data_1wau_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 1wau _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 ' 1' ' ' MET . . . . . 0.48 ' N ' ' O ' ' A' 2001 ' ' HOH . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.252 0 N-CA-C 113.622 0.971 . . . . 103.0 113.622 . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' LYS . . . . . 0.648 ' C ' ' O ' ' A' 2006 ' ' HOH . 1.4 tppt? 71.82 -155.21 0.1 Allowed 'General case' 0 CA--C 1.577 1.985 0 N-CA-C 118.627 2.825 . . . . 103.29 118.627 171.411 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ASN . . . . . 0.751 ' CA ' ' O ' ' A' 2003 ' ' HOH 0.305 0.2 OUTLIER -91.15 35.37 0.92 Allowed 'General case' 0 N--CA 1.521 3.085 0 N-CA-C 117.645 2.461 . . . . 94.55 117.645 169.456 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 48.0 m0 -91.59 127.82 37.18 Favored 'General case' 0 N--CA 1.434 -1.26 0 CA-C-N 114.184 -1.371 . . . . 88.65 114.559 -178.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.29 -37.46 69.89 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 115.122 1.527 . . . . 86.12 115.122 176.872 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.3 p -133.0 155.15 49.7 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 107.738 -1.208 . . . . 79.71 107.738 170.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 94.1 p -87.78 145.78 25.95 Favored 'General case' 0 C--O 1.241 0.643 0 C-N-CA 119.487 -0.885 . . . . 74.0 112.045 -173.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -49.23 -40.26 33.12 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 112.673 0.62 . . . . 71.87 112.673 172.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' GLU . . . . . 0.416 ' CG ' ' O ' ' A' 2014 ' ' HOH . 47.0 tt0 -48.72 -51.71 27.34 Favored 'General case' 0 C--O 1.243 0.753 0 N-CA-C 109.133 -0.691 . . . . 79.01 109.133 175.226 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 59.9 p -65.45 -34.67 78.82 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 114.138 1.162 . . . . 67.26 114.138 -168.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 37.6 mm -61.19 -44.37 98.22 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.202 0 O-C-N 124.274 0.983 . . . . 63.11 108.408 175.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.7 mt -82.51 -21.79 35.31 Favored 'General case' 0 CA--C 1.491 -1.299 0 C-N-CA 119.305 -0.958 . . . . 64.99 110.233 -166.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 25.6 p -94.92 8.72 41.87 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 114.426 1.269 . . . . 66.75 114.426 177.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 28.6 m -69.67 -43.14 73.13 Favored 'General case' 0 CA--C 1.509 -0.618 0 CA-C-N 118.717 0.689 . . . . 63.78 111.215 -177.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -153.79 -179.15 28.95 Favored Glycine 0 C--O 1.26 1.774 0 O-C-N 123.86 0.725 . . . . 61.53 111.913 167.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -70.42 -25.0 26.03 Favored 'Trans proline' 0 N--CA 1.484 0.922 0 C-N-CA 124.381 3.387 . . . . 62.39 118.897 176.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.6 t -130.72 137.95 54.8 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.606 0 N-CA-C 105.834 -1.913 . . . . 63.1 105.834 -171.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 52.8 t -121.92 117.79 29.59 Favored Pre-proline 0 N--CA 1.433 -1.307 0 N-CA-C 102.301 -3.222 . . . . 63.52 102.301 172.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -70.51 141.64 42.66 Favored 'Trans proline' 0 CA--C 1.499 -1.268 0 C-N-CA 122.094 1.863 . . . . 64.56 112.077 177.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 88.2 t -105.66 104.65 17.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 N-CA-C 106.541 -1.651 . . . . 66.19 106.541 179.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 14.7 mt -104.41 133.04 49.58 Favored 'Isoleucine or valine' 0 C--O 1.241 0.648 0 N-CA-C 114.467 1.284 . . . . 66.59 114.467 -164.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 99.8 t -120.51 104.88 16.03 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.5 0 N-CA-C 104.874 -2.269 . . . . 64.83 104.874 172.651 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.3 p -105.68 121.07 57.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 108.223 -1.029 . . . . 66.55 108.223 -176.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.9 mttt -89.91 -43.3 10.69 Favored 'General case' 0 C--O 1.278 2.576 0 CA-C-N 115.071 -0.968 . . . . 79.91 112.204 -175.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.1 126.21 51.83 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 114.815 1.413 . . . . 82.82 114.815 178.398 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 11.4 tp -50.57 -40.75 53.09 Favored 'General case' 0 C--O 1.248 0.982 0 N-CA-C 114.14 1.163 . . . . 71.81 114.14 -176.11 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -66.96 -15.83 63.95 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 115.855 1.798 . . . . 94.92 115.855 -174.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 35.7 m170 -84.05 -22.66 31.18 Favored 'General case' 0 N--CA 1.429 -1.516 0 N-CA-C 113.92 1.082 . . . . 78.57 113.92 177.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -54.51 -56.73 15.88 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 118.702 0.683 . . . . 74.5 109.887 -170.441 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 36.7 t -60.68 -58.62 17.96 Favored Pre-proline 0 CA--C 1.551 0.997 0 CA-C-N 116.246 -0.434 . . . . 70.89 111.122 -168.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -56.42 -36.74 97.7 Favored 'Trans proline' 0 N--CA 1.485 0.998 0 O-C-N 121.892 0.417 . . . . 69.08 112.892 179.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 15.0 ttp -55.72 -53.71 53.25 Favored 'General case' 0 CA--C 1.491 -1.309 0 CA-C-O 121.775 0.798 . . . . 66.75 111.684 177.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -49.93 -47.22 52.49 Favored 'General case' 0 C--O 1.276 2.482 0 CA-C-N 113.649 -1.614 . . . . 66.79 112.903 173.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 15.1 mtpt -68.47 -32.77 73.01 Favored 'General case' 0 C--O 1.254 1.293 0 N-CA-C 109.363 -0.606 . . . . 73.89 109.363 -171.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.4 -51.97 45.48 Favored 'General case' 0 C--O 1.215 -0.717 0 O-C-N 125.543 1.777 . . . . 62.17 107.115 -178.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 4.6 mt -42.13 -61.96 1.04 Allowed 'General case' 0 CA--C 1.496 -1.129 0 CA-C-N 114.6 -1.182 . . . . 65.11 114.075 168.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 45.7 t -53.79 -55.95 11.33 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.224 0 CA-C-N 115.295 -0.866 . . . . 62.02 112.68 175.655 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -48.59 -33.21 9.35 Favored 'General case' 0 C--O 1.201 -1.497 0 O-C-N 124.317 1.01 . . . . 61.83 108.962 -179.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -90.57 21.68 31.39 Favored Glycine 0 C--O 1.247 0.926 0 N-CA-C 115.244 0.858 . . . . 61.76 115.244 178.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 78.28 9.95 86.59 Favored Glycine 0 N--CA 1.444 -0.831 0 N-CA-C 115.636 1.015 . . . . 64.88 115.636 175.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 53.5 t -109.64 119.74 59.47 Favored 'Isoleucine or valine' 0 C--O 1.27 2.141 0 O-C-N 121.282 -1.128 . . . . 67.6 112.103 179.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.8 mtm105 -111.9 -24.82 9.75 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 116.323 1.971 . . . . 82.58 116.323 -166.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 33.0 t -95.39 106.75 18.64 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.164 0 C-N-CA 117.779 -1.568 . . . . 64.45 108.669 177.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 81.0 mt -97.88 129.58 44.82 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 113.284 -1.78 . . . . 65.28 108.62 -178.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ASN . . . . . 0.469 ' C ' ' OD1' ' A' ' 45' ' ' ASN . 10.8 t-20 -118.36 99.89 7.13 Favored 'General case' 0 C--O 1.263 1.799 0 CA-C-O 121.35 0.595 . . . . 70.29 112.228 175.482 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 46.9 t -84.33 115.72 26.86 Favored 'Isoleucine or valine' 0 C--O 1.247 0.951 0 CA-C-N 115.927 -0.579 . . . . 60.98 110.801 178.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 67.6 p -79.23 139.22 37.98 Favored 'General case' 0 CA--C 1.481 -1.695 0 N-CA-C 107.667 -1.234 . . . . 59.97 107.667 -174.305 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.3 mt -82.12 62.55 5.91 Favored 'General case' 0 C--O 1.261 1.694 0 N-CA-C 106.733 -1.58 . . . . 63.12 106.733 179.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 33.0 mtt180 -121.04 0.42 10.2 Favored 'General case' 0 N--CA 1.485 1.325 0 O-C-N 124.142 0.901 . . . . 76.25 109.82 -177.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 39.3 p -128.78 138.43 52.08 Favored 'General case' 0 CA--C 1.481 -1.678 0 CA-C-O 122.949 1.356 . . . . 69.91 110.189 177.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLU . . . . . 0.438 ' CA ' ' O ' ' A' 2034 ' ' HOH . 6.7 mp0 -19.13 -29.46 0.0 OUTLIER 'General case' 0 N--CA 1.412 -2.337 0 CA-C-N 109.43 -3.532 . . . . 78.97 114.12 165.968 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 15.4 p -149.33 31.68 0.74 Allowed 'General case' 0 CA--C 1.563 1.469 0 O-C-N 118.934 -2.354 . . . . 78.33 112.428 -178.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -40.05 -61.35 0.88 Allowed 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 117.878 -1.058 . . . . 65.56 110.54 156.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.4 t -53.07 -47.44 54.62 Favored 'Isoleucine or valine' 0 C--O 1.261 1.666 0 N-CA-C 115.32 1.6 . . . . 60.28 115.32 -176.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ASP . . . . . 1.035 ' OD2' ' O ' ' A' 2040 ' ' HOH . 90.9 m-20 -52.14 -42.4 63.32 Favored 'General case' 0 C--O 1.27 2.158 0 C-N-CA 119.109 -1.036 . . . . 60.32 112.061 172.961 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -65.57 -54.74 23.75 Favored 'General case' 0 CA--C 1.571 1.784 0 N-CA-C 115.229 1.566 . . . . 60.42 115.229 176.333 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 14.0 mt -43.14 -51.46 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.356 0.879 0 CA-C-N 118.214 0.461 . . . . 59.71 109.862 166.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ARG . . . . . 0.43 ' NH1' ' OD1' ' A' ' 55' ' ' ASP . 38.6 ttm105 -54.66 -52.77 61.29 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 113.672 0.99 . . . . 62.97 113.672 179.684 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.06 -37.83 81.73 Favored 'General case' 0 C--O 1.222 -0.378 0 N-CA-C 113.595 0.961 . . . . 63.7 113.595 176.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 44.8 mt -61.39 -41.63 90.62 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.911 0 C-N-CA 116.679 -2.008 . . . . 64.99 111.811 177.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -54.37 -41.42 69.16 Favored 'General case' 0 N--CA 1.44 -0.925 0 CA-C-N 115.462 -0.79 . . . . 68.35 110.754 174.159 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.2 -28.94 28.93 Favored 'General case' 0 C--O 1.208 -1.105 0 C-N-CA 119.27 -0.972 . . . . 77.65 108.988 -167.659 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLU . . . . . 0.404 ' O ' ' CD ' ' A' ' 65' ' ' PRO . 50.2 mt-10 -118.92 -23.66 6.85 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 118.583 -1.247 . . . . 71.96 113.313 -162.252 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 94.1 t -107.63 73.56 0.41 Allowed Pre-proline 0 N--CA 1.41 -2.474 0 N-CA-C 105.908 -1.886 . . . . 68.51 105.908 176.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' PRO . . . . . 0.438 ' CA ' ' O ' ' A' 2044 ' ' HOH . 4.6 Cg_endo -53.71 -28.62 47.81 Favored 'Trans proline' 0 C--N 1.371 1.754 0 O-C-N 123.657 1.346 . . . . 70.43 114.19 177.85 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . 0.255 0.2 OUTLIER -85.42 2.88 42.61 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 114.328 1.233 . . . . 83.6 114.328 -175.234 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -110.41 137.65 47.84 Favored 'General case' 0 CA--C 1.472 -2.04 0 C-N-CA 120.682 -0.407 . . . . 69.02 111.814 -178.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 63.5 mt -88.2 95.48 5.26 Favored 'Isoleucine or valine' 0 C--O 1.241 0.655 0 N-CA-C 108.863 -0.791 . . . . 61.75 108.863 179.122 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 8.3 p -96.46 138.47 21.61 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.84 0 C-N-CA 116.806 -1.958 . . . . 59.28 112.459 -175.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -135.39 -179.25 16.38 Favored Glycine 0 N--CA 1.49 2.253 0 O-C-N 125.38 1.675 . . . . 59.65 113.359 179.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -123.79 133.27 53.85 Favored 'General case' 0 N--CA 1.441 -0.916 0 C-N-CA 119.434 -0.907 . . . . 57.93 110.458 -174.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -104.23 170.96 19.16 Favored Glycine 0 N--CA 1.441 -1.014 0 C-N-CA 118.808 -1.663 . . . . 59.62 112.462 176.061 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 15.3 m 50.73 55.17 9.94 Favored 'General case' 0 CA--C 1.502 -0.87 0 N-CA-C 105.473 -2.047 . . . . 64.75 105.473 179.102 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 71.4 t -98.1 123.88 50.84 Favored 'Isoleucine or valine' 0 C--O 1.248 0.987 0 N-CA-C 103.508 -2.775 . . . . 61.66 103.508 173.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 11.3 mp -111.63 -16.76 13.17 Favored 'General case' 0 C--O 1.256 1.405 0 N-CA-C 117.469 2.396 . . . . 59.14 117.469 -167.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -158.14 164.01 22.67 Favored Pre-proline 0 C--O 1.279 2.655 0 CA-C-N 115.052 -0.976 . . . . 62.05 110.061 -176.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -56.69 -34.49 96.07 Favored 'Trans proline' 0 CA--C 1.533 0.439 0 O-C-N 123.458 1.241 . . . . 62.59 112.564 -176.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 11.5 tm0? -55.44 -58.98 5.52 Favored 'General case' 0 C--O 1.25 1.126 0 N-CA-C 108.91 -0.774 . . . . 77.44 108.91 175.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -57.77 -35.95 71.48 Favored 'General case' 0 C--O 1.189 -2.11 0 C-N-CA 119.939 -0.704 . . . . 66.97 109.433 -178.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 32.6 tp -62.2 -49.99 73.57 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 113.996 1.11 . . . . 61.42 113.996 175.014 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.37 -62.6 1.45 Allowed 'General case' 0 C--O 1.213 -0.818 0 N-CA-C 109.359 -0.608 . . . . 65.37 109.359 170.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -43.77 -47.49 7.99 Favored 'General case' 0 C--O 1.239 0.541 0 N-CA-C 116.44 2.015 . . . . 81.66 116.44 -179.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 15.8 m -80.1 -32.19 13.69 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.148 0 CA-C-N 116.457 -0.338 . . . . 67.86 110.273 -174.483 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 90.2 m -60.11 -38.13 82.07 Favored 'General case' 0 CA--C 1.554 1.106 0 CA-C-O 121.858 0.837 . . . . 70.08 110.759 173.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -77.65 -29.42 51.65 Favored 'General case' 0 C--O 1.199 -1.569 0 O-C-N 121.477 -0.764 . . . . 85.82 111.344 -178.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.83 -20.31 65.91 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 109.4 -0.592 . . . . 71.65 109.4 173.78 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 113.54 10.69 14.4 Favored Glycine 0 C--O 1.254 1.363 0 C-N-CA 119.646 -1.264 . . . . 68.38 115.879 174.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -52.05 131.91 32.24 Favored 'General case' 0 C--O 1.258 1.538 0 C-N-CA 125.293 1.437 . . . . 66.91 110.941 172.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -92.88 -13.44 29.0 Favored 'General case' 0 CA--C 1.498 -1.023 0 CA-C-N 113.719 -1.582 . . . . 78.15 111.19 -177.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 53.7 p90 -163.94 165.45 22.65 Favored 'General case' 0 C--O 1.254 1.31 0 N-CA-C 108.554 -0.906 . . . . 62.72 108.554 172.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -126.71 153.69 45.12 Favored 'General case' 0 C--O 1.246 0.87 0 C-N-CA 119.534 -0.866 . . . . 59.2 112.685 167.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -123.22 143.69 35.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 O-C-N 125.633 1.833 . . . . 60.83 107.396 170.733 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 32.6 p -126.23 153.9 74.46 Favored Pre-proline 0 N--CA 1.427 -1.611 0 CA-C-N 115.115 -0.948 . . . . 61.29 109.448 174.242 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -63.76 -32.25 67.88 Favored 'Trans proline' 0 CA--C 1.572 2.409 0 N-CA-C 116.076 1.529 . . . . 62.09 116.076 176.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -156.16 178.3 32.75 Favored Glycine 0 N--CA 1.486 2.016 0 N-CA-C 106.414 -2.674 . . . . 60.9 106.414 -179.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -113.7 159.53 19.6 Favored 'General case' 0 CA--C 1.578 2.046 0 N-CA-C 116.442 2.016 . . . . 59.01 116.442 -177.369 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 43.5 p -138.09 148.93 45.5 Favored 'General case' 0 C--O 1.284 2.882 0 CA-C-N 120.153 1.342 . . . . 56.24 109.686 173.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' GLU . . . . . 0.475 ' O ' ' C ' ' A' ' 99' ' ' PRO 0.609 11.9 pt-20 -46.44 -58.32 6.9 Favored Pre-proline 0 CA--C 1.613 3.392 0 N-CA-C 105.17 -2.159 . . . . 54.32 105.17 177.751 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' PRO . . . . . 0.475 ' C ' ' O ' ' A' ' 98' ' ' GLU . 84.4 Cg_exo -49.42 -54.32 5.63 Favored 'Trans proline' 0 C--N 1.361 1.188 0 C-N-CA 116.155 -2.097 . . . . 58.45 113.177 -178.093 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 28.9 tp -64.88 -37.27 87.07 Favored 'General case' 0 C--O 1.237 0.413 0 O-C-N 123.837 0.711 . . . . 60.41 110.079 -163.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 22.6 mt -61.13 -49.12 78.55 Favored 'General case' 0 CA--C 1.57 1.714 0 N-CA-C 113.898 1.073 . . . . 58.97 113.898 167.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 9.6 tttp -53.16 -54.66 32.55 Favored 'General case' 0 C--O 1.238 0.49 0 O-C-N 121.229 -0.919 . . . . 70.92 110.097 176.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.51 -38.65 85.07 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 114.616 1.339 . . . . 62.29 114.616 -178.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -73.29 -29.52 62.77 Favored 'General case' 0 CA--C 1.501 -0.94 0 N-CA-C 108.223 -1.029 . . . . 62.76 108.223 -174.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.07 -22.07 56.05 Favored 'General case' 0 CA--C 1.489 -1.4 0 CA-C-N 114.508 -1.224 . . . . 64.23 110.521 -175.585 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -88.64 -31.35 18.59 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 112.758 -2.019 . . . . 75.26 111.61 179.033 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -84.68 -171.15 47.87 Favored Glycine 0 C--N 1.341 0.86 0 C-N-CA 120.921 -0.657 . . . . 63.95 112.544 -176.049 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 49.6 p -102.76 -3.33 26.59 Favored 'General case' 0 C--O 1.254 1.319 0 N-CA-C 114.85 1.426 . . . . 64.15 114.85 -160.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 42.3 pt -132.48 144.9 54.96 Favored Pre-proline 0 N--CA 1.517 2.876 0 C-N-CA 124.297 1.039 . . . . 63.49 111.628 -177.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -68.77 140.14 45.73 Favored 'Trans proline' 0 N--CA 1.448 -1.183 0 C-N-CA 122.985 2.456 . . . . 60.51 113.427 -176.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 11.0 tp -115.88 122.91 46.76 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.374 -0.376 . . . . 59.32 110.073 174.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 3.2 mp -104.75 97.87 13.7 Favored Pre-proline 0 N--CA 1.445 -0.696 0 N-CA-C 102.897 -3.001 . . . . 60.94 102.897 179.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -94.49 148.77 1.87 Allowed 'Trans proline' 0 C--N 1.356 0.966 0 O-C-N 123.011 1.006 . . . . 57.46 111.963 -173.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -69.6 144.69 40.85 Favored Glycine 0 C--O 1.271 2.45 0 O-C-N 125.307 1.63 . . . . 54.39 113.939 178.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 1.6 pp -133.43 165.25 32.74 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.383 0 N-CA-C 113.628 0.973 . . . . 56.53 113.628 174.061 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 66.6 m -133.72 -34.62 1.01 Allowed 'General case' 0 C--O 1.245 0.848 0 O-C-N 120.451 -1.406 . . . . 58.38 111.033 171.269 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 73.5 p -114.98 166.25 12.0 Favored 'General case' 0 C--O 1.202 -1.412 0 N-CA-C 106.46 -1.681 . . . . 57.75 106.46 -173.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 33.1 m -68.7 -40.38 81.52 Favored 'Isoleucine or valine' 0 C--O 1.244 0.799 0 O-C-N 123.912 0.758 . . . . 58.6 110.962 176.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 10.7 m -51.28 -33.8 30.2 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 108.823 -0.806 . . . . 59.18 108.823 175.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' GLU . . . . . 0.636 ' OE1' ' O ' ' A' 2065 ' ' HOH . 50.5 mt-10 -73.41 -58.81 3.05 Favored 'General case' 0 CA--C 1.493 -1.225 0 N-CA-C 106.666 -1.605 . . . . 63.0 106.666 -174.61 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 28.3 tp -38.19 -50.23 1.4 Allowed 'General case' 0 CA--C 1.569 1.706 0 N-CA-C 113.048 0.759 . . . . 57.25 113.048 172.092 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 67.0 mtp -62.25 -46.29 89.49 Favored 'General case' 0 CA--C 1.482 -1.668 0 C-N-CA 125.29 1.436 . . . . 61.9 110.292 -173.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 37.2 tp -56.61 -42.98 79.7 Favored 'General case' 0 C--O 1.251 1.168 0 N-CA-C 113.486 0.921 . . . . 62.11 113.486 175.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -72.0 -27.88 69.6 Favored Glycine 0 C--N 1.337 0.605 0 C-N-CA 119.206 -1.473 . . . . 61.82 110.756 179.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 3.6 mtp -71.08 -27.55 63.7 Favored 'General case' 0 C--O 1.243 0.732 0 N-CA-C 107.653 -1.24 . . . . 65.05 107.653 -178.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 44.2 m-20 -64.3 -29.72 70.79 Favored 'General case' 0 C--O 1.211 -0.925 0 N-CA-C 107.425 -1.324 . . . . 67.1 107.425 -179.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' TYR . . . . . . . . . . . . . 71.4 m-85 -93.43 19.69 8.06 Favored 'General case' 0 N--CA 1.41 -2.434 0 C-N-CA 116.371 -2.131 . . . . 64.78 111.82 179.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 90.28 2.62 73.57 Favored Glycine 0 C--O 1.226 -0.399 0 C-N-CA 120.005 -1.093 . . . . 62.3 115.42 174.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 7.8 mp -78.44 156.84 29.18 Favored 'General case' 0 C--O 1.258 1.543 0 O-C-N 121.725 -0.867 . . . . 63.94 111.246 -178.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' LYS . . . . . 1.147 ' NZ ' ' O ' ' A' 2072 ' ' HOH . 0.0 OUTLIER -143.78 -7.32 0.75 Allowed 'General case' 0 CA--C 1.563 1.455 0 CA-C-N 114.816 -1.083 . . . . 68.6 112.624 179.262 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -112.86 132.13 55.42 Favored 'General case' 0 C--O 1.218 -0.583 0 N-CA-C 114.467 1.284 . . . . 78.19 114.467 178.106 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -142.86 135.23 27.5 Favored 'General case' 0 C--O 1.211 -0.973 0 N-CA-C 115.741 1.756 . . . . 56.53 115.741 -175.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' LYS . . . . . 1.142 ' NZ ' ' O ' ' A' 2074 ' ' HOH . 84.8 tttt -60.03 138.77 57.79 Favored 'General case' 0 C--O 1.282 2.772 0 N-CA-C 101.699 -3.445 . . . . 54.47 101.699 158.596 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -115.38 117.44 30.42 Favored 'General case' 0 C--O 1.259 1.59 0 N-CA-C 104.545 -2.391 . . . . 61.07 104.545 168.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -158.52 141.02 10.39 Favored Pre-proline 0 C--O 1.265 1.914 0 N-CA-C 113.489 0.922 . . . . 63.0 113.489 -161.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_endo -79.6 105.65 0.74 Allowed 'Cis proline' 0 C--O 1.197 -1.549 0 C-N-CA 123.839 -1.317 . . . . 59.1 109.155 -4.607 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -22.88 -74.79 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 117.53 2.419 . . . . 60.64 117.53 176.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' GLU . . . . . 0.432 ' O ' ' N ' ' A' ' 141' ' ' GLY . 19.2 mm-40 -51.11 -78.04 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 120.32 -0.552 . . . . 72.23 110.554 -173.782 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -27.73 -44.52 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 117.245 2.313 . . . . 70.81 117.245 169.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 41.1 m-20 -63.12 4.07 0.22 Allowed 'General case' 0 C--O 1.256 1.427 0 N-CA-C 115.085 1.513 . . . . 71.71 115.085 170.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' A' ' 138' ' ' GLU . . . 99.63 -5.33 58.41 Favored Glycine 0 N--CA 1.484 1.898 0 CA-C-N 120.239 1.381 . . . . 69.31 114.955 -173.678 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 58.69 -146.67 41.34 Favored Glycine 0 C--O 1.259 1.702 0 N-CA-C 118.01 1.964 . . . . 65.46 118.01 178.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 48.5 t -45.0 -73.22 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.181 -2.522 0 N-CA-C 114.535 1.309 . . . . 61.87 114.535 -177.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -35.57 -47.47 0.46 Allowed 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.323 1.049 . . . . 81.02 112.411 175.715 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -59.37 -55.41 35.05 Favored 'General case' 0 C--O 1.257 1.462 0 C-N-CA 124.593 1.157 . . . . 64.43 110.441 -177.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 12.8 tp -62.71 -21.22 65.61 Favored 'General case' 0 C--O 1.201 -1.491 0 CA-C-N 116.024 -0.534 . . . . 62.22 109.955 -177.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -81.4 -37.33 28.31 Favored 'General case' 0 CA--C 1.462 -2.407 0 C-N-CA 115.957 -2.297 . . . . 64.03 107.137 -176.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -61.1 -53.2 60.03 Favored 'General case' 0 C--O 1.264 1.822 0 N-CA-C 105.99 -1.856 . . . . 63.15 105.99 177.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' ILE . . . . . . . . . . . . . 18.4 mt -54.24 -39.06 41.54 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.377 0 CA-C-N 113.746 -1.57 . . . . 67.78 111.422 -177.333 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -88.96 5.82 42.4 Favored 'General case' 0 C--N 1.31 -1.116 0 C-N-CA 117.947 -1.501 . . . . 70.57 112.325 179.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . -51.58 -62.38 5.57 Favored Glycine 0 CA--C 1.541 1.677 0 C-N-CA 120.496 -0.859 . . . . 73.31 111.047 -179.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -71.6 -2.36 11.23 Favored 'Trans proline' 0 C--N 1.369 1.634 0 C-N-CA 123.644 2.896 . . . . 72.94 117.699 -178.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -130.76 84.03 2.16 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 119.236 0.925 . . . . 73.44 110.451 -170.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' SER . . . . . 0.41 ' O ' ' NH2' ' A' ' 157' ' ' ARG . 98.3 p -77.31 -25.28 51.07 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.533 -0.758 . . . . 77.53 109.002 -171.177 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' GLN . . . . . 0.535 ' N ' ' O ' ' A' 2081 ' ' HOH . 0.0 OUTLIER -75.44 -26.03 57.97 Favored 'General case' 0 C--O 1.266 1.932 0 N-CA-C 117.238 2.31 . . . . 88.64 117.238 -178.272 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 46.0 t -82.07 151.07 4.25 Favored 'Isoleucine or valine' 0 C--O 1.245 0.819 0 N-CA-C 105.143 -2.169 . . . . 71.63 105.143 -167.577 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' ARG . . . . . 0.41 ' NH2' ' O ' ' A' ' 154' ' ' SER . 9.4 mmp_? -136.29 142.77 43.96 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 108.3 -1.0 . . . . 68.33 108.3 178.865 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' PHE . . . . . 0.5 ' N ' ' O ' ' A' ' 177' ' ' SER . 50.5 m-85 -115.09 166.38 11.87 Favored 'General case' 0 CA--C 1.48 -1.73 0 CA-C-N 115.081 -0.963 . . . . 61.62 112.132 -175.896 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' CYS . . . . . . . . . . . . . 1.6 t -132.19 93.8 25.27 Favored Pre-proline 0 N--CA 1.45 -0.448 0 CA-C-N 111.837 -2.438 . . . . 59.2 109.041 165.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -65.24 142.55 73.81 Favored 'Trans proline' 0 C--O 1.187 -2.066 0 N-CA-C 115.673 1.374 . . . . 58.0 115.673 -179.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' THR . . . . . . . . . . . . 0.283 87.1 m -143.94 160.21 41.22 Favored 'General case' 0 CA--C 1.474 -1.953 0 N-CA-C 105.046 -2.205 . . . . 61.74 105.046 171.783 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 104.45 91.95 2.24 Favored Glycine 0 C--O 1.262 1.899 0 N-CA-C 110.03 -1.228 . . . . 62.4 110.03 176.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . 88.01 20.34 50.21 Favored Glycine 0 N--CA 1.474 1.224 0 CA-C-O 123.431 1.573 . . . . 61.71 113.28 176.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 66.9 mt -95.92 122.95 47.89 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.18 0 CA-C-O 123.321 1.534 . . . . 66.61 112.575 -178.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 92.6 p -125.9 175.01 3.45 Favored Pre-proline 0 C--O 1.26 1.626 0 O-C-N 119.811 -1.806 . . . . 67.01 108.323 -175.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -47.85 -41.28 32.18 Favored 'Trans proline' 0 C--N 1.37 1.688 0 O-C-N 124.193 1.628 . . . . 66.25 110.524 171.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' ALA . . . . . . . . . . . . . . . -58.18 -38.14 76.1 Favored 'General case' 0 CA--C 1.55 0.975 0 N-CA-C 115.885 1.809 . . . . 64.65 115.885 179.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 46.7 p30 -114.59 -14.56 12.07 Favored 'General case' 0 CA--C 1.549 0.925 0 O-C-N 119.844 -1.785 . . . . 67.77 113.731 -176.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -57.53 -19.07 22.63 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 117.048 2.24 . . . . 68.76 117.048 -170.185 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 7.0 mtp85 -82.53 -37.19 25.54 Favored 'General case' 0 C--O 1.25 1.085 0 C-N-CA 116.56 -2.056 . . . . 88.51 107.328 -179.394 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -45.89 -38.82 7.86 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 120.052 -0.659 . . . . 74.15 111.109 172.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 -74.89 -55.24 6.0 Favored 'General case' 0 C--O 1.251 1.136 0 N-CA-C 114.298 1.222 . . . . 65.17 114.298 175.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 21.5 mt -52.45 -26.33 12.5 Favored 'General case' 0 C--O 1.264 1.834 0 C-N-CA 123.11 0.564 . . . . 60.95 112.196 178.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -58.68 -42.02 87.56 Favored 'General case' 0 C--O 1.202 -1.436 0 N-CA-C 115.082 1.512 . . . . 62.67 115.082 171.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 10.6 mt -58.76 131.28 50.44 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 118.446 2.758 . . . . 63.64 118.446 179.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' LYS . . . . . 1.127 ' NZ ' ' O ' ' A' 2089 ' ' HOH . 0.0 OUTLIER -38.63 -46.97 1.27 Allowed 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 126.163 1.785 . . . . 64.12 112.0 172.995 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' SER . . . . . 0.5 ' O ' ' N ' ' A' ' 158' ' ' PHE . 94.9 p -85.21 3.98 36.79 Favored 'General case' 0 C--O 1.278 2.598 0 N-CA-C 116.063 1.875 . . . . 60.88 116.063 -170.701 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 38.6 t -110.21 117.87 55.73 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.126 0 CA-C-O 118.081 -0.961 . . . . 56.74 109.452 -178.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 13.6 mt -83.33 -39.23 21.02 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 119.818 1.19 . . . . 64.2 112.371 167.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 180' ' ' CYS . . . . . . . . . . . . . 19.0 p -159.66 177.83 10.47 Favored 'General case' 0 CA--C 1.488 -1.426 0 CA-C-N 119.067 0.849 . . . . 60.87 109.143 -176.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 2.1 pp -131.62 164.98 33.03 Favored 'Isoleucine or valine' 0 C--O 1.269 2.121 0 CA-C-O 122.862 1.315 . . . . 60.33 112.2 177.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' GLY . . . . . . . . . . . . . . . -122.08 133.12 9.18 Favored Glycine 0 N--CA 1.432 -1.604 0 N-CA-C 105.421 -3.071 . . . . 61.97 105.421 179.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -143.62 166.58 26.87 Favored Glycine 0 C--O 1.265 2.036 0 CA-C-N 117.761 0.781 . . . . 65.14 112.258 172.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 184' ' ' SER . . . . . 0.433 ' OG ' ' O ' ' A' 2098 ' ' HOH . 0.7 OUTLIER -103.2 4.16 36.47 Favored 'General case' 0 N--CA 1.501 2.108 0 N-CA-C 117.944 2.572 . . . . 70.94 117.944 -178.797 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 185' ' ' TRP . . . . . . . . . . . . 0.252 9.4 p90 -80.22 -17.95 50.85 Favored 'General case' 0 N--CA 1.427 -1.587 0 O-C-N 125.272 1.607 . . . . 68.98 110.09 -167.426 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 186' ' ' LEU . . . . . . . . . . . . . 4.0 mp -79.39 -20.56 47.36 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 119.094 -1.043 . . . . 67.06 110.369 -176.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 187' ' ' VAL . . . . . . . . . . . . . 43.7 t -127.19 89.37 51.89 Favored Pre-proline 0 N--CA 1.428 -1.574 0 N-CA-C 105.241 -2.133 . . . . 68.09 105.241 177.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 188' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_endo -83.54 143.35 10.87 Favored 'Trans proline' 0 C--O 1.244 0.776 0 C-N-CA 121.459 1.439 . . . . 69.98 110.878 173.014 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 189' ' ' ALA . . . . . . . . . . . . . . . -53.41 -45.4 69.33 Favored 'General case' 0 CA--C 1.49 -1.343 0 CA-C-O 118.05 -0.976 . . . . 72.93 109.556 -171.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.26 -27.25 66.17 Favored 'General case' 0 C--O 1.234 0.273 0 O-C-N 125.572 1.795 . . . . 84.21 111.317 -172.131 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -73.03 -37.91 66.74 Favored 'General case' 0 CA--C 1.515 -0.388 0 C-N-CA 119.489 -0.884 . . . . 72.41 113.296 172.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 192' ' ' LEU . . . . . . . . . . . . . 3.1 tp -64.07 -62.98 1.28 Allowed 'General case' 0 CA--C 1.496 -1.116 0 N-CA-C 105.013 -2.217 . . . . 72.07 105.013 176.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -35.0 -42.69 0.17 Allowed 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 114.6 -1.182 . . . . 93.86 111.147 176.789 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -102.04 7.57 41.17 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 114.488 1.292 . . . . 72.93 114.488 -169.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 195' ' ' GLY . . . . . . . . . . . . . . . 44.36 32.59 2.73 Favored Glycine 0 CA--C 1.535 1.283 0 N-CA-C 117.966 1.947 . . . . 70.02 117.966 -169.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 196' ' ' ASP . . . . . 1.095 ' CB ' ' O ' ' A' 2093 ' ' HOH 0.448 0.3 OUTLIER -93.76 69.36 4.02 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 113.759 -3.176 . . . . 68.29 115.144 177.51 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 197' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -50.17 -29.31 9.01 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 112.424 -2.171 . . . . 72.56 114.191 172.184 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 198' ' ' ASP . . . . . 0.944 ' OD2' ' OD2' ' A' ' 196' ' ' ASP . 0.5 OUTLIER -43.31 -53.38 5.27 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 104.911 -2.255 . . . . 65.63 104.911 170.261 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 199' ' ' ARG . . . . . . . . . . . . . 69.3 ttt180 -69.35 -35.25 75.7 Favored 'General case' 0 C--O 1.252 1.229 0 N-CA-C 114.751 1.389 . . . . 62.43 114.751 -172.76 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 200' ' ' ILE . . . . . . . . . . . . . 1.9 mt -64.53 -52.67 52.04 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.351 0 O-C-N 123.546 0.529 . . . . 63.33 112.32 177.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' THR . . . . . . . . . . . . . 55.1 m -43.16 -47.67 6.29 Favored 'General case' 0 C--O 1.247 0.95 0 C-N-CA 122.958 0.503 . . . . 65.3 110.082 172.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . 0.351 0.0 OUTLIER -76.87 -42.33 40.3 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 115.84 -2.344 . . . . 73.28 115.613 -172.506 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 7.8 mt -51.98 -30.44 24.95 Favored 'General case' 0 CA--C 1.491 -1.305 0 O-C-N 123.75 0.656 . . . . 64.37 110.434 173.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' ALA . . . . . . . . . . . . . . . -77.36 -53.44 7.67 Favored 'General case' 0 N--CA 1.44 -0.931 0 O-C-N 124.019 0.824 . . . . 63.94 110.058 179.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 27.9 ttm105 -53.12 -43.11 66.66 Favored 'General case' 0 N--CA 1.403 -2.822 0 C-N-CA 116.192 -2.203 . . . . 94.69 110.417 179.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 88.9 mt-10 -66.16 -31.08 71.71 Favored 'General case' 0 C--O 1.253 1.253 0 C-N-CA 119.425 -0.91 . . . . 77.75 111.297 -173.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -65.07 -47.9 75.67 Favored 'General case' 0 CA--C 1.548 0.888 0 O-C-N 125.636 1.835 . . . . 68.33 109.724 178.095 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 28.2 t -66.7 -32.76 59.47 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-N 116.254 -0.43 . . . . 70.01 111.633 -179.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -79.25 -51.82 8.95 Favored 'General case' 0 CA--C 1.473 -1.994 0 N-CA-C 107.964 -1.124 . . . . 85.94 107.964 -177.624 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' GLY . . . . . . . . . . . . . . . -59.75 -0.26 0.93 Allowed Glycine 0 N--CA 1.418 -2.516 0 CA-C-O 118.806 -0.997 . . . . 77.83 112.895 177.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -95.68 17.07 15.7 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 119.018 2.97 . . . . 83.08 119.018 -179.331 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 28.5 mttt -113.73 -167.23 1.18 Allowed 'General case' 0 N--CA 1.503 2.192 0 N-CA-C 116.97 2.211 . . . . 89.26 116.97 -176.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.524 3.269 0 C-N-CA 127.693 2.397 . . . . 97.61 110.472 -167.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1214 ' ' SO4 . . . . . 1.002 ' S ' ' O ' ' A' 2098 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2001 ' ' HOH . . . . . 0.48 ' O ' ' N ' ' A' ' 1' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2003 ' ' HOH . . . . . 0.751 ' O ' ' CA ' ' A' ' 3' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2005 ' ' HOH . . . . . 0.555 ' O ' ' CD ' ' A' ' 2' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2006 ' ' HOH . . . . . 0.648 ' O ' ' C ' ' A' ' 2' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2009 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2010 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2011 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2012 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2013 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2014 ' ' HOH . . . . . 0.416 ' O ' ' CG ' ' A' ' 9' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2015 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2016 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2017 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2018 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2019 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2020 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2021 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2022 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2023 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2024 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2025 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2026 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2027 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2028 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2029 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2030 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2031 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2032 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2033 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2034 ' ' HOH . . . . . 0.438 ' O ' ' CA ' ' A' ' 51' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2035 ' ' HOH . . . . . 0.432 ' O ' ' CG ' ' A' ' 51' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2036 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2037 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2038 ' ' HOH . . . . . 0.412 ' O ' ' OD1' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2039 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2040 ' ' HOH . . . . . 1.035 ' O ' ' OD2' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2041 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2042 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2043 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2044 ' ' HOH . . . . . 0.438 ' O ' ' CA ' ' A' ' 65' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2045 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2046 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2047 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2048 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2049 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2050 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2051 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2052 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2053 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2054 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2055 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2056 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2057 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2058 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2059 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2060 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2061 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2062 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2063 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2064 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2065 ' ' HOH . . . . . 0.636 ' O ' ' OE1' ' A' ' 120' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2066 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2067 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2068 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2069 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2070 ' ' HOH . . . . . 1.125 ' O ' ' NZ ' ' A' ' 130' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2071 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2072 ' ' HOH . . . . . 1.147 ' O ' ' NZ ' ' A' ' 130' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2073 ' ' HOH . . . . . 0.844 ' O ' ' CG ' ' A' ' 130' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2074 ' ' HOH . . . . . 1.142 ' O ' ' NZ ' ' A' ' 133' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2075 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2076 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2077 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2078 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2079 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2080 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2081 ' ' HOH . . . . . 0.535 ' O ' ' N ' ' A' ' 155' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2082 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2083 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2084 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2085 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2086 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2087 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2088 ' ' HOH . . . . . 0.773 ' O ' ' CE ' ' A' ' 176' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2089 ' ' HOH . . . . . 1.127 ' O ' ' NZ ' ' A' ' 176' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2090 ' ' HOH . . . . . 0.729 ' O ' ' CD ' ' A' ' 176' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2091 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2092 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2093 ' ' HOH . . . . . 1.095 ' O ' ' CB ' ' A' ' 196' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2094 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2095 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2096 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2097 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2098 ' ' HOH . . . . . 1.002 ' O ' ' S ' ' A' 1214 ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2099 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2100 ' ' HOH . . . . . 0.811 ' O ' ' O2 ' ' A' 1214 ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2101 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2102 ' ' HOH . . . . . 0.853 ' O ' ' S ' ' A' 1214 ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 1' ' ' MET . . . . . 0.909 ' HB3' ' O ' ' A' 2070 ' ' HOH . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.252 0 N-CA-C 113.622 0.971 . . . . 103.0 113.622 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 2' ' ' LYS . . . . . 0.927 ' HD2' ' O ' ' A' 2005 ' ' HOH . 1.4 tppt? 71.82 -155.21 0.1 Allowed 'General case' 0 CA--C 1.577 1.985 0 N-CA-C 118.627 2.825 . . . . 103.29000000000001 118.627 171.411 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ASN . . . . . 1.18 ' HA ' ' O ' ' A' 2003 ' ' HOH 0.305 9.3 p30 -91.15 35.37 0.92 Allowed 'General case' 0 N--CA 1.521 3.085 0 N-CA-C 117.645 2.461 . . . . 94.549999999999997 117.645 169.456 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 48.0 m0 -91.59 127.82 37.18 Favored 'General case' 0 N--CA 1.434 -1.26 0 CA-C-N 114.184 -1.371 . . . . 88.650000000000006 114.559 -178.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.29 -37.46 69.89 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 115.122 1.527 . . . . 86.120000000000005 115.122 176.872 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.3 p -133.0 155.15 49.7 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 107.738 -1.208 . . . . 79.709999999999994 107.738 170.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 94.1 p -87.78 145.78 25.95 Favored 'General case' 0 C--O 1.241 0.643 0 C-N-CA 119.487 -0.885 . . . . 74.0 112.045 -173.264 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -49.23 -40.26 33.12 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 112.673 0.62 . . . . 71.870000000000005 112.673 172.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' GLU . . . . . 0.776 ' HG2' ' O ' ' A' 2014 ' ' HOH . 47.0 tt0 -48.72 -51.71 27.34 Favored 'General case' 0 C--O 1.243 0.753 0 N-CA-C 109.133 -0.691 . . . . 79.010000000000005 109.133 175.226 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 59.9 p -65.45 -34.67 78.82 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 114.138 1.162 . . . . 67.260000000000005 114.138 -168.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 37.6 mm -61.19 -44.37 98.22 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.202 0 O-C-N 124.274 0.983 . . . . 63.109999999999999 108.408 175.31 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.7 mt -82.51 -21.79 35.31 Favored 'General case' 0 CA--C 1.491 -1.299 0 C-N-CA 119.305 -0.958 . . . . 64.989999999999995 110.233 -166.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 25.6 p -94.92 8.72 41.87 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 114.426 1.269 . . . . 66.75 114.426 177.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 28.6 m -69.67 -43.14 73.13 Favored 'General case' 0 CA--C 1.509 -0.618 0 CA-C-N 118.717 0.689 . . . . 63.780000000000001 111.215 -177.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -153.79 -179.15 28.95 Favored Glycine 0 C--O 1.26 1.774 0 O-C-N 123.86 0.725 . . . . 61.530000000000001 111.913 167.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -70.42 -25.0 26.03 Favored 'Trans proline' 0 N--CA 1.484 0.922 0 C-N-CA 124.381 3.387 . . . . 62.390000000000001 118.897 176.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.6 t -130.72 137.95 54.8 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.606 0 N-CA-C 105.834 -1.913 . . . . 63.100000000000001 105.834 -171.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' VAL . . . . . 0.439 ' O ' ' HA2' ' A' ' 182' ' ' GLY . 52.8 t -121.92 117.79 29.59 Favored Pre-proline 0 N--CA 1.433 -1.307 0 N-CA-C 102.301 -3.222 . . . . 63.520000000000003 102.301 172.638 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' PRO . . . . . 0.578 ' HD2' ' O ' ' A' ' 43' ' ' VAL . 57.9 Cg_endo -70.51 141.64 42.66 Favored 'Trans proline' 0 CA--C 1.499 -1.268 0 C-N-CA 122.094 1.863 . . . . 64.560000000000002 112.077 177.499 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 88.2 t -105.66 104.65 17.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 N-CA-C 106.541 -1.651 . . . . 66.189999999999998 106.541 179.949 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 14.7 mt -104.41 133.04 49.58 Favored 'Isoleucine or valine' 0 C--O 1.241 0.648 0 N-CA-C 114.467 1.284 . . . . 66.590000000000003 114.467 -164.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 99.8 t -120.51 104.88 16.03 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.5 0 N-CA-C 104.874 -2.269 . . . . 64.829999999999998 104.874 172.651 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.3 p -105.68 121.07 57.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 108.223 -1.029 . . . . 66.549999999999997 108.223 -176.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.9 mttt -89.91 -43.3 10.69 Favored 'General case' 0 C--O 1.278 2.576 0 CA-C-N 115.071 -0.968 . . . . 79.909999999999997 112.204 -175.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.1 126.21 51.83 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 114.815 1.413 . . . . 82.819999999999993 114.815 178.398 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 11.4 tp -50.57 -40.75 53.09 Favored 'General case' 0 C--O 1.248 0.982 0 N-CA-C 114.14 1.163 . . . . 71.810000000000002 114.14 -176.11 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -66.96 -15.83 63.95 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 115.855 1.798 . . . . 94.920000000000002 115.855 -174.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 35.7 m170 -84.05 -22.66 31.18 Favored 'General case' 0 N--CA 1.429 -1.516 0 N-CA-C 113.92 1.082 . . . . 78.569999999999993 113.92 177.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -54.51 -56.73 15.88 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 118.702 0.683 . . . . 74.5 109.887 -170.441 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' VAL . . . . . 0.552 ' O ' ' HG3' ' A' ' 34' ' ' LYS . 36.7 t -60.68 -58.62 17.96 Favored Pre-proline 0 CA--C 1.551 0.997 0 CA-C-N 116.246 -0.434 . . . . 70.890000000000001 111.122 -168.437 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' PRO . . . . . 0.433 ' HD3' ' HB ' ' A' ' 30' ' ' VAL . 21.7 Cg_exo -56.42 -36.74 97.7 Favored 'Trans proline' 0 N--CA 1.485 0.998 0 O-C-N 121.892 0.417 . . . . 69.079999999999998 112.892 179.718 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 15.0 ttp -55.72 -53.71 53.25 Favored 'General case' 0 CA--C 1.491 -1.309 0 CA-C-O 121.775 0.798 . . . . 66.75 111.684 177.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -49.93 -47.22 52.49 Favored 'General case' 0 C--O 1.276 2.482 0 CA-C-N 113.649 -1.614 . . . . 66.790000000000006 112.903 173.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' LYS . . . . . 0.552 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 15.1 mtpt -68.47 -32.77 73.01 Favored 'General case' 0 C--O 1.254 1.293 0 N-CA-C 109.363 -0.606 . . . . 73.890000000000001 109.363 -171.49 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ALA . . . . . 0.444 ' HB2' ' HB3' ' A' ' 197' ' ' TYR . . . -67.4 -51.97 45.48 Favored 'General case' 0 C--O 1.215 -0.717 0 O-C-N 125.543 1.777 . . . . 62.170000000000002 107.115 -178.709 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 4.6 mt -42.13 -61.96 1.04 Allowed 'General case' 0 CA--C 1.496 -1.129 0 CA-C-N 114.6 -1.182 . . . . 65.109999999999999 114.075 168.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 45.7 t -53.79 -55.95 11.33 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.224 0 CA-C-N 115.295 -0.866 . . . . 62.020000000000003 112.68 175.655 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -48.59 -33.21 9.35 Favored 'General case' 0 C--O 1.201 -1.497 0 O-C-N 124.317 1.01 . . . . 61.829999999999998 108.962 -179.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -90.57 21.68 31.39 Favored Glycine 0 C--O 1.247 0.926 0 N-CA-C 115.244 0.858 . . . . 61.759999999999998 115.244 178.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 78.28 9.95 86.59 Favored Glycine 0 N--CA 1.444 -0.831 0 N-CA-C 115.636 1.015 . . . . 64.879999999999995 115.636 175.104 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 53.5 t -109.64 119.74 59.47 Favored 'Isoleucine or valine' 0 C--O 1.27 2.141 0 O-C-N 121.282 -1.128 . . . . 67.599999999999994 112.103 179.026 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.8 mtm105 -111.9 -24.82 9.75 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 116.323 1.971 . . . . 82.579999999999998 116.323 -166.229 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' VAL . . . . . 0.578 ' O ' ' HD2' ' A' ' 19' ' ' PRO . 33.0 t -95.39 106.75 18.64 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.164 0 C-N-CA 117.779 -1.568 . . . . 64.450000000000003 108.669 177.779 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 81.0 mt -97.88 129.58 44.82 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 113.284 -1.78 . . . . 65.280000000000001 108.62 -178.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ASN . . . . . 0.591 HD22 HD13 ' A' ' 92' ' ' ILE . 10.8 t-20 -118.36 99.89 7.13 Favored 'General case' 0 C--O 1.263 1.799 0 CA-C-O 121.35 0.595 . . . . 70.290000000000006 112.228 175.482 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 46.9 t -84.33 115.72 26.86 Favored 'Isoleucine or valine' 0 C--O 1.247 0.951 0 CA-C-N 115.927 -0.579 . . . . 60.979999999999997 110.801 178.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 67.6 p -79.23 139.22 37.98 Favored 'General case' 0 CA--C 1.481 -1.695 0 N-CA-C 107.667 -1.234 . . . . 59.969999999999999 107.667 -174.305 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.3 mt -82.12 62.55 5.91 Favored 'General case' 0 C--O 1.261 1.694 0 N-CA-C 106.733 -1.58 . . . . 63.119999999999997 106.733 179.064 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ARG . . . . . 0.613 ' HD3' ' O ' ' A' 2033 ' ' HOH . 33.0 mtt180 -121.04 0.42 10.2 Favored 'General case' 0 N--CA 1.485 1.325 0 O-C-N 124.142 0.901 . . . . 76.25 109.82 -177.464 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 39.3 p -128.78 138.43 52.08 Favored 'General case' 0 CA--C 1.481 -1.678 0 CA-C-O 122.949 1.356 . . . . 69.909999999999997 110.189 177.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLU . . . . . 0.766 ' HA ' ' O ' ' A' 2034 ' ' HOH . 6.7 mp0 -19.13 -29.46 0.0 OUTLIER 'General case' 0 N--CA 1.412 -2.337 0 CA-C-N 109.43 -3.532 . . . . 78.969999999999999 114.12 165.968 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' CYS . . . . . 0.556 ' HB3' ' O ' ' A' 2026 ' ' HOH . 15.4 p -149.33 31.68 0.74 Allowed 'General case' 0 CA--C 1.563 1.469 0 O-C-N 118.934 -2.354 . . . . 78.329999999999998 112.428 -178.078 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -40.05 -61.35 0.88 Allowed 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 117.878 -1.058 . . . . 65.560000000000002 110.54 156.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.4 t -53.07 -47.44 54.62 Favored 'Isoleucine or valine' 0 C--O 1.261 1.666 0 N-CA-C 115.32 1.6 . . . . 60.280000000000001 115.32 -176.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ASP . . . . . 1.035 ' OD2' ' O ' ' A' 2040 ' ' HOH . 90.9 m-20 -52.14 -42.4 63.32 Favored 'General case' 0 C--O 1.27 2.158 0 C-N-CA 119.109 -1.036 . . . . 60.32 112.061 172.961 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -65.57 -54.74 23.75 Favored 'General case' 0 CA--C 1.571 1.784 0 N-CA-C 115.229 1.566 . . . . 60.420000000000002 115.229 176.333 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 14.0 mt -43.14 -51.46 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.356 0.879 0 CA-C-N 118.214 0.461 . . . . 59.710000000000001 109.862 166.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 38.6 ttm105 -54.66 -52.77 61.29 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 113.672 0.99 . . . . 62.969999999999999 113.672 179.684 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.06 -37.83 81.73 Favored 'General case' 0 C--O 1.222 -0.378 0 N-CA-C 113.595 0.961 . . . . 63.700000000000003 113.595 176.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 44.8 mt -61.39 -41.63 90.62 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.911 0 C-N-CA 116.679 -2.008 . . . . 64.989999999999995 111.811 177.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -54.37 -41.42 69.16 Favored 'General case' 0 N--CA 1.44 -0.925 0 CA-C-N 115.462 -0.79 . . . . 68.349999999999994 110.754 174.159 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.2 -28.94 28.93 Favored 'General case' 0 C--O 1.208 -1.105 0 C-N-CA 119.27 -0.972 . . . . 77.650000000000006 108.988 -167.659 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLU . . . . . 0.432 ' O ' ' HD2' ' A' ' 65' ' ' PRO . 50.2 mt-10 -118.92 -23.66 6.85 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 118.583 -1.247 . . . . 71.959999999999994 113.313 -162.252 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 94.1 t -107.63 73.56 0.41 Allowed Pre-proline 0 N--CA 1.41 -2.474 0 N-CA-C 105.908 -1.886 . . . . 68.510000000000005 105.908 176.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' PRO . . . . . 0.79 ' HA ' ' O ' ' A' 2044 ' ' HOH . 4.6 Cg_endo -53.71 -28.62 47.81 Favored 'Trans proline' 0 C--N 1.371 1.754 0 O-C-N 123.657 1.346 . . . . 70.430000000000007 114.19 177.85 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLU . . . . . 0.615 ' HB2' ' O ' ' A' 2045 ' ' HOH 0.255 0.2 OUTLIER -85.42 2.88 42.61 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 114.328 1.233 . . . . 83.599999999999994 114.328 -175.234 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -110.41 137.65 47.84 Favored 'General case' 0 CA--C 1.472 -2.04 0 C-N-CA 120.682 -0.407 . . . . 69.019999999999996 111.814 -178.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 63.5 mt -88.2 95.48 5.26 Favored 'Isoleucine or valine' 0 C--O 1.241 0.655 0 N-CA-C 108.863 -0.791 . . . . 61.75 108.863 179.122 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 8.3 p -96.46 138.47 21.61 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.84 0 C-N-CA 116.806 -1.958 . . . . 59.280000000000001 112.459 -175.121 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -135.39 -179.25 16.38 Favored Glycine 0 N--CA 1.49 2.253 0 O-C-N 125.38 1.675 . . . . 59.649999999999999 113.359 179.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -123.79 133.27 53.85 Favored 'General case' 0 N--CA 1.441 -0.916 0 C-N-CA 119.434 -0.907 . . . . 57.93 110.458 -174.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -104.23 170.96 19.16 Favored Glycine 0 N--CA 1.441 -1.014 0 C-N-CA 118.808 -1.663 . . . . 59.619999999999997 112.462 176.061 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' THR . . . . . 0.66 HG22 ' O ' ' A' 2046 ' ' HOH . 15.3 m 50.73 55.17 9.94 Favored 'General case' 0 CA--C 1.502 -0.87 0 N-CA-C 105.473 -2.047 . . . . 64.75 105.473 179.102 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 71.4 t -98.1 123.88 50.84 Favored 'Isoleucine or valine' 0 C--O 1.248 0.987 0 N-CA-C 103.508 -2.775 . . . . 61.659999999999997 103.508 173.856 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' LEU . . . . . 0.468 HD13 ' O ' ' A' 2046 ' ' HOH . 11.3 mp -111.63 -16.76 13.17 Favored 'General case' 0 C--O 1.256 1.405 0 N-CA-C 117.469 2.396 . . . . 59.140000000000001 117.469 -167.825 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -158.14 164.01 22.67 Favored Pre-proline 0 C--O 1.279 2.655 0 CA-C-N 115.052 -0.976 . . . . 62.049999999999997 110.061 -176.334 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -56.69 -34.49 96.07 Favored 'Trans proline' 0 CA--C 1.533 0.439 0 O-C-N 123.458 1.241 . . . . 62.590000000000003 112.564 -176.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLN . . . . . 0.497 ' HB2' ' O ' ' A' 2049 ' ' HOH . 11.5 tm0? -55.44 -58.98 5.52 Favored 'General case' 0 C--O 1.25 1.126 0 N-CA-C 108.91 -0.774 . . . . 77.439999999999998 108.91 175.674 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' GLN . . . . . 0.479 ' O ' HG22 ' A' ' 83' ' ' VAL . 78.2 mt-30 -57.77 -35.95 71.48 Favored 'General case' 0 C--O 1.189 -2.11 0 C-N-CA 119.939 -0.704 . . . . 66.969999999999999 109.433 -178.529 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 32.6 tp -62.2 -49.99 73.57 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 113.996 1.11 . . . . 61.420000000000002 113.996 175.014 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.37 -62.6 1.45 Allowed 'General case' 0 C--O 1.213 -0.818 0 N-CA-C 109.359 -0.608 . . . . 65.370000000000005 109.359 170.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' GLU . . . . . 0.606 ' HG3' ' O ' ' A' 2052 ' ' HOH . 21.7 tt0 -43.77 -47.49 7.99 Favored 'General case' 0 C--O 1.239 0.541 0 N-CA-C 116.44 2.015 . . . . 81.659999999999997 116.44 -179.558 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 83' ' ' VAL . . . . . 0.479 HG22 ' O ' ' A' ' 79' ' ' GLN . 15.8 m -80.1 -32.19 13.69 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.148 0 CA-C-N 116.457 -0.338 . . . . 67.859999999999999 110.273 -174.483 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 90.2 m -60.11 -38.13 82.07 Favored 'General case' 0 CA--C 1.554 1.106 0 CA-C-O 121.858 0.837 . . . . 70.079999999999998 110.759 173.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -77.65 -29.42 51.65 Favored 'General case' 0 C--O 1.199 -1.569 0 O-C-N 121.477 -0.764 . . . . 85.819999999999993 111.344 -178.169 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.83 -20.31 65.91 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 109.4 -0.592 . . . . 71.650000000000006 109.4 173.78 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 113.54 10.69 14.4 Favored Glycine 0 C--O 1.254 1.363 0 C-N-CA 119.646 -1.264 . . . . 68.379999999999995 115.879 174.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -52.05 131.91 32.24 Favored 'General case' 0 C--O 1.258 1.538 0 C-N-CA 125.293 1.437 . . . . 66.909999999999997 110.941 172.228 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -92.88 -13.44 29.0 Favored 'General case' 0 CA--C 1.498 -1.023 0 CA-C-N 113.719 -1.582 . . . . 78.150000000000006 111.19 -177.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 53.7 p90 -163.94 165.45 22.65 Favored 'General case' 0 C--O 1.254 1.31 0 N-CA-C 108.554 -0.906 . . . . 62.719999999999999 108.554 172.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -126.71 153.69 45.12 Favored 'General case' 0 C--O 1.246 0.87 0 C-N-CA 119.534 -0.866 . . . . 59.200000000000003 112.685 167.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ILE . . . . . 0.591 HD13 HD22 ' A' ' 45' ' ' ASN . 0.8 OUTLIER -123.22 143.69 35.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 O-C-N 125.633 1.833 . . . . 60.829999999999998 107.396 170.733 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 32.6 p -126.23 153.9 74.46 Favored Pre-proline 0 N--CA 1.427 -1.611 0 CA-C-N 115.115 -0.948 . . . . 61.289999999999999 109.448 174.242 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -63.76 -32.25 67.88 Favored 'Trans proline' 0 CA--C 1.572 2.409 0 N-CA-C 116.076 1.529 . . . . 62.090000000000003 116.076 176.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' GLY . . . . . 0.425 ' HA2' ' O ' ' A' ' 114' ' ' GLY . . . -156.16 178.3 32.75 Favored Glycine 0 N--CA 1.486 2.016 0 N-CA-C 106.414 -2.674 . . . . 60.899999999999999 106.414 -179.446 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -113.7 159.53 19.6 Favored 'General case' 0 CA--C 1.578 2.046 0 N-CA-C 116.442 2.016 . . . . 59.009999999999998 116.442 -177.369 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 43.5 p -138.09 148.93 45.5 Favored 'General case' 0 C--O 1.284 2.882 0 CA-C-N 120.153 1.342 . . . . 56.240000000000002 109.686 173.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' GLU . . . . . 0.764 ' HG3' ' O ' ' A' 2060 ' ' HOH 0.609 11.9 pt-20 -46.44 -58.32 6.9 Favored Pre-proline 0 CA--C 1.613 3.392 0 N-CA-C 105.17 -2.159 . . . . 54.32 105.17 177.751 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 99' ' ' PRO . . . . . 0.475 ' C ' ' O ' ' A' ' 98' ' ' GLU . 84.4 Cg_exo -49.42 -54.32 5.63 Favored 'Trans proline' 0 C--N 1.361 1.188 0 C-N-CA 116.155 -2.097 . . . . 58.450000000000003 113.177 -178.093 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 28.9 tp -64.88 -37.27 87.07 Favored 'General case' 0 C--O 1.237 0.413 0 O-C-N 123.837 0.711 . . . . 60.409999999999997 110.079 -163.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 22.6 mt -61.13 -49.12 78.55 Favored 'General case' 0 CA--C 1.57 1.714 0 N-CA-C 113.898 1.073 . . . . 58.969999999999999 113.898 167.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 9.6 tttp -53.16 -54.66 32.55 Favored 'General case' 0 C--O 1.238 0.49 0 O-C-N 121.229 -0.919 . . . . 70.920000000000002 110.097 176.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.51 -38.65 85.07 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 114.616 1.339 . . . . 62.289999999999999 114.616 -178.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -73.29 -29.52 62.77 Favored 'General case' 0 CA--C 1.501 -0.94 0 N-CA-C 108.223 -1.029 . . . . 62.759999999999998 108.223 -174.727 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.07 -22.07 56.05 Favored 'General case' 0 CA--C 1.489 -1.4 0 CA-C-N 114.508 -1.224 . . . . 64.230000000000004 110.521 -175.585 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -88.64 -31.35 18.59 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 112.758 -2.019 . . . . 75.260000000000005 111.61 179.033 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -84.68 -171.15 47.87 Favored Glycine 0 C--N 1.341 0.86 0 C-N-CA 120.921 -0.657 . . . . 63.950000000000003 112.544 -176.049 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 49.6 p -102.76 -3.33 26.59 Favored 'General case' 0 C--O 1.254 1.319 0 N-CA-C 114.85 1.426 . . . . 64.150000000000006 114.85 -160.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 42.3 pt -132.48 144.9 54.96 Favored Pre-proline 0 N--CA 1.517 2.876 0 C-N-CA 124.297 1.039 . . . . 63.490000000000002 111.628 -177.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -68.77 140.14 45.73 Favored 'Trans proline' 0 N--CA 1.448 -1.183 0 C-N-CA 122.985 2.456 . . . . 60.509999999999998 113.427 -176.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 11.0 tp -115.88 122.91 46.76 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.374 -0.376 . . . . 59.32 110.073 174.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 3.2 mp -104.75 97.87 13.7 Favored Pre-proline 0 N--CA 1.445 -0.696 0 N-CA-C 102.897 -3.001 . . . . 60.939999999999998 102.897 179.809 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -94.49 148.77 1.87 Allowed 'Trans proline' 0 C--N 1.356 0.966 0 O-C-N 123.011 1.006 . . . . 57.460000000000001 111.963 -173.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' GLY . . . . . 0.425 ' O ' ' HA2' ' A' ' 95' ' ' GLY . . . -69.6 144.69 40.85 Favored Glycine 0 C--O 1.271 2.45 0 O-C-N 125.307 1.63 . . . . 54.390000000000001 113.939 178.703 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 1.6 pp -133.43 165.25 32.74 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.383 0 N-CA-C 113.628 0.973 . . . . 56.530000000000001 113.628 174.061 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 66.6 m -133.72 -34.62 1.01 Allowed 'General case' 0 C--O 1.245 0.848 0 O-C-N 120.451 -1.406 . . . . 58.380000000000003 111.033 171.269 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 73.5 p -114.98 166.25 12.0 Favored 'General case' 0 C--O 1.202 -1.412 0 N-CA-C 106.46 -1.681 . . . . 57.75 106.46 -173.488 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 33.1 m -68.7 -40.38 81.52 Favored 'Isoleucine or valine' 0 C--O 1.244 0.799 0 O-C-N 123.912 0.758 . . . . 58.600000000000001 110.962 176.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 10.7 m -51.28 -33.8 30.2 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 108.823 -0.806 . . . . 59.18 108.823 175.444 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' GLU . . . . . 0.636 ' OE1' ' O ' ' A' 2065 ' ' HOH . 50.5 mt-10 -73.41 -58.81 3.05 Favored 'General case' 0 CA--C 1.493 -1.225 0 N-CA-C 106.666 -1.605 . . . . 63.0 106.666 -174.61 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 121' ' ' LEU . . . . . 0.498 HD11 HG11 ' A' ' 156' ' ' VAL . 28.3 tp -38.19 -50.23 1.4 Allowed 'General case' 0 CA--C 1.569 1.706 0 N-CA-C 113.048 0.759 . . . . 57.25 113.048 172.092 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 67.0 mtp -62.25 -46.29 89.49 Favored 'General case' 0 CA--C 1.482 -1.668 0 C-N-CA 125.29 1.436 . . . . 61.899999999999999 110.292 -173.775 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 37.2 tp -56.61 -42.98 79.7 Favored 'General case' 0 C--O 1.251 1.168 0 N-CA-C 113.486 0.921 . . . . 62.109999999999999 113.486 175.368 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -72.0 -27.88 69.6 Favored Glycine 0 C--N 1.337 0.605 0 C-N-CA 119.206 -1.473 . . . . 61.82 110.756 179.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 3.6 mtp -71.08 -27.55 63.7 Favored 'General case' 0 C--O 1.243 0.732 0 N-CA-C 107.653 -1.24 . . . . 65.049999999999997 107.653 -178.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 44.2 m-20 -64.3 -29.72 70.79 Favored 'General case' 0 C--O 1.211 -0.925 0 N-CA-C 107.425 -1.324 . . . . 67.099999999999994 107.425 -179.637 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' TYR . . . . . . . . . . . . . 71.4 m-85 -93.43 19.69 8.06 Favored 'General case' 0 N--CA 1.41 -2.434 0 C-N-CA 116.371 -2.131 . . . . 64.780000000000001 111.82 179.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 90.28 2.62 73.57 Favored Glycine 0 C--O 1.226 -0.399 0 C-N-CA 120.005 -1.093 . . . . 62.299999999999997 115.42 174.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 7.8 mp -78.44 156.84 29.18 Favored 'General case' 0 C--O 1.258 1.543 0 O-C-N 121.725 -0.867 . . . . 63.939999999999998 111.246 -178.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' LYS . . . . . 1.2 ' HG3' ' O ' ' A' 2073 ' ' HOH . 0.0 OUTLIER -143.78 -7.32 0.75 Allowed 'General case' 0 CA--C 1.563 1.455 0 CA-C-N 114.816 -1.083 . . . . 68.599999999999994 112.624 179.262 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 131' ' ' GLU . . . . . 0.564 ' OE2' ' HG2' ' A' ' 130' ' ' LYS . 0.9 OUTLIER -112.86 132.13 55.42 Favored 'General case' 0 C--O 1.218 -0.583 0 N-CA-C 114.467 1.284 . . . . 78.189999999999998 114.467 178.106 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -142.86 135.23 27.5 Favored 'General case' 0 C--O 1.211 -0.973 0 N-CA-C 115.741 1.756 . . . . 56.530000000000001 115.741 -175.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' LYS . . . . . 1.142 ' NZ ' ' O ' ' A' 2074 ' ' HOH . 84.8 tttt -60.03 138.77 57.79 Favored 'General case' 0 C--O 1.282 2.772 0 N-CA-C 101.699 -3.445 . . . . 54.469999999999999 101.699 158.596 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 134' ' ' PHE . . . . . 0.423 ' CE2' ' HA ' ' A' ' 137' ' ' ALA . 68.5 t80 -115.38 117.44 30.42 Favored 'General case' 0 C--O 1.259 1.59 0 N-CA-C 104.545 -2.391 . . . . 61.07 104.545 168.741 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 135' ' ' PHE . . . . . 0.41 ' HA ' ' N ' ' A' ' 137' ' ' ALA . 46.8 t80 -158.52 141.02 10.39 Favored Pre-proline 0 C--O 1.265 1.914 0 N-CA-C 113.489 0.922 . . . . 63.0 113.489 -161.005 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_endo -79.6 105.65 0.74 Allowed 'Cis proline' 0 C--O 1.197 -1.549 0 C-N-CA 123.839 -1.317 . . . . 59.100000000000001 109.155 -4.607 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' ALA . . . . . 0.423 ' HA ' ' CE2' ' A' ' 134' ' ' PHE . . . -22.88 -74.79 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 117.53 2.419 . . . . 60.640000000000001 117.53 176.488 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 138' ' ' GLU . . . . . 0.415 ' O ' ' N ' ' A' ' 141' ' ' GLY . 19.2 mm-40 -51.11 -78.04 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 120.32 -0.552 . . . . 72.230000000000004 110.554 -173.782 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -27.73 -44.52 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 117.245 2.313 . . . . 70.810000000000002 117.245 169.101 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 41.1 m-20 -63.12 4.07 0.22 Allowed 'General case' 0 C--O 1.256 1.427 0 N-CA-C 115.085 1.513 . . . . 71.709999999999994 115.085 170.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' GLY . . . . . 0.415 ' N ' ' O ' ' A' ' 138' ' ' GLU . . . 99.63 -5.33 58.41 Favored Glycine 0 N--CA 1.484 1.898 0 CA-C-N 120.239 1.381 . . . . 69.310000000000002 114.955 -173.678 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 58.69 -146.67 41.34 Favored Glycine 0 C--O 1.259 1.702 0 N-CA-C 118.01 1.964 . . . . 65.459999999999994 118.01 178.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 48.5 t -45.0 -73.22 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.181 -2.522 0 N-CA-C 114.535 1.309 . . . . 61.869999999999997 114.535 -177.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' LYS . . . . . 0.601 ' HE3' ' O ' ' A' 2077 ' ' HOH . 0.0 OUTLIER -35.57 -47.47 0.46 Allowed 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.323 1.049 . . . . 81.019999999999996 112.411 175.715 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -59.37 -55.41 35.05 Favored 'General case' 0 C--O 1.257 1.462 0 C-N-CA 124.593 1.157 . . . . 64.430000000000007 110.441 -177.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 12.8 tp -62.71 -21.22 65.61 Favored 'General case' 0 C--O 1.201 -1.491 0 CA-C-N 116.024 -0.534 . . . . 62.219999999999999 109.955 -177.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -81.4 -37.33 28.31 Favored 'General case' 0 CA--C 1.462 -2.407 0 C-N-CA 115.957 -2.297 . . . . 64.030000000000001 107.137 -176.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -61.1 -53.2 60.03 Favored 'General case' 0 C--O 1.264 1.822 0 N-CA-C 105.99 -1.856 . . . . 63.149999999999999 105.99 177.489 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 149' ' ' ILE . . . . . . . . . . . . . 18.4 mt -54.24 -39.06 41.54 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.377 0 CA-C-N 113.746 -1.57 . . . . 67.780000000000001 111.422 -177.333 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' ALA . . . . . 0.427 ' HB1' ' O ' ' A' 2079 ' ' HOH . . . -88.96 5.82 42.4 Favored 'General case' 0 C--N 1.31 -1.116 0 C-N-CA 117.947 -1.501 . . . . 70.569999999999993 112.325 179.132 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . -51.58 -62.38 5.57 Favored Glycine 0 CA--C 1.541 1.677 0 C-N-CA 120.496 -0.859 . . . . 73.310000000000002 111.047 -179.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -71.6 -2.36 11.23 Favored 'Trans proline' 0 C--N 1.369 1.634 0 C-N-CA 123.644 2.896 . . . . 72.939999999999998 117.699 -178.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -130.76 84.03 2.16 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 119.236 0.925 . . . . 73.439999999999998 110.451 -170.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 154' ' ' SER . . . . . 0.41 ' O ' ' NH2' ' A' ' 157' ' ' ARG . 98.3 p -77.31 -25.28 51.07 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.533 -0.758 . . . . 77.530000000000001 109.002 -171.177 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 155' ' ' GLN . . . . . 0.445 ' N ' ' O ' ' A' 2081 ' ' HOH . 0.0 OUTLIER -75.44 -26.03 57.97 Favored 'General case' 0 C--O 1.266 1.932 0 N-CA-C 117.238 2.31 . . . . 88.640000000000001 117.238 -178.272 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 156' ' ' VAL . . . . . 0.498 HG11 HD11 ' A' ' 121' ' ' LEU . 46.0 t -82.07 151.07 4.25 Favored 'Isoleucine or valine' 0 C--O 1.245 0.819 0 N-CA-C 105.143 -2.169 . . . . 71.629999999999995 105.143 -167.577 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 157' ' ' ARG . . . . . 0.41 ' NH2' ' O ' ' A' ' 154' ' ' SER . 9.4 mmp_? -136.29 142.77 43.96 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 108.3 -1.0 . . . . 68.329999999999998 108.3 178.865 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 158' ' ' PHE . . . . . . . . . . . . . 50.5 m-85 -115.09 166.38 11.87 Favored 'General case' 0 CA--C 1.48 -1.73 0 CA-C-N 115.081 -0.963 . . . . 61.619999999999997 112.132 -175.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 159' ' ' CYS . . . . . 0.528 ' HA ' ' O ' ' A' ' 180' ' ' CYS . 1.6 t -132.19 93.8 25.27 Favored Pre-proline 0 N--CA 1.45 -0.448 0 CA-C-N 111.837 -2.438 . . . . 59.200000000000003 109.041 165.408 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 160' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -65.24 142.55 73.81 Favored 'Trans proline' 0 C--O 1.187 -2.066 0 N-CA-C 115.673 1.374 . . . . 58.0 115.673 -179.292 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 161' ' ' THR . . . . . 0.448 HG22 ' N ' ' A' ' 162' ' ' GLY 0.283 87.1 m -143.94 160.21 41.22 Favored 'General case' 0 CA--C 1.474 -1.953 0 N-CA-C 105.046 -2.205 . . . . 61.740000000000002 105.046 171.783 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 162' ' ' GLY . . . . . 0.448 ' N ' HG22 ' A' ' 161' ' ' THR . . . 104.45 91.95 2.24 Favored Glycine 0 C--O 1.262 1.899 0 N-CA-C 110.03 -1.228 . . . . 62.399999999999999 110.03 176.347 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 163' ' ' GLY . . . . . 0.432 ' HA2' ' O3 ' ' A' 1214 ' ' SO4 . . . 88.01 20.34 50.21 Favored Glycine 0 N--CA 1.474 1.224 0 CA-C-O 123.431 1.573 . . . . 61.710000000000001 113.28 176.23 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 66.9 mt -95.92 122.95 47.89 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.18 0 CA-C-O 123.321 1.534 . . . . 66.609999999999999 112.575 -178.489 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 165' ' ' SER . . . . . 0.529 ' HB2' ' HD2' ' A' ' 166' ' ' PRO . 92.6 p -125.9 175.01 3.45 Favored Pre-proline 0 C--O 1.26 1.626 0 O-C-N 119.811 -1.806 . . . . 67.010000000000005 108.323 -175.547 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 166' ' ' PRO . . . . . 0.529 ' HD2' ' HB2' ' A' ' 165' ' ' SER . 88.0 Cg_exo -47.85 -41.28 32.18 Favored 'Trans proline' 0 C--N 1.37 1.688 0 O-C-N 124.193 1.628 . . . . 66.25 110.524 171.658 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 167' ' ' ALA . . . . . . . . . . . . . . . -58.18 -38.14 76.1 Favored 'General case' 0 CA--C 1.55 0.975 0 N-CA-C 115.885 1.809 . . . . 64.650000000000006 115.885 179.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 46.7 p30 -114.59 -14.56 12.07 Favored 'General case' 0 CA--C 1.549 0.925 0 O-C-N 119.844 -1.785 . . . . 67.769999999999996 113.731 -176.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 169' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -57.53 -19.07 22.63 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 117.048 2.24 . . . . 68.760000000000005 117.048 -170.185 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 170' ' ' ARG . . . . . 0.415 HH22 ' HB2' ' A' ' 213' ' ' LEU . 7.0 mtp85 -82.53 -37.19 25.54 Favored 'General case' 0 C--O 1.25 1.085 0 C-N-CA 116.56 -2.056 . . . . 88.510000000000005 107.328 -179.394 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 171' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -45.89 -38.82 7.86 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 120.052 -0.659 . . . . 74.150000000000006 111.109 172.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 -74.89 -55.24 6.0 Favored 'General case' 0 C--O 1.251 1.136 0 N-CA-C 114.298 1.222 . . . . 65.170000000000002 114.298 175.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 21.5 mt -52.45 -26.33 12.5 Favored 'General case' 0 C--O 1.264 1.834 0 C-N-CA 123.11 0.564 . . . . 60.950000000000003 112.196 178.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -58.68 -42.02 87.56 Favored 'General case' 0 C--O 1.202 -1.436 0 N-CA-C 115.082 1.512 . . . . 62.670000000000002 115.082 171.85 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 10.6 mt -58.76 131.28 50.44 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 118.446 2.758 . . . . 63.640000000000001 118.446 179.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 176' ' ' LYS . . . . . 1.096 ' HE2' ' O ' ' A' 2088 ' ' HOH . 0.0 OUTLIER -38.63 -46.97 1.27 Allowed 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 126.163 1.785 . . . . 64.120000000000005 112.0 172.995 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 177' ' ' SER . . . . . . . . . . . . . 94.9 p -85.21 3.98 36.79 Favored 'General case' 0 C--O 1.278 2.598 0 N-CA-C 116.063 1.875 . . . . 60.880000000000003 116.063 -170.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 38.6 t -110.21 117.87 55.73 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.126 0 CA-C-O 118.081 -0.961 . . . . 56.740000000000002 109.452 -178.891 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 13.6 mt -83.33 -39.23 21.02 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 119.818 1.19 . . . . 64.200000000000003 112.371 167.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 180' ' ' CYS . . . . . 0.528 ' O ' ' HA ' ' A' ' 159' ' ' CYS . 19.0 p -159.66 177.83 10.47 Favored 'General case' 0 CA--C 1.488 -1.426 0 CA-C-N 119.067 0.849 . . . . 60.869999999999997 109.143 -176.634 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 2.1 pp -131.62 164.98 33.03 Favored 'Isoleucine or valine' 0 C--O 1.269 2.121 0 CA-C-O 122.862 1.315 . . . . 60.329999999999998 112.2 177.545 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 182' ' ' GLY . . . . . 0.439 ' HA2' ' O ' ' A' ' 18' ' ' VAL . . . -122.08 133.12 9.18 Favored Glycine 0 N--CA 1.432 -1.604 0 N-CA-C 105.421 -3.071 . . . . 61.969999999999999 105.421 179.343 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -143.62 166.58 26.87 Favored Glycine 0 C--O 1.265 2.036 0 CA-C-N 117.761 0.781 . . . . 65.140000000000001 112.258 172.155 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 184' ' ' SER . . . . . 0.728 ' HB2' ' O ' ' A' 2099 ' ' HOH . 0.7 OUTLIER -103.2 4.16 36.47 Favored 'General case' 0 N--CA 1.501 2.108 0 N-CA-C 117.944 2.572 . . . . 70.939999999999998 117.944 -178.797 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 185' ' ' TRP . . . . . . . . . . . . 0.252 9.4 p90 -80.22 -17.95 50.85 Favored 'General case' 0 N--CA 1.427 -1.587 0 O-C-N 125.272 1.607 . . . . 68.980000000000004 110.09 -167.426 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 186' ' ' LEU . . . . . 0.609 ' H ' HD12 ' A' ' 186' ' ' LEU . 4.0 mp -79.39 -20.56 47.36 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 119.094 -1.043 . . . . 67.060000000000002 110.369 -176.851 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 187' ' ' VAL . . . . . . . . . . . . . 43.7 t -127.19 89.37 51.89 Favored Pre-proline 0 N--CA 1.428 -1.574 0 N-CA-C 105.241 -2.133 . . . . 68.090000000000003 105.241 177.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 188' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_endo -83.54 143.35 10.87 Favored 'Trans proline' 0 C--O 1.244 0.776 0 C-N-CA 121.459 1.439 . . . . 69.980000000000004 110.878 173.014 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 189' ' ' ALA . . . . . . . . . . . . . . . -53.41 -45.4 69.33 Favored 'General case' 0 CA--C 1.49 -1.343 0 CA-C-O 118.05 -0.976 . . . . 72.930000000000007 109.556 -171.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.26 -27.25 66.17 Favored 'General case' 0 C--O 1.234 0.273 0 O-C-N 125.572 1.795 . . . . 84.209999999999994 111.317 -172.131 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -73.03 -37.91 66.74 Favored 'General case' 0 CA--C 1.515 -0.388 0 C-N-CA 119.489 -0.884 . . . . 72.409999999999997 113.296 172.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 192' ' ' LEU . . . . . 0.412 HD12 ' HA ' ' A' ' 192' ' ' LEU . 3.1 tp -64.07 -62.98 1.28 Allowed 'General case' 0 CA--C 1.496 -1.116 0 N-CA-C 105.013 -2.217 . . . . 72.069999999999993 105.013 176.185 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -35.0 -42.69 0.17 Allowed 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 114.6 -1.182 . . . . 93.859999999999999 111.147 176.789 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -102.04 7.57 41.17 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 114.488 1.292 . . . . 72.930000000000007 114.488 -169.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 195' ' ' GLY . . . . . . . . . . . . . . . 44.36 32.59 2.73 Favored Glycine 0 CA--C 1.535 1.283 0 N-CA-C 117.966 1.947 . . . . 70.019999999999996 117.966 -169.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 196' ' ' ASP . . . . . 1.205 ' HB3' ' O ' ' A' 2093 ' ' HOH 0.448 0.3 OUTLIER -93.76 69.36 4.02 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 113.759 -3.176 . . . . 68.290000000000006 115.144 177.51 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 197' ' ' TYR . . . . . 0.444 ' HB3' ' HB2' ' A' ' 35' ' ' ALA . 5.2 m-85 -50.17 -29.31 9.01 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 112.424 -2.171 . . . . 72.560000000000002 114.191 172.184 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 198' ' ' ASP . . . . . 0.944 ' OD2' ' OD2' ' A' ' 196' ' ' ASP . 0.5 OUTLIER -43.31 -53.38 5.27 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 104.911 -2.255 . . . . 65.629999999999995 104.911 170.261 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 199' ' ' ARG . . . . . . . . . . . . . 69.3 ttt180 -69.35 -35.25 75.7 Favored 'General case' 0 C--O 1.252 1.229 0 N-CA-C 114.751 1.389 . . . . 62.43 114.751 -172.76 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 200' ' ' ILE . . . . . . . . . . . . . 1.9 mt -64.53 -52.67 52.04 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.351 0 O-C-N 123.546 0.529 . . . . 63.329999999999998 112.32 177.591 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 201' ' ' THR . . . . . . . . . . . . . 55.1 m -43.16 -47.67 6.29 Favored 'General case' 0 C--O 1.247 0.95 0 C-N-CA 122.958 0.503 . . . . 65.299999999999997 110.082 172.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 202' ' ' LYS . . . . . 0.587 ' HD3' ' N ' ' A' ' 203' ' ' LEU 0.351 0.0 OUTLIER -76.87 -42.33 40.3 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 115.84 -2.344 . . . . 73.280000000000001 115.613 -172.506 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 203' ' ' LEU . . . . . 0.587 ' N ' ' HD3' ' A' ' 202' ' ' LYS . 7.8 mt -51.98 -30.44 24.95 Favored 'General case' 0 CA--C 1.491 -1.305 0 O-C-N 123.75 0.656 . . . . 64.370000000000005 110.434 173.202 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 204' ' ' ALA . . . . . 0.54 ' HA ' HD23 ' A' ' 186' ' ' LEU . . . -77.36 -53.44 7.67 Favored 'General case' 0 N--CA 1.44 -0.931 0 O-C-N 124.019 0.824 . . . . 63.939999999999998 110.058 179.238 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 27.9 ttm105 -53.12 -43.11 66.66 Favored 'General case' 0 N--CA 1.403 -2.822 0 C-N-CA 116.192 -2.203 . . . . 94.689999999999998 110.417 179.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 206' ' ' GLU . . . . . 0.503 ' HG3' ' O ' ' A' ' 202' ' ' LYS . 88.9 mt-10 -66.16 -31.08 71.71 Favored 'General case' 0 C--O 1.253 1.253 0 C-N-CA 119.425 -0.91 . . . . 77.75 111.297 -173.375 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -65.07 -47.9 75.67 Favored 'General case' 0 CA--C 1.548 0.888 0 O-C-N 125.636 1.835 . . . . 68.329999999999998 109.724 178.095 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 208' ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' ' 204' ' ' ALA . 28.2 t -66.7 -32.76 59.47 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-N 116.254 -0.43 . . . . 70.010000000000005 111.633 -179.327 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 209' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -79.25 -51.82 8.95 Favored 'General case' 0 CA--C 1.473 -1.994 0 N-CA-C 107.964 -1.124 . . . . 85.939999999999998 107.964 -177.624 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 210' ' ' GLY . . . . . . . . . . . . . . . -59.75 -0.26 0.93 Allowed Glycine 0 N--CA 1.418 -2.516 0 CA-C-O 118.806 -0.997 . . . . 77.829999999999998 112.895 177.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -95.68 17.07 15.7 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 119.018 2.97 . . . . 83.079999999999998 119.018 -179.331 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 212' ' ' LYS . . . . . 0.588 ' O ' ' HB2' ' A' ' 213' ' ' LEU . 28.5 mttt -113.73 -167.23 1.18 Allowed 'General case' 0 N--CA 1.503 2.192 0 N-CA-C 116.97 2.211 . . . . 89.260000000000005 116.97 -176.973 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 213' ' ' LEU . . . . . 0.588 ' HB2' ' O ' ' A' ' 212' ' ' LYS . 1.0 OUTLIER . . . . . 0 N--CA 1.524 3.269 0 C-N-CA 127.693 2.397 . . . . 97.609999999999999 110.472 -167.399 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1214 ' ' SO4 . . . . . 1.002 ' S ' ' O ' ' A' 2098 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2002 ' ' HOH . . . . . 0.709 ' O ' ' HE2' ' A' ' 2' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2003 ' ' HOH . . . . . 1.18 ' O ' ' HA ' ' A' ' 3' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2005 ' ' HOH . . . . . 0.927 ' O ' ' HD2' ' A' ' 2' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2006 ' ' HOH . . . . . 0.648 ' O ' ' C ' ' A' ' 2' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2009 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2010 ' ' HOH . . . . . 0.475 ' O ' ' HB3' ' A' ' 51' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2011 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2012 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2013 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2014 ' ' HOH . . . . . 0.776 ' O ' ' HG2' ' A' ' 9' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2015 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2016 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2017 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2018 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2019 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2020 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2021 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2022 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2023 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2024 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2025 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2026 ' ' HOH . . . . . 0.556 ' O ' ' HB3' ' A' ' 52' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2027 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2028 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2029 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2030 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2031 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2032 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2033 ' ' HOH . . . . . 0.613 ' O ' ' HD3' ' A' ' 49' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2034 ' ' HOH . . . . . 0.766 ' O ' ' HA ' ' A' ' 51' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2035 ' ' HOH . . . . . 0.568 ' O ' ' HG3' ' A' ' 51' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2036 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2037 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2038 ' ' HOH . . . . . 0.412 ' O ' ' OD1' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2039 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2040 ' ' HOH . . . . . 1.035 ' O ' ' OD2' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2041 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2042 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2043 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2044 ' ' HOH . . . . . 0.79 ' O ' ' HA ' ' A' ' 65' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2045 ' ' HOH . . . . . 0.615 ' O ' ' HB2' ' A' ' 66' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2046 ' ' HOH . . . . . 0.66 ' O ' HG22 ' A' ' 73' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2047 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2048 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2049 ' ' HOH . . . . . 0.497 ' O ' ' HB2' ' A' ' 78' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2050 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2051 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2052 ' ' HOH . . . . . 0.606 ' O ' ' HG3' ' A' ' 82' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2053 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2054 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2055 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2056 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2057 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2058 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2059 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2060 ' ' HOH . . . . . 0.764 ' O ' ' HG3' ' A' ' 98' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2061 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2062 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2063 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2064 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2065 ' ' HOH . . . . . 0.636 ' O ' ' OE1' ' A' ' 120' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2066 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2067 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2068 ' ' HOH . . . . . 0.574 ' O ' ' HE3' ' A' ' 130' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2069 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2070 ' ' HOH . . . . . 1.125 ' O ' ' NZ ' ' A' ' 130' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2071 ' ' HOH . . . . . 0.68 ' O ' ' HD3' ' A' ' 130' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2072 ' ' HOH . . . . . 0.45 ' O ' ' NZ ' ' A' ' 130' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2073 ' ' HOH . . . . . 1.2 ' O ' ' HG3' ' A' ' 130' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2074 ' ' HOH . . . . . 1.142 ' O ' ' NZ ' ' A' ' 133' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2075 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2076 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2077 ' ' HOH . . . . . 0.601 ' O ' ' HE3' ' A' ' 144' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2078 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2079 ' ' HOH . . . . . 0.427 ' O ' ' HB1' ' A' ' 150' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2080 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2081 ' ' HOH . . . . . 0.445 ' O ' ' N ' ' A' ' 155' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2082 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2083 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2084 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2085 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2086 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2087 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2088 ' ' HOH . . . . . 1.096 ' O ' ' HE2' ' A' ' 176' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2089 ' ' HOH . . . . . 0.928 ' O ' ' NZ ' ' A' ' 176' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2090 ' ' HOH . . . . . 0.729 ' O ' ' CD ' ' A' ' 176' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2091 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2092 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2093 ' ' HOH . . . . . 1.205 ' O ' ' HB3' ' A' ' 196' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2094 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2095 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2096 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2097 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2098 ' ' HOH . . . . . 1.002 ' O ' ' S ' ' A' 1214 ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2099 ' ' HOH . . . . . 0.728 ' O ' ' HB2' ' A' ' 184' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2100 ' ' HOH . . . . . 0.811 ' O ' ' O2 ' ' A' 1214 ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2101 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2102 ' ' HOH . . . . . 0.853 ' O ' ' S ' ' A' 1214 ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' MET . . . . . 0.909 ' HB3' ' O ' ' A' 2070 ' ' HOH . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.252 0 N-CA-C 113.622 0.971 . . . . 103.0 113.622 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.927 ' HD2' ' O ' ' A' 2005 ' ' HOH . 1.4 tppt? 71.82 -155.21 0.1 Allowed 'General case' 0 CA--C 1.577 1.985 0 N-CA-C 118.627 2.825 . . . . 103.29 118.627 171.411 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ASN . . . . . 1.18 ' HA ' ' O ' ' A' 2003 ' ' HOH 0.305 0.2 OUTLIER -91.15 35.37 0.92 Allowed 'General case' 0 N--CA 1.521 3.085 0 N-CA-C 117.645 2.461 . . . . 94.55 117.645 169.456 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 48.0 m0 -91.59 127.82 37.18 Favored 'General case' 0 N--CA 1.434 -1.26 0 CA-C-N 114.184 -1.371 . . . . 88.65 114.559 -178.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.29 -37.46 69.89 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 115.122 1.527 . . . . 86.12 115.122 176.872 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.3 p -133.0 155.15 49.7 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 107.738 -1.208 . . . . 79.71 107.738 170.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 94.1 p -87.78 145.78 25.95 Favored 'General case' 0 C--O 1.241 0.643 0 C-N-CA 119.487 -0.885 . . . . 74.0 112.045 -173.264 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -49.23 -40.26 33.12 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 112.673 0.62 . . . . 71.87 112.673 172.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.776 ' HG2' ' O ' ' A' 2014 ' ' HOH . 47.0 tt0 -48.72 -51.71 27.34 Favored 'General case' 0 C--O 1.243 0.753 0 N-CA-C 109.133 -0.691 . . . . 79.01 109.133 175.226 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 59.9 p -65.45 -34.67 78.82 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 114.138 1.162 . . . . 67.26 114.138 -168.068 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 37.6 mm -61.19 -44.37 98.22 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.202 0 O-C-N 124.274 0.983 . . . . 63.11 108.408 175.31 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.7 mt -82.51 -21.79 35.31 Favored 'General case' 0 CA--C 1.491 -1.299 0 C-N-CA 119.305 -0.958 . . . . 64.99 110.233 -166.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 25.6 p -94.92 8.72 41.87 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 114.426 1.269 . . . . 66.75 114.426 177.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 28.6 m -69.67 -43.14 73.13 Favored 'General case' 0 CA--C 1.509 -0.618 0 CA-C-N 118.717 0.689 . . . . 63.78 111.215 -177.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -153.79 -179.15 28.95 Favored Glycine 0 C--O 1.26 1.774 0 O-C-N 123.86 0.725 . . . . 61.53 111.913 167.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -70.42 -25.0 26.03 Favored 'Trans proline' 0 N--CA 1.484 0.922 0 C-N-CA 124.381 3.387 . . . . 62.39 118.897 176.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.6 t -130.72 137.95 54.8 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.606 0 N-CA-C 105.834 -1.913 . . . . 63.1 105.834 -171.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.439 ' O ' ' HA2' ' A' ' 182' ' ' GLY . 52.8 t -121.92 117.79 29.59 Favored Pre-proline 0 N--CA 1.433 -1.307 0 N-CA-C 102.301 -3.222 . . . . 63.52 102.301 172.638 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.578 ' HD2' ' O ' ' A' ' 43' ' ' VAL . 57.9 Cg_endo -70.51 141.64 42.66 Favored 'Trans proline' 0 CA--C 1.499 -1.268 0 C-N-CA 122.094 1.863 . . . . 64.56 112.077 177.499 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 88.2 t -105.66 104.65 17.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 N-CA-C 106.541 -1.651 . . . . 66.19 106.541 179.949 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 14.7 mt -104.41 133.04 49.58 Favored 'Isoleucine or valine' 0 C--O 1.241 0.648 0 N-CA-C 114.467 1.284 . . . . 66.59 114.467 -164.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 99.8 t -120.51 104.88 16.03 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.5 0 N-CA-C 104.874 -2.269 . . . . 64.83 104.874 172.651 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.3 p -105.68 121.07 57.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 108.223 -1.029 . . . . 66.55 108.223 -176.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.9 mttt -89.91 -43.3 10.69 Favored 'General case' 0 C--O 1.278 2.576 0 CA-C-N 115.071 -0.968 . . . . 79.91 112.204 -175.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.1 126.21 51.83 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 114.815 1.413 . . . . 82.82 114.815 178.398 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 11.4 tp -50.57 -40.75 53.09 Favored 'General case' 0 C--O 1.248 0.982 0 N-CA-C 114.14 1.163 . . . . 71.81 114.14 -176.11 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -66.96 -15.83 63.95 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 115.855 1.798 . . . . 94.92 115.855 -174.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 35.7 m170 -84.05 -22.66 31.18 Favored 'General case' 0 N--CA 1.429 -1.516 0 N-CA-C 113.92 1.082 . . . . 78.57 113.92 177.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -54.51 -56.73 15.88 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 118.702 0.683 . . . . 74.5 109.887 -170.441 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.552 ' O ' ' HG3' ' A' ' 34' ' ' LYS . 36.7 t -60.68 -58.62 17.96 Favored Pre-proline 0 CA--C 1.551 0.997 0 CA-C-N 116.246 -0.434 . . . . 70.89 111.122 -168.437 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.433 ' HD3' ' HB ' ' A' ' 30' ' ' VAL . 21.7 Cg_exo -56.42 -36.74 97.7 Favored 'Trans proline' 0 N--CA 1.485 0.998 0 O-C-N 121.892 0.417 . . . . 69.08 112.892 179.718 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 15.0 ttp -55.72 -53.71 53.25 Favored 'General case' 0 CA--C 1.491 -1.309 0 CA-C-O 121.775 0.798 . . . . 66.75 111.684 177.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -49.93 -47.22 52.49 Favored 'General case' 0 C--O 1.276 2.482 0 CA-C-N 113.649 -1.614 . . . . 66.79 112.903 173.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.552 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 15.1 mtpt -68.47 -32.77 73.01 Favored 'General case' 0 C--O 1.254 1.293 0 N-CA-C 109.363 -0.606 . . . . 73.89 109.363 -171.49 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.444 ' HB2' ' HB3' ' A' ' 197' ' ' TYR . . . -67.4 -51.97 45.48 Favored 'General case' 0 C--O 1.215 -0.717 0 O-C-N 125.543 1.777 . . . . 62.17 107.115 -178.709 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 4.6 mt -42.13 -61.96 1.04 Allowed 'General case' 0 CA--C 1.496 -1.129 0 CA-C-N 114.6 -1.182 . . . . 65.11 114.075 168.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 45.7 t -53.79 -55.95 11.33 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.224 0 CA-C-N 115.295 -0.866 . . . . 62.02 112.68 175.655 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -48.59 -33.21 9.35 Favored 'General case' 0 C--O 1.201 -1.497 0 O-C-N 124.317 1.01 . . . . 61.83 108.962 -179.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -90.57 21.68 31.39 Favored Glycine 0 C--O 1.247 0.926 0 N-CA-C 115.244 0.858 . . . . 61.76 115.244 178.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 78.28 9.95 86.59 Favored Glycine 0 N--CA 1.444 -0.831 0 N-CA-C 115.636 1.015 . . . . 64.88 115.636 175.104 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 53.5 t -109.64 119.74 59.47 Favored 'Isoleucine or valine' 0 C--O 1.27 2.141 0 O-C-N 121.282 -1.128 . . . . 67.6 112.103 179.026 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.8 mtm105 -111.9 -24.82 9.75 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 116.323 1.971 . . . . 82.58 116.323 -166.229 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.578 ' O ' ' HD2' ' A' ' 19' ' ' PRO . 33.0 t -95.39 106.75 18.64 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.164 0 C-N-CA 117.779 -1.568 . . . . 64.45 108.669 177.779 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 81.0 mt -97.88 129.58 44.82 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 113.284 -1.78 . . . . 65.28 108.62 -178.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.591 HD22 HD13 ' A' ' 92' ' ' ILE . 10.8 t-20 -118.36 99.89 7.13 Favored 'General case' 0 C--O 1.263 1.799 0 CA-C-O 121.35 0.595 . . . . 70.29 112.228 175.482 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 46.9 t -84.33 115.72 26.86 Favored 'Isoleucine or valine' 0 C--O 1.247 0.951 0 CA-C-N 115.927 -0.579 . . . . 60.98 110.801 178.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 67.6 p -79.23 139.22 37.98 Favored 'General case' 0 CA--C 1.481 -1.695 0 N-CA-C 107.667 -1.234 . . . . 59.97 107.667 -174.305 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.3 mt -82.12 62.55 5.91 Favored 'General case' 0 C--O 1.261 1.694 0 N-CA-C 106.733 -1.58 . . . . 63.12 106.733 179.064 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.613 ' HD3' ' O ' ' A' 2033 ' ' HOH . 33.0 mtt180 -121.04 0.42 10.2 Favored 'General case' 0 N--CA 1.485 1.325 0 O-C-N 124.142 0.901 . . . . 76.25 109.82 -177.464 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 39.3 p -128.78 138.43 52.08 Favored 'General case' 0 CA--C 1.481 -1.678 0 CA-C-O 122.949 1.356 . . . . 69.91 110.189 177.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.766 ' HA ' ' O ' ' A' 2034 ' ' HOH . 6.7 mp0 -19.13 -29.46 0.0 OUTLIER 'General case' 0 N--CA 1.412 -2.337 0 CA-C-N 109.43 -3.532 . . . . 78.97 114.12 165.968 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.556 ' HB3' ' O ' ' A' 2026 ' ' HOH . 15.4 p -149.33 31.68 0.74 Allowed 'General case' 0 CA--C 1.563 1.469 0 O-C-N 118.934 -2.354 . . . . 78.33 112.428 -178.078 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -40.05 -61.35 0.88 Allowed 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 117.878 -1.058 . . . . 65.56 110.54 156.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.4 t -53.07 -47.44 54.62 Favored 'Isoleucine or valine' 0 C--O 1.261 1.666 0 N-CA-C 115.32 1.6 . . . . 60.28 115.32 -176.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ASP . . . . . 1.035 ' OD2' ' O ' ' A' 2040 ' ' HOH . 90.9 m-20 -52.14 -42.4 63.32 Favored 'General case' 0 C--O 1.27 2.158 0 C-N-CA 119.109 -1.036 . . . . 60.32 112.061 172.961 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -65.57 -54.74 23.75 Favored 'General case' 0 CA--C 1.571 1.784 0 N-CA-C 115.229 1.566 . . . . 60.42 115.229 176.333 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 14.0 mt -43.14 -51.46 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.356 0.879 0 CA-C-N 118.214 0.461 . . . . 59.71 109.862 166.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 38.6 ttm105 -54.66 -52.77 61.29 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 113.672 0.99 . . . . 62.97 113.672 179.684 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.06 -37.83 81.73 Favored 'General case' 0 C--O 1.222 -0.378 0 N-CA-C 113.595 0.961 . . . . 63.7 113.595 176.507 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 44.8 mt -61.39 -41.63 90.62 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.911 0 C-N-CA 116.679 -2.008 . . . . 64.99 111.811 177.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -54.37 -41.42 69.16 Favored 'General case' 0 N--CA 1.44 -0.925 0 CA-C-N 115.462 -0.79 . . . . 68.35 110.754 174.159 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.2 -28.94 28.93 Favored 'General case' 0 C--O 1.208 -1.105 0 C-N-CA 119.27 -0.972 . . . . 77.65 108.988 -167.659 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.432 ' O ' ' HD2' ' A' ' 65' ' ' PRO . 50.2 mt-10 -118.92 -23.66 6.85 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 118.583 -1.247 . . . . 71.96 113.313 -162.252 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 94.1 t -107.63 73.56 0.41 Allowed Pre-proline 0 N--CA 1.41 -2.474 0 N-CA-C 105.908 -1.886 . . . . 68.51 105.908 176.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.79 ' HA ' ' O ' ' A' 2044 ' ' HOH . 4.6 Cg_endo -53.71 -28.62 47.81 Favored 'Trans proline' 0 C--N 1.371 1.754 0 O-C-N 123.657 1.346 . . . . 70.43 114.19 177.85 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.615 ' HB2' ' O ' ' A' 2045 ' ' HOH 0.255 0.2 OUTLIER -85.42 2.88 42.61 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 114.328 1.233 . . . . 83.6 114.328 -175.234 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -110.41 137.65 47.84 Favored 'General case' 0 CA--C 1.472 -2.04 0 C-N-CA 120.682 -0.407 . . . . 69.02 111.814 -178.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 63.5 mt -88.2 95.48 5.26 Favored 'Isoleucine or valine' 0 C--O 1.241 0.655 0 N-CA-C 108.863 -0.791 . . . . 61.75 108.863 179.122 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.467 ' H ' ' NE2' ' A' ' 89' ' ' GLN . 8.3 p -96.46 138.47 21.61 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.84 0 C-N-CA 116.806 -1.958 . . . . 59.28 112.459 -175.121 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -135.39 -179.25 16.38 Favored Glycine 0 N--CA 1.49 2.253 0 O-C-N 125.38 1.675 . . . . 59.65 113.359 179.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -123.79 133.27 53.85 Favored 'General case' 0 N--CA 1.441 -0.916 0 C-N-CA 119.434 -0.907 . . . . 57.93 110.458 -174.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -104.23 170.96 19.16 Favored Glycine 0 N--CA 1.441 -1.014 0 C-N-CA 118.808 -1.663 . . . . 59.62 112.462 176.061 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' THR . . . . . 0.66 HG22 ' O ' ' A' 2046 ' ' HOH . 15.3 m 50.73 55.17 9.94 Favored 'General case' 0 CA--C 1.502 -0.87 0 N-CA-C 105.473 -2.047 . . . . 64.75 105.473 179.102 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 71.4 t -98.1 123.88 50.84 Favored 'Isoleucine or valine' 0 C--O 1.248 0.987 0 N-CA-C 103.508 -2.775 . . . . 61.66 103.508 173.856 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.468 HD13 ' O ' ' A' 2046 ' ' HOH . 11.3 mp -111.63 -16.76 13.17 Favored 'General case' 0 C--O 1.256 1.405 0 N-CA-C 117.469 2.396 . . . . 59.14 117.469 -167.825 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -158.14 164.01 22.67 Favored Pre-proline 0 C--O 1.279 2.655 0 CA-C-N 115.052 -0.976 . . . . 62.05 110.061 -176.334 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -56.69 -34.49 96.07 Favored 'Trans proline' 0 CA--C 1.533 0.439 0 O-C-N 123.458 1.241 . . . . 62.59 112.564 -176.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.497 ' HB2' ' O ' ' A' 2049 ' ' HOH . 11.5 tm0? -55.44 -58.98 5.52 Favored 'General case' 0 C--O 1.25 1.126 0 N-CA-C 108.91 -0.774 . . . . 77.44 108.91 175.674 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.479 ' O ' HG22 ' A' ' 83' ' ' VAL . 78.2 mt-30 -57.77 -35.95 71.48 Favored 'General case' 0 C--O 1.189 -2.11 0 C-N-CA 119.939 -0.704 . . . . 66.97 109.433 -178.529 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 32.6 tp -62.2 -49.99 73.57 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 113.996 1.11 . . . . 61.42 113.996 175.014 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.37 -62.6 1.45 Allowed 'General case' 0 C--O 1.213 -0.818 0 N-CA-C 109.359 -0.608 . . . . 65.37 109.359 170.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.606 ' HG3' ' O ' ' A' 2052 ' ' HOH . 21.7 tt0 -43.77 -47.49 7.99 Favored 'General case' 0 C--O 1.239 0.541 0 N-CA-C 116.44 2.015 . . . . 81.66 116.44 -179.558 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.479 HG22 ' O ' ' A' ' 79' ' ' GLN . 15.8 m -80.1 -32.19 13.69 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.148 0 CA-C-N 116.457 -0.338 . . . . 67.86 110.273 -174.483 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 90.2 m -60.11 -38.13 82.07 Favored 'General case' 0 CA--C 1.554 1.106 0 CA-C-O 121.858 0.837 . . . . 70.08 110.759 173.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -77.65 -29.42 51.65 Favored 'General case' 0 C--O 1.199 -1.569 0 O-C-N 121.477 -0.764 . . . . 85.82 111.344 -178.169 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.83 -20.31 65.91 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 109.4 -0.592 . . . . 71.65 109.4 173.78 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 113.54 10.69 14.4 Favored Glycine 0 C--O 1.254 1.363 0 C-N-CA 119.646 -1.264 . . . . 68.38 115.879 174.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -52.05 131.91 32.24 Favored 'General case' 0 C--O 1.258 1.538 0 C-N-CA 125.293 1.437 . . . . 66.91 110.941 172.228 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.467 ' NE2' ' H ' ' A' ' 69' ' ' VAL . 52.1 mt-30 -92.88 -13.44 29.0 Favored 'General case' 0 CA--C 1.498 -1.023 0 CA-C-N 113.719 -1.582 . . . . 78.15 111.19 -177.507 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 53.7 p90 -163.94 165.45 22.65 Favored 'General case' 0 C--O 1.254 1.31 0 N-CA-C 108.554 -0.906 . . . . 62.72 108.554 172.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -126.71 153.69 45.12 Favored 'General case' 0 C--O 1.246 0.87 0 C-N-CA 119.534 -0.866 . . . . 59.2 112.685 167.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.591 HD13 HD22 ' A' ' 45' ' ' ASN . 0.8 OUTLIER -123.22 143.69 35.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 O-C-N 125.633 1.833 . . . . 60.83 107.396 170.733 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 32.6 p -126.23 153.9 74.46 Favored Pre-proline 0 N--CA 1.427 -1.611 0 CA-C-N 115.115 -0.948 . . . . 61.29 109.448 174.242 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -63.76 -32.25 67.88 Favored 'Trans proline' 0 CA--C 1.572 2.409 0 N-CA-C 116.076 1.529 . . . . 62.09 116.076 176.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' GLY . . . . . 0.425 ' HA2' ' O ' ' A' ' 114' ' ' GLY . . . -156.16 178.3 32.75 Favored Glycine 0 N--CA 1.486 2.016 0 N-CA-C 106.414 -2.674 . . . . 60.9 106.414 -179.446 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -113.7 159.53 19.6 Favored 'General case' 0 CA--C 1.578 2.046 0 N-CA-C 116.442 2.016 . . . . 59.01 116.442 -177.369 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 43.5 p -138.09 148.93 45.5 Favored 'General case' 0 C--O 1.284 2.882 0 CA-C-N 120.153 1.342 . . . . 56.24 109.686 173.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.764 ' HG3' ' O ' ' A' 2060 ' ' HOH 0.609 11.9 pt-20 -46.44 -58.32 6.9 Favored Pre-proline 0 CA--C 1.613 3.392 0 N-CA-C 105.17 -2.159 . . . . 54.32 105.17 177.751 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.475 ' C ' ' O ' ' A' ' 98' ' ' GLU . 84.4 Cg_exo -49.42 -54.32 5.63 Favored 'Trans proline' 0 C--N 1.361 1.188 0 C-N-CA 116.155 -2.097 . . . . 58.45 113.177 -178.093 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 28.9 tp -64.88 -37.27 87.07 Favored 'General case' 0 C--O 1.237 0.413 0 O-C-N 123.837 0.711 . . . . 60.41 110.079 -163.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 22.6 mt -61.13 -49.12 78.55 Favored 'General case' 0 CA--C 1.57 1.714 0 N-CA-C 113.898 1.073 . . . . 58.97 113.898 167.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 9.6 tttp -53.16 -54.66 32.55 Favored 'General case' 0 C--O 1.238 0.49 0 O-C-N 121.229 -0.919 . . . . 70.92 110.097 176.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.51 -38.65 85.07 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 114.616 1.339 . . . . 62.29 114.616 -178.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -73.29 -29.52 62.77 Favored 'General case' 0 CA--C 1.501 -0.94 0 N-CA-C 108.223 -1.029 . . . . 62.76 108.223 -174.727 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.07 -22.07 56.05 Favored 'General case' 0 CA--C 1.489 -1.4 0 CA-C-N 114.508 -1.224 . . . . 64.23 110.521 -175.585 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -88.64 -31.35 18.59 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 112.758 -2.019 . . . . 75.26 111.61 179.033 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -84.68 -171.15 47.87 Favored Glycine 0 C--N 1.341 0.86 0 C-N-CA 120.921 -0.657 . . . . 63.95 112.544 -176.049 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 49.6 p -102.76 -3.33 26.59 Favored 'General case' 0 C--O 1.254 1.319 0 N-CA-C 114.85 1.426 . . . . 64.15 114.85 -160.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 42.3 pt -132.48 144.9 54.96 Favored Pre-proline 0 N--CA 1.517 2.876 0 C-N-CA 124.297 1.039 . . . . 63.49 111.628 -177.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -68.77 140.14 45.73 Favored 'Trans proline' 0 N--CA 1.448 -1.183 0 C-N-CA 122.985 2.456 . . . . 60.51 113.427 -176.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 11.0 tp -115.88 122.91 46.76 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.374 -0.376 . . . . 59.32 110.073 174.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 3.2 mp -104.75 97.87 13.7 Favored Pre-proline 0 N--CA 1.445 -0.696 0 N-CA-C 102.897 -3.001 . . . . 60.94 102.897 179.809 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -94.49 148.77 1.87 Allowed 'Trans proline' 0 C--N 1.356 0.966 0 O-C-N 123.011 1.006 . . . . 57.46 111.963 -173.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' GLY . . . . . 0.425 ' O ' ' HA2' ' A' ' 95' ' ' GLY . . . -69.6 144.69 40.85 Favored Glycine 0 C--O 1.271 2.45 0 O-C-N 125.307 1.63 . . . . 54.39 113.939 178.703 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 1.6 pp -133.43 165.25 32.74 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.383 0 N-CA-C 113.628 0.973 . . . . 56.53 113.628 174.061 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 66.6 m -133.72 -34.62 1.01 Allowed 'General case' 0 C--O 1.245 0.848 0 O-C-N 120.451 -1.406 . . . . 58.38 111.033 171.269 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 73.5 p -114.98 166.25 12.0 Favored 'General case' 0 C--O 1.202 -1.412 0 N-CA-C 106.46 -1.681 . . . . 57.75 106.46 -173.488 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 33.1 m -68.7 -40.38 81.52 Favored 'Isoleucine or valine' 0 C--O 1.244 0.799 0 O-C-N 123.912 0.758 . . . . 58.6 110.962 176.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 10.7 m -51.28 -33.8 30.2 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 108.823 -0.806 . . . . 59.18 108.823 175.444 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.636 ' OE1' ' O ' ' A' 2065 ' ' HOH . 50.5 mt-10 -73.41 -58.81 3.05 Favored 'General case' 0 CA--C 1.493 -1.225 0 N-CA-C 106.666 -1.605 . . . . 63.0 106.666 -174.61 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.498 HD11 HG11 ' A' ' 156' ' ' VAL . 28.3 tp -38.19 -50.23 1.4 Allowed 'General case' 0 CA--C 1.569 1.706 0 N-CA-C 113.048 0.759 . . . . 57.25 113.048 172.092 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 67.0 mtp -62.25 -46.29 89.49 Favored 'General case' 0 CA--C 1.482 -1.668 0 C-N-CA 125.29 1.436 . . . . 61.9 110.292 -173.775 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 37.2 tp -56.61 -42.98 79.7 Favored 'General case' 0 C--O 1.251 1.168 0 N-CA-C 113.486 0.921 . . . . 62.11 113.486 175.368 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -72.0 -27.88 69.6 Favored Glycine 0 C--N 1.337 0.605 0 C-N-CA 119.206 -1.473 . . . . 61.82 110.756 179.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 3.6 mtp -71.08 -27.55 63.7 Favored 'General case' 0 C--O 1.243 0.732 0 N-CA-C 107.653 -1.24 . . . . 65.05 107.653 -178.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 44.2 m-20 -64.3 -29.72 70.79 Favored 'General case' 0 C--O 1.211 -0.925 0 N-CA-C 107.425 -1.324 . . . . 67.1 107.425 -179.637 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' TYR . . . . . . . . . . . . . 71.4 m-85 -93.43 19.69 8.06 Favored 'General case' 0 N--CA 1.41 -2.434 0 C-N-CA 116.371 -2.131 . . . . 64.78 111.82 179.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 90.28 2.62 73.57 Favored Glycine 0 C--O 1.226 -0.399 0 C-N-CA 120.005 -1.093 . . . . 62.3 115.42 174.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 7.8 mp -78.44 156.84 29.18 Favored 'General case' 0 C--O 1.258 1.543 0 O-C-N 121.725 -0.867 . . . . 63.94 111.246 -178.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' LYS . . . . . 1.2 ' HG3' ' O ' ' A' 2073 ' ' HOH . 0.0 OUTLIER -143.78 -7.32 0.75 Allowed 'General case' 0 CA--C 1.563 1.455 0 CA-C-N 114.816 -1.083 . . . . 68.6 112.624 179.262 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' GLU . . . . . 0.564 ' OE2' ' HG2' ' A' ' 130' ' ' LYS . 0.9 OUTLIER -112.86 132.13 55.42 Favored 'General case' 0 C--O 1.218 -0.583 0 N-CA-C 114.467 1.284 . . . . 78.19 114.467 178.106 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -142.86 135.23 27.5 Favored 'General case' 0 C--O 1.211 -0.973 0 N-CA-C 115.741 1.756 . . . . 56.53 115.741 -175.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' LYS . . . . . 1.142 ' NZ ' ' O ' ' A' 2074 ' ' HOH . 84.8 tttt -60.03 138.77 57.79 Favored 'General case' 0 C--O 1.282 2.772 0 N-CA-C 101.699 -3.445 . . . . 54.47 101.699 158.596 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' PHE . . . . . 0.423 ' CE2' ' HA ' ' A' ' 137' ' ' ALA . 68.5 t80 -115.38 117.44 30.42 Favored 'General case' 0 C--O 1.259 1.59 0 N-CA-C 104.545 -2.391 . . . . 61.07 104.545 168.741 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' PHE . . . . . 0.41 ' HA ' ' N ' ' A' ' 137' ' ' ALA . 46.8 t80 -158.52 141.02 10.39 Favored Pre-proline 0 C--O 1.265 1.914 0 N-CA-C 113.489 0.922 . . . . 63.0 113.489 -161.005 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_endo -79.6 105.65 0.74 Allowed 'Cis proline' 0 C--O 1.197 -1.549 0 C-N-CA 123.839 -1.317 . . . . 59.1 109.155 -4.607 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' ALA . . . . . 0.423 ' HA ' ' CE2' ' A' ' 134' ' ' PHE . . . -22.88 -74.79 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 117.53 2.419 . . . . 60.64 117.53 176.488 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.415 ' O ' ' N ' ' A' ' 141' ' ' GLY . 19.2 mm-40 -51.11 -78.04 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 120.32 -0.552 . . . . 72.23 110.554 -173.782 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -27.73 -44.52 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 117.245 2.313 . . . . 70.81 117.245 169.101 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 41.1 m-20 -63.12 4.07 0.22 Allowed 'General case' 0 C--O 1.256 1.427 0 N-CA-C 115.085 1.513 . . . . 71.71 115.085 170.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' GLY . . . . . 0.415 ' N ' ' O ' ' A' ' 138' ' ' GLU . . . 99.63 -5.33 58.41 Favored Glycine 0 N--CA 1.484 1.898 0 CA-C-N 120.239 1.381 . . . . 69.31 114.955 -173.678 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 58.69 -146.67 41.34 Favored Glycine 0 C--O 1.259 1.702 0 N-CA-C 118.01 1.964 . . . . 65.46 118.01 178.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 48.5 t -45.0 -73.22 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.181 -2.522 0 N-CA-C 114.535 1.309 . . . . 61.87 114.535 -177.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' LYS . . . . . 0.601 ' HE3' ' O ' ' A' 2077 ' ' HOH . 0.0 OUTLIER -35.57 -47.47 0.46 Allowed 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.323 1.049 . . . . 81.02 112.411 175.715 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -59.37 -55.41 35.05 Favored 'General case' 0 C--O 1.257 1.462 0 C-N-CA 124.593 1.157 . . . . 64.43 110.441 -177.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 12.8 tp -62.71 -21.22 65.61 Favored 'General case' 0 C--O 1.201 -1.491 0 CA-C-N 116.024 -0.534 . . . . 62.22 109.955 -177.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' GLN . . . . . 0.478 HE21 ' HA ' ' A' ' 144' ' ' LYS . 8.5 mt-30 -81.4 -37.33 28.31 Favored 'General case' 0 CA--C 1.462 -2.407 0 C-N-CA 115.957 -2.297 . . . . 64.03 107.137 -176.773 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -61.1 -53.2 60.03 Favored 'General case' 0 C--O 1.264 1.822 0 N-CA-C 105.99 -1.856 . . . . 63.15 105.99 177.489 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' ILE . . . . . . . . . . . . . 18.4 mt -54.24 -39.06 41.54 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.377 0 CA-C-N 113.746 -1.57 . . . . 67.78 111.422 -177.333 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' ALA . . . . . 0.427 ' HB1' ' O ' ' A' 2079 ' ' HOH . . . -88.96 5.82 42.4 Favored 'General case' 0 C--N 1.31 -1.116 0 C-N-CA 117.947 -1.501 . . . . 70.57 112.325 179.132 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . -51.58 -62.38 5.57 Favored Glycine 0 CA--C 1.541 1.677 0 C-N-CA 120.496 -0.859 . . . . 73.31 111.047 -179.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -71.6 -2.36 11.23 Favored 'Trans proline' 0 C--N 1.369 1.634 0 C-N-CA 123.644 2.896 . . . . 72.94 117.699 -178.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -130.76 84.03 2.16 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 119.236 0.925 . . . . 73.44 110.451 -170.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' SER . . . . . 0.41 ' O ' ' NH2' ' A' ' 157' ' ' ARG . 98.3 p -77.31 -25.28 51.07 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.533 -0.758 . . . . 77.53 109.002 -171.177 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' GLN . . . . . 0.445 ' N ' ' O ' ' A' 2081 ' ' HOH . 0.0 OUTLIER -75.44 -26.03 57.97 Favored 'General case' 0 C--O 1.266 1.932 0 N-CA-C 117.238 2.31 . . . . 88.64 117.238 -178.272 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' VAL . . . . . 0.498 HG11 HD11 ' A' ' 121' ' ' LEU . 46.0 t -82.07 151.07 4.25 Favored 'Isoleucine or valine' 0 C--O 1.245 0.819 0 N-CA-C 105.143 -2.169 . . . . 71.63 105.143 -167.577 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' ARG . . . . . 0.41 ' NH2' ' O ' ' A' ' 154' ' ' SER . 9.4 mmp_? -136.29 142.77 43.96 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 108.3 -1.0 . . . . 68.33 108.3 178.865 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' PHE . . . . . . . . . . . . . 50.5 m-85 -115.09 166.38 11.87 Favored 'General case' 0 CA--C 1.48 -1.73 0 CA-C-N 115.081 -0.963 . . . . 61.62 112.132 -175.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' CYS . . . . . 0.528 ' HA ' ' O ' ' A' ' 180' ' ' CYS . 1.6 t -132.19 93.8 25.27 Favored Pre-proline 0 N--CA 1.45 -0.448 0 CA-C-N 111.837 -2.438 . . . . 59.2 109.041 165.408 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -65.24 142.55 73.81 Favored 'Trans proline' 0 C--O 1.187 -2.066 0 N-CA-C 115.673 1.374 . . . . 58.0 115.673 -179.292 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' THR . . . . . 0.448 HG22 ' N ' ' A' ' 162' ' ' GLY 0.283 87.1 m -143.94 160.21 41.22 Favored 'General case' 0 CA--C 1.474 -1.953 0 N-CA-C 105.046 -2.205 . . . . 61.74 105.046 171.783 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' GLY . . . . . 0.448 ' N ' HG22 ' A' ' 161' ' ' THR . . . 104.45 91.95 2.24 Favored Glycine 0 C--O 1.262 1.899 0 N-CA-C 110.03 -1.228 . . . . 62.4 110.03 176.347 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' GLY . . . . . 0.432 ' HA2' ' O3 ' ' A' 1214 ' ' SO4 . . . 88.01 20.34 50.21 Favored Glycine 0 N--CA 1.474 1.224 0 CA-C-O 123.431 1.573 . . . . 61.71 113.28 176.23 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 66.9 mt -95.92 122.95 47.89 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.18 0 CA-C-O 123.321 1.534 . . . . 66.61 112.575 -178.489 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' SER . . . . . 0.529 ' HB2' ' HD2' ' A' ' 166' ' ' PRO . 92.6 p -125.9 175.01 3.45 Favored Pre-proline 0 C--O 1.26 1.626 0 O-C-N 119.811 -1.806 . . . . 67.01 108.323 -175.547 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' PRO . . . . . 0.529 ' HD2' ' HB2' ' A' ' 165' ' ' SER . 88.0 Cg_exo -47.85 -41.28 32.18 Favored 'Trans proline' 0 C--N 1.37 1.688 0 O-C-N 124.193 1.628 . . . . 66.25 110.524 171.658 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' ALA . . . . . . . . . . . . . . . -58.18 -38.14 76.1 Favored 'General case' 0 CA--C 1.55 0.975 0 N-CA-C 115.885 1.809 . . . . 64.65 115.885 179.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 46.7 p30 -114.59 -14.56 12.07 Favored 'General case' 0 CA--C 1.549 0.925 0 O-C-N 119.844 -1.785 . . . . 67.77 113.731 -176.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -57.53 -19.07 22.63 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 117.048 2.24 . . . . 68.76 117.048 -170.185 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' ARG . . . . . 0.415 HH22 ' HB2' ' A' ' 213' ' ' LEU . 7.0 mtp85 -82.53 -37.19 25.54 Favored 'General case' 0 C--O 1.25 1.085 0 C-N-CA 116.56 -2.056 . . . . 88.51 107.328 -179.394 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -45.89 -38.82 7.86 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 120.052 -0.659 . . . . 74.15 111.109 172.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 -74.89 -55.24 6.0 Favored 'General case' 0 C--O 1.251 1.136 0 N-CA-C 114.298 1.222 . . . . 65.17 114.298 175.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 21.5 mt -52.45 -26.33 12.5 Favored 'General case' 0 C--O 1.264 1.834 0 C-N-CA 123.11 0.564 . . . . 60.95 112.196 178.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -58.68 -42.02 87.56 Favored 'General case' 0 C--O 1.202 -1.436 0 N-CA-C 115.082 1.512 . . . . 62.67 115.082 171.85 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 10.6 mt -58.76 131.28 50.44 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 118.446 2.758 . . . . 63.64 118.446 179.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' LYS . . . . . 1.096 ' HE2' ' O ' ' A' 2088 ' ' HOH . 0.0 OUTLIER -38.63 -46.97 1.27 Allowed 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 126.163 1.785 . . . . 64.12 112.0 172.995 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' SER . . . . . . . . . . . . . 94.9 p -85.21 3.98 36.79 Favored 'General case' 0 C--O 1.278 2.598 0 N-CA-C 116.063 1.875 . . . . 60.88 116.063 -170.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 38.6 t -110.21 117.87 55.73 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.126 0 CA-C-O 118.081 -0.961 . . . . 56.74 109.452 -178.891 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 13.6 mt -83.33 -39.23 21.02 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 119.818 1.19 . . . . 64.2 112.371 167.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 180' ' ' CYS . . . . . 0.528 ' O ' ' HA ' ' A' ' 159' ' ' CYS . 19.0 p -159.66 177.83 10.47 Favored 'General case' 0 CA--C 1.488 -1.426 0 CA-C-N 119.067 0.849 . . . . 60.87 109.143 -176.634 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 2.1 pp -131.62 164.98 33.03 Favored 'Isoleucine or valine' 0 C--O 1.269 2.121 0 CA-C-O 122.862 1.315 . . . . 60.33 112.2 177.545 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' GLY . . . . . 0.439 ' HA2' ' O ' ' A' ' 18' ' ' VAL . . . -122.08 133.12 9.18 Favored Glycine 0 N--CA 1.432 -1.604 0 N-CA-C 105.421 -3.071 . . . . 61.97 105.421 179.343 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -143.62 166.58 26.87 Favored Glycine 0 C--O 1.265 2.036 0 CA-C-N 117.761 0.781 . . . . 65.14 112.258 172.155 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 184' ' ' SER . . . . . 0.728 ' HB2' ' O ' ' A' 2099 ' ' HOH . 0.7 OUTLIER -103.2 4.16 36.47 Favored 'General case' 0 N--CA 1.501 2.108 0 N-CA-C 117.944 2.572 . . . . 70.94 117.944 -178.797 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 185' ' ' TRP . . . . . . . . . . . . 0.252 9.4 p90 -80.22 -17.95 50.85 Favored 'General case' 0 N--CA 1.427 -1.587 0 O-C-N 125.272 1.607 . . . . 68.98 110.09 -167.426 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 186' ' ' LEU . . . . . 0.609 ' H ' HD12 ' A' ' 186' ' ' LEU . 4.0 mp -79.39 -20.56 47.36 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 119.094 -1.043 . . . . 67.06 110.369 -176.851 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 187' ' ' VAL . . . . . . . . . . . . . 43.7 t -127.19 89.37 51.89 Favored Pre-proline 0 N--CA 1.428 -1.574 0 N-CA-C 105.241 -2.133 . . . . 68.09 105.241 177.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 188' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_endo -83.54 143.35 10.87 Favored 'Trans proline' 0 C--O 1.244 0.776 0 C-N-CA 121.459 1.439 . . . . 69.98 110.878 173.014 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 189' ' ' ALA . . . . . . . . . . . . . . . -53.41 -45.4 69.33 Favored 'General case' 0 CA--C 1.49 -1.343 0 CA-C-O 118.05 -0.976 . . . . 72.93 109.556 -171.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.26 -27.25 66.17 Favored 'General case' 0 C--O 1.234 0.273 0 O-C-N 125.572 1.795 . . . . 84.21 111.317 -172.131 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -73.03 -37.91 66.74 Favored 'General case' 0 CA--C 1.515 -0.388 0 C-N-CA 119.489 -0.884 . . . . 72.41 113.296 172.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 192' ' ' LEU . . . . . 0.412 ' HA ' HD12 ' A' ' 192' ' ' LEU . 3.1 tp -64.07 -62.98 1.28 Allowed 'General case' 0 CA--C 1.496 -1.116 0 N-CA-C 105.013 -2.217 . . . . 72.07 105.013 176.185 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -35.0 -42.69 0.17 Allowed 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 114.6 -1.182 . . . . 93.86 111.147 176.789 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -102.04 7.57 41.17 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 114.488 1.292 . . . . 72.93 114.488 -169.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 195' ' ' GLY . . . . . . . . . . . . . . . 44.36 32.59 2.73 Favored Glycine 0 CA--C 1.535 1.283 0 N-CA-C 117.966 1.947 . . . . 70.02 117.966 -169.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 196' ' ' ASP . . . . . 1.205 ' HB3' ' O ' ' A' 2093 ' ' HOH 0.448 0.3 OUTLIER -93.76 69.36 4.02 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 113.759 -3.176 . . . . 68.29 115.144 177.51 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 197' ' ' TYR . . . . . 0.444 ' HB3' ' HB2' ' A' ' 35' ' ' ALA . 5.2 m-85 -50.17 -29.31 9.01 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 112.424 -2.171 . . . . 72.56 114.191 172.184 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 198' ' ' ASP . . . . . 0.944 ' OD2' ' OD2' ' A' ' 196' ' ' ASP . 0.5 OUTLIER -43.31 -53.38 5.27 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 104.911 -2.255 . . . . 65.63 104.911 170.261 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 199' ' ' ARG . . . . . . . . . . . . . 69.3 ttt180 -69.35 -35.25 75.7 Favored 'General case' 0 C--O 1.252 1.229 0 N-CA-C 114.751 1.389 . . . . 62.43 114.751 -172.76 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 200' ' ' ILE . . . . . . . . . . . . . 1.9 mt -64.53 -52.67 52.04 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.351 0 O-C-N 123.546 0.529 . . . . 63.33 112.32 177.591 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' THR . . . . . . . . . . . . . 55.1 m -43.16 -47.67 6.29 Favored 'General case' 0 C--O 1.247 0.95 0 C-N-CA 122.958 0.503 . . . . 65.3 110.082 172.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' LYS . . . . . 0.587 ' HD3' ' N ' ' A' ' 203' ' ' LEU 0.351 0.0 OUTLIER -76.87 -42.33 40.3 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 115.84 -2.344 . . . . 73.28 115.613 -172.506 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' LEU . . . . . 0.587 ' N ' ' HD3' ' A' ' 202' ' ' LYS . 7.8 mt -51.98 -30.44 24.95 Favored 'General case' 0 CA--C 1.491 -1.305 0 O-C-N 123.75 0.656 . . . . 64.37 110.434 173.202 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' ALA . . . . . 0.54 ' HA ' HD23 ' A' ' 186' ' ' LEU . . . -77.36 -53.44 7.67 Favored 'General case' 0 N--CA 1.44 -0.931 0 O-C-N 124.019 0.824 . . . . 63.94 110.058 179.238 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 27.9 ttm105 -53.12 -43.11 66.66 Favored 'General case' 0 N--CA 1.403 -2.822 0 C-N-CA 116.192 -2.203 . . . . 94.69 110.417 179.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' GLU . . . . . 0.503 ' HG3' ' O ' ' A' ' 202' ' ' LYS . 88.9 mt-10 -66.16 -31.08 71.71 Favored 'General case' 0 C--O 1.253 1.253 0 C-N-CA 119.425 -0.91 . . . . 77.75 111.297 -173.375 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -65.07 -47.9 75.67 Favored 'General case' 0 CA--C 1.548 0.888 0 O-C-N 125.636 1.835 . . . . 68.33 109.724 178.095 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' ' 204' ' ' ALA . 28.2 t -66.7 -32.76 59.47 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-N 116.254 -0.43 . . . . 70.01 111.633 -179.327 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -79.25 -51.82 8.95 Favored 'General case' 0 CA--C 1.473 -1.994 0 N-CA-C 107.964 -1.124 . . . . 85.94 107.964 -177.624 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' GLY . . . . . . . . . . . . . . . -59.75 -0.26 0.93 Allowed Glycine 0 N--CA 1.418 -2.516 0 CA-C-O 118.806 -0.997 . . . . 77.83 112.895 177.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -95.68 17.07 15.7 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 119.018 2.97 . . . . 83.08 119.018 -179.331 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' LYS . . . . . 0.588 ' O ' ' HB2' ' A' ' 213' ' ' LEU . 28.5 mttt -113.73 -167.23 1.18 Allowed 'General case' 0 N--CA 1.503 2.192 0 N-CA-C 116.97 2.211 . . . . 89.26 116.97 -176.973 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' LEU . . . . . 0.588 ' HB2' ' O ' ' A' ' 212' ' ' LYS . 1.0 OUTLIER . . . . . 0 N--CA 1.524 3.269 0 C-N-CA 127.693 2.397 . . . . 97.61 110.472 -167.399 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1214 ' ' SO4 . . . . . 1.002 ' S ' ' O ' ' A' 2098 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2002 ' ' HOH . . . . . 0.709 ' O ' ' HE2' ' A' ' 2' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2003 ' ' HOH . . . . . 1.18 ' O ' ' HA ' ' A' ' 3' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2005 ' ' HOH . . . . . 0.927 ' O ' ' HD2' ' A' ' 2' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2006 ' ' HOH . . . . . 0.648 ' O ' ' C ' ' A' ' 2' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2009 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2010 ' ' HOH . . . . . 0.475 ' O ' ' HB3' ' A' ' 51' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2011 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2012 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2013 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2014 ' ' HOH . . . . . 0.776 ' O ' ' HG2' ' A' ' 9' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2015 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2016 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2017 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2018 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2019 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2020 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2021 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2022 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2023 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2024 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2025 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2026 ' ' HOH . . . . . 0.556 ' O ' ' HB3' ' A' ' 52' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2027 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2028 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2029 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2030 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2031 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2032 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2033 ' ' HOH . . . . . 0.613 ' O ' ' HD3' ' A' ' 49' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2034 ' ' HOH . . . . . 0.766 ' O ' ' HA ' ' A' ' 51' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2035 ' ' HOH . . . . . 0.568 ' O ' ' HG3' ' A' ' 51' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2036 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2037 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2038 ' ' HOH . . . . . 0.412 ' O ' ' OD1' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2039 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2040 ' ' HOH . . . . . 1.035 ' O ' ' OD2' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2041 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2042 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2043 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2044 ' ' HOH . . . . . 0.79 ' O ' ' HA ' ' A' ' 65' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2045 ' ' HOH . . . . . 0.615 ' O ' ' HB2' ' A' ' 66' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2046 ' ' HOH . . . . . 0.66 ' O ' HG22 ' A' ' 73' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2047 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2048 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2049 ' ' HOH . . . . . 0.497 ' O ' ' HB2' ' A' ' 78' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2050 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2051 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2052 ' ' HOH . . . . . 0.606 ' O ' ' HG3' ' A' ' 82' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2053 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2054 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2055 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2056 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2057 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2058 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2059 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2060 ' ' HOH . . . . . 0.764 ' O ' ' HG3' ' A' ' 98' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2061 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2062 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2063 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2064 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2065 ' ' HOH . . . . . 0.636 ' O ' ' OE1' ' A' ' 120' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2066 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2067 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2068 ' ' HOH . . . . . 0.574 ' O ' ' HE3' ' A' ' 130' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2069 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2070 ' ' HOH . . . . . 1.125 ' O ' ' NZ ' ' A' ' 130' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2071 ' ' HOH . . . . . 0.68 ' O ' ' HD3' ' A' ' 130' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2072 ' ' HOH . . . . . 0.45 ' O ' ' NZ ' ' A' ' 130' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2073 ' ' HOH . . . . . 1.2 ' O ' ' HG3' ' A' ' 130' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2074 ' ' HOH . . . . . 1.142 ' O ' ' NZ ' ' A' ' 133' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2075 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2076 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2077 ' ' HOH . . . . . 0.601 ' O ' ' HE3' ' A' ' 144' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2078 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2079 ' ' HOH . . . . . 0.427 ' O ' ' HB1' ' A' ' 150' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2080 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2081 ' ' HOH . . . . . 0.445 ' O ' ' N ' ' A' ' 155' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2082 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2083 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2084 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2085 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2086 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2087 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2088 ' ' HOH . . . . . 1.096 ' O ' ' HE2' ' A' ' 176' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2089 ' ' HOH . . . . . 0.928 ' O ' ' NZ ' ' A' ' 176' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2090 ' ' HOH . . . . . 0.729 ' O ' ' CD ' ' A' ' 176' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2091 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2092 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2093 ' ' HOH . . . . . 1.205 ' O ' ' HB3' ' A' ' 196' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2094 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2095 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2096 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2097 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2098 ' ' HOH . . . . . 1.002 ' O ' ' S ' ' A' 1214 ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2099 ' ' HOH . . . . . 0.728 ' O ' ' HB2' ' A' ' 184' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2100 ' ' HOH . . . . . 0.811 ' O ' ' O2 ' ' A' 1214 ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2101 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2102 ' ' HOH . . . . . 0.853 ' O ' ' S ' ' A' 1214 ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_