data_4ioh_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 4ioh _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 ' 2' ' ' MSE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.539 0.523 0 N-CA-C 112.078 0.399 . . . . 113.7 112.078 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -71.66 126.71 30.4 Favored 'General case' 0 C--O 1.242 0.679 0 N-CA-C 110.016 -0.364 . . . . 118.5 110.016 177.585 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -86.15 139.67 30.88 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 120.865 -0.334 . . . . 81.38 111.29 -170.999 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' MSE . . . . . . . . . . . . . 0.0 OUTLIER -122.81 148.15 45.72 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 117.37 2.359 . . . . 95.47 117.37 -156.764 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 21.0 p30 -99.96 -178.01 3.72 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 121.801 -0.562 . . . . 78.11 112.505 178.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -58.65 -34.22 50.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 C-N-CA 120.372 -0.531 . . . . 110.44 111.316 -176.712 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 14.0 mt -75.6 -18.7 59.63 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 113.675 0.991 . . . . 108.61 113.675 -172.417 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 106.32 2.51 38.32 Favored Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 111.15 -0.78 . . . . 87.96 111.15 179.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -98.76 168.63 9.45 Favored Pre-proline 0 C--O 1.239 0.546 0 CA-C-N 116.943 0.371 . . . . 98.3 111.234 179.126 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -62.85 132.41 37.12 Favored 'Trans proline' 0 C--N 1.354 0.823 0 O-C-N 122.957 0.978 . . . . 76.74 111.652 172.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 20.0 tp -51.22 129.64 24.91 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 115.003 -0.999 . . . . 74.09 111.066 178.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -99.25 -178.22 3.85 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 119.164 -1.014 . . . . 94.12 111.583 179.331 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 42.4 t -64.77 145.56 56.06 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 115.872 -0.603 . . . . 66.04 110.101 178.735 -175.937 -156.578 96.061 101.3 2.023 103.781 36.987 -84.451 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 49.3 t -99.12 72.73 1.89 Allowed 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 103.414 -2.81 . . . . 71.98 103.414 163.667 -173.933 -58.146 18.969 53.143 17.583 131.048 136.406 -179.806 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.8 m -90.13 159.44 16.77 Favored 'General case' 0 C--O 1.245 0.816 0 CA-C-N 116.26 -0.427 . . . . 84.28 111.968 -169.778 -84.451 36.987 96.061 103.781 2.023 101.3 -156.578 -175.937 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -91.54 150.57 21.14 Favored 'General case' 0 C--O 1.246 0.895 0 CA-C-N 115.712 -0.676 . . . . 87.15 111.691 170.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -72.61 131.38 84.49 Favored Pre-proline 0 C--N 1.328 -0.329 0 C-N-CA 119.976 -0.69 . . . . 102.86 109.257 165.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -81.28 146.5 69.71 Favored 'Cis proline' 0 CA--C 1.53 0.28 0 O-C-N 122.545 0.76 . . . . 87.9 113.661 10.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.8 tp -89.34 143.46 26.81 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-O 121.37 0.605 . . . . 82.02 110.753 -176.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' THR . . . . . 0.435 ' OG1' ' N ' ' A' ' 22' ' ' GLY . 1.3 t -116.82 170.57 8.51 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 118.602 -1.239 . . . . 90.83 113.744 -164.772 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLY . . . . . 0.435 ' N ' ' OG1' ' A' ' 21' ' ' THR . . . 84.44 141.71 5.23 Favored Glycine 0 N--CA 1.439 -1.149 0 N-CA-C 110.414 -1.075 . . . . 61.16 110.414 -177.153 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -51.64 -24.59 5.76 Favored 'General case' 0 CA--C 1.552 1.043 0 N-CA-C 114.08 1.141 . . . . 83.76 114.08 172.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 81.6 m-85 -114.11 13.37 18.07 Favored 'General case' 0 CA--C 1.483 -1.625 0 N-CA-C 108.944 -0.761 . . . . 68.59 108.944 -176.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.4 mtp180 53.65 36.75 24.41 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 113.614 -1.63 . . . . 118.44 111.741 170.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 53.1 p-10 -105.98 -1.96 23.39 Favored 'General case' 0 C--O 1.244 0.793 0 CA-C-N 115.711 -0.677 . . . . 68.66 111.27 173.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 103.14 7.76 42.96 Favored Glycine 0 C--O 1.215 -1.047 0 C-N-CA 119.433 -1.365 . . . . 53.64 113.006 176.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -132.98 135.47 45.5 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.646 0.736 . . . . 66.46 112.664 -168.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 86.3 m -77.23 49.03 0.66 Allowed 'General case' 0 CA--C 1.489 -1.399 0 C-N-CA 120.183 -0.607 . . . . 75.26 109.796 177.256 -59.488 -33.637 -76.363 108.836 2.042 100.203 -80.132 -50.398 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 18.7 ptt85 -91.1 156.11 18.14 Favored 'General case' 0 CA--C 1.503 -0.856 0 N-CA-C 107.597 -1.261 . . . . 78.54 107.597 176.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 11.5 t -113.14 -173.39 2.24 Favored 'General case' 0 N--CA 1.434 -1.23 0 N-CA-C 106.597 -1.631 . . . . 84.37 106.597 -176.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 170.47 -151.35 16.12 Favored Glycine 0 N--CA 1.442 -0.966 0 C-N-CA 120.136 -1.031 . . . . 78.94 110.853 -174.505 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -77.83 -54.8 5.91 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 113.041 0.756 . . . . 91.47 113.041 -166.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -57.49 -51.08 59.96 Favored Glycine 0 CA--C 1.523 0.537 0 C-N-CA 120.762 -0.732 . . . . 125.93 112.91 -175.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ASP . . . . . 0.433 ' OD1' ' N ' ' A' ' 37' ' ' GLY . 56.2 t0 -61.6 137.2 58.23 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.301 -0.45 . . . . 117.56 110.459 -179.68 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 1.6 t -121.89 -8.27 9.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 108.156 -1.053 . . . . 115.74 108.156 168.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLY . . . . . 0.433 ' N ' ' OD1' ' A' ' 35' ' ' ASP . . . -73.37 -18.51 79.36 Favored Glycine 0 N--CA 1.451 -0.342 0 CA-C-N 115.656 -0.702 . . . . 109.16 114.596 178.591 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 52.94 68.64 0.8 Allowed 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.548 0.689 . . . . 96.99 112.798 -171.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 54.0 m80 -80.46 75.62 7.3 Favored 'General case' 0 C--O 1.245 0.863 0 N-CA-C 107.35 -1.352 . . . . 98.2 107.35 174.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 10.7 m -112.36 5.6 8.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 N-CA-C 114.411 1.263 . . . . 77.19 114.411 -175.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 49.6 t -108.06 110.39 31.76 Favored 'Isoleucine or valine' 0 C--O 1.246 0.903 0 N-CA-C 113.245 0.831 . . . . 78.64 113.245 -178.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 53.0 t -80.36 101.67 9.12 Favored 'General case' 0 C--O 1.251 1.153 0 C-N-CA 118.209 -1.396 . . . . 80.67 112.762 175.45 -179.806 136.406 18.969 131.048 17.583 53.143 -58.146 -173.933 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -112.46 161.74 16.38 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-N 115.96 -0.564 . . . . 79.06 110.373 -176.184 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLN . . . . . 0.447 ' NE2' ' O ' ' A' ' 75' ' ' GLY . 52.4 tt0 -103.03 133.83 47.48 Favored 'General case' 0 C--O 1.241 0.637 0 N-CA-C 108.738 -0.838 . . . . 106.04 108.738 171.791 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' MSE . . . . . 0.65 ' O ' ' N ' ' A' ' 75' ' ' GLY . 32.2 mmt -72.83 126.4 29.84 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 119.5 -0.88 . . . . 106.12 112.823 -170.812 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 68.0 p -114.05 138.77 49.94 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 115.645 -0.707 . . . . 117.09 109.658 169.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -56.15 -32.15 64.01 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 112.656 0.613 . . . . 116.11 112.656 -174.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' GLU . . . . . 0.412 ' O ' ' N ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -62.3 -49.93 73.68 Favored 'General case' 0 C--O 1.249 1.06 0 CA-C-O 121.371 0.605 . . . . 131.16 111.646 177.246 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -63.99 -39.87 95.08 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.987 -1.006 . . . . 118.64 111.527 178.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 94.0 mt -53.86 -46.93 71.41 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 107.592 -1.262 . . . . 116.41 107.592 176.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 6.4 m -69.24 -49.97 51.43 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 113.793 -1.549 . . . . 108.75 110.393 -178.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' PHE . . . . . 0.412 ' N ' ' O ' ' A' ' 48' ' ' GLU . 60.5 t80 -52.35 -55.98 17.95 Favored 'General case' 0 CA--C 1.561 1.375 0 N-CA-C 115.314 1.598 . . . . 118.14 115.314 177.6 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -67.54 -30.72 70.44 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 114.723 1.379 . . . . 104.63 114.723 -178.192 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 33.1 ttm180 -54.75 -45.94 74.23 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 109.497 -0.557 . . . . 155.41 109.497 175.318 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.72 -25.97 66.83 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 114.748 -1.114 . . . . 131.7 113.069 178.803 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 8.7 mmt180 -89.86 -10.86 43.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.304 -0.407 . . . . 155.05 110.952 -174.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 115.97 17.65 6.26 Favored Glycine 0 CA--C 1.524 0.624 0 CA-C-N 116.327 -0.397 . . . . 118.0 112.437 -179.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -134.86 53.92 1.97 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.428 0.691 . . . . 104.08 110.508 -165.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.37 110.77 4.26 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.498 -0.319 . . . . 127.78 111.475 177.281 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.8 mt -106.12 21.97 16.47 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 121.298 0.571 . . . . 102.81 110.697 176.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 8.7 m -109.19 -43.03 4.24 Favored 'General case' 0 CA--C 1.504 -0.82 0 CA-C-N 115.796 -0.638 . . . . 122.22 111.746 -166.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.9 m -69.24 116.57 43.66 Favored Pre-proline 0 C--O 1.24 0.601 0 CA-C-N 115.207 -0.906 . . . . 124.14 110.847 -177.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_exo -57.33 162.91 9.05 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.706 2.271 . . . . 121.02 110.131 -177.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -163.13 96.52 1.07 Allowed Pre-proline 0 C--O 1.235 0.32 0 O-C-N 123.762 0.664 . . . . 122.56 110.469 173.922 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -79.78 43.37 1.49 Allowed 'Trans proline' 0 CA--C 1.535 0.552 0 N-CA-C 115.12 1.161 . . . . 148.58 115.12 179.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.61 -53.39 16.11 Favored 'General case' 0 CA--C 1.51 -0.568 0 N-CA-C 104.822 -2.288 . . . . 133.71 104.822 169.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -84.69 -0.35 53.21 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 113.879 -1.51 . . . . 115.91 111.999 175.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 57.47 70.22 0.67 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.984 0.897 . . . . 137.14 108.667 -157.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -124.41 90.97 50.19 Favored Pre-proline 0 N--CA 1.438 -1.03 0 CA-C-N 114.845 -1.07 . . . . 120.52 109.66 174.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -63.29 136.88 57.79 Favored 'Trans proline' 0 CA--C 1.528 0.176 0 N-CA-C 107.092 -1.926 . . . . 123.12 107.092 164.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -64.19 -165.06 0.84 Allowed Glycine 0 CA--C 1.521 0.457 0 CA-C-N 118.953 0.797 . . . . 105.42 114.134 -175.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 63.8 mt -108.29 114.85 29.03 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 116.369 1.989 . . . . 127.57 116.369 -169.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.31 152.64 96.46 Favored Pre-proline 0 C--O 1.237 0.439 0 N-CA-C 108.576 -0.898 . . . . 127.22 108.576 170.29 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -60.41 158.93 29.22 Favored 'Trans proline' 0 C--O 1.246 0.921 0 C-N-CA 116.77 -1.687 . . . . 120.2 110.812 168.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLY . . . . . 0.65 ' N ' ' O ' ' A' ' 45' ' ' MSE . . . 84.28 -26.36 5.07 Favored Glycine 0 CA--C 1.528 0.894 0 C-N-CA 120.317 -0.944 . . . . 107.35 113.572 -176.871 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -69.14 148.33 50.1 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 122.533 -0.392 . . . . 120.71 111.351 174.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -90.52 156.11 18.41 Favored 'General case' 0 C--O 1.251 1.135 0 C-N-CA 122.656 0.382 . . . . 110.36 110.676 178.388 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 42.7 t-105 -166.1 155.29 11.57 Favored 'General case' 0 C--O 1.261 1.675 0 C-N-CA 118.811 -1.155 . . . . 76.9 113.171 -177.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 32.8 m -99.77 112.77 24.99 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 117.865 -1.534 . . . . 77.64 109.292 177.48 -50.398 -80.132 -76.363 100.203 2.042 108.836 -33.637 -59.488 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 13.6 mt -109.94 152.01 26.39 Favored 'General case' 0 CA--C 1.497 -1.092 0 CA-C-N 114.508 -1.224 . . . . 104.48 108.644 -170.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 59.9 m -59.03 149.48 27.46 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 119.592 -0.843 . . . . 86.65 109.014 172.221 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -69.11 -52.95 23.05 Favored 'General case' 0 N--CA 1.44 -0.961 0 N-CA-C 106.103 -1.814 . . . . 103.83 106.103 -179.045 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -52.27 -34.39 46.15 Favored 'General case' 0 C--O 1.222 -0.366 0 O-C-N 124.234 0.959 . . . . 108.65 112.548 176.704 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.1 mmt180 -79.32 -10.38 59.8 Favored 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 112.412 0.523 . . . . 116.84 112.412 178.71 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' TRP . . . . . . . . . . . . . 86.3 t90 -99.06 -43.91 6.49 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 108.208 -1.034 . . . . 115.69 108.208 177.113 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.8 ttp180 -61.09 -22.37 64.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.119 -0.946 . . . . 135.31 109.558 179.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -63.84 -54.5 34.06 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.857 -0.611 . . . . 134.92 110.23 169.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.29 -18.56 64.56 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 112.47 0.545 . . . . 119.75 112.47 -177.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 8.0 tp -70.97 -51.83 23.33 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 123.044 0.215 . . . . 147.22 111.548 176.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -77.41 -7.33 55.96 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 116.685 -0.234 . . . . 150.79 111.624 178.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -104.79 20.55 18.52 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.253 0.549 . . . . 122.57 109.957 172.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 53.99 25.99 32.9 Favored Glycine 0 C--O 1.223 -0.574 0 N-CA-C 117.697 1.839 . . . . 132.89 117.697 174.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 19.0 m -134.11 19.93 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 113.861 1.06 . . . . 138.0 113.861 -176.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -55.12 129.18 67.07 Favored Pre-proline 0 N--CA 1.47 0.532 0 N-CA-C 114.711 1.374 . . . . 108.27 114.711 -179.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -77.81 157.07 31.37 Favored 'Trans proline' 0 C--O 1.248 1.002 0 C-N-CA 122.044 1.83 . . . . 92.0 111.839 -179.409 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -68.82 120.93 7.8 Favored 'Trans proline' 0 CA--C 1.53 0.281 0 C-N-CA 122.334 2.023 . . . . 98.39 113.06 -173.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 3.5 m -96.93 149.54 4.85 Favored 'Isoleucine or valine' 0 C--O 1.239 0.511 0 N-CA-C 113.684 0.994 . . . . 116.63 113.684 -178.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 6.5 mt -106.78 103.37 15.36 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.65 0 N-CA-C 107.01 -1.478 . . . . 81.55 107.01 174.769 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 6.7 mp -71.53 -26.95 62.87 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 116.379 1.992 . . . . 90.25 116.379 -165.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 36.9 mp0 -75.01 -9.53 58.62 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 119.346 -0.942 . . . . 87.2 108.664 -179.478 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -111.75 12.99 21.07 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-N 115.207 -0.906 . . . . 64.68 112.537 -177.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -123.26 132.89 54.19 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 119.076 -1.05 . . . . 77.89 112.501 178.148 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 17.1 t-80 -60.3 154.22 20.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.594 -1.184 . . . . 82.16 113.786 -170.318 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.58 -30.85 71.88 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 115.795 -0.638 . . . . 81.69 111.912 -173.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 60.8 p -67.7 -8.67 37.03 Favored 'General case' 0 C--O 1.219 -0.51 0 N-CA-C 113.668 0.988 . . . . 85.04 113.668 179.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -59.39 -30.71 68.63 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 108.484 -0.932 . . . . 90.14 108.484 172.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 12.8 mt -70.23 -16.86 63.11 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 113.83 1.048 . . . . 99.37 113.83 -177.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -76.32 -6.34 51.1 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 116.048 -0.523 . . . . 121.58 109.978 168.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -112.42 -49.73 2.94 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 116.664 -0.244 . . . . 111.19 110.702 179.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 29.7 m -129.15 -173.97 1.1 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.3 0 N-CA-C 110.256 -0.276 . . . . 98.45 110.256 177.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 24.4 p -103.82 168.4 9.16 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 112.093 0.405 . . . . 105.17 112.093 -176.285 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.77 -35.49 80.88 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 107.115 -1.439 . . . . 122.85 107.115 179.124 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.23 -34.11 74.33 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 114.328 -1.306 . . . . 140.37 113.76 -168.218 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -85.28 -21.27 29.09 Favored 'General case' 0 C--O 1.24 0.6 0 CA-C-O 121.849 0.833 . . . . 121.77 110.088 177.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 12.1 mt -72.99 -54.31 8.94 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-N 114.524 -1.217 . . . . 97.48 109.9 171.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 6.3 mttt -55.21 -47.97 74.53 Favored 'General case' 0 C--O 1.244 0.773 0 O-C-N 124.434 1.084 . . . . 98.53 110.239 175.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -42.41 -49.53 5.2 Favored 'General case' 0 C--O 1.243 0.723 0 O-C-N 124.563 1.165 . . . . 104.66 111.398 174.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -105.61 45.52 0.96 Allowed 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 116.178 1.918 . . . . 121.05 116.178 -179.139 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -75.3 -154.4 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 107.825 -1.176 . . . . 105.87 107.825 178.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -111.86 1.41 16.53 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.827 1.047 . . . . 110.74 113.827 179.968 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.261 1.808 0 CA-C-O 118.838 -0.979 . . . . 113.15 114.861 -179.963 . . . . . . . . 0 0 . 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 build full ' A' A ' 2' ' ' MSE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.539 0.523 0 N-CA-C 112.078 0.399 . . . . 113.7 112.078 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -71.66 126.71 30.4 Favored 'General case' 0 C--O 1.242 0.679 0 N-CA-C 110.016 -0.364 . . . . 118.5 110.016 177.585 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -86.15 139.67 30.88 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 120.865 -0.334 . . . . 81.379999999999995 111.29 -170.999 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' MSE . . . . . . . . . . . . . 0.0 OUTLIER -122.81 148.15 45.72 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 117.37 2.359 . . . . 95.469999999999999 117.37 -156.764 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 21.0 p30 -99.96 -178.01 3.72 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 121.801 -0.562 . . . . 78.109999999999999 112.505 178.178 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' VAL . . . . . 0.455 HG22 HD23 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -58.65 -34.22 50.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 C-N-CA 120.372 -0.531 . . . . 110.44 111.316 -176.712 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LEU . . . . . 0.455 HD23 HG22 ' A' ' 7' ' ' VAL . 14.0 mt -75.6 -18.7 59.63 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 113.675 0.991 . . . . 108.61 113.675 -172.417 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 106.32 2.51 38.32 Favored Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 111.15 -0.78 . . . . 87.959999999999994 111.15 179.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' THR . . . . . 0.557 ' HB ' ' O ' ' A' ' 207' ' ' HOH . 0.9 OUTLIER -98.76 168.63 9.45 Favored Pre-proline 0 C--O 1.239 0.546 0 CA-C-N 116.943 0.371 . . . . 98.299999999999997 111.234 179.126 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -62.85 132.41 37.12 Favored 'Trans proline' 0 C--N 1.354 0.823 0 O-C-N 122.957 0.978 . . . . 76.739999999999995 111.652 172.446 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 20.0 tp -51.22 129.64 24.91 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 115.003 -0.999 . . . . 74.090000000000003 111.066 178.138 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -99.25 -178.22 3.85 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 119.164 -1.014 . . . . 94.120000000000005 111.583 179.331 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 42.4 t -64.77 145.56 56.06 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 115.872 -0.603 . . . . 66.040000000000006 110.101 178.735 -175.937 -156.578 96.061 101.3 2.023 103.781 36.987 -84.451 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 49.3 t -99.12 72.73 1.89 Allowed 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 103.414 -2.81 . . . . 71.980000000000004 103.414 163.667 -173.933 -58.146 18.969 53.143 17.583 131.048 136.406 -179.806 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.8 m -90.13 159.44 16.77 Favored 'General case' 0 C--O 1.245 0.816 0 CA-C-N 116.26 -0.427 . . . . 84.280000000000001 111.968 -169.778 -84.451 36.987 96.061 103.781 2.023 101.3 -156.578 -175.937 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -91.54 150.57 21.14 Favored 'General case' 0 C--O 1.246 0.895 0 CA-C-N 115.712 -0.676 . . . . 87.150000000000006 111.691 170.334 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -72.61 131.38 84.49 Favored Pre-proline 0 C--N 1.328 -0.329 0 C-N-CA 119.976 -0.69 . . . . 102.86 109.257 165.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -81.28 146.5 69.71 Favored 'Cis proline' 0 CA--C 1.53 0.28 0 O-C-N 122.545 0.76 . . . . 87.900000000000006 113.661 10.228 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LEU . . . . . 0.462 HD12 ' H ' ' A' ' 21' ' ' THR . 43.8 tp -89.34 143.46 26.81 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-O 121.37 0.605 . . . . 82.019999999999996 110.753 -176.928 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' THR . . . . . 0.822 HG23 ' HA2' ' A' ' 27' ' ' GLY . 1.3 t -116.82 170.57 8.51 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 118.602 -1.239 . . . . 90.829999999999998 113.744 -164.772 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLY . . . . . 0.435 ' N ' ' OG1' ' A' ' 21' ' ' THR . . . 84.44 141.71 5.23 Favored Glycine 0 N--CA 1.439 -1.149 0 N-CA-C 110.414 -1.075 . . . . 61.159999999999997 110.414 -177.153 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -51.64 -24.59 5.76 Favored 'General case' 0 CA--C 1.552 1.043 0 N-CA-C 114.08 1.141 . . . . 83.760000000000005 114.08 172.682 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 81.6 m-85 -114.11 13.37 18.07 Favored 'General case' 0 CA--C 1.483 -1.625 0 N-CA-C 108.944 -0.761 . . . . 68.590000000000003 108.944 -176.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.4 mtp180 53.65 36.75 24.41 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 113.614 -1.63 . . . . 118.44 111.741 170.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 53.1 p-10 -105.98 -1.96 23.39 Favored 'General case' 0 C--O 1.244 0.793 0 CA-C-N 115.711 -0.677 . . . . 68.659999999999997 111.27 173.396 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLY . . . . . 0.822 ' HA2' HG23 ' A' ' 21' ' ' THR . . . 103.14 7.76 42.96 Favored Glycine 0 C--O 1.215 -1.047 0 C-N-CA 119.433 -1.365 . . . . 53.640000000000001 113.006 176.66 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -132.98 135.47 45.5 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.646 0.736 . . . . 66.459999999999994 112.664 -168.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 86.3 m -77.23 49.03 0.66 Allowed 'General case' 0 CA--C 1.489 -1.399 0 C-N-CA 120.183 -0.607 . . . . 75.260000000000005 109.796 177.256 -59.488 -33.637 -76.363 108.836 2.042 100.203 -80.132 -50.398 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 18.7 ptt85 -91.1 156.11 18.14 Favored 'General case' 0 CA--C 1.503 -0.856 0 N-CA-C 107.597 -1.261 . . . . 78.540000000000006 107.597 176.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 11.5 t -113.14 -173.39 2.24 Favored 'General case' 0 N--CA 1.434 -1.23 0 N-CA-C 106.597 -1.631 . . . . 84.370000000000005 106.597 -176.727 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 170.47 -151.35 16.12 Favored Glycine 0 N--CA 1.442 -0.966 0 C-N-CA 120.136 -1.031 . . . . 78.939999999999998 110.853 -174.505 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -77.83 -54.8 5.91 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 113.041 0.756 . . . . 91.469999999999999 113.041 -166.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -57.49 -51.08 59.96 Favored Glycine 0 CA--C 1.523 0.537 0 C-N-CA 120.762 -0.732 . . . . 125.93000000000001 112.91 -175.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ASP . . . . . 0.423 ' OD1' ' N ' ' A' ' 37' ' ' GLY . 56.2 t0 -61.6 137.2 58.23 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.301 -0.45 . . . . 117.56 110.459 -179.68 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 1.6 t -121.89 -8.27 9.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 108.156 -1.053 . . . . 115.73999999999999 108.156 168.291 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLY . . . . . 0.423 ' N ' ' OD1' ' A' ' 35' ' ' ASP . . . -73.37 -18.51 79.36 Favored Glycine 0 N--CA 1.451 -0.342 0 CA-C-N 115.656 -0.702 . . . . 109.16 114.596 178.591 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 52.94 68.64 0.8 Allowed 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.548 0.689 . . . . 96.989999999999995 112.798 -171.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 54.0 m80 -80.46 75.62 7.3 Favored 'General case' 0 C--O 1.245 0.863 0 N-CA-C 107.35 -1.352 . . . . 98.200000000000003 107.35 174.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' VAL . . . . . 0.476 ' HB ' ' HB3' ' A' ' 103' ' ' HIS . 10.7 m -112.36 5.6 8.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 N-CA-C 114.411 1.263 . . . . 77.189999999999998 114.411 -175.898 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' VAL . . . . . 0.603 ' HA ' ' HB ' ' A' ' 102' ' ' THR . 49.6 t -108.06 110.39 31.76 Favored 'Isoleucine or valine' 0 C--O 1.246 0.903 0 N-CA-C 113.245 0.831 . . . . 78.640000000000001 113.245 -178.726 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 53.0 t -80.36 101.67 9.12 Favored 'General case' 0 C--O 1.251 1.153 0 C-N-CA 118.209 -1.396 . . . . 80.670000000000002 112.762 175.45 -179.806 136.406 18.969 131.048 17.583 53.143 -58.146 -173.933 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -112.46 161.74 16.38 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-N 115.96 -0.564 . . . . 79.060000000000002 110.373 -176.184 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLN . . . . . 0.592 ' HB3' ' HG2' ' A' ' 96' ' ' PRO . 52.4 tt0 -103.03 133.83 47.48 Favored 'General case' 0 C--O 1.241 0.637 0 N-CA-C 108.738 -0.838 . . . . 106.04000000000001 108.738 171.791 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' MSE . . . . . 0.617 ' HE1' HD11 ' A' ' 80' ' ' LEU . 32.2 mmt -72.83 126.4 29.84 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 119.5 -0.88 . . . . 106.12 112.823 -170.812 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 68.0 p -114.05 138.77 49.94 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 115.645 -0.707 . . . . 117.09 109.658 169.329 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ALA . . . . . 0.486 ' HA ' HD12 ' A' ' 50' ' ' LEU . . . -56.15 -32.15 64.01 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 112.656 0.613 . . . . 116.11 112.656 -174.067 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.3 -49.93 73.68 Favored 'General case' 0 C--O 1.249 1.06 0 CA-C-O 121.371 0.605 . . . . 131.16 111.646 177.246 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -63.99 -39.87 95.08 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.987 -1.006 . . . . 118.64 111.527 178.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LEU . . . . . 0.486 HD12 ' HA ' ' A' ' 47' ' ' ALA . 94.0 mt -53.86 -46.93 71.41 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 107.592 -1.262 . . . . 116.41 107.592 176.004 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 6.4 m -69.24 -49.97 51.43 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 113.793 -1.549 . . . . 108.75 110.393 -178.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -52.35 -55.98 17.95 Favored 'General case' 0 CA--C 1.561 1.375 0 N-CA-C 115.314 1.598 . . . . 118.14 115.314 177.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -67.54 -30.72 70.44 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 114.723 1.379 . . . . 104.63 114.723 -178.192 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ARG . . . . . 0.575 ' HG3' ' HB2' ' A' ' 59' ' ' ASP . 33.1 ttm180 -54.75 -45.94 74.23 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 109.497 -0.557 . . . . 155.41 109.497 175.318 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.72 -25.97 66.83 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 114.748 -1.114 . . . . 131.69999999999999 113.069 178.803 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 8.7 mmt180 -89.86 -10.86 43.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.304 -0.407 . . . . 155.05000000000001 110.952 -174.051 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 115.97 17.65 6.26 Favored Glycine 0 CA--C 1.524 0.624 0 CA-C-N 116.327 -0.397 . . . . 118.0 112.437 -179.272 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -134.86 53.92 1.97 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.428 0.691 . . . . 104.08 110.508 -165.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ASP . . . . . 0.575 ' HB2' ' HG3' ' A' ' 54' ' ' ARG . 0.7 OUTLIER -68.37 110.77 4.26 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.498 -0.319 . . . . 127.78 111.475 177.281 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.8 mt -106.12 21.97 16.47 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 121.298 0.571 . . . . 102.81 110.697 176.264 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 8.7 m -109.19 -43.03 4.24 Favored 'General case' 0 CA--C 1.504 -0.82 0 CA-C-N 115.796 -0.638 . . . . 122.22 111.746 -166.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' THR . . . . . 0.409 ' HA ' ' HD3' ' A' ' 63' ' ' PRO . 1.9 m -69.24 116.57 43.66 Favored Pre-proline 0 C--O 1.24 0.601 0 CA-C-N 115.207 -0.906 . . . . 124.14 110.847 -177.752 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 62' ' ' THR . 43.7 Cg_exo -57.33 162.91 9.05 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.706 2.271 . . . . 121.02 110.131 -177.829 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -163.13 96.52 1.07 Allowed Pre-proline 0 C--O 1.235 0.32 0 O-C-N 123.762 0.664 . . . . 122.56 110.469 173.922 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -79.78 43.37 1.49 Allowed 'Trans proline' 0 CA--C 1.535 0.552 0 N-CA-C 115.12 1.161 . . . . 148.58000000000001 115.12 179.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.61 -53.39 16.11 Favored 'General case' 0 CA--C 1.51 -0.568 0 N-CA-C 104.822 -2.288 . . . . 133.71000000000001 104.822 169.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' TYR . . . . . 0.674 ' HE2' ' O ' ' A' ' 203' ' ' HOH . 2.4 m-85 -84.69 -0.35 53.21 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 113.879 -1.51 . . . . 115.91 111.999 175.334 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 57.47 70.22 0.67 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.984 0.897 . . . . 137.13999999999999 108.667 -157.096 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -124.41 90.97 50.19 Favored Pre-proline 0 N--CA 1.438 -1.03 0 CA-C-N 114.845 -1.07 . . . . 120.52 109.66 174.675 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -63.29 136.88 57.79 Favored 'Trans proline' 0 CA--C 1.528 0.176 0 N-CA-C 107.092 -1.926 . . . . 123.12 107.092 164.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -64.19 -165.06 0.84 Allowed Glycine 0 CA--C 1.521 0.457 0 CA-C-N 118.953 0.797 . . . . 105.42 114.134 -175.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 63.8 mt -108.29 114.85 29.03 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 116.369 1.989 . . . . 127.56999999999999 116.369 -169.293 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.31 152.64 96.46 Favored Pre-proline 0 C--O 1.237 0.439 0 N-CA-C 108.576 -0.898 . . . . 127.22 108.576 170.29 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -60.41 158.93 29.22 Favored 'Trans proline' 0 C--O 1.246 0.921 0 C-N-CA 116.77 -1.687 . . . . 120.2 110.812 168.756 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLY . . . . . 0.517 ' N ' ' O ' ' A' ' 45' ' ' MSE . . . 84.28 -26.36 5.07 Favored Glycine 0 CA--C 1.528 0.894 0 C-N-CA 120.317 -0.944 . . . . 107.34999999999999 113.572 -176.871 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -69.14 148.33 50.1 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 122.533 -0.392 . . . . 120.70999999999999 111.351 174.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -90.52 156.11 18.41 Favored 'General case' 0 C--O 1.251 1.135 0 C-N-CA 122.656 0.382 . . . . 110.36 110.676 178.388 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' TRP . . . . . 0.403 ' HD1' HD23 ' A' ' 80' ' ' LEU . 42.7 t-105 -166.1 155.29 11.57 Favored 'General case' 0 C--O 1.261 1.675 0 C-N-CA 118.811 -1.155 . . . . 76.900000000000006 113.171 -177.58 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 32.8 m -99.77 112.77 24.99 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 117.865 -1.534 . . . . 77.640000000000001 109.292 177.48 -50.398 -80.132 -76.363 100.203 2.042 108.836 -33.637 -59.488 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LEU . . . . . 0.617 HD11 ' HE1' ' A' ' 45' ' ' MSE . 13.6 mt -109.94 152.01 26.39 Favored 'General case' 0 CA--C 1.497 -1.092 0 CA-C-N 114.508 -1.224 . . . . 104.48 108.644 -170.533 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 59.9 m -59.03 149.48 27.46 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 119.592 -0.843 . . . . 86.650000000000006 109.014 172.221 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -69.11 -52.95 23.05 Favored 'General case' 0 N--CA 1.44 -0.961 0 N-CA-C 106.103 -1.814 . . . . 103.83 106.103 -179.045 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -52.27 -34.39 46.15 Favored 'General case' 0 C--O 1.222 -0.366 0 O-C-N 124.234 0.959 . . . . 108.65000000000001 112.548 176.704 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ARG . . . . . 0.402 ' HA ' ' HD2' ' A' ' 84' ' ' ARG . 1.1 mmt180 -79.32 -10.38 59.8 Favored 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 112.412 0.523 . . . . 116.84 112.412 178.71 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' TRP . . . . . 0.459 ' CD1' ' HD2' ' A' ' 95' ' ' PRO . 86.3 t90 -99.06 -43.91 6.49 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 108.208 -1.034 . . . . 115.69 108.208 177.113 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.8 ttp180 -61.09 -22.37 64.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.119 -0.946 . . . . 135.31 109.558 179.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -63.84 -54.5 34.06 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.857 -0.611 . . . . 134.91999999999999 110.23 169.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.29 -18.56 64.56 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 112.47 0.545 . . . . 119.75 112.47 -177.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 8.0 tp -70.97 -51.83 23.33 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 123.044 0.215 . . . . 147.22 111.548 176.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -77.41 -7.33 55.96 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 116.685 -0.234 . . . . 150.78999999999999 111.624 178.168 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -104.79 20.55 18.52 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.253 0.549 . . . . 122.56999999999999 109.957 172.464 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 53.99 25.99 32.9 Favored Glycine 0 C--O 1.223 -0.574 0 N-CA-C 117.697 1.839 . . . . 132.88999999999999 117.697 174.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 19.0 m -134.11 19.93 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 113.861 1.06 . . . . 138.0 113.861 -176.75 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -55.12 129.18 67.07 Favored Pre-proline 0 N--CA 1.47 0.532 0 N-CA-C 114.711 1.374 . . . . 108.27 114.711 -179.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' PRO . . . . . 0.459 ' HD2' ' CD1' ' A' ' 85' ' ' TRP . 64.9 Cg_endo -77.81 157.07 31.37 Favored 'Trans proline' 0 C--O 1.248 1.002 0 C-N-CA 122.044 1.83 . . . . 92.0 111.839 -179.409 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' PRO . . . . . 0.592 ' HG2' ' HB3' ' A' ' 44' ' ' GLN . 59.2 Cg_endo -68.82 120.93 7.8 Favored 'Trans proline' 0 CA--C 1.53 0.281 0 C-N-CA 122.334 2.023 . . . . 98.390000000000001 113.06 -173.63 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 3.5 m -96.93 149.54 4.85 Favored 'Isoleucine or valine' 0 C--O 1.239 0.511 0 N-CA-C 113.684 0.994 . . . . 116.63 113.684 -178.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 6.5 mt -106.78 103.37 15.36 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.65 0 N-CA-C 107.01 -1.478 . . . . 81.549999999999997 107.01 174.769 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 6.7 mp -71.53 -26.95 62.87 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 116.379 1.992 . . . . 90.25 116.379 -165.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 36.9 mp0 -75.01 -9.53 58.62 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 119.346 -0.942 . . . . 87.200000000000003 108.664 -179.478 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -111.75 12.99 21.07 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-N 115.207 -0.906 . . . . 64.680000000000007 112.537 -177.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' THR . . . . . 0.603 ' HB ' ' HA ' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -123.26 132.89 54.19 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 119.076 -1.05 . . . . 77.890000000000001 112.501 178.148 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HIS . . . . . 0.476 ' HB3' ' HB ' ' A' ' 40' ' ' VAL . 17.1 t-80 -60.3 154.22 20.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.594 -1.184 . . . . 82.159999999999997 113.786 -170.318 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.58 -30.85 71.88 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 115.795 -0.638 . . . . 81.689999999999998 111.912 -173.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 60.8 p -67.7 -8.67 37.03 Favored 'General case' 0 C--O 1.219 -0.51 0 N-CA-C 113.668 0.988 . . . . 85.040000000000006 113.668 179.706 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -59.39 -30.71 68.63 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 108.484 -0.932 . . . . 90.140000000000001 108.484 172.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' LEU . . . . . 0.421 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 12.8 mt -70.23 -16.86 63.11 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 113.83 1.048 . . . . 99.370000000000005 113.83 -177.521 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -76.32 -6.34 51.1 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 116.048 -0.523 . . . . 121.58 109.978 168.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -112.42 -49.73 2.94 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 116.664 -0.244 . . . . 111.19 110.702 179.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' VAL . . . . . 0.421 ' O ' ' HA ' ' A' ' 107' ' ' LEU . 29.7 m -129.15 -173.97 1.1 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.3 0 N-CA-C 110.256 -0.276 . . . . 98.450000000000003 110.256 177.001 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 111' ' ' SER . . . . . 0.521 ' OG ' ' HG2' ' A' ' 113' ' ' GLU . 24.4 p -103.82 168.4 9.16 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 112.093 0.405 . . . . 105.17 112.093 -176.285 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.77 -35.49 80.88 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 107.115 -1.439 . . . . 122.84999999999999 107.115 179.124 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 113' ' ' GLU . . . . . 0.521 ' HG2' ' OG ' ' A' ' 111' ' ' SER . 0.0 OUTLIER -69.23 -34.11 74.33 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 114.328 -1.306 . . . . 140.37 113.76 -168.218 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -85.28 -21.27 29.09 Favored 'General case' 0 C--O 1.24 0.6 0 CA-C-O 121.849 0.833 . . . . 121.77 110.088 177.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 12.1 mt -72.99 -54.31 8.94 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-N 114.524 -1.217 . . . . 97.480000000000004 109.9 171.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 6.3 mttt -55.21 -47.97 74.53 Favored 'General case' 0 C--O 1.244 0.773 0 O-C-N 124.434 1.084 . . . . 98.530000000000001 110.239 175.382 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -42.41 -49.53 5.2 Favored 'General case' 0 C--O 1.243 0.723 0 O-C-N 124.563 1.165 . . . . 104.66 111.398 174.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -105.61 45.52 0.96 Allowed 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 116.178 1.918 . . . . 121.05 116.178 -179.139 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -75.3 -154.4 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 107.825 -1.176 . . . . 105.87 107.825 178.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' LEU . . . . . 0.449 ' HA ' HD23 ' A' ' 120' ' ' LEU . 1.0 OUTLIER -111.86 1.41 16.53 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.827 1.047 . . . . 110.73999999999999 113.827 179.968 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.261 1.808 0 CA-C-O 118.838 -0.979 . . . . 113.15000000000001 114.861 -179.963 . . . . . . . . 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 . . . . . 0.674 ' O ' ' HE2' ' A' ' 67' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.557 ' O ' ' HB ' ' A' ' 10' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 nobuild full ' A' A ' 2' ' ' MSE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.539 0.523 0 N-CA-C 112.078 0.399 . . . . 113.7 112.078 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -71.66 126.71 30.4 Favored 'General case' 0 C--O 1.242 0.679 0 N-CA-C 110.016 -0.364 . . . . 118.5 110.016 177.585 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -86.15 139.67 30.88 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 120.865 -0.334 . . . . 81.379999999999995 111.29 -170.999 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' MSE . . . . . . . . . . . . . 0.0 OUTLIER -122.81 148.15 45.72 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 117.37 2.359 . . . . 95.469999999999999 117.37 -156.764 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 21.0 p30 -99.96 -178.01 3.72 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 121.801 -0.562 . . . . 78.109999999999999 112.505 178.178 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.455 HG22 HD23 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -58.65 -34.22 50.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 C-N-CA 120.372 -0.531 . . . . 110.44 111.316 -176.712 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.455 HD23 HG22 ' A' ' 7' ' ' VAL . 14.0 mt -75.6 -18.7 59.63 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 113.675 0.991 . . . . 108.61 113.675 -172.417 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 106.32 2.51 38.32 Favored Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 111.15 -0.78 . . . . 87.959999999999994 111.15 179.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' THR . . . . . 0.557 ' HB ' ' O ' ' A' ' 207' ' ' HOH . 0.9 OUTLIER -98.76 168.63 9.45 Favored Pre-proline 0 C--O 1.239 0.546 0 CA-C-N 116.943 0.371 . . . . 98.299999999999997 111.234 179.126 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -62.85 132.41 37.12 Favored 'Trans proline' 0 C--N 1.354 0.823 0 O-C-N 122.957 0.978 . . . . 76.739999999999995 111.652 172.446 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 20.0 tp -51.22 129.64 24.91 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 115.003 -0.999 . . . . 74.090000000000003 111.066 178.138 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -99.25 -178.22 3.85 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 119.164 -1.014 . . . . 94.120000000000005 111.583 179.331 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 42.4 t -64.77 145.56 56.06 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 115.872 -0.603 . . . . 66.040000000000006 110.101 178.735 -175.937 -156.578 96.061 101.3 2.023 103.781 36.987 -84.451 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 49.3 t -99.12 72.73 1.89 Allowed 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 103.414 -2.81 . . . . 71.980000000000004 103.414 163.667 -173.933 -58.146 18.969 53.143 17.583 131.048 136.406 -179.806 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.8 m -90.13 159.44 16.77 Favored 'General case' 0 C--O 1.245 0.816 0 CA-C-N 116.26 -0.427 . . . . 84.280000000000001 111.968 -169.778 -84.451 36.987 96.061 103.781 2.023 101.3 -156.578 -175.937 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -91.54 150.57 21.14 Favored 'General case' 0 C--O 1.246 0.895 0 CA-C-N 115.712 -0.676 . . . . 87.150000000000006 111.691 170.334 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -72.61 131.38 84.49 Favored Pre-proline 0 C--N 1.328 -0.329 0 C-N-CA 119.976 -0.69 . . . . 102.86 109.257 165.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -81.28 146.5 69.71 Favored 'Cis proline' 0 CA--C 1.53 0.28 0 O-C-N 122.545 0.76 . . . . 87.900000000000006 113.661 10.228 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.462 HD12 ' H ' ' A' ' 21' ' ' THR . 43.8 tp -89.34 143.46 26.81 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-O 121.37 0.605 . . . . 82.019999999999996 110.753 -176.928 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' THR . . . . . 0.822 HG23 ' HA2' ' A' ' 27' ' ' GLY . 1.3 t -116.82 170.57 8.51 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 118.602 -1.239 . . . . 90.829999999999998 113.744 -164.772 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.435 ' N ' ' OG1' ' A' ' 21' ' ' THR . . . 84.44 141.71 5.23 Favored Glycine 0 N--CA 1.439 -1.149 0 N-CA-C 110.414 -1.075 . . . . 61.159999999999997 110.414 -177.153 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -51.64 -24.59 5.76 Favored 'General case' 0 CA--C 1.552 1.043 0 N-CA-C 114.08 1.141 . . . . 83.760000000000005 114.08 172.682 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 81.6 m-85 -114.11 13.37 18.07 Favored 'General case' 0 CA--C 1.483 -1.625 0 N-CA-C 108.944 -0.761 . . . . 68.590000000000003 108.944 -176.164 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.4 mtp180 53.65 36.75 24.41 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 113.614 -1.63 . . . . 118.44 111.741 170.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 53.1 p-10 -105.98 -1.96 23.39 Favored 'General case' 0 C--O 1.244 0.793 0 CA-C-N 115.711 -0.677 . . . . 68.659999999999997 111.27 173.396 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.822 ' HA2' HG23 ' A' ' 21' ' ' THR . . . 103.14 7.76 42.96 Favored Glycine 0 C--O 1.215 -1.047 0 C-N-CA 119.433 -1.365 . . . . 53.640000000000001 113.006 176.66 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -132.98 135.47 45.5 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.646 0.736 . . . . 66.459999999999994 112.664 -168.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 86.3 m -77.23 49.03 0.66 Allowed 'General case' 0 CA--C 1.489 -1.399 0 C-N-CA 120.183 -0.607 . . . . 75.260000000000005 109.796 177.256 -59.488 -33.637 -76.363 108.836 2.042 100.203 -80.132 -50.398 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 18.7 ptt85 -91.1 156.11 18.14 Favored 'General case' 0 CA--C 1.503 -0.856 0 N-CA-C 107.597 -1.261 . . . . 78.540000000000006 107.597 176.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 11.5 t -113.14 -173.39 2.24 Favored 'General case' 0 N--CA 1.434 -1.23 0 N-CA-C 106.597 -1.631 . . . . 84.370000000000005 106.597 -176.727 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 170.47 -151.35 16.12 Favored Glycine 0 N--CA 1.442 -0.966 0 C-N-CA 120.136 -1.031 . . . . 78.939999999999998 110.853 -174.505 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -77.83 -54.8 5.91 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 113.041 0.756 . . . . 91.469999999999999 113.041 -166.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -57.49 -51.08 59.96 Favored Glycine 0 CA--C 1.523 0.537 0 C-N-CA 120.762 -0.732 . . . . 125.93000000000001 112.91 -175.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.423 ' OD1' ' N ' ' A' ' 37' ' ' GLY . 56.2 t0 -61.6 137.2 58.23 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.301 -0.45 . . . . 117.56 110.459 -179.68 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 1.6 t -121.89 -8.27 9.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 108.156 -1.053 . . . . 115.73999999999999 108.156 168.291 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.423 ' N ' ' OD1' ' A' ' 35' ' ' ASP . . . -73.37 -18.51 79.36 Favored Glycine 0 N--CA 1.451 -0.342 0 CA-C-N 115.656 -0.702 . . . . 109.16 114.596 178.591 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 52.94 68.64 0.8 Allowed 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.548 0.689 . . . . 96.989999999999995 112.798 -171.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 54.0 m80 -80.46 75.62 7.3 Favored 'General case' 0 C--O 1.245 0.863 0 N-CA-C 107.35 -1.352 . . . . 98.200000000000003 107.35 174.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.476 ' HB ' ' HB3' ' A' ' 103' ' ' HIS . 10.7 m -112.36 5.6 8.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 N-CA-C 114.411 1.263 . . . . 77.189999999999998 114.411 -175.898 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.603 ' HA ' ' HB ' ' A' ' 102' ' ' THR . 49.6 t -108.06 110.39 31.76 Favored 'Isoleucine or valine' 0 C--O 1.246 0.903 0 N-CA-C 113.245 0.831 . . . . 78.640000000000001 113.245 -178.726 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 53.0 t -80.36 101.67 9.12 Favored 'General case' 0 C--O 1.251 1.153 0 C-N-CA 118.209 -1.396 . . . . 80.670000000000002 112.762 175.45 -179.806 136.406 18.969 131.048 17.583 53.143 -58.146 -173.933 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -112.46 161.74 16.38 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-N 115.96 -0.564 . . . . 79.060000000000002 110.373 -176.184 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.592 ' HB3' ' HG2' ' A' ' 96' ' ' PRO . 52.4 tt0 -103.03 133.83 47.48 Favored 'General case' 0 C--O 1.241 0.637 0 N-CA-C 108.738 -0.838 . . . . 106.04000000000001 108.738 171.791 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' MSE . . . . . 0.617 ' HE1' HD11 ' A' ' 80' ' ' LEU . 32.2 mmt -72.83 126.4 29.84 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 119.5 -0.88 . . . . 106.12 112.823 -170.812 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 68.0 p -114.05 138.77 49.94 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 115.645 -0.707 . . . . 117.09 109.658 169.329 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.486 ' HA ' HD12 ' A' ' 50' ' ' LEU . . . -56.15 -32.15 64.01 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 112.656 0.613 . . . . 116.11 112.656 -174.067 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.3 -49.93 73.68 Favored 'General case' 0 C--O 1.249 1.06 0 CA-C-O 121.371 0.605 . . . . 131.16 111.646 177.246 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -63.99 -39.87 95.08 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.987 -1.006 . . . . 118.64 111.527 178.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.486 HD12 ' HA ' ' A' ' 47' ' ' ALA . 94.0 mt -53.86 -46.93 71.41 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 107.592 -1.262 . . . . 116.41 107.592 176.004 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 6.4 m -69.24 -49.97 51.43 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 113.793 -1.549 . . . . 108.75 110.393 -178.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -52.35 -55.98 17.95 Favored 'General case' 0 CA--C 1.561 1.375 0 N-CA-C 115.314 1.598 . . . . 118.14 115.314 177.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -67.54 -30.72 70.44 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 114.723 1.379 . . . . 104.63 114.723 -178.192 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.575 ' HG3' ' HB2' ' A' ' 59' ' ' ASP . 33.1 ttm180 -54.75 -45.94 74.23 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 109.497 -0.557 . . . . 155.41 109.497 175.318 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.72 -25.97 66.83 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 114.748 -1.114 . . . . 131.69999999999999 113.069 178.803 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 8.7 mmt180 -89.86 -10.86 43.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.304 -0.407 . . . . 155.05000000000001 110.952 -174.051 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 115.97 17.65 6.26 Favored Glycine 0 CA--C 1.524 0.624 0 CA-C-N 116.327 -0.397 . . . . 118.0 112.437 -179.272 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -134.86 53.92 1.97 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.428 0.691 . . . . 104.08 110.508 -165.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.575 ' HB2' ' HG3' ' A' ' 54' ' ' ARG . 0.7 OUTLIER -68.37 110.77 4.26 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.498 -0.319 . . . . 127.78 111.475 177.281 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.8 mt -106.12 21.97 16.47 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 121.298 0.571 . . . . 102.81 110.697 176.264 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 8.7 m -109.19 -43.03 4.24 Favored 'General case' 0 CA--C 1.504 -0.82 0 CA-C-N 115.796 -0.638 . . . . 122.22 111.746 -166.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' THR . . . . . 0.409 ' HA ' ' HD3' ' A' ' 63' ' ' PRO . 1.9 m -69.24 116.57 43.66 Favored Pre-proline 0 C--O 1.24 0.601 0 CA-C-N 115.207 -0.906 . . . . 124.14 110.847 -177.752 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 62' ' ' THR . 43.7 Cg_exo -57.33 162.91 9.05 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.706 2.271 . . . . 121.02 110.131 -177.829 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -163.13 96.52 1.07 Allowed Pre-proline 0 C--O 1.235 0.32 0 O-C-N 123.762 0.664 . . . . 122.56 110.469 173.922 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -79.78 43.37 1.49 Allowed 'Trans proline' 0 CA--C 1.535 0.552 0 N-CA-C 115.12 1.161 . . . . 148.58000000000001 115.12 179.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.61 -53.39 16.11 Favored 'General case' 0 CA--C 1.51 -0.568 0 N-CA-C 104.822 -2.288 . . . . 133.71000000000001 104.822 169.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.674 ' HE2' ' O ' ' A' ' 203' ' ' HOH . 2.4 m-85 -84.69 -0.35 53.21 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 113.879 -1.51 . . . . 115.91 111.999 175.334 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 57.47 70.22 0.67 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.984 0.897 . . . . 137.13999999999999 108.667 -157.096 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -124.41 90.97 50.19 Favored Pre-proline 0 N--CA 1.438 -1.03 0 CA-C-N 114.845 -1.07 . . . . 120.52 109.66 174.675 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -63.29 136.88 57.79 Favored 'Trans proline' 0 CA--C 1.528 0.176 0 N-CA-C 107.092 -1.926 . . . . 123.12 107.092 164.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -64.19 -165.06 0.84 Allowed Glycine 0 CA--C 1.521 0.457 0 CA-C-N 118.953 0.797 . . . . 105.42 114.134 -175.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 63.8 mt -108.29 114.85 29.03 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 116.369 1.989 . . . . 127.56999999999999 116.369 -169.293 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.31 152.64 96.46 Favored Pre-proline 0 C--O 1.237 0.439 0 N-CA-C 108.576 -0.898 . . . . 127.22 108.576 170.29 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -60.41 158.93 29.22 Favored 'Trans proline' 0 C--O 1.246 0.921 0 C-N-CA 116.77 -1.687 . . . . 120.2 110.812 168.756 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLY . . . . . 0.517 ' N ' ' O ' ' A' ' 45' ' ' MSE . . . 84.28 -26.36 5.07 Favored Glycine 0 CA--C 1.528 0.894 0 C-N-CA 120.317 -0.944 . . . . 107.34999999999999 113.572 -176.871 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -69.14 148.33 50.1 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 122.533 -0.392 . . . . 120.70999999999999 111.351 174.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -90.52 156.11 18.41 Favored 'General case' 0 C--O 1.251 1.135 0 C-N-CA 122.656 0.382 . . . . 110.36 110.676 178.388 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' TRP . . . . . 0.403 ' HD1' HD23 ' A' ' 80' ' ' LEU . 42.7 t-105 -166.1 155.29 11.57 Favored 'General case' 0 C--O 1.261 1.675 0 C-N-CA 118.811 -1.155 . . . . 76.900000000000006 113.171 -177.58 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 32.8 m -99.77 112.77 24.99 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 117.865 -1.534 . . . . 77.640000000000001 109.292 177.48 -50.398 -80.132 -76.363 100.203 2.042 108.836 -33.637 -59.488 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.617 HD11 ' HE1' ' A' ' 45' ' ' MSE . 13.6 mt -109.94 152.01 26.39 Favored 'General case' 0 CA--C 1.497 -1.092 0 CA-C-N 114.508 -1.224 . . . . 104.48 108.644 -170.533 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 59.9 m -59.03 149.48 27.46 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 119.592 -0.843 . . . . 86.650000000000006 109.014 172.221 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -69.11 -52.95 23.05 Favored 'General case' 0 N--CA 1.44 -0.961 0 N-CA-C 106.103 -1.814 . . . . 103.83 106.103 -179.045 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -52.27 -34.39 46.15 Favored 'General case' 0 C--O 1.222 -0.366 0 O-C-N 124.234 0.959 . . . . 108.65000000000001 112.548 176.704 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.402 ' HA ' ' HD2' ' A' ' 84' ' ' ARG . 1.1 mmt180 -79.32 -10.38 59.8 Favored 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 112.412 0.523 . . . . 116.84 112.412 178.71 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' TRP . . . . . 0.459 ' CD1' ' HD2' ' A' ' 95' ' ' PRO . 86.3 t90 -99.06 -43.91 6.49 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 108.208 -1.034 . . . . 115.69 108.208 177.113 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.8 ttp180 -61.09 -22.37 64.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.119 -0.946 . . . . 135.31 109.558 179.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -63.84 -54.5 34.06 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.857 -0.611 . . . . 134.91999999999999 110.23 169.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.29 -18.56 64.56 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 112.47 0.545 . . . . 119.75 112.47 -177.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 8.0 tp -70.97 -51.83 23.33 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 123.044 0.215 . . . . 147.22 111.548 176.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -77.41 -7.33 55.96 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 116.685 -0.234 . . . . 150.78999999999999 111.624 178.168 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -104.79 20.55 18.52 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.253 0.549 . . . . 122.56999999999999 109.957 172.464 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 53.99 25.99 32.9 Favored Glycine 0 C--O 1.223 -0.574 0 N-CA-C 117.697 1.839 . . . . 132.88999999999999 117.697 174.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 19.0 m -134.11 19.93 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 113.861 1.06 . . . . 138.0 113.861 -176.75 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -55.12 129.18 67.07 Favored Pre-proline 0 N--CA 1.47 0.532 0 N-CA-C 114.711 1.374 . . . . 108.27 114.711 -179.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.459 ' HD2' ' CD1' ' A' ' 85' ' ' TRP . 64.9 Cg_endo -77.81 157.07 31.37 Favored 'Trans proline' 0 C--O 1.248 1.002 0 C-N-CA 122.044 1.83 . . . . 92.0 111.839 -179.409 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.592 ' HG2' ' HB3' ' A' ' 44' ' ' GLN . 59.2 Cg_endo -68.82 120.93 7.8 Favored 'Trans proline' 0 CA--C 1.53 0.281 0 C-N-CA 122.334 2.023 . . . . 98.390000000000001 113.06 -173.63 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 3.5 m -96.93 149.54 4.85 Favored 'Isoleucine or valine' 0 C--O 1.239 0.511 0 N-CA-C 113.684 0.994 . . . . 116.63 113.684 -178.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 6.5 mt -106.78 103.37 15.36 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.65 0 N-CA-C 107.01 -1.478 . . . . 81.549999999999997 107.01 174.769 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 6.7 mp -71.53 -26.95 62.87 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 116.379 1.992 . . . . 90.25 116.379 -165.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 36.9 mp0 -75.01 -9.53 58.62 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 119.346 -0.942 . . . . 87.200000000000003 108.664 -179.478 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -111.75 12.99 21.07 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-N 115.207 -0.906 . . . . 64.680000000000007 112.537 -177.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' THR . . . . . 0.603 ' HB ' ' HA ' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -123.26 132.89 54.19 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 119.076 -1.05 . . . . 77.890000000000001 112.501 178.148 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.476 ' HB3' ' HB ' ' A' ' 40' ' ' VAL . 17.1 t-80 -60.3 154.22 20.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.594 -1.184 . . . . 82.159999999999997 113.786 -170.318 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.58 -30.85 71.88 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 115.795 -0.638 . . . . 81.689999999999998 111.912 -173.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 60.8 p -67.7 -8.67 37.03 Favored 'General case' 0 C--O 1.219 -0.51 0 N-CA-C 113.668 0.988 . . . . 85.040000000000006 113.668 179.706 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -59.39 -30.71 68.63 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 108.484 -0.932 . . . . 90.140000000000001 108.484 172.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.421 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 12.8 mt -70.23 -16.86 63.11 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 113.83 1.048 . . . . 99.370000000000005 113.83 -177.521 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -76.32 -6.34 51.1 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 116.048 -0.523 . . . . 121.58 109.978 168.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -112.42 -49.73 2.94 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 116.664 -0.244 . . . . 111.19 110.702 179.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.421 ' O ' ' HA ' ' A' ' 107' ' ' LEU . 29.7 m -129.15 -173.97 1.1 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.3 0 N-CA-C 110.256 -0.276 . . . . 98.450000000000003 110.256 177.001 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' SER . . . . . 0.521 ' OG ' ' HG2' ' A' ' 113' ' ' GLU . 24.4 p -103.82 168.4 9.16 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 112.093 0.405 . . . . 105.17 112.093 -176.285 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.77 -35.49 80.88 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 107.115 -1.439 . . . . 122.84999999999999 107.115 179.124 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.521 ' HG2' ' OG ' ' A' ' 111' ' ' SER . 0.0 OUTLIER -69.23 -34.11 74.33 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 114.328 -1.306 . . . . 140.37 113.76 -168.218 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -85.28 -21.27 29.09 Favored 'General case' 0 C--O 1.24 0.6 0 CA-C-O 121.849 0.833 . . . . 121.77 110.088 177.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 12.1 mt -72.99 -54.31 8.94 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-N 114.524 -1.217 . . . . 97.480000000000004 109.9 171.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 6.3 mttt -55.21 -47.97 74.53 Favored 'General case' 0 C--O 1.244 0.773 0 O-C-N 124.434 1.084 . . . . 98.530000000000001 110.239 175.382 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -42.41 -49.53 5.2 Favored 'General case' 0 C--O 1.243 0.723 0 O-C-N 124.563 1.165 . . . . 104.66 111.398 174.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -105.61 45.52 0.96 Allowed 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 116.178 1.918 . . . . 121.05 116.178 -179.139 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -75.3 -154.4 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 107.825 -1.176 . . . . 105.87 107.825 178.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.449 ' HA ' HD23 ' A' ' 120' ' ' LEU . 1.0 OUTLIER -111.86 1.41 16.53 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.827 1.047 . . . . 110.73999999999999 113.827 179.968 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.261 1.808 0 CA-C-O 118.838 -0.979 . . . . 113.15000000000001 114.861 -179.963 . . . . . . . . 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 . . . . . 0.674 ' O ' ' HE2' ' A' ' 67' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.557 ' O ' ' HB ' ' A' ' 10' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 stop_ save_