 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 28' ' ' VAL . . . . . . . . . . . . . 67.2 t -59.48 -44.13 92.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 C-N-CA 122.523 0.329 . . . . 23.35 111.409 173.489 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.19 -48.09 71.81 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 122.725 0.41 . . . . 23.23 111.279 -178.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.28 -41.23 88.42 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 112.369 0.507 . . . . 23.31 112.369 173.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 31' ' ' SER . . . . . . . . . . . . . 49.1 m -60.38 -40.56 91.3 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.947 0.721 . . . . 24.7 112.947 177.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 32' ' ' ILE . . . . . . . . . . . . . 91.3 mt -64.24 -40.82 90.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 O-C-N 121.873 -0.517 . . . . 25.37 111.42 177.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 33' ' ' MSE . . . . . . . . . . . . . 48.1 mtt -63.88 -41.29 97.77 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 122.766 0.426 . . . . 31.0 111.824 174.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.93 -41.35 98.72 Favored Glycine 0 N--CA 1.466 0.657 0 N-CA-C 111.086 -0.805 . . . . 28.33 111.086 179.402 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 35' ' ' ILE . . . . . . . . . . . . . 98.2 mt -59.23 -55.85 20.9 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.954 0 C-N-CA 123.463 0.705 . . . . 28.21 112.445 176.186 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 36' ' ' LEU . . . . . . . . . . . . . 30.8 tp -51.77 -48.36 63.79 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 112.333 0.494 . . . . 31.41 112.333 172.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 37' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -56.97 -48.11 79.15 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 113.47 0.915 . . . . 34.32 113.47 177.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 38' ' ' LEU . . . . . . . . . . . . . 61.9 mt -69.65 -34.26 73.76 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 116.273 -0.422 . . . . 30.07 111.755 -177.128 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 39' ' ' ILE . . . . . 0.444 HG13 ' HE1' ' G' ' 33' ' ' MSE . 43.6 mt -58.84 -47.9 87.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 N-CA-C 112.243 0.46 . . . . 29.21 112.243 172.347 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 40' ' ' LEU . . . . . . . . . . . . . 67.2 mt -63.99 -37.84 88.9 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.792 -0.185 . . . . 31.36 110.827 177.494 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 41' ' ' TRP . . . . . . . . . . . . . 86.1 t90 -62.45 -45.92 90.86 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 123.552 0.533 . . . . 32.34 110.713 179.654 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 42' ' ' ILE . . . . . . . . . . . . . 51.2 mt -64.54 -46.17 93.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 C-N-CA 123.264 0.626 . . . . 32.94 112.347 -179.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 43' ' ' LEU . . . . . . . . . . . . . 80.9 mt -55.51 -45.69 77.09 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.908 0.385 . . . . 36.58 111.887 177.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 44' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -62.48 -36.68 83.25 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 112.871 0.693 . . . . 40.91 112.871 176.695 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 45' ' ' ARG . . . . . . . . . . . . . 49.3 tpt85 -73.53 -17.34 61.22 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 112.627 0.603 . . . . 35.4 112.627 -176.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.15 -42.32 93.9 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 113.0 0.741 . . . . 38.04 113.0 179.779 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 47' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.262 -3.219 0 O-C-N 120.985 -1.072 . . . . 36.68 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 302' ' ' BOG . . . . . 0.58 ' O2 ' ' CE1' ' A' ' 37' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 401' ' ' PEG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 803' ' ' PEG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 301' ' ' BOG . . . . . 0.408 H1'1 ' NE2' ' C' ' 37' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 402' ' ' PEG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 403' ' ' PEG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 303' ' ' BOG . . . . . 0.429 ' H5 ' ' HG3' ' C' ' 25' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 501' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 702' ' ' BOG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 801' ' ' PEG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 802' ' ' PEG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' G' G ' 701' ' ' BOG . . . . . 0.615 ' H3 ' ' CD1' ' G' ' 41' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 703' ' ' BOG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 804' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 805' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 806' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 807' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 808' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 809' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 48' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 49' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 50' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 51' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 52' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 53' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 54' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 803' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 804' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 805' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 806' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 807' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 808' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 48' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 49' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 50' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' G' G ' 704' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' G' G ' 705' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' G' G ' 706' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' G' G ' 707' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 48' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 49' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 50' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 51' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 52' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 81.3 p . . . . . 0 N--CA 1.485 1.322 0 N-CA-C 109.79 -0.448 . . . . 33.04 109.79 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m -110.15 164.18 12.89 Favored 'General case' 0 C--O 1.239 0.511 0 N-CA-C 109.096 -0.705 . . . . 30.8 109.096 178.102 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -60.58 142.93 90.93 Favored Pre-proline 0 N--CA 1.471 0.609 0 N-CA-C 109.073 -0.714 . . . . 33.43 109.073 173.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -53.95 -34.46 76.77 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 121.216 1.278 . . . . 29.12 113.332 -178.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.1 tt -69.21 -34.38 74.8 Favored 'General case' 0 C--O 1.242 0.684 0 CA-C-O 121.036 0.446 . . . . 31.19 112.024 179.05 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 75.8 t -71.0 -39.25 74.84 Favored 'Isoleucine or valine' 0 C--O 1.239 0.514 0 N-CA-C 109.247 -0.649 . . . . 24.06 109.247 177.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 33.7 t -59.01 -45.03 92.51 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 N-CA-C 112.509 0.559 . . . . 23.16 112.509 171.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.39 -39.98 95.97 Favored 'General case' 0 C--O 1.207 -1.167 0 N-CA-C 112.806 0.669 . . . . 22.37 112.806 178.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.31 -38.0 89.49 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 123.484 0.714 . . . . 20.88 110.336 179.461 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 74.9 m -67.95 -45.97 72.75 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 113.624 0.972 . . . . 22.26 113.624 178.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 81.7 mt -57.18 -45.16 84.49 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 C-N-CA 122.573 0.349 . . . . 23.84 111.546 172.714 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' MSE . . . . . . . . . . . . . 4.3 ttm -53.48 -45.48 69.61 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 112.878 0.696 . . . . 37.15 112.878 171.588 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.23 -39.92 97.5 Favored Glycine 0 N--CA 1.47 0.954 0 N-CA-C 111.681 -0.567 . . . . 25.04 111.681 177.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 20.7 mt -66.22 -44.58 91.3 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 O-C-N 122.485 -0.421 . . . . 21.93 110.699 177.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 48.5 tp -57.83 -42.44 84.36 Favored 'General case' 0 C--O 1.24 0.562 0 C-N-CA 120.343 -0.543 . . . . 20.52 111.988 173.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' HIS . . . . . 0.58 ' CE1' ' O2 ' ' A' ' 302' ' ' BOG . 22.4 t-160 -57.76 -47.14 83.36 Favored 'General case' 0 C--O 1.242 0.688 0 CA-C-N 116.554 -0.294 . . . . 26.36 111.409 178.861 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.403 ' HB2' ' HE3' ' D' ' 33' ' ' MSE . 62.1 tp -57.68 -50.02 74.57 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 112.648 0.61 . . . . 22.72 112.648 175.017 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 78.8 mt -51.53 -48.06 35.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 N-CA-C 113.243 0.831 . . . . 20.76 113.243 176.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 85.5 mt -63.69 -37.06 85.94 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 120.742 -0.383 . . . . 20.42 111.861 179.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 90.2 t90 -65.83 -42.54 90.42 Favored 'General case' 0 C--O 1.244 0.764 0 CA-C-N 116.354 -0.384 . . . . 29.64 110.835 177.663 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 92.0 mt -61.78 -50.3 80.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 O-C-N 123.421 0.45 . . . . 26.03 111.382 177.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 77.9 mt -58.52 -41.53 85.67 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 112.179 0.437 . . . . 29.85 112.179 179.113 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -58.25 -43.02 87.65 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.073 0.768 . . . . 35.59 113.073 173.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 27.8 mmt180 -69.64 -37.22 76.69 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 120.876 -0.329 . . . . 46.21 111.256 -177.363 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 65.6 mt -67.24 -38.42 85.16 Favored 'General case' 0 C--N 1.329 -0.283 0 O-C-N 123.649 0.593 . . . . 37.8 112.462 177.087 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.268 -2.959 0 O-C-N 117.767 -3.083 . . . . 37.85 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 87.1 p . . . . . 0 N--CA 1.482 1.127 0 N-CA-C 109.192 -0.67 . . . . 30.84 109.192 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 66.6 m -78.34 149.48 33.43 Favored 'General case' 0 C--O 1.237 0.43 0 N-CA-C 112.281 0.474 . . . . 28.36 112.281 -175.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -59.94 142.19 89.06 Favored Pre-proline 0 N--CA 1.479 0.998 0 C-N-CA 123.374 0.67 . . . . 31.58 109.415 172.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_exo -51.13 -34.71 48.92 Favored 'Trans proline' 0 C--N 1.348 0.549 0 O-C-N 122.992 0.996 . . . . 28.51 114.637 178.082 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 1.2 pp -71.92 -24.51 61.65 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 118.328 -1.349 . . . . 31.68 113.507 -178.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' VAL . . . . . . . . . . . . . 55.8 t -77.9 -41.42 27.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 N-CA-C 109.002 -0.74 . . . . 25.25 109.002 -179.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 47.0 t -52.02 -48.64 40.78 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.981 0 CA-C-O 121.53 0.681 . . . . 24.79 111.307 169.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.19 -49.32 77.63 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 115.524 -0.762 . . . . 24.77 110.806 -179.116 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' ALA . . . . . 0.412 ' HA ' ' HG3' ' B' ' 33' ' ' MSE . . . -61.58 -38.65 88.33 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-O 119.281 -0.39 . . . . 25.5 111.346 178.597 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 54.3 m -66.24 -46.39 77.32 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 109.583 -0.525 . . . . 27.37 109.583 178.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' ILE . . . . . . . . . . . . . 76.9 mt -56.64 -47.09 82.83 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 CA-C-O 117.887 -1.054 . . . . 29.74 111.442 174.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' MSE . . . . . 0.444 ' HE3' HG12 ' C' ' 35' ' ' ILE 0.326 0.0 OUTLIER -58.8 -34.73 71.82 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 118.011 -1.476 . . . . 40.87 113.18 175.473 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.63 -46.72 89.19 Favored Glycine 0 C--N 1.333 0.373 0 O-C-N 123.293 0.37 . . . . 28.88 113.166 178.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' ILE . . . . . . . . . . . . . 89.4 mt -61.24 -45.01 99.44 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 N-CA-C 111.974 0.361 . . . . 26.74 111.974 175.255 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 31.0 tp -59.23 -45.2 91.77 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 112.546 0.573 . . . . 29.68 112.546 177.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' HIS . . . . . 0.407 ' HB2' H6'2 ' B' ' 301' ' ' BOG . 23.7 t-160 -53.24 -50.03 65.61 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 123.276 0.36 . . . . 31.53 111.15 175.48 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 46.8 tp -58.13 -49.96 75.16 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 121.504 0.669 . . . . 26.91 112.541 177.402 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' ILE . . . . . . . . . . . . . 89.0 mt -57.64 -44.38 85.33 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 CA-C-N 115.787 -0.642 . . . . 25.37 111.896 -179.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 78.9 mt -62.15 -48.11 81.56 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.884 0.373 . . . . 26.38 111.221 179.435 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' TRP . . . . . . . . . . . . . 89.5 t90 -54.44 -45.43 73.07 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 115.545 -0.752 . . . . 33.84 111.879 177.634 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' ILE . . . . . . . . . . . . . 97.1 mt -60.31 -51.39 73.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 N-CA-C 112.834 0.679 . . . . 28.36 112.834 175.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 80.2 mt -59.21 -41.36 88.42 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 112.912 0.708 . . . . 30.29 112.912 178.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -58.57 -42.51 88.11 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 124.235 1.014 . . . . 35.56 110.275 178.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 14.6 tpp180 -76.83 -20.72 56.02 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 114.49 1.293 . . . . 48.03 114.49 -174.446 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 95.3 mt -77.87 -29.83 50.58 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.116 0.484 . . . . 36.19 110.538 177.828 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.264 -3.112 0 O-C-N 120.22 -1.55 . . . . 37.26 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 22' ' ' SER . . . . . . . . . . . . . 92.7 p . . . . . 0 N--CA 1.482 1.135 0 N-CA-C 108.07 -1.085 . . . . 28.32 108.07 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 23' ' ' SER . . . . . . . . . . . . . 66.1 m -109.96 149.5 29.85 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 109.388 -0.597 . . . . 25.91 109.388 179.44 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -70.97 152.64 94.94 Favored Pre-proline 0 N--CA 1.475 0.788 0 N-CA-C 109.985 -0.376 . . . . 30.11 109.985 -178.353 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 25' ' ' PRO . . . . . 0.429 ' HG3' ' H5 ' ' C' ' 303' ' ' BOG . 88.6 Cg_exo -48.97 -42.09 38.72 Favored 'Trans proline' 0 CA--C 1.548 1.202 0 C-N-CA 123.004 2.469 . . . . 26.02 115.975 179.319 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 89.4 mt -66.66 -29.88 70.01 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 113.876 1.065 . . . . 22.85 113.876 177.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 27' ' ' VAL . . . . . . . . . . . . . 91.1 t -76.46 -39.82 33.88 Favored 'Isoleucine or valine' 0 C--O 1.252 1.212 0 CA-C-O 121.79 0.805 . . . . 21.61 109.634 -179.926 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 28' ' ' VAL . . . . . . . . . . . . . 60.8 t -61.98 -47.51 92.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 115.897 -0.592 . . . . 21.74 110.576 172.344 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.45 -44.82 80.85 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 112.312 0.486 . . . . 22.22 112.312 176.26 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.28 -34.99 78.56 Favored 'General case' 0 CA--C 1.51 -0.58 0 O-C-N 122.06 -0.4 . . . . 23.54 110.423 -177.786 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 31' ' ' SER . . . . . . . . . . . . . 67.8 m -69.68 -40.39 76.42 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 123.441 0.463 . . . . 22.05 110.37 179.349 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 91.1 mt -62.46 -41.47 91.99 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 CA-C-O 121.346 0.593 . . . . 23.02 109.552 176.069 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 33' ' ' MSE . . . . . . . . . . . . . 84.4 mmm -66.94 -35.7 80.57 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 113.115 0.783 . . . . 35.71 113.115 178.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.97 -42.08 98.39 Favored Glycine 0 N--CA 1.471 1.006 0 N-CA-C 110.218 -1.153 . . . . 23.39 110.218 174.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 35' ' ' ILE . . . . . 0.444 HG12 ' HE3' ' B' ' 33' ' ' MSE . 76.4 mt -64.84 -44.24 96.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 O-C-N 122.589 -0.359 . . . . 25.06 110.374 177.036 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 53.4 tp -53.86 -49.72 67.85 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.996 -0.44 . . . . 21.05 111.526 174.552 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 37' ' ' HIS . . . . . 0.408 ' NE2' H1'1 ' B' ' 301' ' ' BOG . 63.6 t60 -54.09 -48.94 70.15 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.305 0.642 . . . . 29.23 112.14 177.295 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 49.1 tp -55.32 -48.1 74.65 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.697 0.629 . . . . 21.95 112.697 174.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 39' ' ' ILE . . . . . . . . . . . . . 46.1 mt -65.37 -41.98 92.51 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 CA-C-O 121.186 0.517 . . . . 20.76 112.001 -178.679 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 40' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.9 -44.53 91.24 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.362 0.875 . . . . 20.64 113.362 174.965 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 41' ' ' TRP . . . . . . . . . . . . . 91.0 t90 -60.01 -44.1 94.81 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 112.861 0.689 . . . . 28.53 112.861 175.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 42' ' ' ILE . . . . . . . . . . . . . 61.4 mt -62.96 -49.48 83.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 CA-C-N 116.867 -0.151 . . . . 25.18 110.997 177.756 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 81.8 mt -62.71 -38.58 91.02 Favored 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 111.916 0.339 . . . . 24.84 111.916 -179.809 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 44' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -53.17 -43.81 67.36 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 117.69 0.223 . . . . 31.98 111.267 174.398 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 52.4 mtp85 -75.16 -23.49 57.76 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 114.382 1.252 . . . . 34.19 114.382 -177.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 46' ' ' LEU . . . . . . . . . . . . . 55.4 mt -70.2 -26.42 63.87 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 113.117 0.784 . . . . 32.87 113.117 178.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 47' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.262 -3.197 0 O-C-N 121.007 -1.058 . . . . 32.91 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 22' ' ' SER . . . . . . . . . . . . . 98.3 p . . . . . 0 N--CA 1.481 1.08 0 N-CA-C 110.247 -0.279 . . . . 30.58 110.247 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 23' ' ' SER . . . . . . . . . . . . . 73.3 m -74.75 141.86 44.38 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 114.284 1.216 . . . . 28.48 114.284 -170.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -56.5 139.06 75.47 Favored Pre-proline 0 CA--C 1.545 0.771 0 CA-C-N 114.645 -1.161 . . . . 32.61 109.754 173.999 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 25' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_endo -52.92 -30.09 46.56 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 N-CA-C 114.918 1.084 . . . . 27.57 114.918 178.309 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 63.3 mt -72.31 -34.09 67.85 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 117.654 0.207 . . . . 25.2 110.743 -179.285 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 27' ' ' VAL . . . . . . . . . . . . . 61.7 t -70.47 -43.51 77.95 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 CA-C-N 116.386 -0.37 . . . . 24.06 110.297 177.619 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 28' ' ' VAL . . . . . . . . . . . . . 87.7 t -57.76 -44.52 86.1 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 N-CA-C 109.133 -0.691 . . . . 23.17 109.133 175.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.39 -47.56 72.94 Favored 'General case' 0 CA--C 1.506 -0.727 0 O-C-N 122.339 -0.226 . . . . 23.36 110.499 -176.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.94 -30.42 70.9 Favored 'General case' 0 CA--C 1.551 0.991 0 N-CA-C 113.025 0.75 . . . . 23.15 113.025 177.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 31' ' ' SER . . . . . . . . . . . . . 49.1 m -68.3 -43.88 76.68 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 112.425 0.528 . . . . 24.67 112.425 176.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 32' ' ' ILE . . . . . 0.466 ' O ' HD12 ' D' ' 36' ' ' LEU . 71.0 mt -59.65 -44.73 94.14 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 CA-C-N 116.435 -0.348 . . . . 26.43 110.352 177.734 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 33' ' ' MSE . . . . . 0.482 ' HE2' H3'2 ' A' ' 302' ' ' BOG . 16.2 mmt -59.99 -41.5 92.17 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 112.567 0.58 . . . . 45.36 112.567 173.169 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 34' ' ' GLY . . . . . . . . . . . . . . . -73.2 -31.92 60.92 Favored Glycine 0 N--CA 1.466 0.684 0 O-C-N 122.125 -0.36 . . . . 32.96 112.656 -176.648 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 35' ' ' ILE . . . . . . . . . . . . . 45.8 mt -58.98 -59.08 4.28 Favored 'Isoleucine or valine' 0 C--O 1.241 0.629 0 C-N-CA 123.254 0.622 . . . . 32.68 110.156 171.093 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 36' ' ' LEU . . . . . 0.466 HD12 ' O ' ' D' ' 32' ' ' ILE . 1.9 mp -46.95 -57.32 5.09 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-O 121.108 0.48 . . . . 36.51 112.183 172.73 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 37' ' ' HIS . . . . . 0.417 ' CE1' ' H5 ' ' A' ' 302' ' ' BOG . 63.0 t60 -51.76 -45.07 63.57 Favored 'General case' 0 CA--C 1.555 1.168 0 N-CA-C 116.0 1.852 . . . . 36.14 116.0 -178.874 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 81.9 mt -76.66 -26.31 54.68 Favored 'General case' 0 C--O 1.243 0.743 0 CA-C-O 120.724 0.297 . . . . 32.1 111.773 -179.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 39' ' ' ILE . . . . . . . . . . . . . 32.4 mt -61.47 -48.69 87.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 C-N-CA 120.424 -0.51 . . . . 32.07 110.391 170.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 40' ' ' LEU . . . . . . . . . . . . . 41.0 mt -65.01 -37.48 87.79 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 112.042 0.386 . . . . 31.86 112.042 177.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 41' ' ' TRP . . . . . . . . . . . . . 83.0 t90 -61.15 -55.48 31.84 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 110.069 -0.345 . . . . 35.08 110.069 178.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 42' ' ' ILE . . . . . . . . . . . . . 47.3 mt -55.45 -42.71 68.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 N-CA-C 112.303 0.482 . . . . 35.15 112.303 179.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 11.5 mt -58.29 -44.13 88.37 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 112.669 0.618 . . . . 36.67 112.669 176.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 44' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -59.52 -39.23 83.21 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.617 0.767 . . . . 41.99 111.638 174.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 45' ' ' ARG . . . . . . . . . . . . . 47.0 tpt85 -70.53 -18.64 62.94 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 113.727 1.01 . . . . 36.61 113.727 -173.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 46' ' ' LEU . . . . . . . . . . . . . 54.9 mt -73.51 -27.54 61.42 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 112.142 0.423 . . . . 36.9 112.142 -178.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 47' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.26 -3.308 1 O-C-N 113.161 -5.962 . . . . 38.36 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 22' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 N--CA 1.496 1.833 0 CA-C-O 120.363 0.125 . . . . 38.5 111.211 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 23' ' ' SER . . . . . . . . . . . . . 18.5 m -128.26 150.48 50.03 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 105.385 -2.08 . . . . 33.1 105.385 157.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 24' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -67.87 142.03 95.19 Favored Pre-proline 0 N--CA 1.469 0.523 0 CA-C-O 119.507 -0.282 . . . . 34.67 110.649 178.36 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 25' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo -41.63 -46.42 6.26 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.856 2.37 . . . . 29.13 113.563 178.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 26' ' ' LEU . . . . . . . . . . . . . 11.4 tp -61.27 -39.04 88.91 Favored 'General case' 0 C--O 1.251 1.132 0 C-N-CA 125.184 1.394 . . . . 31.71 113.274 -178.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 27' ' ' VAL . . . . . . . . . . . . . 66.0 t -70.73 -43.21 77.52 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 CA-C-N 115.604 -0.725 . . . . 25.95 111.69 175.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 28' ' ' VAL . . . . . . . . . . . . . 48.0 t -55.46 -44.3 75.49 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 CA-C-O 120.52 0.2 . . . . 24.3 111.498 168.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.48 -43.89 88.79 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 112.478 0.547 . . . . 25.36 112.478 -178.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.16 -36.48 77.65 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 112.323 0.49 . . . . 24.62 112.323 174.518 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 31' ' ' SER . . . . . . . . . . . . . 50.4 m -68.52 -39.56 81.13 Favored 'General case' 0 C--N 1.33 -0.261 0 O-C-N 122.209 -0.307 . . . . 24.27 111.687 178.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 32' ' ' ILE . . . . . . . . . . . . . 55.0 mt -65.45 -43.12 94.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 120.545 -0.462 . . . . 24.18 110.799 178.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 33' ' ' MSE . . . . . . . . . . . . . 22.9 ttp -52.82 -46.97 67.95 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.402 0.681 . . . . 30.85 110.832 172.673 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.66 -47.39 91.45 Favored Glycine 0 N--CA 1.466 0.685 0 N-CA-C 111.702 -0.559 . . . . 25.19 111.702 -179.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 35' ' ' ILE . . . . . . . . . . . . . 68.9 mt -62.29 -46.18 97.03 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 N-CA-C 112.244 0.461 . . . . 24.78 112.244 177.763 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 36' ' ' LEU . . . . . . . . . . . . . 38.0 tp -55.88 -44.9 78.6 Favored 'General case' 0 C--O 1.246 0.882 0 N-CA-C 112.976 0.732 . . . . 24.82 112.976 170.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 37' ' ' HIS . . . . . . . . . . . . . 18.6 t-160 -52.87 -50.77 63.17 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 116.273 -0.421 . . . . 33.48 111.108 175.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 38' ' ' LEU . . . . . . . . . . . . . 59.2 tp -59.62 -44.31 93.5 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 113.706 1.002 . . . . 29.52 113.706 175.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 39' ' ' ILE . . . . . . . . . . . . . 85.8 mt -58.2 -48.67 84.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 CA-C-O 121.264 0.554 . . . . 27.26 110.213 178.688 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 40' ' ' LEU . . . . . . . . . . . . . 75.4 mt -61.61 -40.5 95.06 Favored 'General case' 0 C--O 1.221 -0.417 0 N-CA-C 112.678 0.621 . . . . 28.92 112.678 -178.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 41' ' ' TRP . . . . . . . . . . . . . 88.8 t90 -64.13 -47.86 78.3 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 110.069 -0.345 . . . . 37.48 110.069 179.007 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 42' ' ' ILE . . . . . . . . . . . . . 95.6 mt -55.38 -48.2 77.18 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 O-C-N 123.423 0.452 . . . . 34.55 111.155 176.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 43' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.65 -42.49 92.9 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.238 -0.437 . . . . 37.43 111.987 178.013 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 44' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -59.09 -44.92 91.97 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 120.689 -0.405 . . . . 44.35 111.703 178.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 45' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -71.51 -28.79 64.15 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 114.511 1.3 . . . . 53.15 114.511 -177.472 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 46' ' ' LEU . . . . . . . . . . . . . 74.1 mt -73.78 -20.19 60.55 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 121.14 -0.224 . . . . 43.23 110.494 176.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 47' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.268 -2.966 0 O-C-N 116.72 -3.737 . . . . 42.58 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 22' ' ' SER . . . . . . . . . . . . . 60.1 p . . . . . 0 N--CA 1.488 1.46 0 CA-C-O 120.875 0.369 . . . . 35.91 110.389 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 23' ' ' SER . . . . . . . . . . . . . 72.8 m -77.32 146.84 36.53 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.628 0.603 . . . . 32.91 112.628 -176.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 24' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -61.55 137.38 94.81 Favored Pre-proline 0 N--CA 1.476 0.866 0 C-N-CA 123.115 0.566 . . . . 32.8 111.06 171.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 25' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_exo -42.31 -42.64 7.74 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 124.111 3.208 . . . . 29.77 113.084 174.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 26' ' ' LEU . . . . . . . . . . . . . 1.4 tp -62.38 -40.46 96.55 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 123.057 0.543 . . . . 30.48 112.438 179.993 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 27' ' ' VAL . . . . . . . . . . . . . 82.4 t -67.93 -49.6 67.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.594 -0.73 . . . . 26.87 111.12 174.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 28' ' ' VAL . . . . . . . . . . . . . 29.8 t -48.63 -52.94 7.83 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 122.518 0.327 . . . . 26.95 110.837 171.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 29' ' ' ALA . . . . . 0.499 ' O ' ' HG3' ' F' ' 33' ' ' MSE . . . -56.73 -44.31 81.54 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 113.676 0.991 . . . . 25.93 113.676 178.513 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 30' ' ' ALA . . . . . . . . . . . . . . . -65.74 -35.45 80.75 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 113.351 0.871 . . . . 25.0 113.351 177.36 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 31' ' ' SER . . . . . . . . . . . . . 50.8 m -67.79 -42.79 81.1 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 121.233 -0.187 . . . . 25.59 111.44 176.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 32' ' ' ILE . . . . . . . . . . . . . 74.5 mt -58.58 -48.55 85.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 121.11 -0.236 . . . . 29.46 110.616 175.184 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 33' ' ' MSE . . . . . 0.534 ' HE1' HG12 ' G' ' 35' ' ' ILE . 10.6 ttm -50.51 -44.68 56.21 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 113.063 0.764 . . . . 37.76 113.063 173.039 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.98 -45.1 94.87 Favored Glycine 0 N--CA 1.466 0.667 0 C-N-CA 121.43 -0.414 . . . . 30.13 112.322 178.38 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 35' ' ' ILE . . . . . . . . . . . . . 98.2 mt -63.6 -44.95 98.76 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 0 C-N-CA 122.818 0.447 . . . . 27.79 111.221 -179.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 36' ' ' LEU . . . . . 0.506 HD23 H6'1 ' G' ' 701' ' ' BOG . 47.0 tp -62.2 -40.72 97.01 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 121.141 -0.224 . . . . 30.35 111.546 177.586 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 37' ' ' HIS . . . . . . . . . . . . . 16.4 t-80 -61.22 -45.24 95.38 Favored 'General case' 0 C--O 1.243 0.729 0 O-C-N 123.393 0.433 . . . . 35.67 110.979 -178.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 38' ' ' LEU . . . . . . . . . . . . . 31.5 tp -57.77 -45.57 85.76 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 120.666 -0.414 . . . . 25.95 111.932 175.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 39' ' ' ILE . . . . . . . . . . . . . 96.4 mt -63.29 -39.57 85.78 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 CA-C-N 116.44 -0.345 . . . . 25.05 111.824 -179.496 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 40' ' ' LEU . . . . . . . . . . . . . 48.4 mt -67.04 -43.48 82.64 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 120.791 0.329 . . . . 24.19 111.177 178.205 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 41' ' ' TRP . . . . . . . . . . . . . 89.9 t90 -59.33 -43.9 92.68 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.832 -0.622 . . . . 32.34 111.98 176.156 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 42' ' ' ILE . . . . . . . . . . . . . 84.2 mt -62.97 -48.01 90.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 109.994 -0.373 . . . . 25.39 109.994 177.8 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 43' ' ' LEU . . . . . . . . . . . . . 86.5 mt -60.62 -41.24 94.43 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 123.427 0.455 . . . . 26.59 110.302 -178.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 44' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -61.76 -42.86 99.52 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 112.425 0.528 . . . . 32.39 112.425 177.485 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 45' ' ' ARG . . . . . . . . . . . . . 12.1 mmt180 -63.74 -33.57 75.94 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 114.114 1.153 . . . . 43.22 114.114 178.567 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 46' ' ' LEU . . . . . . . . . . . . . 78.6 mt -68.66 -4.87 17.19 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.599 0.238 . . . . 33.65 110.811 -179.166 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 47' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.266 -3.06 2 O-C-N 109.996 -7.94 . . . . 35.52 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 22' ' ' SER . . . . . . . . . . . . . 1.1 p . . . . . 0 N--CA 1.486 1.369 0 N-CA-C 109.382 -0.599 . . . . 34.15 109.382 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' G' G ' 23' ' ' SER . . . . . . . . . . . . . 48.8 m -63.14 144.28 57.05 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 123.575 0.547 . . . . 29.42 111.918 -170.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 24' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -64.52 151.84 90.75 Favored Pre-proline 0 CA--C 1.534 0.328 0 N-CA-C 108.898 -0.778 . . . . 31.79 108.898 179.298 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 25' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -51.06 -41.59 56.4 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 122.042 1.828 . . . . 25.47 115.119 174.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 26' ' ' LEU . . . . . . . . . . . . . 69.4 mt -65.81 -32.58 74.19 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 112.759 0.652 . . . . 23.33 112.759 179.607 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 27' ' ' VAL . . . . . . . . . . . . . 59.5 t -70.01 -46.34 73.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 CA-C-N 115.767 -0.651 . . . . 23.26 110.087 177.107 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 28' ' ' VAL . . . . . . . . . . . . . 90.4 t -58.44 -46.56 89.47 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 CA-C-N 116.861 -0.154 . . . . 22.46 110.691 173.75 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.73 -42.5 88.9 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 113.967 1.099 . . . . 22.63 113.967 178.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.18 -35.21 79.18 Favored 'General case' 0 CA--C 1.506 -0.716 0 C-N-CA 120.938 -0.305 . . . . 23.89 110.362 -179.297 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 31' ' ' SER . . . . . . . . . . . . . 75.0 m -68.63 -40.46 80.3 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 123.746 0.654 . . . . 25.25 111.011 -179.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 32' ' ' ILE . . . . . . . . . . . . . 83.6 mt -64.79 -43.22 96.47 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.003 0 CA-C-N 116.398 -0.365 . . . . 22.34 110.537 175.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 33' ' ' MSE . . . . . 0.444 ' HE1' HG13 ' H' ' 39' ' ' ILE . 88.5 mtp -66.43 -32.06 73.2 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 113.129 0.788 . . . . 31.84 113.129 179.518 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 34' ' ' GLY . . . . . . . . . . . . . . . -65.16 -44.56 93.8 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 111.537 -0.625 . . . . 23.53 111.537 172.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 35' ' ' ILE . . . . . 0.534 HG12 ' HE1' ' F' ' 33' ' ' MSE . 97.5 mt -61.96 -41.59 91.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 O-C-N 122.282 -0.54 . . . . 23.89 112.419 172.376 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 36' ' ' LEU . . . . . . . . . . . . . 39.8 tp -59.87 -44.72 94.0 Favored 'General case' 0 N--CA 1.45 -0.452 0 O-C-N 121.861 -0.524 . . . . 22.05 110.767 176.464 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 37' ' ' HIS . . . . . . . . . . . . . 77.1 t60 -58.22 -45.36 87.81 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.157 0.799 . . . . 28.85 113.157 177.417 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 38' ' ' LEU . . . . . . . . . . . . . 13.1 tp -59.62 -47.1 86.91 Favored 'General case' 0 C--O 1.222 -0.394 0 C-N-CA 120.107 -0.637 . . . . 22.09 110.043 179.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 39' ' ' ILE . . . . . . . . . . . . . 59.2 mt -65.11 -39.11 84.49 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 N-CA-C 113.318 0.858 . . . . 23.17 113.318 178.391 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 40' ' ' LEU . . . . . . . . . . . . . 79.0 mt -65.95 -36.7 84.07 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 119.385 -0.926 . . . . 19.95 111.635 175.706 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 41' ' ' TRP . . . . . 0.615 ' CD1' ' H3 ' ' G' ' 701' ' ' BOG . 81.8 t90 -61.32 -46.0 92.08 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 112.498 0.555 . . . . 28.09 112.498 175.081 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 42' ' ' ILE . . . . . . . . . . . . . 95.6 mt -62.4 -51.81 67.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-N 116.607 -0.27 . . . . 23.99 111.344 177.409 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 43' ' ' LEU . . . . . . . . . . . . . 84.2 mt -60.65 -38.26 84.23 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 112.204 0.446 . . . . 25.83 112.204 -179.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 44' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -53.06 -43.23 66.53 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 122.781 0.432 . . . . 31.24 111.772 172.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 45' ' ' ARG . . . . . . . . . . . . . 63.0 mtp85 -74.84 -27.76 60.41 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 113.704 1.002 . . . . 33.62 113.704 -178.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 46' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.74 -40.18 96.1 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 116.134 -0.484 . . . . 31.61 112.112 176.084 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 47' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.268 -2.967 0 O-C-N 126.342 2.276 . . . . 33.03 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 22' ' ' SER . . . . . . . . . . . . . 13.6 p . . . . . 0 N--CA 1.495 1.785 0 N-CA-C 109.265 -0.643 . . . . 36.06 109.265 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 23' ' ' SER . . . . . . . . . . . . . 70.3 m -67.64 149.66 49.77 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 112.935 0.717 . . . . 30.6 112.935 -174.247 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 24' ' ' ASP . . . . . 0.401 ' HB3' HG23 ' H' ' 27' ' ' VAL . 11.4 t70 -62.27 136.28 95.5 Favored Pre-proline 0 N--CA 1.471 0.596 0 N-CA-C 107.92 -1.141 . . . . 31.95 107.92 172.97 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 25' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -58.38 -26.27 76.77 Favored 'Trans proline' 0 CA--C 1.543 0.949 0 N-CA-C 115.262 1.216 . . . . 27.71 115.262 -178.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 26' ' ' LEU . . . . . . . . . . . . . 41.3 mt -66.74 -31.31 71.87 Favored 'General case' 0 C--O 1.243 0.763 0 CA-C-O 121.684 0.754 . . . . 26.01 112.381 172.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 27' ' ' VAL . . . . . 0.401 HG23 ' HB3' ' H' ' 24' ' ' ASP . 93.6 t -76.77 -42.02 33.38 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 CA-C-N 115.131 -0.94 . . . . 25.44 110.232 -177.538 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 28' ' ' VAL . . . . . . . . . . . . . 67.2 t -59.48 -44.13 92.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 C-N-CA 122.523 0.329 . . . . 23.35 111.409 173.489 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.19 -48.09 71.81 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 122.725 0.41 . . . . 23.23 111.279 -178.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.28 -41.23 88.42 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 112.369 0.507 . . . . 23.31 112.369 173.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 31' ' ' SER . . . . . . . . . . . . . 49.1 m -60.38 -40.56 91.3 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.947 0.721 . . . . 24.7 112.947 177.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 32' ' ' ILE . . . . . . . . . . . . . 91.3 mt -64.24 -40.82 90.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 O-C-N 121.873 -0.517 . . . . 25.37 111.42 177.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 33' ' ' MSE . . . . . . . . . . . . . 48.1 mtt -63.88 -41.29 97.77 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 122.766 0.426 . . . . 31.0 111.824 174.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.93 -41.35 98.72 Favored Glycine 0 N--CA 1.466 0.657 0 N-CA-C 111.086 -0.805 . . . . 28.33 111.086 179.402 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 35' ' ' ILE . . . . . . . . . . . . . 98.2 mt -59.23 -55.85 20.9 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.954 0 C-N-CA 123.463 0.705 . . . . 28.21 112.445 176.186 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 36' ' ' LEU . . . . . . . . . . . . . 30.8 tp -51.77 -48.36 63.79 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 112.333 0.494 . . . . 31.41 112.333 172.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 37' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -56.97 -48.11 79.15 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 113.47 0.915 . . . . 34.32 113.47 177.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 38' ' ' LEU . . . . . . . . . . . . . 61.9 mt -69.65 -34.26 73.76 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 116.273 -0.422 . . . . 30.07 111.755 -177.128 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 39' ' ' ILE . . . . . 0.444 HG13 ' HE1' ' G' ' 33' ' ' MSE . 43.6 mt -58.84 -47.9 87.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 N-CA-C 112.243 0.46 . . . . 29.21 112.243 172.347 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 40' ' ' LEU . . . . . . . . . . . . . 67.2 mt -63.99 -37.84 88.9 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.792 -0.185 . . . . 31.36 110.827 177.494 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 41' ' ' TRP . . . . . . . . . . . . . 86.1 t90 -62.45 -45.92 90.86 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 123.552 0.533 . . . . 32.34 110.713 179.654 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 42' ' ' ILE . . . . . . . . . . . . . 51.2 mt -64.54 -46.17 93.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 C-N-CA 123.264 0.626 . . . . 32.94 112.347 -179.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 43' ' ' LEU . . . . . . . . . . . . . 80.9 mt -55.51 -45.69 77.09 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.908 0.385 . . . . 36.58 111.887 177.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 44' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -62.48 -36.68 83.25 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 112.871 0.693 . . . . 40.91 112.871 176.695 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 45' ' ' ARG . . . . . . . . . . . . . 49.3 tpt85 -73.53 -17.34 61.22 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 112.627 0.603 . . . . 35.4 112.627 -176.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.15 -42.32 93.9 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 113.0 0.741 . . . . 38.04 113.0 179.779 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 47' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.262 -3.219 0 O-C-N 120.985 -1.072 . . . . 36.68 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' BOG . . . . . 0.58 ' O2 ' ' CE1' ' A' ' 37' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 401' ' ' PEG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 803' ' ' PEG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 301' ' ' BOG . . . . . 0.408 H1'1 ' NE2' ' C' ' 37' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 402' ' ' PEG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 403' ' ' PEG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 303' ' ' BOG . . . . . 0.429 ' H5 ' ' HG3' ' C' ' 25' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 501' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 702' ' ' BOG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 801' ' ' PEG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 802' ' ' PEG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' G' G ' 701' ' ' BOG . . . . . 0.615 ' H3 ' ' CD1' ' G' ' 41' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 703' ' ' BOG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 804' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 805' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 806' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 807' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 808' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 809' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 48' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 49' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 50' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 51' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 52' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 53' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 54' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 803' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 804' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 805' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 806' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 807' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 808' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 48' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 49' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 50' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' G' G ' 704' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' G' G ' 705' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' G' G ' 706' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' G' G ' 707' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 48' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 49' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 50' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 51' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 52' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_