data_5ht1_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 5ht1 _Structure_validation_residue.Date_analyzed 2016-10-13 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 ' 0' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.432 -1.326 0 CA-C-O 121.235 0.541 . . . . 33.53 110.794 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.68 153.22 41.29 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 122.359 1.076 . . . . 63.43 111.926 166.704 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 59.6 p -121.15 138.89 53.99 Favored 'General case' 0 N--CA 1.445 -0.707 0 N-CA-C 102.243 -3.243 . . . . 40.33 102.243 161.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -141.49 130.81 23.61 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 105.386 -2.079 . . . . 52.55 105.386 -167.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 93.5 m -109.32 126.18 53.11 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.83 -0.433 . . . . 39.58 109.83 170.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 10.7 pt -125.48 -161.45 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 C-N-CA 120.04 -0.664 . . . . 29.43 112.753 -168.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -51.98 126.93 19.79 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.0 -0.68 . . . . 47.35 109.912 179.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 96.91 3.64 59.12 Favored Glycine 0 N--CA 1.448 -0.562 0 CA-C-N 115.879 -0.601 . . . . 31.23 114.112 171.153 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 73.11 16.3 78.55 Favored Glycine 0 C--O 1.214 -1.13 0 N-CA-C 112.008 -0.437 . . . . 26.16 112.008 -170.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 90.2 t -73.71 128.39 36.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 O-C-N 121.958 -0.731 . . . . 26.7 109.419 -179.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . . . -105.29 130.07 53.5 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.713 0.768 . . . . 47.91 111.83 179.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.3 mt -108.19 118.67 56.31 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 N-CA-C 108.026 -1.102 . . . . 27.76 108.026 175.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -109.81 124.61 51.6 Favored 'General case' 0 CA--C 1.508 -0.646 0 N-CA-C 108.763 -0.828 . . . . 35.52 108.763 171.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.2 mtt-85 -87.74 118.41 27.23 Favored 'General case' 0 C--N 1.319 -0.745 0 C-N-CA 119.819 -0.752 . . . . 34.63 109.174 -177.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 71.2 mt -93.17 -53.87 3.94 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.14 -0.482 . . . . 22.9 111.14 -178.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 39.2 p -137.67 142.88 38.32 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-O 121.025 0.44 . . . . 27.84 110.818 175.78 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -73.31 153.86 50.95 Favored 'Trans proline' 0 C--O 1.22 -0.409 0 C-N-CA 122.139 1.892 . . . . 26.58 115.09 -168.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -102.84 -153.66 24.52 Favored Glycine 0 C--O 1.223 -0.582 0 N-CA-C 108.946 -1.662 . . . . 25.54 108.946 171.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -78.82 -13.2 59.94 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 119.168 -1.013 . . . . 34.17 111.769 -177.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 73.14 8.36 74.09 Favored Glycine 0 CA--C 1.521 0.426 0 CA-C-N 116.211 -0.449 . . . . 29.63 113.658 174.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -133.27 -34.19 1.09 Allowed 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 112.163 0.431 . . . . 67.66 112.163 -173.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 90.6 m -101.62 101.61 12.17 Favored 'General case' 0 C--O 1.225 -0.212 0 N-CA-C 113.187 0.81 . . . . 33.04 113.187 -177.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -115.07 145.01 33.18 Favored Pre-proline 0 C--N 1.326 -0.427 0 N-CA-C 109.353 -0.61 . . . . 28.9 109.353 -178.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -74.98 143.87 29.64 Favored 'Trans proline' 0 C--O 1.22 -0.418 0 C-N-CA 120.805 1.003 . . . . 30.09 111.867 178.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 12.6 mptt -119.87 159.27 24.95 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.402 -0.592 . . . . 47.56 109.402 173.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -35.53 129.49 0.56 Allowed 'General case' 0 CA--C 1.516 -0.343 0 O-C-N 123.633 0.583 . . . . 56.97 111.283 178.295 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 91.93 -25.47 16.63 Favored Glycine 0 N--CA 1.446 -0.696 0 CA-C-N 115.026 -0.988 . . . . 29.29 114.089 -179.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -58.61 139.65 55.58 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.1 -0.64 . . . . 36.53 110.803 -176.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.6 tp -75.3 132.53 41.07 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 107.769 -1.197 . . . . 29.85 107.769 168.002 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.0 m -125.78 139.31 51.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 O-C-N 122.144 -0.348 . . . . 32.18 110.377 176.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 59.0 m -107.92 119.89 40.73 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 107.393 -1.336 . . . . 26.2 107.393 176.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.5 mp -123.21 141.9 41.8 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.325 0 O-C-N 123.41 0.444 . . . . 26.67 111.482 -172.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -111.75 121.21 44.47 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 105.553 -2.018 . . . . 25.07 105.553 167.195 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 43.6 p90 -133.94 171.69 13.83 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 122.601 1.191 . . . . 26.45 113.862 -175.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -145.37 127.53 15.69 Favored 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 104.039 -2.578 . . . . 26.06 104.039 174.572 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -111.51 134.47 12.14 Favored Glycine 0 C--O 1.219 -0.806 0 CA-C-N 116.266 -0.424 . . . . 21.18 112.059 -179.305 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 39.5 m -132.94 157.42 45.17 Favored 'General case' 0 C--O 1.217 -0.621 0 C-N-CA 122.694 0.398 . . . . 25.92 111.037 -175.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 41.5 mt -95.45 165.32 12.41 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.17 -1.048 . . . . 27.42 108.17 173.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -58.12 -20.94 44.12 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.094 -0.642 . . . . 47.9 111.591 -176.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 27.6 p-10 -94.02 11.59 29.24 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 113.918 1.081 . . . . 35.24 113.918 -174.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 96.31 -20.85 48.47 Favored Glycine 0 N--CA 1.448 -0.554 0 CA-C-N 115.946 -0.57 . . . . 29.62 112.853 177.076 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -62.04 121.06 12.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.563 0.22 . . . . 55.79 111.405 -176.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -77.32 142.65 39.29 Favored 'General case' 0 CA--C 1.515 -0.383 0 C-N-CA 123.442 0.697 . . . . 48.97 109.157 175.693 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 8.0 p90 -136.23 1.71 2.7 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 115.214 1.561 . . . . 29.11 115.214 -172.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 44.7 t0 172.75 142.14 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 107.46 -1.311 . . . . 29.11 107.46 -175.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 29.5 t -165.21 113.17 1.0 Allowed 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.253 -0.647 . . . . 30.27 109.253 -174.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 59.5 p -76.54 -22.66 54.08 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 107.767 -1.197 . . . . 24.68 107.767 -178.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 20.8 t -64.53 -39.47 85.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.559 -0.746 . . . . 31.67 112.506 176.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -71.45 -15.58 62.34 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-O 120.891 0.377 . . . . 42.24 110.667 -178.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ARG . . . . . 0.629 ' NH2' ' O ' ' A' ' 201' ' ' HOH . 3.1 mtp180 -95.81 -14.28 23.38 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.859 -0.61 . . . . 35.27 112.065 -175.174 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 79.39 2.22 87.3 Favored Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 114.702 0.641 . . . . 35.4 114.702 174.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 92.9 p -141.69 139.19 18.11 Favored Pre-proline 0 C--O 1.222 -0.376 0 CA-C-O 121.018 0.437 . . . . 34.32 110.728 175.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_exo -71.58 168.16 24.4 Favored 'Trans proline' 0 C--N 1.328 -0.53 0 C-N-CA 123.703 2.936 . . . . 28.47 113.158 -172.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -102.57 136.18 42.86 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 114.576 -1.193 . . . . 27.34 109.659 175.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 -114.08 146.41 40.27 Favored 'General case' 0 CA--C 1.509 -0.629 0 N-CA-C 109.605 -0.517 . . . . 41.8 109.605 175.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 20.7 p -165.24 158.6 16.57 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.562 -0.455 . . . . 34.5 111.039 174.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -88.59 138.85 31.06 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 108.908 -0.775 . . . . 39.14 108.908 168.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 9.2 tp -108.65 140.3 27.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 N-CA-C 112.747 0.647 . . . . 32.8 112.747 -168.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 76.15 30.0 57.82 Favored Glycine 0 C--O 1.225 -0.443 0 CA-C-N 116.477 -0.328 . . . . 35.99 113.307 179.908 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 1.5 m -130.84 8.79 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 O-C-N 122.729 -0.277 . . . . 42.24 111.223 179.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 81.16 23.02 59.81 Favored Glycine 0 N--CA 1.451 -0.336 0 N-CA-C 115.106 0.803 . . . . 35.36 115.106 176.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -95.24 -3.7 47.13 Favored 'General case' 0 CA--C 1.509 -0.602 0 CA-C-N 117.295 0.547 . . . . 49.5 111.569 -177.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 2.7 m -142.7 173.14 7.1 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.483 0 N-CA-C 106.571 -1.64 . . . . 34.19 106.571 177.224 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.8 pt -52.85 153.39 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 C-N-CA 120.022 -0.671 . . . . 30.88 110.751 179.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.29 -36.84 71.54 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.258 -0.428 . . . . 35.64 111.475 -179.83 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -58.71 -30.31 65.57 Favored Glycine 0 N--CA 1.451 -0.359 0 CA-C-N 115.916 -0.584 . . . . 26.11 113.206 -179.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 15.4 m0 -81.43 -37.38 28.16 Favored 'General case' 0 C--O 1.215 -0.719 0 N-CA-C 112.647 0.61 . . . . 34.04 112.647 175.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -62.15 -38.65 89.81 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 119.192 -1.003 . . . . 29.22 109.302 176.031 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.5 -41.4 55.42 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.83 0.348 . . . . 23.64 111.875 178.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -85.47 -51.72 3.6 Favored Glycine 0 N--CA 1.453 -0.218 0 N-CA-C 116.41 1.324 . . . . 25.59 116.41 -169.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 33.9 mm -47.6 -43.96 52.61 Favored Pre-proline 0 N--CA 1.474 0.732 0 N-CA-C 115.802 1.778 . . . . 25.64 115.802 -179.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -67.31 -8.75 22.97 Favored 'Trans proline' 0 CA--C 1.535 0.563 0 C-N-CA 120.859 1.039 . . . . 24.06 114.415 -176.815 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 35.1 mttp -94.24 3.59 55.04 Favored 'General case' 0 C--O 1.245 0.838 0 C-N-CA 119.545 -0.862 . . . . 43.42 111.947 177.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 40.4 mt -101.86 150.86 22.74 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.567 -0.742 . . . . 24.47 111.228 176.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 4.9 p -106.31 155.65 19.29 Favored 'General case' 0 CA--C 1.499 -0.996 0 N-CA-C 107.074 -1.454 . . . . 24.86 107.074 178.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 5.3 p -56.49 129.39 18.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.558 0 CA-C-O 121.614 0.721 . . . . 24.39 111.927 -173.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 96.89 -16.0 61.69 Favored Glycine 0 C--O 1.214 -1.096 0 CA-C-N 115.481 -0.781 . . . . 20.61 111.363 -178.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 80.2 tt0 -69.03 143.13 54.39 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 113.971 1.1 . . . . 33.72 113.971 -174.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.7 tptm -118.75 130.3 55.73 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 107.339 -1.356 . . . . 33.78 107.339 178.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -150.83 154.24 36.89 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.552 -0.459 . . . . 25.37 111.721 -169.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 18.0 ttm180 -102.32 127.08 49.46 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 119.836 -0.745 . . . . 23.97 109.623 172.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 32.1 mt -104.69 122.0 44.76 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 108.141 -1.059 . . . . 24.74 108.141 172.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 58.7 m -103.96 101.4 11.19 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 107.903 -1.147 . . . . 30.61 107.903 174.317 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 19.5 mt -106.25 117.9 56.17 Favored Pre-proline 0 C--O 1.234 0.275 0 N-CA-C 111.993 0.368 . . . . 27.1 111.993 -169.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -68.86 156.19 66.21 Favored 'Trans proline' 0 N--CA 1.472 0.22 0 C-N-CA 120.94 1.094 . . . . 27.13 110.983 -179.91 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -37.9 -55.83 1.79 Allowed Glycine 0 C--O 1.224 -0.5 0 N-CA-C 117.566 1.786 . . . . 29.31 117.566 -176.275 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -58.71 -27.69 84.19 Favored 'Trans proline' 0 C--O 1.234 0.302 0 C-N-CA 121.376 1.384 . . . . 24.76 113.039 -176.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -92.36 -1.44 57.04 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 113.491 0.923 . . . . 31.45 113.491 177.233 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -114.13 -120.51 0.3 Allowed 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.233 0.613 . . . . 25.19 111.495 -179.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -90.58 1.0 57.15 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 114.561 1.319 . . . . 41.88 114.561 -177.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 81.61 -169.24 50.61 Favored Glycine 0 N--CA 1.44 -1.034 0 C-N-CA 120.543 -0.837 . . . . 32.52 113.863 165.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -72.66 -18.4 25.38 Favored 'Trans proline' 0 N--CA 1.459 -0.52 0 O-C-N 123.116 1.061 . . . . 40.5 110.843 -169.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 28.2 ttm105 -86.89 -46.17 10.16 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 123.702 0.626 . . . . 51.05 112.409 177.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 68.27 -163.06 48.96 Favored Glycine 0 C--O 1.223 -0.533 0 N-CA-C 108.404 -1.878 . . . . 40.85 108.404 -174.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' PHE . . . . . . . . . . . . . 18.2 m-30 -120.47 97.84 48.65 Favored Pre-proline 0 N--CA 1.469 0.494 0 N-CA-C 107.312 -1.366 . . . . 68.58 107.312 170.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -55.87 130.67 41.62 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.218 1.945 . . . . 31.2 112.283 -168.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 97.3 -15.7 61.86 Favored Glycine 0 CA--C 1.525 0.7 0 CA-C-O 121.698 0.61 . . . . 33.02 112.635 -175.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -125.31 -64.53 1.07 Allowed 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 108.83 -0.804 . . . . 35.94 108.83 -177.312 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 64.4 mt -117.63 112.23 39.07 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 115.859 -0.609 . . . . 27.75 111.178 176.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_exo -48.33 155.28 2.15 Favored 'Trans proline' 0 C--N 1.341 0.151 1 C-N-CA 126.958 5.105 . . . . 37.29 113.151 173.842 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -56.01 132.03 49.51 Favored 'Trans proline' 0 C--O 1.219 -0.463 0 C-N-CA 121.798 1.665 . . . . 33.86 111.673 176.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 17.6 t30 56.19 36.75 27.97 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 114.072 1.138 . . . . 33.6 114.072 172.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -81.57 139.02 35.32 Favored 'General case' 0 C--O 1.238 0.489 0 CA-C-N 115.953 -0.567 . . . . 26.96 111.855 -174.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 82.0 m -79.25 125.21 29.17 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 115.414 -0.812 . . . . 27.8 108.976 172.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 15.2 mt -105.43 136.65 44.59 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 115.967 -0.561 . . . . 23.6 111.519 -178.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 2.2 mp -108.0 119.68 58.03 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.829 0 N-CA-C 107.192 -1.41 . . . . 27.48 107.192 176.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -114.76 125.1 53.31 Favored 'General case' 0 CA--C 1.497 -1.086 0 C-N-CA 120.458 -0.497 . . . . 26.47 109.718 178.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -94.42 111.13 22.87 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 106.826 -1.546 . . . . 42.25 106.826 164.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 16.5 m -121.31 144.95 28.72 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.367 0 O-C-N 123.32 0.388 . . . . 24.95 111.649 -175.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -119.69 122.43 41.45 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 109.692 -0.485 . . . . 29.9 109.692 168.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 53.4 tp -76.62 115.72 16.64 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 106.723 -1.584 . . . . 22.8 106.723 173.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 20.7 mt -94.45 -30.69 14.31 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 120.808 0.337 . . . . 25.84 111.564 -176.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 5.9 tttt -164.8 144.66 7.25 Favored 'General case' 0 CA--C 1.511 -0.544 0 N-CA-C 112.547 0.573 . . . . 35.89 112.547 -169.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 55.0 t -122.63 131.84 72.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 CA-C-N 115.431 -0.804 . . . . 30.65 109.927 174.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 11.4 m120 . . . . . 0 N--CA 1.469 0.476 0 O-C-N 121.703 -0.623 . . . . 38.85 111.327 165.604 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . 0.629 ' O ' ' NH2' ' A' ' 49' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 build full ' A' A ' 0' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.432 -1.326 0 CA-C-O 121.235 0.541 . . . . 33.530000000000001 110.794 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.68 153.22 41.29 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 122.359 1.076 . . . . 63.43 111.926 166.704 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 59.6 p -121.15 138.89 53.99 Favored 'General case' 0 N--CA 1.445 -0.707 0 N-CA-C 102.243 -3.243 . . . . 40.329999999999998 102.243 161.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -141.49 130.81 23.61 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 105.386 -2.079 . . . . 52.549999999999997 105.386 -167.445 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 93.5 m -109.32 126.18 53.11 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.83 -0.433 . . . . 39.579999999999998 109.83 170.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 10.7 pt -125.48 -161.45 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 C-N-CA 120.04 -0.664 . . . . 29.43 112.753 -168.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -51.98 126.93 19.79 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.0 -0.68 . . . . 47.350000000000001 109.912 179.487 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 96.91 3.64 59.12 Favored Glycine 0 N--CA 1.448 -0.562 0 CA-C-N 115.879 -0.601 . . . . 31.23 114.112 171.153 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 73.11 16.3 78.55 Favored Glycine 0 C--O 1.214 -1.13 0 N-CA-C 112.008 -0.437 . . . . 26.16 112.008 -170.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 90.2 t -73.71 128.39 36.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 O-C-N 121.958 -0.731 . . . . 26.699999999999999 109.419 -179.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . . . -105.29 130.07 53.5 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.713 0.768 . . . . 47.909999999999997 111.83 179.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.3 mt -108.19 118.67 56.31 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 N-CA-C 108.026 -1.102 . . . . 27.760000000000002 108.026 175.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -109.81 124.61 51.6 Favored 'General case' 0 CA--C 1.508 -0.646 0 N-CA-C 108.763 -0.828 . . . . 35.520000000000003 108.763 171.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.2 mtt-85 -87.74 118.41 27.23 Favored 'General case' 0 C--N 1.319 -0.745 0 C-N-CA 119.819 -0.752 . . . . 34.630000000000003 109.174 -177.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 71.2 mt -93.17 -53.87 3.94 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.14 -0.482 . . . . 22.899999999999999 111.14 -178.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 39.2 p -137.67 142.88 38.32 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-O 121.025 0.44 . . . . 27.84 110.818 175.78 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -73.31 153.86 50.95 Favored 'Trans proline' 0 C--O 1.22 -0.409 0 C-N-CA 122.139 1.892 . . . . 26.579999999999998 115.09 -168.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -102.84 -153.66 24.52 Favored Glycine 0 C--O 1.223 -0.582 0 N-CA-C 108.946 -1.662 . . . . 25.539999999999999 108.946 171.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -78.82 -13.2 59.94 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 119.168 -1.013 . . . . 34.170000000000002 111.769 -177.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 73.14 8.36 74.09 Favored Glycine 0 CA--C 1.521 0.426 0 CA-C-N 116.211 -0.449 . . . . 29.629999999999999 113.658 174.936 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -133.27 -34.19 1.09 Allowed 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 112.163 0.431 . . . . 67.659999999999997 112.163 -173.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 90.6 m -101.62 101.61 12.17 Favored 'General case' 0 C--O 1.225 -0.212 0 N-CA-C 113.187 0.81 . . . . 33.039999999999999 113.187 -177.387 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -115.07 145.01 33.18 Favored Pre-proline 0 C--N 1.326 -0.427 0 N-CA-C 109.353 -0.61 . . . . 28.899999999999999 109.353 -178.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -74.98 143.87 29.64 Favored 'Trans proline' 0 C--O 1.22 -0.418 0 C-N-CA 120.805 1.003 . . . . 30.09 111.867 178.06 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 12.6 mptt -119.87 159.27 24.95 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.402 -0.592 . . . . 47.560000000000002 109.402 173.973 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -35.53 129.49 0.56 Allowed 'General case' 0 CA--C 1.516 -0.343 0 O-C-N 123.633 0.583 . . . . 56.969999999999999 111.283 178.295 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 91.93 -25.47 16.63 Favored Glycine 0 N--CA 1.446 -0.696 0 CA-C-N 115.026 -0.988 . . . . 29.289999999999999 114.089 -179.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -58.61 139.65 55.58 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.1 -0.64 . . . . 36.530000000000001 110.803 -176.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.6 tp -75.3 132.53 41.07 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 107.769 -1.197 . . . . 29.850000000000001 107.769 168.002 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' VAL . . . . . 0.745 HG23 HD13 ' A' ' 31' ' ' ILE . 3.0 m -125.78 139.31 51.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 O-C-N 122.144 -0.348 . . . . 32.18 110.377 176.448 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 59.0 m -107.92 119.89 40.73 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 107.393 -1.336 . . . . 26.199999999999999 107.393 176.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ILE . . . . . 0.745 HD13 HG23 ' A' ' 29' ' ' VAL . 1.5 mp -123.21 141.9 41.8 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.325 0 O-C-N 123.41 0.444 . . . . 26.670000000000002 111.482 -172.351 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -111.75 121.21 44.47 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 105.553 -2.018 . . . . 25.07 105.553 167.195 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 43.6 p90 -133.94 171.69 13.83 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 122.601 1.191 . . . . 26.449999999999999 113.862 -175.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -145.37 127.53 15.69 Favored 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 104.039 -2.578 . . . . 26.059999999999999 104.039 174.572 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -111.51 134.47 12.14 Favored Glycine 0 C--O 1.219 -0.806 0 CA-C-N 116.266 -0.424 . . . . 21.18 112.059 -179.305 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 39.5 m -132.94 157.42 45.17 Favored 'General case' 0 C--O 1.217 -0.621 0 C-N-CA 122.694 0.398 . . . . 25.920000000000002 111.037 -175.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 41.5 mt -95.45 165.32 12.41 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.17 -1.048 . . . . 27.420000000000002 108.17 173.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -58.12 -20.94 44.12 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.094 -0.642 . . . . 47.899999999999999 111.591 -176.468 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 27.6 p-10 -94.02 11.59 29.24 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 113.918 1.081 . . . . 35.240000000000002 113.918 -174.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 96.31 -20.85 48.47 Favored Glycine 0 N--CA 1.448 -0.554 0 CA-C-N 115.946 -0.57 . . . . 29.620000000000001 112.853 177.076 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -62.04 121.06 12.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.563 0.22 . . . . 55.789999999999999 111.405 -176.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' LYS . . . . . 0.417 ' HE2' ' OD2' ' A' ' 48' ' ' ASP . 0.2 OUTLIER -77.32 142.65 39.29 Favored 'General case' 0 CA--C 1.515 -0.383 0 C-N-CA 123.442 0.697 . . . . 48.969999999999999 109.157 175.693 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 8.0 p90 -136.23 1.71 2.7 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 115.214 1.561 . . . . 29.109999999999999 115.214 -172.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 44.7 t0 172.75 142.14 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 107.46 -1.311 . . . . 29.109999999999999 107.46 -175.245 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 29.5 t -165.21 113.17 1.0 Allowed 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.253 -0.647 . . . . 30.27 109.253 -174.605 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 59.5 p -76.54 -22.66 54.08 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 107.767 -1.197 . . . . 24.68 107.767 -178.981 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 20.8 t -64.53 -39.47 85.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.559 -0.746 . . . . 31.670000000000002 112.506 176.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ASP . . . . . 0.417 ' OD2' ' HE2' ' A' ' 42' ' ' LYS . 97.2 m-20 -71.45 -15.58 62.34 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-O 120.891 0.377 . . . . 42.240000000000002 110.667 -178.533 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 3.1 mtp180 -95.81 -14.28 23.38 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.859 -0.61 . . . . 35.270000000000003 112.065 -175.174 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 79.39 2.22 87.3 Favored Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 114.702 0.641 . . . . 35.399999999999999 114.702 174.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' SER . . . . . 0.408 ' HA ' ' HD3' ' A' ' 52' ' ' PRO . 92.9 p -141.69 139.19 18.11 Favored Pre-proline 0 C--O 1.222 -0.376 0 CA-C-O 121.018 0.437 . . . . 34.32 110.728 175.538 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 51' ' ' SER . 16.4 Cg_exo -71.58 168.16 24.4 Favored 'Trans proline' 0 C--N 1.328 -0.53 0 C-N-CA 123.703 2.936 . . . . 28.469999999999999 113.158 -172.846 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -102.57 136.18 42.86 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 114.576 -1.193 . . . . 27.34 109.659 175.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -114.08 146.41 40.27 Favored 'General case' 0 CA--C 1.509 -0.629 0 N-CA-C 109.605 -0.517 . . . . 41.799999999999997 109.605 175.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 20.7 p -165.24 158.6 16.57 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.562 -0.455 . . . . 34.5 111.039 174.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -88.59 138.85 31.06 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 108.908 -0.775 . . . . 39.140000000000001 108.908 168.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ILE . . . . . 0.449 HD11 ' O ' ' A' ' 66' ' ' TRP . 9.2 tp -108.65 140.3 27.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 N-CA-C 112.747 0.647 . . . . 32.799999999999997 112.747 -168.35 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 76.15 30.0 57.82 Favored Glycine 0 C--O 1.225 -0.443 0 CA-C-N 116.477 -0.328 . . . . 35.990000000000002 113.307 179.908 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' VAL . . . . . 0.47 HG23 ' HG3' ' A' ' 61' ' ' GLN . 1.5 m -130.84 8.79 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 O-C-N 122.729 -0.277 . . . . 42.240000000000002 111.223 179.264 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 81.16 23.02 59.81 Favored Glycine 0 N--CA 1.451 -0.336 0 N-CA-C 115.106 0.803 . . . . 35.359999999999999 115.106 176.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLN . . . . . 0.47 ' HG3' HG23 ' A' ' 59' ' ' VAL . 78.8 mt-30 -95.24 -3.7 47.13 Favored 'General case' 0 CA--C 1.509 -0.602 0 CA-C-N 117.295 0.547 . . . . 49.5 111.569 -177.368 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 2.7 m -142.7 173.14 7.1 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.483 0 N-CA-C 106.571 -1.64 . . . . 34.189999999999998 106.571 177.224 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.8 pt -52.85 153.39 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 C-N-CA 120.022 -0.671 . . . . 30.879999999999999 110.751 179.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' LYS . . . . . 0.515 ' HB2' ' NZ ' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -57.29 -36.84 71.54 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.258 -0.428 . . . . 35.640000000000001 111.475 -179.83 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -58.71 -30.31 65.57 Favored Glycine 0 N--CA 1.451 -0.359 0 CA-C-N 115.916 -0.584 . . . . 26.109999999999999 113.206 -179.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' TRP . . . . . 0.449 ' O ' HD11 ' A' ' 57' ' ' ILE . 15.4 m0 -81.43 -37.38 28.16 Favored 'General case' 0 C--O 1.215 -0.719 0 N-CA-C 112.647 0.61 . . . . 34.039999999999999 112.647 175.082 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -62.15 -38.65 89.81 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 119.192 -1.003 . . . . 29.219999999999999 109.302 176.031 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.5 -41.4 55.42 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.83 0.348 . . . . 23.640000000000001 111.875 178.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -85.47 -51.72 3.6 Favored Glycine 0 N--CA 1.453 -0.218 0 N-CA-C 116.41 1.324 . . . . 25.59 116.41 -169.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 33.9 mm -47.6 -43.96 52.61 Favored Pre-proline 0 N--CA 1.474 0.732 0 N-CA-C 115.802 1.778 . . . . 25.640000000000001 115.802 -179.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -67.31 -8.75 22.97 Favored 'Trans proline' 0 CA--C 1.535 0.563 0 C-N-CA 120.859 1.039 . . . . 24.059999999999999 114.415 -176.815 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 35.1 mttp -94.24 3.59 55.04 Favored 'General case' 0 C--O 1.245 0.838 0 C-N-CA 119.545 -0.862 . . . . 43.420000000000002 111.947 177.546 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 40.4 mt -101.86 150.86 22.74 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.567 -0.742 . . . . 24.469999999999999 111.228 176.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 4.9 p -106.31 155.65 19.29 Favored 'General case' 0 CA--C 1.499 -0.996 0 N-CA-C 107.074 -1.454 . . . . 24.859999999999999 107.074 178.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 5.3 p -56.49 129.39 18.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.558 0 CA-C-O 121.614 0.721 . . . . 24.390000000000001 111.927 -173.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 96.89 -16.0 61.69 Favored Glycine 0 C--O 1.214 -1.096 0 CA-C-N 115.481 -0.781 . . . . 20.609999999999999 111.363 -178.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 80.2 tt0 -69.03 143.13 54.39 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 113.971 1.1 . . . . 33.719999999999999 113.971 -174.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.7 tptm -118.75 130.3 55.73 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 107.339 -1.356 . . . . 33.780000000000001 107.339 178.475 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -150.83 154.24 36.89 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.552 -0.459 . . . . 25.370000000000001 111.721 -169.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 18.0 ttm180 -102.32 127.08 49.46 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 119.836 -0.745 . . . . 23.969999999999999 109.623 172.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 32.1 mt -104.69 122.0 44.76 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 108.141 -1.059 . . . . 24.739999999999998 108.141 172.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 58.7 m -103.96 101.4 11.19 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 107.903 -1.147 . . . . 30.609999999999999 107.903 174.317 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 19.5 mt -106.25 117.9 56.17 Favored Pre-proline 0 C--O 1.234 0.275 0 N-CA-C 111.993 0.368 . . . . 27.100000000000001 111.993 -169.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -68.86 156.19 66.21 Favored 'Trans proline' 0 N--CA 1.472 0.22 0 C-N-CA 120.94 1.094 . . . . 27.129999999999999 110.983 -179.91 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -37.9 -55.83 1.79 Allowed Glycine 0 C--O 1.224 -0.5 0 N-CA-C 117.566 1.786 . . . . 29.309999999999999 117.566 -176.275 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -58.71 -27.69 84.19 Favored 'Trans proline' 0 C--O 1.234 0.302 0 C-N-CA 121.376 1.384 . . . . 24.760000000000002 113.039 -176.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -92.36 -1.44 57.04 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 113.491 0.923 . . . . 31.449999999999999 113.491 177.233 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -114.13 -120.51 0.3 Allowed 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.233 0.613 . . . . 25.190000000000001 111.495 -179.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -90.58 1.0 57.15 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 114.561 1.319 . . . . 41.880000000000003 114.561 -177.657 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 81.61 -169.24 50.61 Favored Glycine 0 N--CA 1.44 -1.034 0 C-N-CA 120.543 -0.837 . . . . 32.520000000000003 113.863 165.649 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -72.66 -18.4 25.38 Favored 'Trans proline' 0 N--CA 1.459 -0.52 0 O-C-N 123.116 1.061 . . . . 40.5 110.843 -169.079 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 28.2 ttm105 -86.89 -46.17 10.16 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 123.702 0.626 . . . . 51.049999999999997 112.409 177.46 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 68.27 -163.06 48.96 Favored Glycine 0 C--O 1.223 -0.533 0 N-CA-C 108.404 -1.878 . . . . 40.850000000000001 108.404 -174.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' PHE . . . . . . . . . . . . . 18.2 m-30 -120.47 97.84 48.65 Favored Pre-proline 0 N--CA 1.469 0.494 0 N-CA-C 107.312 -1.366 . . . . 68.579999999999998 107.312 170.323 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -55.87 130.67 41.62 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.218 1.945 . . . . 31.199999999999999 112.283 -168.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 97.3 -15.7 61.86 Favored Glycine 0 CA--C 1.525 0.7 0 CA-C-O 121.698 0.61 . . . . 33.020000000000003 112.635 -175.059 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -125.31 -64.53 1.07 Allowed 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 108.83 -0.804 . . . . 35.939999999999998 108.83 -177.312 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 64.4 mt -117.63 112.23 39.07 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 115.859 -0.609 . . . . 27.75 111.178 176.487 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_exo -48.33 155.28 2.15 Favored 'Trans proline' 0 C--N 1.341 0.151 1 C-N-CA 126.958 5.105 . . . . 37.289999999999999 113.151 173.842 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -56.01 132.03 49.51 Favored 'Trans proline' 0 C--O 1.219 -0.463 0 C-N-CA 121.798 1.665 . . . . 33.859999999999999 111.673 176.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 17.6 t30 56.19 36.75 27.97 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 114.072 1.138 . . . . 33.600000000000001 114.072 172.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -81.57 139.02 35.32 Favored 'General case' 0 C--O 1.238 0.489 0 CA-C-N 115.953 -0.567 . . . . 26.960000000000001 111.855 -174.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 82.0 m -79.25 125.21 29.17 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 115.414 -0.812 . . . . 27.800000000000001 108.976 172.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 15.2 mt -105.43 136.65 44.59 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 115.967 -0.561 . . . . 23.600000000000001 111.519 -178.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 2.2 mp -108.0 119.68 58.03 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.829 0 N-CA-C 107.192 -1.41 . . . . 27.48 107.192 176.775 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -114.76 125.1 53.31 Favored 'General case' 0 CA--C 1.497 -1.086 0 C-N-CA 120.458 -0.497 . . . . 26.469999999999999 109.718 178.138 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -94.42 111.13 22.87 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 106.826 -1.546 . . . . 42.25 106.826 164.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 16.5 m -121.31 144.95 28.72 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.367 0 O-C-N 123.32 0.388 . . . . 24.949999999999999 111.649 -175.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -119.69 122.43 41.45 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 109.692 -0.485 . . . . 29.899999999999999 109.692 168.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 53.4 tp -76.62 115.72 16.64 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 106.723 -1.584 . . . . 22.800000000000001 106.723 173.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 20.7 mt -94.45 -30.69 14.31 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 120.808 0.337 . . . . 25.84 111.564 -176.143 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 5.9 tttt -164.8 144.66 7.25 Favored 'General case' 0 CA--C 1.511 -0.544 0 N-CA-C 112.547 0.573 . . . . 35.890000000000001 112.547 -169.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 55.0 t -122.63 131.84 72.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 CA-C-N 115.431 -0.804 . . . . 30.649999999999999 109.927 174.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 11.4 m120 . . . . . 0 N--CA 1.469 0.476 0 O-C-N 121.703 -0.623 . . . . 38.850000000000001 111.327 165.604 . . . . . . . . 0 0 . 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 0 . 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 nobuild full ' A' A ' 0' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.432 -1.326 0 CA-C-O 121.235 0.541 . . . . 33.530000000000001 110.794 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.68 153.22 41.29 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 122.359 1.076 . . . . 63.43 111.926 166.704 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 59.6 p -121.15 138.89 53.99 Favored 'General case' 0 N--CA 1.445 -0.707 0 N-CA-C 102.243 -3.243 . . . . 40.329999999999998 102.243 161.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -141.49 130.81 23.61 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 105.386 -2.079 . . . . 52.549999999999997 105.386 -167.445 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 93.5 m -109.32 126.18 53.11 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.83 -0.433 . . . . 39.579999999999998 109.83 170.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 10.7 pt -125.48 -161.45 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 C-N-CA 120.04 -0.664 . . . . 29.43 112.753 -168.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -51.98 126.93 19.79 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.0 -0.68 . . . . 47.350000000000001 109.912 179.487 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 96.91 3.64 59.12 Favored Glycine 0 N--CA 1.448 -0.562 0 CA-C-N 115.879 -0.601 . . . . 31.23 114.112 171.153 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 73.11 16.3 78.55 Favored Glycine 0 C--O 1.214 -1.13 0 N-CA-C 112.008 -0.437 . . . . 26.16 112.008 -170.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 90.2 t -73.71 128.39 36.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 O-C-N 121.958 -0.731 . . . . 26.699999999999999 109.419 -179.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . . . -105.29 130.07 53.5 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.713 0.768 . . . . 47.909999999999997 111.83 179.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.3 mt -108.19 118.67 56.31 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 N-CA-C 108.026 -1.102 . . . . 27.760000000000002 108.026 175.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -109.81 124.61 51.6 Favored 'General case' 0 CA--C 1.508 -0.646 0 N-CA-C 108.763 -0.828 . . . . 35.520000000000003 108.763 171.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.2 mtt-85 -87.74 118.41 27.23 Favored 'General case' 0 C--N 1.319 -0.745 0 C-N-CA 119.819 -0.752 . . . . 34.630000000000003 109.174 -177.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 71.2 mt -93.17 -53.87 3.94 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.14 -0.482 . . . . 22.899999999999999 111.14 -178.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 39.2 p -137.67 142.88 38.32 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-O 121.025 0.44 . . . . 27.84 110.818 175.78 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -73.31 153.86 50.95 Favored 'Trans proline' 0 C--O 1.22 -0.409 0 C-N-CA 122.139 1.892 . . . . 26.579999999999998 115.09 -168.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -102.84 -153.66 24.52 Favored Glycine 0 C--O 1.223 -0.582 0 N-CA-C 108.946 -1.662 . . . . 25.539999999999999 108.946 171.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -78.82 -13.2 59.94 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 119.168 -1.013 . . . . 34.170000000000002 111.769 -177.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 73.14 8.36 74.09 Favored Glycine 0 CA--C 1.521 0.426 0 CA-C-N 116.211 -0.449 . . . . 29.629999999999999 113.658 174.936 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -133.27 -34.19 1.09 Allowed 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 112.163 0.431 . . . . 67.659999999999997 112.163 -173.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 90.6 m -101.62 101.61 12.17 Favored 'General case' 0 C--O 1.225 -0.212 0 N-CA-C 113.187 0.81 . . . . 33.039999999999999 113.187 -177.387 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -115.07 145.01 33.18 Favored Pre-proline 0 C--N 1.326 -0.427 0 N-CA-C 109.353 -0.61 . . . . 28.899999999999999 109.353 -178.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -74.98 143.87 29.64 Favored 'Trans proline' 0 C--O 1.22 -0.418 0 C-N-CA 120.805 1.003 . . . . 30.09 111.867 178.06 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 12.6 mptt -119.87 159.27 24.95 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.402 -0.592 . . . . 47.560000000000002 109.402 173.973 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -35.53 129.49 0.56 Allowed 'General case' 0 CA--C 1.516 -0.343 0 O-C-N 123.633 0.583 . . . . 56.969999999999999 111.283 178.295 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 91.93 -25.47 16.63 Favored Glycine 0 N--CA 1.446 -0.696 0 CA-C-N 115.026 -0.988 . . . . 29.289999999999999 114.089 -179.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -58.61 139.65 55.58 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.1 -0.64 . . . . 36.530000000000001 110.803 -176.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.6 tp -75.3 132.53 41.07 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 107.769 -1.197 . . . . 29.850000000000001 107.769 168.002 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.745 HG23 HD13 ' A' ' 31' ' ' ILE . 3.0 m -125.78 139.31 51.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 O-C-N 122.144 -0.348 . . . . 32.18 110.377 176.448 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 59.0 m -107.92 119.89 40.73 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 107.393 -1.336 . . . . 26.199999999999999 107.393 176.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.745 HD13 HG23 ' A' ' 29' ' ' VAL . 1.5 mp -123.21 141.9 41.8 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.325 0 O-C-N 123.41 0.444 . . . . 26.670000000000002 111.482 -172.351 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -111.75 121.21 44.47 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 105.553 -2.018 . . . . 25.07 105.553 167.195 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 43.6 p90 -133.94 171.69 13.83 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 122.601 1.191 . . . . 26.449999999999999 113.862 -175.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -145.37 127.53 15.69 Favored 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 104.039 -2.578 . . . . 26.059999999999999 104.039 174.572 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -111.51 134.47 12.14 Favored Glycine 0 C--O 1.219 -0.806 0 CA-C-N 116.266 -0.424 . . . . 21.18 112.059 -179.305 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 39.5 m -132.94 157.42 45.17 Favored 'General case' 0 C--O 1.217 -0.621 0 C-N-CA 122.694 0.398 . . . . 25.920000000000002 111.037 -175.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 41.5 mt -95.45 165.32 12.41 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.17 -1.048 . . . . 27.420000000000002 108.17 173.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -58.12 -20.94 44.12 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.094 -0.642 . . . . 47.899999999999999 111.591 -176.468 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 27.6 p-10 -94.02 11.59 29.24 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 113.918 1.081 . . . . 35.240000000000002 113.918 -174.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 96.31 -20.85 48.47 Favored Glycine 0 N--CA 1.448 -0.554 0 CA-C-N 115.946 -0.57 . . . . 29.620000000000001 112.853 177.076 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -62.04 121.06 12.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.563 0.22 . . . . 55.789999999999999 111.405 -176.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.417 ' HE2' ' OD2' ' A' ' 48' ' ' ASP . 0.2 OUTLIER -77.32 142.65 39.29 Favored 'General case' 0 CA--C 1.515 -0.383 0 C-N-CA 123.442 0.697 . . . . 48.969999999999999 109.157 175.693 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 8.0 p90 -136.23 1.71 2.7 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 115.214 1.561 . . . . 29.109999999999999 115.214 -172.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 44.7 t0 172.75 142.14 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 107.46 -1.311 . . . . 29.109999999999999 107.46 -175.245 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 29.5 t -165.21 113.17 1.0 Allowed 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.253 -0.647 . . . . 30.27 109.253 -174.605 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 59.5 p -76.54 -22.66 54.08 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 107.767 -1.197 . . . . 24.68 107.767 -178.981 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 20.8 t -64.53 -39.47 85.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.559 -0.746 . . . . 31.670000000000002 112.506 176.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.417 ' OD2' ' HE2' ' A' ' 42' ' ' LYS . 97.2 m-20 -71.45 -15.58 62.34 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-O 120.891 0.377 . . . . 42.240000000000002 110.667 -178.533 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 3.1 mtp180 -95.81 -14.28 23.38 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.859 -0.61 . . . . 35.270000000000003 112.065 -175.174 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 79.39 2.22 87.3 Favored Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 114.702 0.641 . . . . 35.399999999999999 114.702 174.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' SER . . . . . 0.408 ' HA ' ' HD3' ' A' ' 52' ' ' PRO . 92.9 p -141.69 139.19 18.11 Favored Pre-proline 0 C--O 1.222 -0.376 0 CA-C-O 121.018 0.437 . . . . 34.32 110.728 175.538 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 51' ' ' SER . 16.4 Cg_exo -71.58 168.16 24.4 Favored 'Trans proline' 0 C--N 1.328 -0.53 0 C-N-CA 123.703 2.936 . . . . 28.469999999999999 113.158 -172.846 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -102.57 136.18 42.86 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 114.576 -1.193 . . . . 27.34 109.659 175.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 -114.08 146.41 40.27 Favored 'General case' 0 CA--C 1.509 -0.629 0 N-CA-C 109.605 -0.517 . . . . 41.799999999999997 109.605 175.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 20.7 p -165.24 158.6 16.57 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.562 -0.455 . . . . 34.5 111.039 174.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -88.59 138.85 31.06 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 108.908 -0.775 . . . . 39.140000000000001 108.908 168.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.449 HD11 ' O ' ' A' ' 66' ' ' TRP . 9.2 tp -108.65 140.3 27.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 N-CA-C 112.747 0.647 . . . . 32.799999999999997 112.747 -168.35 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 76.15 30.0 57.82 Favored Glycine 0 C--O 1.225 -0.443 0 CA-C-N 116.477 -0.328 . . . . 35.990000000000002 113.307 179.908 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.47 HG23 ' HG3' ' A' ' 61' ' ' GLN . 1.5 m -130.84 8.79 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 O-C-N 122.729 -0.277 . . . . 42.240000000000002 111.223 179.264 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 81.16 23.02 59.81 Favored Glycine 0 N--CA 1.451 -0.336 0 N-CA-C 115.106 0.803 . . . . 35.359999999999999 115.106 176.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.47 ' HG3' HG23 ' A' ' 59' ' ' VAL . 24.0 mt-30 -95.24 -3.7 47.13 Favored 'General case' 0 CA--C 1.509 -0.602 0 CA-C-N 117.295 0.547 . . . . 49.5 111.569 -177.368 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 2.7 m -142.7 173.14 7.1 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.483 0 N-CA-C 106.571 -1.64 . . . . 34.189999999999998 106.571 177.224 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.8 pt -52.85 153.39 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 C-N-CA 120.022 -0.671 . . . . 30.879999999999999 110.751 179.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.515 ' HB2' ' NZ ' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -57.29 -36.84 71.54 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.258 -0.428 . . . . 35.640000000000001 111.475 -179.83 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -58.71 -30.31 65.57 Favored Glycine 0 N--CA 1.451 -0.359 0 CA-C-N 115.916 -0.584 . . . . 26.109999999999999 113.206 -179.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' TRP . . . . . 0.449 ' O ' HD11 ' A' ' 57' ' ' ILE . 15.4 m0 -81.43 -37.38 28.16 Favored 'General case' 0 C--O 1.215 -0.719 0 N-CA-C 112.647 0.61 . . . . 34.039999999999999 112.647 175.082 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -62.15 -38.65 89.81 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 119.192 -1.003 . . . . 29.219999999999999 109.302 176.031 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.5 -41.4 55.42 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.83 0.348 . . . . 23.640000000000001 111.875 178.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -85.47 -51.72 3.6 Favored Glycine 0 N--CA 1.453 -0.218 0 N-CA-C 116.41 1.324 . . . . 25.59 116.41 -169.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 33.9 mm -47.6 -43.96 52.61 Favored Pre-proline 0 N--CA 1.474 0.732 0 N-CA-C 115.802 1.778 . . . . 25.640000000000001 115.802 -179.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -67.31 -8.75 22.97 Favored 'Trans proline' 0 CA--C 1.535 0.563 0 C-N-CA 120.859 1.039 . . . . 24.059999999999999 114.415 -176.815 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 35.1 mttp -94.24 3.59 55.04 Favored 'General case' 0 C--O 1.245 0.838 0 C-N-CA 119.545 -0.862 . . . . 43.420000000000002 111.947 177.546 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 40.4 mt -101.86 150.86 22.74 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.567 -0.742 . . . . 24.469999999999999 111.228 176.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 4.9 p -106.31 155.65 19.29 Favored 'General case' 0 CA--C 1.499 -0.996 0 N-CA-C 107.074 -1.454 . . . . 24.859999999999999 107.074 178.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 5.3 p -56.49 129.39 18.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.558 0 CA-C-O 121.614 0.721 . . . . 24.390000000000001 111.927 -173.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 96.89 -16.0 61.69 Favored Glycine 0 C--O 1.214 -1.096 0 CA-C-N 115.481 -0.781 . . . . 20.609999999999999 111.363 -178.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 80.2 tt0 -69.03 143.13 54.39 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 113.971 1.1 . . . . 33.719999999999999 113.971 -174.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.7 tptm -118.75 130.3 55.73 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 107.339 -1.356 . . . . 33.780000000000001 107.339 178.475 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -150.83 154.24 36.89 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.552 -0.459 . . . . 25.370000000000001 111.721 -169.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 18.0 ttm180 -102.32 127.08 49.46 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 119.836 -0.745 . . . . 23.969999999999999 109.623 172.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 32.1 mt -104.69 122.0 44.76 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 108.141 -1.059 . . . . 24.739999999999998 108.141 172.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 58.7 m -103.96 101.4 11.19 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 107.903 -1.147 . . . . 30.609999999999999 107.903 174.317 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 19.5 mt -106.25 117.9 56.17 Favored Pre-proline 0 C--O 1.234 0.275 0 N-CA-C 111.993 0.368 . . . . 27.100000000000001 111.993 -169.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -68.86 156.19 66.21 Favored 'Trans proline' 0 N--CA 1.472 0.22 0 C-N-CA 120.94 1.094 . . . . 27.129999999999999 110.983 -179.91 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -37.9 -55.83 1.79 Allowed Glycine 0 C--O 1.224 -0.5 0 N-CA-C 117.566 1.786 . . . . 29.309999999999999 117.566 -176.275 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -58.71 -27.69 84.19 Favored 'Trans proline' 0 C--O 1.234 0.302 0 C-N-CA 121.376 1.384 . . . . 24.760000000000002 113.039 -176.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -92.36 -1.44 57.04 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 113.491 0.923 . . . . 31.449999999999999 113.491 177.233 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -114.13 -120.51 0.3 Allowed 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.233 0.613 . . . . 25.190000000000001 111.495 -179.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -90.58 1.0 57.15 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 114.561 1.319 . . . . 41.880000000000003 114.561 -177.657 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 81.61 -169.24 50.61 Favored Glycine 0 N--CA 1.44 -1.034 0 C-N-CA 120.543 -0.837 . . . . 32.520000000000003 113.863 165.649 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -72.66 -18.4 25.38 Favored 'Trans proline' 0 N--CA 1.459 -0.52 0 O-C-N 123.116 1.061 . . . . 40.5 110.843 -169.079 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 28.2 ttm105 -86.89 -46.17 10.16 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 123.702 0.626 . . . . 51.049999999999997 112.409 177.46 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 68.27 -163.06 48.96 Favored Glycine 0 C--O 1.223 -0.533 0 N-CA-C 108.404 -1.878 . . . . 40.850000000000001 108.404 -174.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' PHE . . . . . . . . . . . . . 18.2 m-30 -120.47 97.84 48.65 Favored Pre-proline 0 N--CA 1.469 0.494 0 N-CA-C 107.312 -1.366 . . . . 68.579999999999998 107.312 170.323 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -55.87 130.67 41.62 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.218 1.945 . . . . 31.199999999999999 112.283 -168.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 97.3 -15.7 61.86 Favored Glycine 0 CA--C 1.525 0.7 0 CA-C-O 121.698 0.61 . . . . 33.020000000000003 112.635 -175.059 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -125.31 -64.53 1.07 Allowed 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 108.83 -0.804 . . . . 35.939999999999998 108.83 -177.312 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 64.4 mt -117.63 112.23 39.07 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 115.859 -0.609 . . . . 27.75 111.178 176.487 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_exo -48.33 155.28 2.15 Favored 'Trans proline' 0 C--N 1.341 0.151 1 C-N-CA 126.958 5.105 . . . . 37.289999999999999 113.151 173.842 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -56.01 132.03 49.51 Favored 'Trans proline' 0 C--O 1.219 -0.463 0 C-N-CA 121.798 1.665 . . . . 33.859999999999999 111.673 176.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 17.6 t30 56.19 36.75 27.97 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 114.072 1.138 . . . . 33.600000000000001 114.072 172.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -81.57 139.02 35.32 Favored 'General case' 0 C--O 1.238 0.489 0 CA-C-N 115.953 -0.567 . . . . 26.960000000000001 111.855 -174.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 82.0 m -79.25 125.21 29.17 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 115.414 -0.812 . . . . 27.800000000000001 108.976 172.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 15.2 mt -105.43 136.65 44.59 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 115.967 -0.561 . . . . 23.600000000000001 111.519 -178.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 2.2 mp -108.0 119.68 58.03 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.829 0 N-CA-C 107.192 -1.41 . . . . 27.48 107.192 176.775 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -114.76 125.1 53.31 Favored 'General case' 0 CA--C 1.497 -1.086 0 C-N-CA 120.458 -0.497 . . . . 26.469999999999999 109.718 178.138 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -94.42 111.13 22.87 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 106.826 -1.546 . . . . 42.25 106.826 164.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 16.5 m -121.31 144.95 28.72 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.367 0 O-C-N 123.32 0.388 . . . . 24.949999999999999 111.649 -175.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -119.69 122.43 41.45 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 109.692 -0.485 . . . . 29.899999999999999 109.692 168.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 53.4 tp -76.62 115.72 16.64 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 106.723 -1.584 . . . . 22.800000000000001 106.723 173.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 20.7 mt -94.45 -30.69 14.31 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 120.808 0.337 . . . . 25.84 111.564 -176.143 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 5.9 tttt -164.8 144.66 7.25 Favored 'General case' 0 CA--C 1.511 -0.544 0 N-CA-C 112.547 0.573 . . . . 35.890000000000001 112.547 -169.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 55.0 t -122.63 131.84 72.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 CA-C-N 115.431 -0.804 . . . . 30.649999999999999 109.927 174.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 11.4 m120 . . . . . 0 N--CA 1.469 0.476 0 O-C-N 121.703 -0.623 . . . . 38.850000000000001 111.327 165.604 . . . . . . . . 0 0 . 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 0 . 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 stop_ save_