data_2ey5_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 2ey5 _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 ' 7' ' ' LEU . . . . . . . . . . . . . 26.1 mt . . . . . 0 N--CA 1.463 0.202 0 CA-C-O 121.388 0.613 . . . . 71.180000000000007 110.368 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 17.6 p-80 -137.39 147.6 45.58 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 123.874 1.797 . . . . 100.13 110.738 177.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 17.1 mttt -81.66 140.43 34.38 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.049 -1.432 . . . . 86.900000000000006 111.307 174.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' GLU . . . . . 0.435 ' OE2' ' OH ' ' A' ' 27' ' ' TYR . 14.5 mt-10 -126.33 144.03 47.93 Favored Pre-proline 0 N--CA 1.444 -0.752 0 C-N-CA 126.225 1.81 . . . . 60.960000000000001 110.164 174.209 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -73.35 148.12 42.84 Favored 'Trans proline' 0 C--N 1.326 -0.626 0 O-C-N 124.243 1.654 . . . . 39.560000000000002 112.89 -178.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -151.84 165.88 33.13 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 107.917 -1.142 . . . . 37.310000000000002 107.917 179.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 25.7 m -126.95 135.65 51.19 Favored 'General case' 0 C--N 1.327 -0.404 0 O-C-N 124.293 0.996 . . . . 46.469999999999999 110.344 -179.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 47.6 tp -59.09 132.74 54.92 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 125.422 1.701 . . . . 36.829999999999998 111.223 179.207 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 79.6 mt -108.92 -54.15 5.75 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.19 0 C-N-CA 116.09 -2.244 . . . . 46.740000000000002 105.941 169.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 23.5 tttt -159.43 133.92 7.8 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 115.018 -0.992 . . . . 72.920000000000002 112.935 -179.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -76.38 136.59 39.5 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.036 -0.727 . . . . 38.280000000000001 109.036 169.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.7 mt -111.44 -39.94 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 C-N-CA 119.071 -1.052 . . . . 53.75 111.939 -176.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ASP . . . . . 0.407 ' OD1' ' OG1' ' A' ' 44' ' ' THR . 0.3 OUTLIER -154.24 178.65 9.76 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 108.528 -0.916 . . . . 90.540000000000006 108.528 -176.605 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -56.76 -35.86 69.64 Favored Glycine 0 C--O 1.222 -0.648 0 C-N-CA 118.864 -1.636 . . . . 25.960000000000001 110.461 176.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 54.1 p30 -117.86 10.74 13.3 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 118.961 -1.096 . . . . 70.159999999999997 111.546 -170.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 64.3 m -137.96 126.28 23.19 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.544 -0.462 . . . . 34.630000000000003 111.684 -177.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 27.8 m -135.67 143.7 35.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 C-N-CA 124.897 1.279 . . . . 40.939999999999998 111.335 179.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 11.9 ttmt -97.83 123.73 41.91 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 124.737 1.215 . . . . 115.66 109.065 176.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 70.5 mt -126.35 155.48 41.98 Favored 'General case' 0 C--N 1.322 -0.629 0 O-C-N 124.91 1.381 . . . . 36.950000000000003 111.738 -177.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 24.5 tpp -92.43 115.43 28.08 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 106.641 -1.614 . . . . 78.189999999999998 106.641 168.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' TYR . . . . . 0.435 ' OH ' ' OE2' ' A' ' 10' ' ' GLU . 72.1 t80 -129.69 119.9 24.27 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 118.723 -1.191 . . . . 44.259999999999998 110.386 -175.714 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 56.44 43.95 25.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 118.832 0.742 . . . . 117.5 111.204 -176.481 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 71.4 -0.4 33.44 Favored Glycine 0 N--CA 1.443 -0.899 0 N-CA-C 116.15 1.22 . . . . 58.950000000000003 116.15 179.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -115.18 138.95 23.84 Favored Pre-proline 0 C--O 1.233 0.229 0 O-C-N 120.898 -1.354 . . . . 110.66 112.072 179.845 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_exo -74.6 135.87 20.49 Favored 'Trans proline' 0 C--N 1.323 -0.794 0 N-CA-C 106.626 -2.105 . . . . 52.270000000000003 106.626 175.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 7.6 ttt -149.74 141.28 23.42 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.6 0.715 . . . . 58.890000000000001 111.45 -174.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 88.9 m -91.99 127.4 37.44 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 120.393 -1.442 . . . . 42.82 111.249 175.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -106.3 140.45 39.22 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 119.982 -0.687 . . . . 31.420000000000002 110.35 178.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 21.9 tpt85 -103.23 131.03 50.59 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 116.749 -1.596 . . . . 45.100000000000001 106.794 173.047 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 51.8 mt -73.11 121.29 19.98 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 119.839 1.2 . . . . 26.609999999999999 110.78 -177.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.3 mt -58.97 138.88 57.28 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.471 1.107 . . . . 36.960000000000001 113.475 177.592 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 59.0 mt 67.56 7.27 5.5 Favored 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 130.996 3.719 . . . . 43.439999999999998 114.009 170.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.2 m -125.99 141.81 44.56 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 C-N-CA 116.096 -2.242 . . . . 39.960000000000001 111.491 179.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -116.73 102.22 9.24 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 128.932 2.893 . . . . 157.59999999999999 110.986 174.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -92.23 143.15 27.04 Favored Pre-proline 0 N--CA 1.437 -1.091 0 C-N-CA 129.986 3.315 . . . . 56.789999999999999 111.279 178.57 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -60.77 145.83 98.34 Favored 'Trans proline' 0 C--N 1.323 -0.782 0 N-CA-C 107.564 -1.745 . . . . 54.57 107.564 174.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLU . . . . . 0.452 ' N ' ' OE2' ' A' ' 52' ' ' GLU . 10.8 tt0 -99.6 147.42 25.38 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 118.055 -0.974 . . . . 155.15000000000001 113.243 -170.339 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' THR . . . . . 0.407 ' OG1' ' OD1' ' A' ' 19' ' ' ASP . 53.1 p -95.65 -17.54 21.24 Favored 'General case' 0 CA--C 1.532 0.275 0 O-C-N 125.498 1.748 . . . . 57.280000000000001 109.132 166.037 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 4.4 mtmm -106.65 179.38 4.28 Favored 'General case' 0 C--N 1.333 -0.117 0 O-C-N 121.566 -0.709 . . . . 148.33000000000001 112.12 -178.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 77.91 120.91 0.03 OUTLIER Pre-proline 0 C--N 1.323 -0.584 0 C-N-CA 127.803 2.441 . . . . 157.91 112.548 177.999 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -69.68 -21.78 33.38 Favored 'Trans proline' 0 C--N 1.329 -0.46 0 O-C-N 122.745 0.866 . . . . 128.74000000000001 110.043 179.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.6 mmtt -79.81 50.03 1.12 Allowed 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.705 -0.622 . . . . 150.78 110.811 176.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 155.69 -96.81 0.0 OUTLIER 'General case' 0 C--N 1.305 -1.353 1 C-N-CA 138.574 6.75 . . . . 131.53999999999999 108.412 -172.445 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 134.71 -116.11 1.54 Allowed Glycine 0 CA--C 1.521 0.451 0 C-N-CA 125.776 1.655 . . . . 127.94 112.582 179.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 32.4 t -111.69 74.93 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 C-N-CA 124.283 1.033 . . . . 117.92 109.637 171.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLU . . . . . 0.452 ' OE2' ' N ' ' A' ' 43' ' ' GLU . 1.9 mt-10 -62.79 167.91 4.25 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 123.466 0.706 . . . . 55.740000000000002 112.263 -174.534 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 8.0 tttm -68.55 129.21 39.25 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.844 -0.617 . . . . 95.269999999999996 111.603 -177.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 81.36 -8.22 1.4 Allowed 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 128.567 2.747 . . . . 66.969999999999999 111.07 -178.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -48.88 -53.83 16.55 Favored Glycine 0 C--O 1.236 0.232 0 CA-C-N 115.544 -0.753 . . . . 36.590000000000003 111.578 173.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -66.04 -29.61 48.39 Favored 'Trans proline' 0 C--N 1.326 -0.645 0 CA-C-N 119.463 1.632 . . . . 41.630000000000003 112.073 -179.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 30.0 mp0 -69.39 -44.2 71.94 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 124.69 1.244 . . . . 68.870000000000005 113.459 175.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.7 -39.67 91.5 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-O 124.856 2.265 . . . . 31.390000000000001 109.325 179.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.2 t -62.43 -44.36 96.61 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-N 111.729 -2.487 . . . . 43.590000000000003 112.144 178.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.32 -32.28 69.96 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 123.026 1.393 . . . . 36.359999999999999 109.951 -178.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -66.05 -48.63 70.41 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 116.894 -1.922 . . . . 46.539999999999999 111.322 -179.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 61.8 m -59.63 -43.38 93.85 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 117.433 -3.292 . . . . 31.34 111.499 178.534 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 14.4 tttm -63.49 -44.63 93.8 Favored 'General case' 0 C--O 1.236 0.346 0 O-C-N 118.359 -2.713 . . . . 44.340000000000003 112.573 -177.316 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 14.6 mttt -65.57 -41.23 93.14 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 123.255 1.503 . . . . 127.81 108.901 -179.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 14.1 ttt -60.81 -44.89 96.29 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 112.752 -2.022 . . . . 43.229999999999997 111.326 -176.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 16.1 m -80.22 -29.68 12.48 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 116.455 -2.098 . . . . 32.009999999999998 111.98 -179.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 78.1 mt-10 -69.94 -33.19 71.79 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 118.579 -1.249 . . . . 68.920000000000002 112.863 -177.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -92.16 3.82 54.5 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 122.105 0.955 . . . . 68.150000000000006 112.558 -175.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -82.06 148.12 28.76 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 117.684 -1.606 . . . . 38.859999999999999 111.867 -178.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -77.36 -40.5 43.74 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 121.716 -0.615 . . . . 95.959999999999994 111.431 170.222 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.9 mttt -133.45 129.93 37.93 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-N 115.019 -0.992 . . . . 86.879999999999995 112.655 -179.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 23.6 mt -110.4 137.0 44.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 121.93 0.872 . . . . 44.170000000000002 110.429 170.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -131.99 144.08 50.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 116.406 -1.759 . . . . 51.960000000000001 109.773 -179.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 27.1 m -108.79 143.65 18.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 O-C-N 127.489 2.993 . . . . 54.299999999999997 108.752 175.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -129.74 106.33 8.63 Favored 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 125.109 1.364 . . . . 42.659999999999997 107.837 178.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 -74.73 153.94 38.61 Favored 'General case' 0 C--N 1.323 -0.569 0 O-C-N 124.866 1.353 . . . . 30.870000000000001 109.922 175.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -92.94 -163.36 1.04 Allowed 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 117.22 -1.372 . . . . 37.780000000000001 108.57 178.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 9.7 mtmt -87.45 -17.97 30.97 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 122.106 2.23 . . . . 96.200000000000003 114.529 -174.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -87.16 -154.78 26.88 Favored Glycine 0 N--CA 1.444 -0.783 0 C-N-CA 127.723 2.583 . . . . 29.48 112.009 -174.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.13 150.2 46.11 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-N 117.361 0.581 . . . . 83.870000000000005 109.877 178.328 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.66 -1.4 18.1 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 120.321 -1.487 . . . . 77.420000000000002 113.838 -173.797 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 94.2 m -129.87 146.41 51.59 Favored 'General case' 0 C--N 1.32 -0.681 0 C-N-CA 125.977 1.711 . . . . 96.239999999999995 110.22 176.036 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 46.5 p30 -97.24 -176.16 3.44 Favored 'General case' 0 C--O 1.241 0.609 0 C-N-CA 118.36 -1.336 . . . . 34.299999999999997 110.457 172.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.1 pttp -66.36 -15.71 63.49 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 119.139 -2.226 . . . . 94.969999999999999 113.005 -176.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -94.42 5.52 51.54 Favored 'General case' 0 CA--C 1.511 -0.53 0 CA-C-N 120.128 1.331 . . . . 43.520000000000003 110.801 -178.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 90.9 4.56 69.25 Favored Glycine 0 C--N 1.333 0.396 0 C-N-CA 117.578 -2.249 . . . . 32.659999999999997 111.838 175.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 26.8 mtm180 -86.5 137.69 32.33 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 116.448 -2.101 . . . . 49.0 113.529 179.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -59.72 143.56 46.66 Favored Glycine 0 C--O 1.241 0.537 0 CA-C-O 122.93 1.294 . . . . 25.920000000000002 113.997 168.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 88.4 mt -112.52 104.86 12.97 Favored 'General case' 0 CA--C 1.511 -0.545 0 O-C-N 121.344 -1.092 . . . . 30.280000000000001 109.364 -179.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -147.27 167.22 24.81 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 117.163 -1.815 . . . . 29.780000000000001 113.215 -170.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -92.31 126.12 37.26 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 106.068 -1.827 . . . . 35.140000000000001 106.068 167.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 11.9 mm -109.85 135.02 50.11 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-O 115.904 -1.998 . . . . 27.079999999999998 109.41 -175.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -117.98 129.37 55.56 Favored 'General case' 0 C--N 1.318 -0.766 0 O-C-N 128.481 3.613 . . . . 39.549999999999997 111.189 -173.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -115.66 114.82 25.4 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 107.134 -1.432 . . . . 26.449999999999999 107.134 176.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ASP . . . . . 0.463 ' O ' ' NZ ' ' A' ' 97' ' ' LYS . 72.9 m-20 42.09 48.1 4.03 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 125.661 1.85 . . . . 42.119999999999997 112.683 -172.251 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 87.14 -4.66 86.13 Favored Glycine 0 CA--C 1.506 -0.51 0 C-N-CA 119.609 -1.281 . . . . 28.16 113.969 173.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LYS . . . . . 0.463 ' NZ ' ' O ' ' A' ' 95' ' ' ASP . 0.3 OUTLIER -106.69 130.02 54.49 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 119.276 -0.97 . . . . 108.23999999999999 109.8 179.238 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 33.3 ttm -74.34 116.43 15.0 Favored 'General case' 0 C--N 1.33 -0.24 0 O-C-N 124.591 1.182 . . . . 28.109999999999999 110.75 -178.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 94.4 t -60.54 -37.68 75.85 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.459 0 CA-C-N 115.05 -0.977 . . . . 33.25 109.444 177.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.47 -43.02 97.37 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 117.812 -1.555 . . . . 29.960000000000001 111.033 -177.043 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' GLU . . . . . 0.441 ' OE1' ' OG ' ' A' ' 128' ' ' SER . 14.5 tm-20 -69.83 -45.13 68.5 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 118.611 -0.709 . . . . 49.460000000000001 111.942 -179.375 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -52.9 -46.2 67.91 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 122.097 0.951 . . . . 30.109999999999999 111.793 178.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 19.7 mt -58.46 -41.35 84.97 Favored 'General case' 0 C--O 1.226 -0.162 0 O-C-N 119.069 -2.269 . . . . 37.890000000000001 112.49 -179.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 39.6 t -74.46 -40.42 48.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 CA-C-O 124.064 1.887 . . . . 35.210000000000001 109.113 -175.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 49.0 tpt85 -60.12 -34.06 72.99 Favored 'General case' 0 C--O 1.235 0.298 0 O-C-N 119.465 -2.022 . . . . 41.57 111.901 177.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 70.5 mm-40 -85.08 7.33 21.97 Favored 'General case' 0 C--O 1.237 0.445 0 O-C-N 123.735 0.647 . . . . 45.390000000000001 112.583 179.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.74 30.06 76.94 Favored Glycine 0 C--N 1.332 0.353 0 C-N-CA 117.71 -2.186 . . . . 34.939999999999998 110.854 -179.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 53.0 mt -111.19 10.81 21.83 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 118.505 -1.278 . . . . 32.590000000000003 112.417 177.381 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -158.31 154.81 27.71 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 117.85 -1.071 . . . . 33.219999999999999 109.198 173.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.25 161.15 13.85 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 117.4 -1.286 . . . . 115.44 109.113 167.815 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 69.2 t -79.91 124.77 38.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 117.16 -1.4 . . . . 35.310000000000002 107.255 172.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -59.82 156.97 13.1 Favored 'General case' 0 C--N 1.312 -1.052 1 C-N-CA 131.762 4.025 . . . . 51.700000000000003 116.548 -178.834 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -62.15 131.79 50.66 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 105.854 -1.906 . . . . 136.02000000000001 105.854 170.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 87.1 t -103.05 127.96 56.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 O-C-N 120.637 -1.289 . . . . 51.909999999999997 113.029 -164.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 83.7 m-85 -106.6 107.93 19.18 Favored 'General case' 0 C--O 1.24 0.579 0 C-N-CA 119.563 -0.855 . . . . 96.469999999999999 110.969 -178.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.88 152.05 87.88 Favored Pre-proline 0 N--CA 1.47 0.574 0 C-N-CA 117.112 -1.835 . . . . 100.16 107.386 177.322 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -93.21 20.21 34.77 Favored 'Cis proline' 0 C--N 1.321 -0.885 0 C-N-CA 122.611 -1.829 . . . . 36.07 112.216 3.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 33.0 m-20 -87.73 71.03 9.67 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 118.916 -1.114 . . . . 35.340000000000003 108.281 -179.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 31.0 p30 -152.62 19.25 0.62 Allowed 'General case' 0 CA--C 1.521 -0.147 0 C-N-CA 117.892 -1.523 . . . . 66.510000000000005 111.876 -170.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 92.6 m -49.97 -48.84 52.01 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 114.957 -1.019 . . . . 47.119999999999997 113.559 179.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 33.4 m-70 -93.75 16.99 12.7 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 118.031 -2.918 . . . . 36.030000000000001 113.125 -174.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 62.8 tt0 -56.6 -43.69 80.39 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 123.769 1.747 . . . . 50.350000000000001 113.707 -174.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -68.03 -41.08 82.67 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 120.016 -1.678 . . . . 129.99000000000001 110.692 -175.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -57.47 -46.25 83.9 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 122.674 1.226 . . . . 77.689999999999998 112.146 -179.394 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 30.5 mt -69.93 -36.22 75.15 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 122.551 1.167 . . . . 46.439999999999998 112.048 178.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 3.7 mtt-85 -64.64 -32.96 74.86 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 117.106 -1.838 . . . . 57.399999999999999 110.468 -178.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.47 -46.66 89.09 Favored 'General case' 0 C--N 1.318 -0.786 0 O-C-N 126.886 2.616 . . . . 96.120000000000005 109.707 173.261 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' SER . . . . . 0.441 ' OG ' ' OE1' ' A' ' 101' ' ' GLU . 66.5 m -69.53 -33.4 72.74 Favored 'General case' 0 CA--C 1.513 -0.471 0 C-N-CA 116.113 -2.235 . . . . 33.079999999999998 108.773 179.029 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -70.89 -34.29 71.44 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 115.635 -2.426 . . . . 42.969999999999999 111.549 -175.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -65.64 -34.02 77.25 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.883 0.849 . . . . 39.020000000000003 112.13 176.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 34.9 tp60 -69.54 -51.51 34.91 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 120.576 -1.328 . . . . 44.32 109.437 178.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -53.02 -42.12 65.36 Favored 'General case' 0 C--O 1.244 0.804 0 C-N-CA 117.924 -1.51 . . . . 51.170000000000002 112.8 173.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 1.4 mttp -67.35 -42.41 83.53 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 118.758 -2.464 . . . . 117.28 110.146 177.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.63 -36.16 73.64 Favored 'General case' 0 N--CA 1.463 0.213 0 O-C-N 124.75 1.281 . . . . 100.08 108.851 178.142 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -86.84 1.45 52.39 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 119.089 -1.044 . . . . 45.880000000000003 111.042 -178.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 1.4 mttm 52.21 44.75 29.42 Favored 'General case' 0 C--N 1.33 -0.263 0 O-C-N 124.848 1.343 . . . . 87.879999999999995 113.359 177.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 42.6 mt -85.5 137.4 32.92 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 126.476 1.91 . . . . 43.460000000000001 113.86 -177.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 30.7 m120 37.47 -104.91 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 128.699 2.799 . . . . 55.770000000000003 114.783 177.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -37.16 -43.65 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.699 0 C-N-CA 126.224 1.81 . . . . 72.189999999999998 112.281 170.767 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' TRP . . . . . . . . . . . . . 60.8 m95 -89.88 7.46 37.11 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 114.57 -1.195 . . . . 60.310000000000002 113.146 -173.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.325 -0.463 0 CA-C-O 122.775 1.274 . . . . 126.04000000000001 112.19 -178.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 26.1 mt . . . . . 0 N--CA 1.463 0.202 0 CA-C-O 121.388 0.613 . . . . 71.180000000000007 110.368 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 17.6 p-80 -137.39 147.6 45.58 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 123.874 1.797 . . . . 100.13 110.738 177.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 17.1 mttt -81.66 140.43 34.38 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.049 -1.432 . . . . 86.900000000000006 111.307 174.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -126.33 144.03 47.93 Favored Pre-proline 0 N--CA 1.444 -0.752 0 C-N-CA 126.225 1.81 . . . . 60.960000000000001 110.164 174.209 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -73.35 148.12 42.84 Favored 'Trans proline' 0 C--N 1.326 -0.626 0 O-C-N 124.243 1.654 . . . . 39.560000000000002 112.89 -178.656 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -151.84 165.88 33.13 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 107.917 -1.142 . . . . 37.310000000000002 107.917 179.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 25.7 m -126.95 135.65 51.19 Favored 'General case' 0 C--N 1.327 -0.404 0 O-C-N 124.293 0.996 . . . . 46.469999999999999 110.344 -179.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 47.6 tp -59.09 132.74 54.92 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 125.422 1.701 . . . . 36.829999999999998 111.223 179.207 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 79.6 mt -108.92 -54.15 5.75 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.19 0 C-N-CA 116.09 -2.244 . . . . 46.740000000000002 105.941 169.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 23.5 tttt -159.43 133.92 7.8 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 115.018 -0.992 . . . . 72.920000000000002 112.935 -179.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ALA . . . . . 0.401 ' HB1' ' O ' ' A' ' 216' ' ' HOH . . . -76.38 136.59 39.5 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.036 -0.727 . . . . 38.280000000000001 109.036 169.856 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.7 mt -111.44 -39.94 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 C-N-CA 119.071 -1.052 . . . . 53.75 111.939 -176.809 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -154.24 178.65 9.76 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 108.528 -0.916 . . . . 90.540000000000006 108.528 -176.605 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -56.76 -35.86 69.64 Favored Glycine 0 C--O 1.222 -0.648 0 C-N-CA 118.864 -1.636 . . . . 25.960000000000001 110.461 176.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 54.1 p30 -117.86 10.74 13.3 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 118.961 -1.096 . . . . 70.159999999999997 111.546 -170.546 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 64.3 m -137.96 126.28 23.19 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.544 -0.462 . . . . 34.630000000000003 111.684 -177.367 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 27.8 m -135.67 143.7 35.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 C-N-CA 124.897 1.279 . . . . 40.939999999999998 111.335 179.289 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 11.9 ttmt -97.83 123.73 41.91 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 124.737 1.215 . . . . 115.66 109.065 176.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 70.5 mt -126.35 155.48 41.98 Favored 'General case' 0 C--N 1.322 -0.629 0 O-C-N 124.91 1.381 . . . . 36.950000000000003 111.738 -177.487 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' MET . . . . . 0.443 ' HE2' ' HB2' ' A' ' 26' ' ' MET . 24.5 tpp -92.43 115.43 28.08 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 106.641 -1.614 . . . . 78.189999999999998 106.641 168.799 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 72.1 t80 -129.69 119.9 24.27 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 118.723 -1.191 . . . . 44.259999999999998 110.386 -175.714 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' LYS . . . . . 0.647 ' NZ ' ' H ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER 56.44 43.95 25.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 118.832 0.742 . . . . 117.5 111.204 -176.481 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 71.4 -0.4 33.44 Favored Glycine 0 N--CA 1.443 -0.899 0 N-CA-C 116.15 1.22 . . . . 58.950000000000003 116.15 179.056 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -115.18 138.95 23.84 Favored Pre-proline 0 C--O 1.233 0.229 0 O-C-N 120.898 -1.354 . . . . 110.66 112.072 179.845 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_exo -74.6 135.87 20.49 Favored 'Trans proline' 0 C--N 1.323 -0.794 0 N-CA-C 106.626 -2.105 . . . . 52.270000000000003 106.626 175.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 7.6 ttt -149.74 141.28 23.42 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.6 0.715 . . . . 58.890000000000001 111.45 -174.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 88.9 m -91.99 127.4 37.44 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 120.393 -1.442 . . . . 42.82 111.249 175.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -106.3 140.45 39.22 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 119.982 -0.687 . . . . 31.420000000000002 110.35 178.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 21.9 tpt85 -103.23 131.03 50.59 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 116.749 -1.596 . . . . 45.100000000000001 106.794 173.047 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 51.8 mt -73.11 121.29 19.98 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 119.839 1.2 . . . . 26.609999999999999 110.78 -177.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.3 mt -58.97 138.88 57.28 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.471 1.107 . . . . 36.960000000000001 113.475 177.592 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' LEU . . . . . 0.697 HD23 ' O ' ' A' ' 234' ' ' HOH . 59.0 mt 67.56 7.27 5.5 Favored 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 130.996 3.719 . . . . 43.439999999999998 114.009 170.037 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.2 m -125.99 141.81 44.56 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 C-N-CA 116.096 -2.242 . . . . 39.960000000000001 111.491 179.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -116.73 102.22 9.24 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 128.932 2.893 . . . . 157.59999999999999 110.986 174.586 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -92.23 143.15 27.04 Favored Pre-proline 0 N--CA 1.437 -1.091 0 C-N-CA 129.986 3.315 . . . . 56.789999999999999 111.279 178.57 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -60.77 145.83 98.34 Favored 'Trans proline' 0 C--N 1.323 -0.782 0 N-CA-C 107.564 -1.745 . . . . 54.57 107.564 174.591 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLU . . . . . 0.596 ' HG2' ' H ' ' A' ' 45' ' ' LYS . 10.8 tt0 -99.6 147.42 25.38 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 118.055 -0.974 . . . . 155.15000000000001 113.243 -170.339 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 53.1 p -95.65 -17.54 21.24 Favored 'General case' 0 CA--C 1.532 0.275 0 O-C-N 125.498 1.748 . . . . 57.280000000000001 109.132 166.037 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LYS . . . . . 0.596 ' H ' ' HG2' ' A' ' 43' ' ' GLU . 4.4 mtmm -106.65 179.38 4.28 Favored 'General case' 0 C--N 1.333 -0.117 0 O-C-N 121.566 -0.709 . . . . 148.33000000000001 112.12 -178.31 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 77.91 120.91 0.03 OUTLIER Pre-proline 0 C--N 1.323 -0.584 0 C-N-CA 127.803 2.441 . . . . 157.91 112.548 177.999 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -69.68 -21.78 33.38 Favored 'Trans proline' 0 C--N 1.329 -0.46 0 O-C-N 122.745 0.866 . . . . 128.74000000000001 110.043 179.056 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LYS . . . . . 0.527 ' O ' ' HE3' ' A' ' 49' ' ' LYS . 12.6 mmtt -79.81 50.03 1.12 Allowed 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.705 -0.622 . . . . 150.78 110.811 176.87 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' LYS . . . . . 0.527 ' HE3' ' O ' ' A' ' 48' ' ' LYS . 0.0 OUTLIER 155.69 -96.81 0.0 OUTLIER 'General case' 0 C--N 1.305 -1.353 1 C-N-CA 138.574 6.75 . . . . 131.53999999999999 108.412 -172.445 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 50' ' ' GLY . . . . . 0.423 ' H ' ' CG ' ' A' ' 49' ' ' LYS . . . 134.71 -116.11 1.54 Allowed Glycine 0 CA--C 1.521 0.451 0 C-N-CA 125.776 1.655 . . . . 127.94 112.582 179.222 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 32.4 t -111.69 74.93 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 C-N-CA 124.283 1.033 . . . . 117.92 109.637 171.037 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -62.79 167.91 4.25 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 123.466 0.706 . . . . 55.740000000000002 112.263 -174.534 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 8.0 tttm -68.55 129.21 39.25 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.844 -0.617 . . . . 95.269999999999996 111.603 -177.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 81.36 -8.22 1.4 Allowed 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 128.567 2.747 . . . . 66.969999999999999 111.07 -178.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -48.88 -53.83 16.55 Favored Glycine 0 C--O 1.236 0.232 0 CA-C-N 115.544 -0.753 . . . . 36.590000000000003 111.578 173.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' PRO . . . . . 0.419 ' HD2' ' O ' ' A' ' 229' ' ' HOH . 31.5 Cg_exo -66.04 -29.61 48.39 Favored 'Trans proline' 0 C--N 1.326 -0.645 0 CA-C-N 119.463 1.632 . . . . 41.630000000000003 112.073 -179.245 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 30.0 mp0 -69.39 -44.2 71.94 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 124.69 1.244 . . . . 68.870000000000005 113.459 175.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.7 -39.67 91.5 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-O 124.856 2.265 . . . . 31.390000000000001 109.325 179.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.2 t -62.43 -44.36 96.61 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-N 111.729 -2.487 . . . . 43.590000000000003 112.144 178.023 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.32 -32.28 69.96 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 123.026 1.393 . . . . 36.359999999999999 109.951 -178.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -66.05 -48.63 70.41 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 116.894 -1.922 . . . . 46.539999999999999 111.322 -179.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' THR . . . . . 0.506 ' O ' HG22 ' A' ' 66' ' ' VAL . 61.8 m -59.63 -43.38 93.85 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 117.433 -3.292 . . . . 31.34 111.499 178.534 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' LYS . . . . . 0.593 ' O ' ' HG3' ' A' ' 67' ' ' GLU . 14.4 tttm -63.49 -44.63 93.8 Favored 'General case' 0 C--O 1.236 0.346 0 O-C-N 118.359 -2.713 . . . . 44.340000000000003 112.573 -177.316 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 14.6 mttt -65.57 -41.23 93.14 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 123.255 1.503 . . . . 127.81 108.901 -179.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 14.1 ttt -60.81 -44.89 96.29 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 112.752 -2.022 . . . . 43.229999999999997 111.326 -176.682 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' VAL . . . . . 0.506 HG22 ' O ' ' A' ' 62' ' ' THR . 16.1 m -80.22 -29.68 12.48 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 116.455 -2.098 . . . . 32.009999999999998 111.98 -179.149 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLU . . . . . 0.593 ' HG3' ' O ' ' A' ' 63' ' ' LYS . 78.1 mt-10 -69.94 -33.19 71.79 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 118.579 -1.249 . . . . 68.920000000000002 112.863 -177.199 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -92.16 3.82 54.5 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 122.105 0.955 . . . . 68.150000000000006 112.558 -175.645 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -82.06 148.12 28.76 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 117.684 -1.606 . . . . 38.859999999999999 111.867 -178.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LYS . . . . . 0.431 ' HZ3' ' HB2' ' A' ' 70' ' ' LYS . 0.6 OUTLIER -77.36 -40.5 43.74 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 121.716 -0.615 . . . . 95.959999999999994 111.431 170.222 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.9 mttt -133.45 129.93 37.93 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-N 115.019 -0.992 . . . . 86.879999999999995 112.655 -179.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 23.6 mt -110.4 137.0 44.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 121.93 0.872 . . . . 44.170000000000002 110.429 170.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -131.99 144.08 50.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 116.406 -1.759 . . . . 51.960000000000001 109.773 -179.474 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' VAL . . . . . 0.441 HG12 HD13 ' A' ' 92' ' ' ILE . 27.1 m -108.79 143.65 18.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 O-C-N 127.489 2.993 . . . . 54.299999999999997 108.752 175.371 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -129.74 106.33 8.63 Favored 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 125.109 1.364 . . . . 42.659999999999997 107.837 178.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 -74.73 153.94 38.61 Favored 'General case' 0 C--N 1.323 -0.569 0 O-C-N 124.866 1.353 . . . . 30.870000000000001 109.922 175.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -92.94 -163.36 1.04 Allowed 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 117.22 -1.372 . . . . 37.780000000000001 108.57 178.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 9.7 mtmt -87.45 -17.97 30.97 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 122.106 2.23 . . . . 96.200000000000003 114.529 -174.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -87.16 -154.78 26.88 Favored Glycine 0 N--CA 1.444 -0.783 0 C-N-CA 127.723 2.583 . . . . 29.48 112.009 -174.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.13 150.2 46.11 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-N 117.361 0.581 . . . . 83.870000000000005 109.877 178.328 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.66 -1.4 18.1 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 120.321 -1.487 . . . . 77.420000000000002 113.838 -173.797 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' THR . . . . . 0.419 HG22 ' O ' ' A' ' 83' ' ' ASP . 94.2 m -129.87 146.41 51.59 Favored 'General case' 0 C--N 1.32 -0.681 0 C-N-CA 125.977 1.711 . . . . 96.239999999999995 110.22 176.036 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ASP . . . . . 0.419 ' O ' HG22 ' A' ' 82' ' ' THR . 46.5 p30 -97.24 -176.16 3.44 Favored 'General case' 0 C--O 1.241 0.609 0 C-N-CA 118.36 -1.336 . . . . 34.299999999999997 110.457 172.329 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.1 pttp -66.36 -15.71 63.49 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 119.139 -2.226 . . . . 94.969999999999999 113.005 -176.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -94.42 5.52 51.54 Favored 'General case' 0 CA--C 1.511 -0.53 0 CA-C-N 120.128 1.331 . . . . 43.520000000000003 110.801 -178.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 90.9 4.56 69.25 Favored Glycine 0 C--N 1.333 0.396 0 C-N-CA 117.578 -2.249 . . . . 32.659999999999997 111.838 175.561 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 26.8 mtm180 -86.5 137.69 32.33 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 116.448 -2.101 . . . . 49.0 113.529 179.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -59.72 143.56 46.66 Favored Glycine 0 C--O 1.241 0.537 0 CA-C-O 122.93 1.294 . . . . 25.920000000000002 113.997 168.794 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 88.4 mt -112.52 104.86 12.97 Favored 'General case' 0 CA--C 1.511 -0.545 0 O-C-N 121.344 -1.092 . . . . 30.280000000000001 109.364 -179.194 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -147.27 167.22 24.81 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 117.163 -1.815 . . . . 29.780000000000001 113.215 -170.293 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -92.31 126.12 37.26 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 106.068 -1.827 . . . . 35.140000000000001 106.068 167.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ILE . . . . . 0.441 HD13 HG12 ' A' ' 74' ' ' VAL . 11.9 mm -109.85 135.02 50.11 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-O 115.904 -1.998 . . . . 27.079999999999998 109.41 -175.744 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -117.98 129.37 55.56 Favored 'General case' 0 C--N 1.318 -0.766 0 O-C-N 128.481 3.613 . . . . 39.549999999999997 111.189 -173.288 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -115.66 114.82 25.4 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 107.134 -1.432 . . . . 26.449999999999999 107.134 176.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 42.09 48.1 4.03 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 125.661 1.85 . . . . 42.119999999999997 112.683 -172.251 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 87.14 -4.66 86.13 Favored Glycine 0 CA--C 1.506 -0.51 0 C-N-CA 119.609 -1.281 . . . . 28.16 113.969 173.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LYS . . . . . 0.471 ' HE3' ' O ' ' A' ' 238' ' ' HOH . 0.3 OUTLIER -106.69 130.02 54.49 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 119.276 -0.97 . . . . 108.23999999999999 109.8 179.238 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 33.3 ttm -74.34 116.43 15.0 Favored 'General case' 0 C--N 1.33 -0.24 0 O-C-N 124.591 1.182 . . . . 28.109999999999999 110.75 -178.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 94.4 t -60.54 -37.68 75.85 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.459 0 CA-C-N 115.05 -0.977 . . . . 33.25 109.444 177.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.47 -43.02 97.37 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 117.812 -1.555 . . . . 29.960000000000001 111.033 -177.043 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 14.5 tm-20 -69.83 -45.13 68.5 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 118.611 -0.709 . . . . 49.460000000000001 111.942 -179.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -52.9 -46.2 67.91 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 122.097 0.951 . . . . 30.109999999999999 111.793 178.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 19.7 mt -58.46 -41.35 84.97 Favored 'General case' 0 C--O 1.226 -0.162 0 O-C-N 119.069 -2.269 . . . . 37.890000000000001 112.49 -179.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 39.6 t -74.46 -40.42 48.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 CA-C-O 124.064 1.887 . . . . 35.210000000000001 109.113 -175.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 49.0 tpt85 -60.12 -34.06 72.99 Favored 'General case' 0 C--O 1.235 0.298 0 O-C-N 119.465 -2.022 . . . . 41.57 111.901 177.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 70.5 mm-40 -85.08 7.33 21.97 Favored 'General case' 0 C--O 1.237 0.445 0 O-C-N 123.735 0.647 . . . . 45.390000000000001 112.583 179.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.74 30.06 76.94 Favored Glycine 0 C--N 1.332 0.353 0 C-N-CA 117.71 -2.186 . . . . 34.939999999999998 110.854 -179.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 53.0 mt -111.19 10.81 21.83 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 118.505 -1.278 . . . . 32.590000000000003 112.417 177.381 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -158.31 154.81 27.71 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 117.85 -1.071 . . . . 33.219999999999999 109.198 173.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.25 161.15 13.85 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 117.4 -1.286 . . . . 115.44 109.113 167.815 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 69.2 t -79.91 124.77 38.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 117.16 -1.4 . . . . 35.310000000000002 107.255 172.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -59.82 156.97 13.1 Favored 'General case' 0 C--N 1.312 -1.052 1 C-N-CA 131.762 4.025 . . . . 51.700000000000003 116.548 -178.834 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -62.15 131.79 50.66 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 105.854 -1.906 . . . . 136.02000000000001 105.854 170.578 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 87.1 t -103.05 127.96 56.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 O-C-N 120.637 -1.289 . . . . 51.909999999999997 113.029 -164.229 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 83.7 m-85 -106.6 107.93 19.18 Favored 'General case' 0 C--O 1.24 0.579 0 C-N-CA 119.563 -0.855 . . . . 96.469999999999999 110.969 -178.464 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' LYS . . . . . 0.603 ' HB3' ' NZ ' ' A' ' 116' ' ' LYS . 0.0 OUTLIER -63.88 152.05 87.88 Favored Pre-proline 0 N--CA 1.47 0.574 0 C-N-CA 117.112 -1.835 . . . . 100.16 107.386 177.322 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -93.21 20.21 34.77 Favored 'Cis proline' 0 C--N 1.321 -0.885 0 C-N-CA 122.611 -1.829 . . . . 36.07 112.216 3.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 33.0 m-20 -87.73 71.03 9.67 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 118.916 -1.114 . . . . 35.340000000000003 108.281 -179.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -152.62 19.25 0.62 Allowed 'General case' 0 CA--C 1.521 -0.147 0 C-N-CA 117.892 -1.523 . . . . 66.510000000000005 111.876 -170.098 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 92.6 m -49.97 -48.84 52.01 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 114.957 -1.019 . . . . 47.119999999999997 113.559 179.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 33.4 m-70 -93.75 16.99 12.7 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 118.031 -2.918 . . . . 36.030000000000001 113.125 -174.848 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 62.8 tt0 -56.6 -43.69 80.39 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 123.769 1.747 . . . . 50.350000000000001 113.707 -174.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' GLN . . . . . 0.45 ' HG2' ' O ' ' A' ' 235' ' ' HOH . 47.5 mm-40 -68.03 -41.08 82.67 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 120.016 -1.678 . . . . 129.99000000000001 110.692 -175.15 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -57.47 -46.25 83.9 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 122.674 1.226 . . . . 77.689999999999998 112.146 -179.394 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 30.5 mt -69.93 -36.22 75.15 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 122.551 1.167 . . . . 46.439999999999998 112.048 178.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 3.7 mtt-85 -64.64 -32.96 74.86 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 117.106 -1.838 . . . . 57.399999999999999 110.468 -178.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' LYS . . . . . 0.443 ' HE2' ' HB3' ' A' ' 127' ' ' LYS . 0.0 OUTLIER -61.47 -46.66 89.09 Favored 'General case' 0 C--N 1.318 -0.786 0 O-C-N 126.886 2.616 . . . . 96.120000000000005 109.707 173.261 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 66.5 m -69.53 -33.4 72.74 Favored 'General case' 0 CA--C 1.513 -0.471 0 C-N-CA 116.113 -2.235 . . . . 33.079999999999998 108.773 179.029 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' GLU . . . . . 0.522 ' O ' ' HG3' ' A' ' 133' ' ' LYS . 36.2 tt0 -70.89 -34.29 71.44 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 115.635 -2.426 . . . . 42.969999999999999 111.549 -175.886 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -65.64 -34.02 77.25 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.883 0.849 . . . . 39.020000000000003 112.13 176.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -69.54 -51.51 34.91 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 120.576 -1.328 . . . . 44.32 109.437 178.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -53.02 -42.12 65.36 Favored 'General case' 0 C--O 1.244 0.804 0 C-N-CA 117.924 -1.51 . . . . 51.170000000000002 112.8 173.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' LYS . . . . . 0.561 ' HD3' ' CH2' ' A' ' 140' ' ' TRP . 1.4 mttp -67.35 -42.41 83.53 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 118.758 -2.464 . . . . 117.28 110.146 177.959 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.63 -36.16 73.64 Favored 'General case' 0 N--CA 1.463 0.213 0 O-C-N 124.75 1.281 . . . . 100.08 108.851 178.142 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -86.84 1.45 52.39 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 119.089 -1.044 . . . . 45.880000000000003 111.042 -178.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 1.4 mttm 52.21 44.75 29.42 Favored 'General case' 0 C--N 1.33 -0.263 0 O-C-N 124.848 1.343 . . . . 87.879999999999995 113.359 177.398 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 42.6 mt -85.5 137.4 32.92 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 126.476 1.91 . . . . 43.460000000000001 113.86 -177.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 37.47 -104.91 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 128.699 2.799 . . . . 55.770000000000003 114.783 177.264 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' ILE . . . . . 0.458 HG22 ' CD2' ' A' ' 140' ' ' TRP . 0.1 OUTLIER -37.16 -43.65 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.699 0 C-N-CA 126.224 1.81 . . . . 72.189999999999998 112.281 170.767 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 140' ' ' TRP . . . . . 0.561 ' CH2' ' HD3' ' A' ' 133' ' ' LYS . 60.8 m95 -89.88 7.46 37.11 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 114.57 -1.195 . . . . 60.310000000000002 113.146 -173.498 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.325 -0.463 0 CA-C-O 122.775 1.274 . . . . 126.04000000000001 112.19 -178.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . 0.401 ' O ' ' HB1' ' A' ' 17' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 229' ' ' HOH . . . . . 0.419 ' O ' ' HD2' ' A' ' 56' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 234' ' ' HOH . . . . . 0.697 ' O ' HD23 ' A' ' 38' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 235' ' ' HOH . . . . . 0.45 ' O ' ' HG2' ' A' ' 123' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 238' ' ' HOH . . . . . 0.471 ' O ' ' HE3' ' A' ' 97' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 26.1 mt . . . . . 0 N--CA 1.463 0.202 0 CA-C-O 121.388 0.613 . . . . 71.18 110.368 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 17.6 p-80 -137.39 147.6 45.58 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 123.874 1.797 . . . . 100.13 110.738 177.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 17.1 mttt -81.66 140.43 34.38 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.049 -1.432 . . . . 86.9 111.307 174.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -126.33 144.03 47.93 Favored Pre-proline 0 N--CA 1.444 -0.752 0 C-N-CA 126.225 1.81 . . . . 60.96 110.164 174.209 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -73.35 148.12 42.84 Favored 'Trans proline' 0 C--N 1.326 -0.626 0 O-C-N 124.243 1.654 . . . . 39.56 112.89 -178.656 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -151.84 165.88 33.13 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 107.917 -1.142 . . . . 37.31 107.917 179.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 25.7 m -126.95 135.65 51.19 Favored 'General case' 0 C--N 1.327 -0.404 0 O-C-N 124.293 0.996 . . . . 46.47 110.344 -179.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 47.6 tp -59.09 132.74 54.92 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 125.422 1.701 . . . . 36.83 111.223 179.207 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 79.6 mt -108.92 -54.15 5.75 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.19 0 C-N-CA 116.09 -2.244 . . . . 46.74 105.941 169.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 23.5 tttt -159.43 133.92 7.8 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 115.018 -0.992 . . . . 72.92 112.935 -179.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.401 ' HB1' ' O ' ' A' ' 216' ' ' HOH . . . -76.38 136.59 39.5 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.036 -0.727 . . . . 38.28 109.036 169.856 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.7 mt -111.44 -39.94 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 C-N-CA 119.071 -1.052 . . . . 53.75 111.939 -176.809 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -154.24 178.65 9.76 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 108.528 -0.916 . . . . 90.54 108.528 -176.605 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -56.76 -35.86 69.64 Favored Glycine 0 C--O 1.222 -0.648 0 C-N-CA 118.864 -1.636 . . . . 25.96 110.461 176.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 54.1 p30 -117.86 10.74 13.3 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 118.961 -1.096 . . . . 70.16 111.546 -170.546 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 64.3 m -137.96 126.28 23.19 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.544 -0.462 . . . . 34.63 111.684 -177.367 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 27.8 m -135.67 143.7 35.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 C-N-CA 124.897 1.279 . . . . 40.94 111.335 179.289 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 11.9 ttmt -97.83 123.73 41.91 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 124.737 1.215 . . . . 115.66 109.065 176.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 70.5 mt -126.35 155.48 41.98 Favored 'General case' 0 C--N 1.322 -0.629 0 O-C-N 124.91 1.381 . . . . 36.95 111.738 -177.487 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' MET . . . . . 0.443 ' HE2' ' HB2' ' A' ' 26' ' ' MET . 24.5 tpp -92.43 115.43 28.08 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 106.641 -1.614 . . . . 78.19 106.641 168.799 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 72.1 t80 -129.69 119.9 24.27 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 118.723 -1.191 . . . . 44.26 110.386 -175.714 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.647 ' H ' ' NZ ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER 56.44 43.95 25.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 118.832 0.742 . . . . 117.5 111.204 -176.481 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 71.4 -0.4 33.44 Favored Glycine 0 N--CA 1.443 -0.899 0 N-CA-C 116.15 1.22 . . . . 58.95 116.15 179.056 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -115.18 138.95 23.84 Favored Pre-proline 0 C--O 1.233 0.229 0 O-C-N 120.898 -1.354 . . . . 110.66 112.072 179.845 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_exo -74.6 135.87 20.49 Favored 'Trans proline' 0 C--N 1.323 -0.794 0 N-CA-C 106.626 -2.105 . . . . 52.27 106.626 175.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 7.6 ttt -149.74 141.28 23.42 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.6 0.715 . . . . 58.89 111.45 -174.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 88.9 m -91.99 127.4 37.44 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 120.393 -1.442 . . . . 42.82 111.249 175.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -106.3 140.45 39.22 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 119.982 -0.687 . . . . 31.42 110.35 178.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 21.9 tpt85 -103.23 131.03 50.59 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 116.749 -1.596 . . . . 45.1 106.794 173.047 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 51.8 mt -73.11 121.29 19.98 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 119.839 1.2 . . . . 26.61 110.78 -177.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.3 mt -58.97 138.88 57.28 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.471 1.107 . . . . 36.96 113.475 177.592 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.697 HD23 ' O ' ' A' ' 234' ' ' HOH . 59.0 mt 67.56 7.27 5.5 Favored 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 130.996 3.719 . . . . 43.44 114.009 170.037 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.2 m -125.99 141.81 44.56 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 C-N-CA 116.096 -2.242 . . . . 39.96 111.491 179.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -116.73 102.22 9.24 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 128.932 2.893 . . . . 157.6 110.986 174.586 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -92.23 143.15 27.04 Favored Pre-proline 0 N--CA 1.437 -1.091 0 C-N-CA 129.986 3.315 . . . . 56.79 111.279 178.57 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -60.77 145.83 98.34 Favored 'Trans proline' 0 C--N 1.323 -0.782 0 N-CA-C 107.564 -1.745 . . . . 54.57 107.564 174.591 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.596 ' HG2' ' H ' ' A' ' 45' ' ' LYS . 10.8 tt0 -99.6 147.42 25.38 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 118.055 -0.974 . . . . 155.15 113.243 -170.339 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 53.1 p -95.65 -17.54 21.24 Favored 'General case' 0 CA--C 1.532 0.275 0 O-C-N 125.498 1.748 . . . . 57.28 109.132 166.037 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.596 ' H ' ' HG2' ' A' ' 43' ' ' GLU . 4.4 mtmm -106.65 179.38 4.28 Favored 'General case' 0 C--N 1.333 -0.117 0 O-C-N 121.566 -0.709 . . . . 148.33 112.12 -178.31 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 77.91 120.91 0.03 OUTLIER Pre-proline 0 C--N 1.323 -0.584 0 C-N-CA 127.803 2.441 . . . . 157.91 112.548 177.999 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -69.68 -21.78 33.38 Favored 'Trans proline' 0 C--N 1.329 -0.46 0 O-C-N 122.745 0.866 . . . . 128.74 110.043 179.056 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.527 ' O ' ' HE3' ' A' ' 49' ' ' LYS . 12.6 mmtt -79.81 50.03 1.12 Allowed 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.705 -0.622 . . . . 150.78 110.811 176.87 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.527 ' HE3' ' O ' ' A' ' 48' ' ' LYS . 0.0 OUTLIER 155.69 -96.81 0.0 OUTLIER 'General case' 0 C--N 1.305 -1.353 1 C-N-CA 138.574 6.75 . . . . 131.54 108.412 -172.445 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.423 ' H ' ' CG ' ' A' ' 49' ' ' LYS . . . 134.71 -116.11 1.54 Allowed Glycine 0 CA--C 1.521 0.451 0 C-N-CA 125.776 1.655 . . . . 127.94 112.582 179.222 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 32.4 t -111.69 74.93 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 C-N-CA 124.283 1.033 . . . . 117.92 109.637 171.037 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -62.79 167.91 4.25 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 123.466 0.706 . . . . 55.74 112.263 -174.534 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 8.0 tttm -68.55 129.21 39.25 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.844 -0.617 . . . . 95.27 111.603 -177.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 81.36 -8.22 1.4 Allowed 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 128.567 2.747 . . . . 66.97 111.07 -178.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -48.88 -53.83 16.55 Favored Glycine 0 C--O 1.236 0.232 0 CA-C-N 115.544 -0.753 . . . . 36.59 111.578 173.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.419 ' HD2' ' O ' ' A' ' 229' ' ' HOH . 31.5 Cg_exo -66.04 -29.61 48.39 Favored 'Trans proline' 0 C--N 1.326 -0.645 0 CA-C-N 119.463 1.632 . . . . 41.63 112.073 -179.245 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 30.0 mp0 -69.39 -44.2 71.94 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 124.69 1.244 . . . . 68.87 113.459 175.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.7 -39.67 91.5 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-O 124.856 2.265 . . . . 31.39 109.325 179.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.2 t -62.43 -44.36 96.61 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-N 111.729 -2.487 . . . . 43.59 112.144 178.023 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.32 -32.28 69.96 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 123.026 1.393 . . . . 36.36 109.951 -178.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -66.05 -48.63 70.41 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 116.894 -1.922 . . . . 46.54 111.322 -179.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' THR . . . . . 0.506 ' O ' HG22 ' A' ' 66' ' ' VAL . 61.8 m -59.63 -43.38 93.85 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 117.433 -3.292 . . . . 31.34 111.499 178.534 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.593 ' O ' ' HG3' ' A' ' 67' ' ' GLU . 14.4 tttm -63.49 -44.63 93.8 Favored 'General case' 0 C--O 1.236 0.346 0 O-C-N 118.359 -2.713 . . . . 44.34 112.573 -177.316 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 14.6 mttt -65.57 -41.23 93.14 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 123.255 1.503 . . . . 127.81 108.901 -179.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 14.1 ttt -60.81 -44.89 96.29 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 112.752 -2.022 . . . . 43.23 111.326 -176.682 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.506 HG22 ' O ' ' A' ' 62' ' ' THR . 16.1 m -80.22 -29.68 12.48 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 116.455 -2.098 . . . . 32.01 111.98 -179.149 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.593 ' HG3' ' O ' ' A' ' 63' ' ' LYS . 78.1 mt-10 -69.94 -33.19 71.79 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 118.579 -1.249 . . . . 68.92 112.863 -177.199 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -92.16 3.82 54.5 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 122.105 0.955 . . . . 68.15 112.558 -175.645 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -82.06 148.12 28.76 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 117.684 -1.606 . . . . 38.86 111.867 -178.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.431 ' HZ3' ' HB2' ' A' ' 70' ' ' LYS . 0.6 OUTLIER -77.36 -40.5 43.74 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 121.716 -0.615 . . . . 95.96 111.431 170.222 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.9 mttt -133.45 129.93 37.93 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-N 115.019 -0.992 . . . . 86.88 112.655 -179.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 23.6 mt -110.4 137.0 44.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 121.93 0.872 . . . . 44.17 110.429 170.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -131.99 144.08 50.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 116.406 -1.759 . . . . 51.96 109.773 -179.474 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.441 HG12 HD13 ' A' ' 92' ' ' ILE . 27.1 m -108.79 143.65 18.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 O-C-N 127.489 2.993 . . . . 54.3 108.752 175.371 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -129.74 106.33 8.63 Favored 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 125.109 1.364 . . . . 42.66 107.837 178.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 -74.73 153.94 38.61 Favored 'General case' 0 C--N 1.323 -0.569 0 O-C-N 124.866 1.353 . . . . 30.87 109.922 175.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -92.94 -163.36 1.04 Allowed 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 117.22 -1.372 . . . . 37.78 108.57 178.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 9.7 mtmt -87.45 -17.97 30.97 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 122.106 2.23 . . . . 96.2 114.529 -174.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -87.16 -154.78 26.88 Favored Glycine 0 N--CA 1.444 -0.783 0 C-N-CA 127.723 2.583 . . . . 29.48 112.009 -174.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.13 150.2 46.11 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-N 117.361 0.581 . . . . 83.87 109.877 178.328 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.66 -1.4 18.1 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 120.321 -1.487 . . . . 77.42 113.838 -173.797 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' THR . . . . . 0.419 HG22 ' O ' ' A' ' 83' ' ' ASP . 94.2 m -129.87 146.41 51.59 Favored 'General case' 0 C--N 1.32 -0.681 0 C-N-CA 125.977 1.711 . . . . 96.24 110.22 176.036 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.419 ' O ' HG22 ' A' ' 82' ' ' THR . 46.5 p30 -97.24 -176.16 3.44 Favored 'General case' 0 C--O 1.241 0.609 0 C-N-CA 118.36 -1.336 . . . . 34.3 110.457 172.329 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.1 pttp -66.36 -15.71 63.49 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 119.139 -2.226 . . . . 94.97 113.005 -176.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -94.42 5.52 51.54 Favored 'General case' 0 CA--C 1.511 -0.53 0 CA-C-N 120.128 1.331 . . . . 43.52 110.801 -178.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 90.9 4.56 69.25 Favored Glycine 0 C--N 1.333 0.396 0 C-N-CA 117.578 -2.249 . . . . 32.66 111.838 175.561 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 26.8 mtm180 -86.5 137.69 32.33 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 116.448 -2.101 . . . . 49.0 113.529 179.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -59.72 143.56 46.66 Favored Glycine 0 C--O 1.241 0.537 0 CA-C-O 122.93 1.294 . . . . 25.92 113.997 168.794 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 88.4 mt -112.52 104.86 12.97 Favored 'General case' 0 CA--C 1.511 -0.545 0 O-C-N 121.344 -1.092 . . . . 30.28 109.364 -179.194 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -147.27 167.22 24.81 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 117.163 -1.815 . . . . 29.78 113.215 -170.293 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -92.31 126.12 37.26 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 106.068 -1.827 . . . . 35.14 106.068 167.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.441 HD13 HG12 ' A' ' 74' ' ' VAL . 11.9 mm -109.85 135.02 50.11 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-O 115.904 -1.998 . . . . 27.08 109.41 -175.744 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -117.98 129.37 55.56 Favored 'General case' 0 C--N 1.318 -0.766 0 O-C-N 128.481 3.613 . . . . 39.55 111.189 -173.288 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -115.66 114.82 25.4 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 107.134 -1.432 . . . . 26.45 107.134 176.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 42.09 48.1 4.03 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 125.661 1.85 . . . . 42.12 112.683 -172.251 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 87.14 -4.66 86.13 Favored Glycine 0 CA--C 1.506 -0.51 0 C-N-CA 119.609 -1.281 . . . . 28.16 113.969 173.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.471 ' HE3' ' O ' ' A' ' 238' ' ' HOH . 0.3 OUTLIER -106.69 130.02 54.49 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 119.276 -0.97 . . . . 108.24 109.8 179.238 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 33.3 ttm -74.34 116.43 15.0 Favored 'General case' 0 C--N 1.33 -0.24 0 O-C-N 124.591 1.182 . . . . 28.11 110.75 -178.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 94.4 t -60.54 -37.68 75.85 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.459 0 CA-C-N 115.05 -0.977 . . . . 33.25 109.444 177.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.47 -43.02 97.37 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 117.812 -1.555 . . . . 29.96 111.033 -177.043 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 14.5 tm-20 -69.83 -45.13 68.5 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 118.611 -0.709 . . . . 49.46 111.942 -179.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -52.9 -46.2 67.91 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 122.097 0.951 . . . . 30.11 111.793 178.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 19.7 mt -58.46 -41.35 84.97 Favored 'General case' 0 C--O 1.226 -0.162 0 O-C-N 119.069 -2.269 . . . . 37.89 112.49 -179.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 39.6 t -74.46 -40.42 48.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 CA-C-O 124.064 1.887 . . . . 35.21 109.113 -175.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 49.0 tpt85 -60.12 -34.06 72.99 Favored 'General case' 0 C--O 1.235 0.298 0 O-C-N 119.465 -2.022 . . . . 41.57 111.901 177.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 70.5 mm-40 -85.08 7.33 21.97 Favored 'General case' 0 C--O 1.237 0.445 0 O-C-N 123.735 0.647 . . . . 45.39 112.583 179.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.74 30.06 76.94 Favored Glycine 0 C--N 1.332 0.353 0 C-N-CA 117.71 -2.186 . . . . 34.94 110.854 -179.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 53.0 mt -111.19 10.81 21.83 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 118.505 -1.278 . . . . 32.59 112.417 177.381 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -158.31 154.81 27.71 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 117.85 -1.071 . . . . 33.22 109.198 173.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.25 161.15 13.85 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 117.4 -1.286 . . . . 115.44 109.113 167.815 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 69.2 t -79.91 124.77 38.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 117.16 -1.4 . . . . 35.31 107.255 172.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -59.82 156.97 13.1 Favored 'General case' 0 C--N 1.312 -1.052 1 C-N-CA 131.762 4.025 . . . . 51.7 116.548 -178.834 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -62.15 131.79 50.66 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 105.854 -1.906 . . . . 136.02 105.854 170.578 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 87.1 t -103.05 127.96 56.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 O-C-N 120.637 -1.289 . . . . 51.91 113.029 -164.229 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 83.7 m-85 -106.6 107.93 19.18 Favored 'General case' 0 C--O 1.24 0.579 0 C-N-CA 119.563 -0.855 . . . . 96.47 110.969 -178.464 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.728 ' NZ ' HD21 ' A' ' 119' ' ' ASN . 0.0 OUTLIER -63.88 152.05 87.88 Favored Pre-proline 0 N--CA 1.47 0.574 0 C-N-CA 117.112 -1.835 . . . . 100.16 107.386 177.322 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -93.21 20.21 34.77 Favored 'Cis proline' 0 C--N 1.321 -0.885 0 C-N-CA 122.611 -1.829 . . . . 36.07 112.216 3.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 33.0 m-20 -87.73 71.03 9.67 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 118.916 -1.114 . . . . 35.34 108.281 -179.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ASN . . . . . 0.728 HD21 ' NZ ' ' A' ' 116' ' ' LYS . 31.0 p30 -152.62 19.25 0.62 Allowed 'General case' 0 CA--C 1.521 -0.147 0 C-N-CA 117.892 -1.523 . . . . 66.51 111.876 -170.098 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 92.6 m -49.97 -48.84 52.01 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 114.957 -1.019 . . . . 47.12 113.559 179.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 33.4 m-70 -93.75 16.99 12.7 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 118.031 -2.918 . . . . 36.03 113.125 -174.848 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 62.8 tt0 -56.6 -43.69 80.39 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 123.769 1.747 . . . . 50.35 113.707 -174.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.462 ' HA ' ' NE2' ' A' ' 123' ' ' GLN . 14.1 mm100 -68.03 -41.08 82.67 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 120.016 -1.678 . . . . 129.99 110.692 -175.15 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -57.47 -46.25 83.9 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 122.674 1.226 . . . . 77.69 112.146 -179.394 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 30.5 mt -69.93 -36.22 75.15 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 122.551 1.167 . . . . 46.44 112.048 178.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 3.7 mtt-85 -64.64 -32.96 74.86 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 117.106 -1.838 . . . . 57.4 110.468 -178.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' LYS . . . . . 0.443 ' HB3' ' HE2' ' A' ' 127' ' ' LYS . 0.0 OUTLIER -61.47 -46.66 89.09 Favored 'General case' 0 C--N 1.318 -0.786 0 O-C-N 126.886 2.616 . . . . 96.12 109.707 173.261 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 66.5 m -69.53 -33.4 72.74 Favored 'General case' 0 CA--C 1.513 -0.471 0 C-N-CA 116.113 -2.235 . . . . 33.08 108.773 179.029 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' GLU . . . . . 0.522 ' O ' ' HG3' ' A' ' 133' ' ' LYS . 36.2 tt0 -70.89 -34.29 71.44 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 115.635 -2.426 . . . . 42.97 111.549 -175.886 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -65.64 -34.02 77.25 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.883 0.849 . . . . 39.02 112.13 176.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' GLN . . . . . 0.42 ' NE2' ' HD2' ' A' ' 134' ' ' LYS . 34.9 tp60 -69.54 -51.51 34.91 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 120.576 -1.328 . . . . 44.32 109.437 178.576 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -53.02 -42.12 65.36 Favored 'General case' 0 C--O 1.244 0.804 0 C-N-CA 117.924 -1.51 . . . . 51.17 112.8 173.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.561 ' HD3' ' CH2' ' A' ' 140' ' ' TRP . 1.4 mttp -67.35 -42.41 83.53 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 118.758 -2.464 . . . . 117.28 110.146 177.959 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.42 ' HD2' ' NE2' ' A' ' 131' ' ' GLN . 0.0 OUTLIER -58.63 -36.16 73.64 Favored 'General case' 0 N--CA 1.463 0.213 0 O-C-N 124.75 1.281 . . . . 100.08 108.851 178.142 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -86.84 1.45 52.39 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 119.089 -1.044 . . . . 45.88 111.042 -178.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 1.4 mttm 52.21 44.75 29.42 Favored 'General case' 0 C--N 1.33 -0.263 0 O-C-N 124.848 1.343 . . . . 87.88 113.359 177.398 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 42.6 mt -85.5 137.4 32.92 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 126.476 1.91 . . . . 43.46 113.86 -177.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 30.7 m120 37.47 -104.91 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 128.699 2.799 . . . . 55.77 114.783 177.264 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' ILE . . . . . 0.458 HG22 ' CD2' ' A' ' 140' ' ' TRP . 0.1 OUTLIER -37.16 -43.65 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.699 0 C-N-CA 126.224 1.81 . . . . 72.19 112.281 170.767 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' TRP . . . . . 0.561 ' CH2' ' HD3' ' A' ' 133' ' ' LYS . 60.8 m95 -89.88 7.46 37.11 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 114.57 -1.195 . . . . 60.31 113.146 -173.498 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.325 -0.463 0 CA-C-O 122.775 1.274 . . . . 126.04 112.19 -178.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . 0.401 ' O ' ' HB1' ' A' ' 17' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 229' ' ' HOH . . . . . 0.419 ' O ' ' HD2' ' A' ' 56' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 234' ' ' HOH . . . . . 0.697 ' O ' HD23 ' A' ' 38' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 235' ' ' HOH . . . . . 0.45 ' O ' ' HG2' ' A' ' 123' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 238' ' ' HOH . . . . . 0.471 ' O ' ' HE3' ' A' ' 97' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_