data_3vtu_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 3vtu _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.9 t . . . . . 0 C--O 1.266 1.972 0 N-CA-C 105.737 -1.949 . . . . 29.91 105.737 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -61.59 -3.64 3.65 Favored 'Trans proline' 0 C--O 1.165 -3.172 0 CA-C-O 115.519 -1.95 . . . . 25.550000000000001 112.187 171.159 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 59.6 tt0 -66.03 -26.01 67.32 Favored 'General case' 0 C--O 1.2 -1.522 0 CA-C-N 120.983 1.72 . . . . 20.809999999999999 108.675 175.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -107.05 151.46 40.7 Favored Pre-proline 0 C--O 1.294 3.412 0 O-C-N 125.039 1.462 . . . . 19.699999999999999 112.083 -172.092 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 8.7 Cg_endo -70.9 153.43 63.69 Favored 'Trans proline' 0 N--CA 1.452 -0.919 0 O-C-N 125.013 2.06 . . . . 17.07 107.934 -177.269 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 77.7 p -69.09 153.28 44.01 Favored 'General case' 0 C--O 1.263 1.777 0 CA-C-O 122.14 0.971 . . . . 26.760000000000002 113.122 173.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -69.24 135.5 50.63 Favored 'General case' 0 CA--C 1.556 1.192 0 CA-C-N 114.6 -1.182 . . . . 26.129999999999999 110.302 176.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 17.9 mtpt -108.4 140.94 40.97 Favored 'General case' 0 C--O 1.266 1.972 0 N-CA-C 105.803 -1.925 . . . . 37.509999999999998 105.803 -176.17 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 36.9 p -91.0 171.05 9.54 Favored 'General case' 0 N--CA 1.501 2.12 0 C-N-CA 116.967 -1.893 . . . . 16.140000000000001 112.051 179.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -55.92 -41.9 75.26 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.142 -0.974 . . . . 18.260000000000002 112.566 177.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -69.77 -21.64 63.41 Favored 'General case' 0 N--CA 1.441 -0.901 0 C-N-CA 118.892 -1.123 . . . . 13.1 111.554 -179.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -83.07 -17.21 43.98 Favored 'General case' 0 C--O 1.279 2.618 0 O-C-N 124.476 1.11 . . . . 32.060000000000002 109.421 175.161 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 91.2 mtm-85 -90.54 -23.67 20.84 Favored 'General case' 0 CA--C 1.563 1.463 0 CA-C-N 121.321 1.873 . . . . 30.48 109.636 -174.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 27.8 mmt-85 -139.2 134.54 32.88 Favored 'General case' 0 CA--C 1.467 -2.238 0 N-CA-C 107.915 -1.142 . . . . 47.659999999999997 107.915 -169.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 62.3 p -76.18 162.37 28.03 Favored 'General case' 0 C--O 1.272 2.256 0 C-N-CA 119.382 -0.927 . . . . 14.73 109.273 -174.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -50.2 -45.91 54.04 Favored 'General case' 0 C--O 1.204 -1.341 0 CA-C-O 118.922 -0.561 . . . . 12.75 110.773 177.483 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 61.5 mp0 -72.83 -29.17 63.02 Favored 'General case' 0 N--CA 1.44 -0.944 0 O-C-N 123.903 0.752 . . . . 23.190000000000001 109.807 -171.76 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -66.06 -46.09 79.02 Favored 'General case' 0 C--O 1.257 1.497 0 N-CA-C 113.219 0.822 . . . . 23.41 113.219 170.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 20.1 mtm180 -62.23 -42.35 99.24 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 124.593 1.183 . . . . 13.23 111.952 178.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 40.6 t -53.64 -51.34 44.07 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.009 0 CA-C-O 118.509 -0.758 . . . . 14.17 108.979 178.496 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 45.0 tp10 -66.35 -36.81 83.83 Favored 'General case' 0 C--O 1.204 -1.301 0 O-C-N 126.155 2.159 . . . . 24.25 109.159 -174.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . 0.264 99.7 m-20 -61.3 -45.99 92.15 Favored 'General case' 0 CA--C 1.576 1.963 0 N-CA-C 107.576 -1.268 . . . . 27.399999999999999 107.576 179.627 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 43.6 t -67.44 -39.09 81.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 C-N-CA 120.489 -0.484 . . . . 11.58 110.037 -177.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 64.5 ttp85 -53.39 -46.09 69.53 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 123.311 0.382 . . . . 32.890000000000001 111.042 175.273 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 98.2 mt -64.19 -47.46 79.7 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 124.631 1.207 . . . . 26.949999999999999 113.966 176.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 86.8 mt -59.28 -42.57 87.56 Favored 'Isoleucine or valine' 0 C--O 1.271 2.236 0 O-C-N 120.842 -1.161 . . . . 17.32 112.356 177.651 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 30.6 mmm180 -63.9 -39.57 94.48 Favored 'General case' 0 C--O 1.211 -0.96 0 O-C-N 121.121 -0.987 . . . . 38.289999999999999 111.388 -177.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -72.48 -46.4 55.03 Favored 'General case' 0 C--O 1.259 1.595 0 C-N-CA 123.679 0.791 . . . . 45.329999999999998 111.636 176.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -78.96 -26.08 43.49 Favored 'General case' 0 C--O 1.265 1.898 0 N-CA-C 113.507 0.929 . . . . 23.73 113.507 -173.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 66.6 m80 -141.5 69.13 26.13 Favored Pre-proline 0 C--O 1.272 2.289 0 N-CA-C 108.915 -0.772 . . . . 16.539999999999999 108.915 -171.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -66.75 -21.04 51.95 Favored 'Trans proline' 0 CA--C 1.552 1.411 0 C-N-CA 121.599 1.533 . . . . 16.32 114.758 -165.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 65.2 p -99.16 5.79 46.67 Favored 'General case' 0 C--O 1.27 2.173 0 CA-C-O 118.287 -0.863 . . . . 12.84 110.65 -177.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -101.93 141.29 35.01 Favored 'General case' 0 CA--C 1.502 -0.901 0 CA-C-O 123.911 1.815 . . . . 21.100000000000001 110.588 175.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 29.7 mm -97.68 132.18 25.53 Favored Pre-proline 0 C--O 1.273 2.296 0 CA-C-N 113.41 -1.723 . . . . 10.539999999999999 109.281 173.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -86.45 113.68 1.17 Allowed 'Trans proline' 0 N--CA 1.488 1.187 0 O-C-N 123.745 1.392 . . . . 10.43 111.077 -177.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 22.4 t -124.19 133.15 70.09 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.631 0 O-C-N 125.431 1.707 . . . . 9.5600000000000005 109.442 -169.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 44.9 mm -106.89 121.2 59.37 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 N-CA-C 106.96 -1.496 . . . . 7.79 106.96 174.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 73.7 mt -119.93 125.23 74.06 Favored 'Isoleucine or valine' 0 C--O 1.259 1.579 0 N-CA-C 107.276 -1.379 . . . . 9.1899999999999995 107.276 -177.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -140.87 148.79 41.05 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 115.321 -0.854 . . . . 14.220000000000001 109.865 -173.162 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 55.5 ttp180 -73.59 137.23 44.15 Favored 'General case' 0 C--O 1.301 3.805 0 CA-C-N 114.524 -1.216 . . . . 10.51 109.105 175.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -50.91 136.97 21.75 Favored 'General case' 0 C--O 1.258 1.551 0 CA-C-N 113.182 -1.826 . . . . 36.840000000000003 111.67 173.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 18.3 pttm -59.26 -34.38 72.16 Favored 'General case' 0 N--CA 1.487 1.397 0 CA-C-N 115.263 -0.88 . . . . 41.700000000000003 112.503 -172.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -89.84 11.86 69.16 Favored Glycine 0 CA--C 1.537 1.408 0 C-N-CA 118.536 -1.792 . . . . 17.02 117.568 177.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.2 tp10 -72.15 131.71 43.16 Favored 'General case' 0 CA--C 1.485 -1.543 0 O-C-N 120.295 -1.709 . . . . 13.69 113.49 -172.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 66.0 mmtt -121.77 -1.93 9.38 Favored 'General case' 0 N--CA 1.442 -0.869 0 N-CA-C 116.039 1.866 . . . . 34.340000000000003 116.039 -177.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 61.5 mt-30 -107.15 -36.87 6.44 Favored 'General case' 0 C--O 1.286 3.009 0 CA-C-O 123.961 1.838 . . . . 34.590000000000003 115.427 175.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 75.1 mt -93.87 150.63 38.91 Favored Pre-proline 0 N--CA 1.406 -2.638 0 O-C-N 119.053 -2.279 . . . . 11.960000000000001 111.721 -172.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -80.77 168.32 17.74 Favored 'Trans proline' 0 CA--C 1.547 1.15 0 C-N-CA 122.287 1.992 . . . . 10.9 109.37 -177.136 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.3 p -77.31 146.32 8.7 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.621 0 CA-C-N 113.508 -1.678 . . . . 18.010000000000002 109.105 -179.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 31.6 tp -85.51 144.25 28.05 Favored 'General case' 0 C--O 1.198 -1.635 0 CA-C-O 117.88 -1.057 . . . . 18.050000000000001 111.746 -177.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 49.0 p-10 -87.27 16.4 5.29 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.962 1.255 . . . . 29.710000000000001 112.499 -170.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 45.7 tttt -161.35 147.33 14.2 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 102.072 -3.307 . . . . 30.739999999999998 102.072 -176.003 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 91.1 m -111.42 -40.27 4.43 Favored 'General case' 0 C--O 1.207 -1.154 0 N-CA-C 113.545 0.943 . . . . 18.149999999999999 113.545 173.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 33.8 ttpt -106.56 121.58 44.59 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 119.243 -0.983 . . . . 27.82 112.503 -174.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -118.1 140.22 50.09 Favored 'General case' 0 CA--C 1.485 -1.541 0 C-N-CA 123.4 0.68 . . . . 14.98 110.399 -173.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 69.1 mt -102.79 100.69 10.71 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 105.36 -2.089 . . . . 17.879999999999999 105.36 170.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 38.2 t -95.79 124.29 52.99 Favored Pre-proline 0 C--O 1.241 0.639 0 O-C-N 123.817 0.698 . . . . 11.34 110.217 -174.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_exo -54.77 137.25 74.3 Favored 'Trans proline' 0 CA--C 1.546 1.107 0 C-N-CA 117.113 -1.458 . . . . 10.02 109.502 176.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 53.6 p-10 -66.47 -15.91 63.72 Favored 'General case' 0 C--O 1.213 -0.847 0 N-CA-C 115.612 1.708 . . . . 16.129999999999999 115.612 -168.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 30.5 p80 -87.3 -5.01 59.08 Favored 'General case' 0 C--O 1.242 0.706 0 CA-C-O 117.391 -1.29 . . . . 15.529999999999999 112.04 178.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 47.7 t -71.99 137.59 23.3 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.053 0 CA-C-N 119.45 1.023 . . . . 10.59 109.71 -177.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 16.7 p30 -100.26 174.57 6.07 Favored 'General case' 0 C--N 1.314 -0.969 0 C-N-CA 118.848 -1.141 . . . . 18.870000000000001 112.245 178.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 38.9 mmt -72.27 -28.56 63.2 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 115.573 -2.451 . . . . 17.510000000000002 112.466 -171.02 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.1 p -63.69 -42.98 97.94 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 106.995 -1.483 . . . . 21.960000000000001 106.995 179.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -62.86 -42.89 99.93 Favored 'General case' 0 CA--C 1.566 1.569 0 CA-C-N 114.025 -1.443 . . . . 15.869999999999999 113.686 178.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 30.0 tp -64.85 -41.26 95.85 Favored 'General case' 0 N--CA 1.485 1.282 0 CA-C-O 116.402 -1.761 . . . . 11.039999999999999 110.777 178.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 74.4 mt -56.45 -43.91 78.99 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.732 0 O-C-N 124.841 1.338 . . . . 11.31 111.001 173.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 44.2 tttp -63.65 -39.46 94.39 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 117.819 -1.552 . . . . 29.989999999999998 109.973 -179.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 38.8 mt -63.13 -44.68 99.56 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 O-C-N 125.184 1.552 . . . . 16.670000000000002 112.293 -178.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 44.1 mm -73.84 -35.55 43.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 118.529 -1.269 . . . . 14.4 110.819 179.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 78.2 mtp85 -62.47 -35.36 79.08 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 118.245 -1.382 . . . . 10.369999999999999 108.379 177.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 34.5 ttm180 -67.49 -44.06 79.41 Favored 'General case' 0 N--CA 1.486 1.349 0 O-C-N 124.885 1.366 . . . . 19.100000000000001 110.777 179.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 15.2 mtt180 -60.76 -37.42 81.76 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 123.533 0.52 . . . . 21.66 110.834 179.242 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 81.6 mt -81.82 -6.02 58.71 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 114.586 1.328 . . . . 12.970000000000001 114.586 -179.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 63.27 39.03 9.94 Favored 'General case' 0 C--O 1.26 1.643 0 C-N-CA 124.635 1.174 . . . . 36.039999999999999 110.965 178.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 63.1 mt -76.52 149.87 36.66 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 117.529 -1.668 . . . . 16.879999999999999 109.967 -173.78 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 45.5 m-20 -84.6 160.49 20.42 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-N 114.343 -1.299 . . . . 36.960000000000001 108.654 168.162 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.86 -15.5 59.09 Favored 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 112.866 0.691 . . . . 21.649999999999999 112.866 178.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -76.77 -10.64 59.52 Favored 'General case' 0 CA--C 1.508 -0.673 0 N-CA-C 115.538 1.681 . . . . 32.009999999999998 115.538 176.496 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -97.74 126.19 42.95 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 113.237 0.829 . . . . 26.09 113.237 -175.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -77.42 151.82 34.59 Favored 'General case' 0 C--O 1.254 1.33 0 CA-C-N 114.088 -1.415 . . . . 10.82 107.803 177.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 30.8 t80 -154.9 128.54 8.59 Favored 'General case' 0 C--O 1.282 2.776 0 N-CA-C 107.275 -1.38 . . . . 9.0999999999999996 107.275 -178.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -126.25 138.29 53.61 Favored 'General case' 0 CA--C 1.497 -1.062 0 O-C-N 125.068 1.48 . . . . 15.0 111.545 176.483 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 41.6 tp -115.48 114.16 24.65 Favored 'General case' 0 N--CA 1.429 -1.502 0 N-CA-C 106.359 -1.719 . . . . 15.41 106.359 -175.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LEU . . . . . 0.984 ' CD1' ' CZ ' ' A' ' 123' ' ' PHE . 23.1 mt -111.06 140.77 45.32 Favored 'General case' 0 N--CA 1.533 3.725 0 O-C-N 121.875 -0.516 . . . . 15.52 109.92 -171.804 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 73.7 t -125.65 125.3 68.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 N-CA-C 105.42 -2.067 . . . . 12.33 105.42 173.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 24.4 m120 41.15 50.68 3.34 Favored 'General case' 0 C--O 1.182 -2.496 0 O-C-N 124.292 0.995 . . . . 14.359999999999999 113.629 179.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 81.6 7.85 87.66 Favored Glycine 0 C--O 1.252 1.27 0 N-CA-C 117.966 1.946 . . . . 15.65 117.966 174.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' HIS . . . . . 0.423 ' CD2' ' O ' ' A' ' 508' ' ' HOH . 37.0 p-80 -140.06 157.09 46.19 Favored 'General case' 0 N--CA 1.424 -1.759 0 C-N-CA 117.837 -1.545 . . . . 14.35 112.374 176.919 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 39.3 t -85.47 139.24 31.65 Favored 'General case' 0 C--O 1.275 2.4 0 CA-C-O 123.72 1.724 . . . . 16.68 112.583 -170.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 32.5 mmt -92.51 -8.4 44.6 Favored 'General case' 0 C--O 1.261 1.687 0 N-CA-C 115.412 1.634 . . . . 24.140000000000001 115.412 -174.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' VAL . . . . . 0.434 ' CG1' ' N ' ' A' ' 94' ' ' SER . 4.8 p -49.39 -42.04 15.84 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.911 0 N-CA-C 120.43 3.493 . . . . 32.25 120.43 176.727 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' SER . . . . . 0.434 ' N ' ' CG1' ' A' ' 93' ' ' VAL . 8.1 m -88.29 5.9 39.62 Favored 'General case' 0 C--N 1.317 -0.843 0 O-C-N 120.67 -1.269 . . . . 38.240000000000002 113.364 -177.312 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 58.3 t -66.3 -46.09 88.01 Favored 'Isoleucine or valine' 0 C--O 1.253 1.251 0 CA-C-O 122.684 1.23 . . . . 37.579999999999998 110.759 -175.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . 0.457 0.0 OUTLIER 23.81 -2.16 0.0 OUTLIER 'General case' 0 N--CA 1.424 -1.744 2 N-CA-C 126.258 5.651 . . . . 39.859999999999999 126.258 -156.428 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 19.5 p -56.93 163.93 2.59 Favored Pre-proline 1 N--CA 1.542 4.149 0 CA-C-N 125.076 3.58 . . . . 33.590000000000003 103.288 168.473 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -66.84 159.93 49.19 Favored 'Trans proline' 0 CA--C 1.489 -1.749 0 O-C-N 123.967 1.509 . . . . 27.350000000000001 108.266 176.38 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 16.0 tt -62.44 -23.61 32.81 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.046 0 CA-C-N 114.464 -1.244 . . . . 13.59 112.163 174.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 78.1 p -53.79 -37.82 63.88 Favored 'General case' 0 C--O 1.247 0.969 0 O-C-N 118.847 -2.408 . . . . 20.390000000000001 114.858 172.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 -77.12 -38.81 51.38 Favored 'General case' 0 CA--C 1.489 -1.371 0 O-C-N 124.613 1.195 . . . . 41.0 110.93 179.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 93.5 t -59.29 -39.45 78.91 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.115 0 C-N-CA 117.823 -1.551 . . . . 14.17 108.865 174.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -60.24 -47.16 87.15 Favored 'General case' 0 N--CA 1.457 -0.104 0 CA-C-N 119.135 0.88 . . . . 13.31 110.297 -179.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 62.0 mm-40 -62.75 -39.14 93.2 Favored 'General case' 0 C--O 1.246 0.872 0 CA-C-N 114.986 -1.006 . . . . 38.469999999999999 109.602 -173.173 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 58.1 m -77.3 -32.64 55.54 Favored 'General case' 0 C--O 1.255 1.372 0 N-CA-C 114.811 1.411 . . . . 24.91 114.811 -178.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' GLU . . . . . 0.403 ' OE2' ' CE1' ' A' ' 90' ' ' HIS . 40.3 mm-40 -122.22 -7.11 8.81 Favored 'General case' 0 C--O 1.261 1.662 0 N-CA-C 115.104 1.52 . . . . 11.92 115.104 -159.873 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 60.1 pttt -63.23 149.48 45.39 Favored 'General case' 0 C--O 1.266 1.928 0 CA-C-O 123.593 1.663 . . . . 36.469999999999999 109.007 -170.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -67.89 159.47 30.43 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 113.254 -1.793 . . . . 10.279999999999999 109.599 175.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 67.9 tt0 -54.45 -33.57 59.85 Favored 'General case' 0 C--O 1.267 2.017 0 CA-C-N 112.459 -2.155 . . . . 29.109999999999999 112.716 169.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 49.1 p30 -73.47 -7.55 52.24 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 115.856 -2.338 . . . . 12.25 113.107 178.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 98.02 -12.16 63.96 Favored Glycine 0 C--N 1.351 1.411 0 N-CA-C 117.845 1.898 . . . . 10.359999999999999 117.845 -179.259 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 -87.17 153.24 21.66 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 117.796 -1.562 . . . . 9.3800000000000008 108.953 172.76 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 50.3 tp -96.54 119.55 35.23 Favored 'General case' 0 C--O 1.255 1.351 0 N-CA-C 106.357 -1.72 . . . . 9.5999999999999996 106.357 168.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 58.3 m-85 -96.47 134.33 39.78 Favored 'General case' 0 C--O 1.282 2.784 0 CA-C-N 113.702 -1.59 . . . . 8.6099999999999994 114.298 177.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 24.6 mtt -128.78 149.74 50.59 Favored 'General case' 0 C--O 1.248 1.026 0 CA-C-N 113.841 -1.527 . . . . 14.43 110.79 172.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 90.1 t -129.12 133.83 65.14 Favored 'Isoleucine or valine' 0 C--O 1.26 1.608 0 N-CA-C 105.774 -1.936 . . . . 14.33 105.774 -179.021 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 54.8 p90 -112.4 153.45 27.3 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 116.391 -2.124 . . . . 8.0600000000000005 110.045 178.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -159.37 164.28 34.83 Favored 'General case' 0 N--CA 1.485 1.278 0 CA-C-N 114.41 -1.268 . . . . 8.6899999999999995 109.037 -177.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 75.6 p -81.91 -3.74 54.91 Favored 'General case' 0 CA--C 1.573 1.861 0 CA-C-N 114.826 -1.079 . . . . 15.56 111.229 178.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -135.56 159.62 41.05 Favored 'General case' 0 N--CA 1.485 1.278 0 O-C-N 119.813 -1.805 . . . . 36.130000000000003 108.31 174.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -79.56 -30.31 41.64 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 117.761 2.504 . . . . 37.549999999999997 117.761 179.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 52.6 p -123.68 147.15 47.68 Favored 'General case' 0 C--O 1.246 0.871 0 N-CA-C 106.831 -1.544 . . . . 29.0 106.831 176.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' PHE . . . . . 0.984 ' CZ ' ' CD1' ' A' ' 86' ' ' LEU . 5.4 p90 . . . . . 0 C--O 1.252 1.186 0 O-C-N 125.591 1.807 . . . . 46.049999999999997 111.832 -170.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 508' ' ' HOH . . . . . 0.423 ' O ' ' CD2' ' A' ' 90' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 535' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 536' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 537' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 538' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 539' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 540' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 541' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 542' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 543' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 544' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 545' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 546' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 547' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 548' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 549' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 550' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 551' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 552' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 553' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 554' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 555' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 556' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 557' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 558' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 559' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 560' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 561' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 562' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 563' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 564' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 565' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 566' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 567' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 568' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 569' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 570' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 571' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 572' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 573' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 574' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 575' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 576' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 577' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 578' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 579' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 580' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 581' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 582' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 583' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 584' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 585' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 586' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 587' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 588' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 589' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 590' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 591' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 592' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 593' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 594' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 595' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 596' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 597' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 598' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 599' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 600' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 601' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 602' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 603' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 604' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 605' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 606' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 607' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 608' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.9 t . . . . . 0 C--O 1.266 1.972 0 N-CA-C 105.737 -1.949 . . . . 29.91 105.737 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -61.59 -3.64 3.65 Favored 'Trans proline' 0 C--O 1.165 -3.172 0 CA-C-O 115.519 -1.95 . . . . 25.55 112.187 171.159 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 59.6 tt0 -66.03 -26.01 67.32 Favored 'General case' 0 C--O 1.2 -1.522 0 CA-C-N 120.983 1.72 . . . . 20.81 108.675 175.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -107.05 151.46 40.7 Favored Pre-proline 0 C--O 1.294 3.412 0 O-C-N 125.039 1.462 . . . . 19.7 112.083 -172.092 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 8.7 Cg_endo -70.9 153.43 63.69 Favored 'Trans proline' 0 N--CA 1.452 -0.919 0 O-C-N 125.013 2.06 . . . . 17.07 107.934 -177.269 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 77.7 p -69.09 153.28 44.01 Favored 'General case' 0 C--O 1.263 1.777 0 CA-C-O 122.14 0.971 . . . . 26.76 113.122 173.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -69.24 135.5 50.63 Favored 'General case' 0 CA--C 1.556 1.192 0 CA-C-N 114.6 -1.182 . . . . 26.13 110.302 176.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 17.9 mtpt -108.4 140.94 40.97 Favored 'General case' 0 C--O 1.266 1.972 0 N-CA-C 105.803 -1.925 . . . . 37.51 105.803 -176.17 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 36.9 p -91.0 171.05 9.54 Favored 'General case' 0 N--CA 1.501 2.12 0 C-N-CA 116.967 -1.893 . . . . 16.14 112.051 179.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -55.92 -41.9 75.26 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.142 -0.974 . . . . 18.26 112.566 177.391 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -69.77 -21.64 63.41 Favored 'General case' 0 N--CA 1.441 -0.901 0 C-N-CA 118.892 -1.123 . . . . 13.1 111.554 -179.044 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -83.07 -17.21 43.98 Favored 'General case' 0 C--O 1.279 2.618 0 O-C-N 124.476 1.11 . . . . 32.06 109.421 175.161 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 91.2 mtm-85 -90.54 -23.67 20.84 Favored 'General case' 0 CA--C 1.563 1.463 0 CA-C-N 121.321 1.873 . . . . 30.48 109.636 -174.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 27.8 mmt-85 -139.2 134.54 32.88 Favored 'General case' 0 CA--C 1.467 -2.238 0 N-CA-C 107.915 -1.142 . . . . 47.66 107.915 -169.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 62.3 p -76.18 162.37 28.03 Favored 'General case' 0 C--O 1.272 2.256 0 C-N-CA 119.382 -0.927 . . . . 14.73 109.273 -174.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -50.2 -45.91 54.04 Favored 'General case' 0 C--O 1.204 -1.341 0 CA-C-O 118.922 -0.561 . . . . 12.75 110.773 177.483 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 61.5 mp0 -72.83 -29.17 63.02 Favored 'General case' 0 N--CA 1.44 -0.944 0 O-C-N 123.903 0.752 . . . . 23.19 109.807 -171.76 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -66.06 -46.09 79.02 Favored 'General case' 0 C--O 1.257 1.497 0 N-CA-C 113.219 0.822 . . . . 23.41 113.219 170.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ARG . . . . . 0.566 ' HD2' ' OD2' ' A' ' 110' ' ' ASP . 20.1 mtm180 -62.23 -42.35 99.24 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 124.593 1.183 . . . . 13.23 111.952 178.291 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 40.6 t -53.64 -51.34 44.07 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.009 0 CA-C-O 118.509 -0.758 . . . . 14.17 108.979 178.496 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 45.0 tp10 -66.35 -36.81 83.83 Favored 'General case' 0 C--O 1.204 -1.301 0 O-C-N 126.155 2.159 . . . . 24.25 109.159 -174.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . 0.264 99.7 m-20 -61.3 -45.99 92.15 Favored 'General case' 0 CA--C 1.576 1.963 0 N-CA-C 107.576 -1.268 . . . . 27.4 107.576 179.627 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 43.6 t -67.44 -39.09 81.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 C-N-CA 120.489 -0.484 . . . . 11.58 110.037 -177.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 64.5 ttp85 -53.39 -46.09 69.53 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 123.311 0.382 . . . . 32.89 111.042 175.273 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 98.2 mt -64.19 -47.46 79.7 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 124.631 1.207 . . . . 26.95 113.966 176.489 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 86.8 mt -59.28 -42.57 87.56 Favored 'Isoleucine or valine' 0 C--O 1.271 2.236 0 O-C-N 120.842 -1.161 . . . . 17.32 112.356 177.651 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ARG . . . . . 0.655 ' HD2' ' O ' ' A' ' 528' ' ' HOH . 30.6 mmm180 -63.9 -39.57 94.48 Favored 'General case' 0 C--O 1.211 -0.96 0 O-C-N 121.121 -0.987 . . . . 38.29 111.388 -177.712 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -72.48 -46.4 55.03 Favored 'General case' 0 C--O 1.259 1.595 0 C-N-CA 123.679 0.791 . . . . 45.33 111.636 176.087 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -78.96 -26.08 43.49 Favored 'General case' 0 C--O 1.265 1.898 0 N-CA-C 113.507 0.929 . . . . 23.73 113.507 -173.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -141.5 69.13 26.13 Favored Pre-proline 0 C--O 1.272 2.289 0 N-CA-C 108.915 -0.772 . . . . 16.54 108.915 -171.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -66.75 -21.04 51.95 Favored 'Trans proline' 0 CA--C 1.552 1.411 0 C-N-CA 121.599 1.533 . . . . 16.32 114.758 -165.44 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 65.2 p -99.16 5.79 46.67 Favored 'General case' 0 C--O 1.27 2.173 0 CA-C-O 118.287 -0.863 . . . . 12.84 110.65 -177.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -101.93 141.29 35.01 Favored 'General case' 0 CA--C 1.502 -0.901 0 CA-C-O 123.911 1.815 . . . . 21.1 110.588 175.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 29.7 mm -97.68 132.18 25.53 Favored Pre-proline 0 C--O 1.273 2.296 0 CA-C-N 113.41 -1.723 . . . . 10.54 109.281 173.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -86.45 113.68 1.17 Allowed 'Trans proline' 0 N--CA 1.488 1.187 0 O-C-N 123.745 1.392 . . . . 10.43 111.077 -177.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 22.4 t -124.19 133.15 70.09 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.631 0 O-C-N 125.431 1.707 . . . . 9.56 109.442 -169.16 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 44.9 mm -106.89 121.2 59.37 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 N-CA-C 106.96 -1.496 . . . . 7.79 106.96 174.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 73.7 mt -119.93 125.23 74.06 Favored 'Isoleucine or valine' 0 C--O 1.259 1.579 0 N-CA-C 107.276 -1.379 . . . . 9.19 107.276 -177.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -140.87 148.79 41.05 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 115.321 -0.854 . . . . 14.22 109.865 -173.162 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 55.5 ttp180 -73.59 137.23 44.15 Favored 'General case' 0 C--O 1.301 3.805 0 CA-C-N 114.524 -1.216 . . . . 10.51 109.105 175.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -50.91 136.97 21.75 Favored 'General case' 0 C--O 1.258 1.551 0 CA-C-N 113.182 -1.826 . . . . 36.84 111.67 173.846 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 18.3 pttm -59.26 -34.38 72.16 Favored 'General case' 0 N--CA 1.487 1.397 0 CA-C-N 115.263 -0.88 . . . . 41.7 112.503 -172.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -89.84 11.86 69.16 Favored Glycine 0 CA--C 1.537 1.408 0 C-N-CA 118.536 -1.792 . . . . 17.02 117.568 177.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.2 tp10 -72.15 131.71 43.16 Favored 'General case' 0 CA--C 1.485 -1.543 0 O-C-N 120.295 -1.709 . . . . 13.69 113.49 -172.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 66.0 mmtt -121.77 -1.93 9.38 Favored 'General case' 0 N--CA 1.442 -0.869 0 N-CA-C 116.039 1.866 . . . . 34.34 116.039 -177.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 61.5 mt-30 -107.15 -36.87 6.44 Favored 'General case' 0 C--O 1.286 3.009 0 CA-C-O 123.961 1.838 . . . . 34.59 115.427 175.794 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 75.1 mt -93.87 150.63 38.91 Favored Pre-proline 0 N--CA 1.406 -2.638 0 O-C-N 119.053 -2.279 . . . . 11.96 111.721 -172.192 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -80.77 168.32 17.74 Favored 'Trans proline' 0 CA--C 1.547 1.15 0 C-N-CA 122.287 1.992 . . . . 10.9 109.37 -177.136 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.3 p -77.31 146.32 8.7 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.621 0 CA-C-N 113.508 -1.678 . . . . 18.01 109.105 -179.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 31.6 tp -85.51 144.25 28.05 Favored 'General case' 0 C--O 1.198 -1.635 0 CA-C-O 117.88 -1.057 . . . . 18.05 111.746 -177.522 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 49.0 p-10 -87.27 16.4 5.29 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.962 1.255 . . . . 29.71 112.499 -170.262 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 45.7 tttt -161.35 147.33 14.2 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 102.072 -3.307 . . . . 30.74 102.072 -176.003 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 91.1 m -111.42 -40.27 4.43 Favored 'General case' 0 C--O 1.207 -1.154 0 N-CA-C 113.545 0.943 . . . . 18.15 113.545 173.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 33.8 ttpt -106.56 121.58 44.59 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 119.243 -0.983 . . . . 27.82 112.503 -174.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -118.1 140.22 50.09 Favored 'General case' 0 CA--C 1.485 -1.541 0 C-N-CA 123.4 0.68 . . . . 14.98 110.399 -173.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 69.1 mt -102.79 100.69 10.71 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 105.36 -2.089 . . . . 17.88 105.36 170.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 38.2 t -95.79 124.29 52.99 Favored Pre-proline 0 C--O 1.241 0.639 0 O-C-N 123.817 0.698 . . . . 11.34 110.217 -174.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_exo -54.77 137.25 74.3 Favored 'Trans proline' 0 CA--C 1.546 1.107 0 C-N-CA 117.113 -1.458 . . . . 10.02 109.502 176.605 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 53.6 p-10 -66.47 -15.91 63.72 Favored 'General case' 0 C--O 1.213 -0.847 0 N-CA-C 115.612 1.708 . . . . 16.13 115.612 -168.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 30.5 p80 -87.3 -5.01 59.08 Favored 'General case' 0 C--O 1.242 0.706 0 CA-C-O 117.391 -1.29 . . . . 15.53 112.04 178.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 47.7 t -71.99 137.59 23.3 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.053 0 CA-C-N 119.45 1.023 . . . . 10.59 109.71 -177.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 16.7 p30 -100.26 174.57 6.07 Favored 'General case' 0 C--N 1.314 -0.969 0 C-N-CA 118.848 -1.141 . . . . 18.87 112.245 178.309 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 38.9 mmt -72.27 -28.56 63.2 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 115.573 -2.451 . . . . 17.51 112.466 -171.02 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.1 p -63.69 -42.98 97.94 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 106.995 -1.483 . . . . 21.96 106.995 179.069 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -62.86 -42.89 99.93 Favored 'General case' 0 CA--C 1.566 1.569 0 CA-C-N 114.025 -1.443 . . . . 15.87 113.686 178.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 30.0 tp -64.85 -41.26 95.85 Favored 'General case' 0 N--CA 1.485 1.282 0 CA-C-O 116.402 -1.761 . . . . 11.04 110.777 178.185 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 74.4 mt -56.45 -43.91 78.99 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.732 0 O-C-N 124.841 1.338 . . . . 11.31 111.001 173.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 44.2 tttp -63.65 -39.46 94.39 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 117.819 -1.552 . . . . 29.99 109.973 -179.004 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 38.8 mt -63.13 -44.68 99.56 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 O-C-N 125.184 1.552 . . . . 16.67 112.293 -178.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 44.1 mm -73.84 -35.55 43.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 118.529 -1.269 . . . . 14.4 110.819 179.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 78.2 mtp85 -62.47 -35.36 79.08 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 118.245 -1.382 . . . . 10.37 108.379 177.648 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 34.5 ttm180 -67.49 -44.06 79.41 Favored 'General case' 0 N--CA 1.486 1.349 0 O-C-N 124.885 1.366 . . . . 19.1 110.777 179.418 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 15.2 mtt180 -60.76 -37.42 81.76 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 123.533 0.52 . . . . 21.66 110.834 179.242 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 81.6 mt -81.82 -6.02 58.71 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 114.586 1.328 . . . . 12.97 114.586 -179.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 63.27 39.03 9.94 Favored 'General case' 0 C--O 1.26 1.643 0 C-N-CA 124.635 1.174 . . . . 36.04 110.965 178.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 63.1 mt -76.52 149.87 36.66 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 117.529 -1.668 . . . . 16.88 109.967 -173.78 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 45.5 m-20 -84.6 160.49 20.42 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-N 114.343 -1.299 . . . . 36.96 108.654 168.162 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.86 -15.5 59.09 Favored 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 112.866 0.691 . . . . 21.65 112.866 178.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -76.77 -10.64 59.52 Favored 'General case' 0 CA--C 1.508 -0.673 0 N-CA-C 115.538 1.681 . . . . 32.01 115.538 176.496 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -97.74 126.19 42.95 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 113.237 0.829 . . . . 26.09 113.237 -175.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -77.42 151.82 34.59 Favored 'General case' 0 C--O 1.254 1.33 0 CA-C-N 114.088 -1.415 . . . . 10.82 107.803 177.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 30.8 t80 -154.9 128.54 8.59 Favored 'General case' 0 C--O 1.282 2.776 0 N-CA-C 107.275 -1.38 . . . . 9.1 107.275 -178.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -126.25 138.29 53.61 Favored 'General case' 0 CA--C 1.497 -1.062 0 O-C-N 125.068 1.48 . . . . 15.0 111.545 176.483 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 41.6 tp -115.48 114.16 24.65 Favored 'General case' 0 N--CA 1.429 -1.502 0 N-CA-C 106.359 -1.719 . . . . 15.41 106.359 -175.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LEU . . . . . 0.984 ' CD1' ' CZ ' ' A' ' 123' ' ' PHE . 23.1 mt -111.06 140.77 45.32 Favored 'General case' 0 N--CA 1.533 3.725 0 O-C-N 121.875 -0.516 . . . . 15.52 109.92 -171.804 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 73.7 t -125.65 125.3 68.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 N-CA-C 105.42 -2.067 . . . . 12.33 105.42 173.291 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 41.15 50.68 3.34 Favored 'General case' 0 C--O 1.182 -2.496 0 O-C-N 124.292 0.995 . . . . 14.36 113.629 179.85 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 81.6 7.85 87.66 Favored Glycine 0 C--O 1.252 1.27 0 N-CA-C 117.966 1.946 . . . . 15.65 117.966 174.037 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 7.0 p80 -140.06 157.09 46.19 Favored 'General case' 0 N--CA 1.424 -1.759 0 C-N-CA 117.837 -1.545 . . . . 14.35 112.374 176.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 39.3 t -85.47 139.24 31.65 Favored 'General case' 0 C--O 1.275 2.4 0 CA-C-O 123.72 1.724 . . . . 16.68 112.583 -170.007 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 32.5 mmt -92.51 -8.4 44.6 Favored 'General case' 0 C--O 1.261 1.687 0 N-CA-C 115.412 1.634 . . . . 24.14 115.412 -174.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' VAL . . . . . 0.55 HG13 ' N ' ' A' ' 94' ' ' SER . 4.8 p -49.39 -42.04 15.84 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.911 0 N-CA-C 120.43 3.493 . . . . 32.25 120.43 176.727 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 94' ' ' SER . . . . . 0.55 ' N ' HG13 ' A' ' 93' ' ' VAL . 8.1 m -88.29 5.9 39.62 Favored 'General case' 0 C--N 1.317 -0.843 0 O-C-N 120.67 -1.269 . . . . 38.24 113.364 -177.312 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 58.3 t -66.3 -46.09 88.01 Favored 'Isoleucine or valine' 0 C--O 1.253 1.251 0 CA-C-O 122.684 1.23 . . . . 37.58 110.759 -175.282 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . 0.457 0.0 OUTLIER 23.81 -2.16 0.0 OUTLIER 'General case' 0 N--CA 1.424 -1.744 2 N-CA-C 126.258 5.651 . . . . 39.86 126.258 -156.428 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 19.5 p -56.93 163.93 2.59 Favored Pre-proline 1 N--CA 1.542 4.149 0 CA-C-N 125.076 3.58 . . . . 33.59 103.288 168.473 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -66.84 159.93 49.19 Favored 'Trans proline' 0 CA--C 1.489 -1.749 0 O-C-N 123.967 1.509 . . . . 27.35 108.266 176.38 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 16.0 tt -62.44 -23.61 32.81 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.046 0 CA-C-N 114.464 -1.244 . . . . 13.59 112.163 174.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 78.1 p -53.79 -37.82 63.88 Favored 'General case' 0 C--O 1.247 0.969 0 O-C-N 118.847 -2.408 . . . . 20.39 114.858 172.31 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 -77.12 -38.81 51.38 Favored 'General case' 0 CA--C 1.489 -1.371 0 O-C-N 124.613 1.195 . . . . 41.0 110.93 179.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 93.5 t -59.29 -39.45 78.91 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.115 0 C-N-CA 117.823 -1.551 . . . . 14.17 108.865 174.648 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -60.24 -47.16 87.15 Favored 'General case' 0 N--CA 1.457 -0.104 0 CA-C-N 119.135 0.88 . . . . 13.31 110.297 -179.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' GLU . . . . . 0.514 ' HG2' ' O ' ' A' ' 533' ' ' HOH . 62.0 mm-40 -62.75 -39.14 93.2 Favored 'General case' 0 C--O 1.246 0.872 0 CA-C-N 114.986 -1.006 . . . . 38.47 109.602 -173.173 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 58.1 m -77.3 -32.64 55.54 Favored 'General case' 0 C--O 1.255 1.372 0 N-CA-C 114.811 1.411 . . . . 24.91 114.811 -178.306 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 40.3 mm-40 -122.22 -7.11 8.81 Favored 'General case' 0 C--O 1.261 1.662 0 N-CA-C 115.104 1.52 . . . . 11.92 115.104 -159.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 60.1 pttt -63.23 149.48 45.39 Favored 'General case' 0 C--O 1.266 1.928 0 CA-C-O 123.593 1.663 . . . . 36.47 109.007 -170.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -67.89 159.47 30.43 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 113.254 -1.793 . . . . 10.28 109.599 175.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' GLU . . . . . 0.473 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 67.9 tt0 -54.45 -33.57 59.85 Favored 'General case' 0 C--O 1.267 2.017 0 CA-C-N 112.459 -2.155 . . . . 29.11 112.716 169.598 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ASP . . . . . 0.566 ' OD2' ' HD2' ' A' ' 20' ' ' ARG . 49.1 p30 -73.47 -7.55 52.24 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 115.856 -2.338 . . . . 12.25 113.107 178.87 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 98.02 -12.16 63.96 Favored Glycine 0 C--N 1.351 1.411 0 N-CA-C 117.845 1.898 . . . . 10.36 117.845 -179.259 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 -87.17 153.24 21.66 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 117.796 -1.562 . . . . 9.38 108.953 172.76 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 50.3 tp -96.54 119.55 35.23 Favored 'General case' 0 C--O 1.255 1.351 0 N-CA-C 106.357 -1.72 . . . . 9.6 106.357 168.386 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 58.3 m-85 -96.47 134.33 39.78 Favored 'General case' 0 C--O 1.282 2.784 0 CA-C-N 113.702 -1.59 . . . . 8.61 114.298 177.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 24.6 mtt -128.78 149.74 50.59 Favored 'General case' 0 C--O 1.248 1.026 0 CA-C-N 113.841 -1.527 . . . . 14.43 110.79 172.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 90.1 t -129.12 133.83 65.14 Favored 'Isoleucine or valine' 0 C--O 1.26 1.608 0 N-CA-C 105.774 -1.936 . . . . 14.33 105.774 -179.021 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 54.8 p90 -112.4 153.45 27.3 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 116.391 -2.124 . . . . 8.06 110.045 178.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -159.37 164.28 34.83 Favored 'General case' 0 N--CA 1.485 1.278 0 CA-C-N 114.41 -1.268 . . . . 8.69 109.037 -177.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 75.6 p -81.91 -3.74 54.91 Favored 'General case' 0 CA--C 1.573 1.861 0 CA-C-N 114.826 -1.079 . . . . 15.56 111.229 178.936 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -135.56 159.62 41.05 Favored 'General case' 0 N--CA 1.485 1.278 0 O-C-N 119.813 -1.805 . . . . 36.13 108.31 174.584 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -79.56 -30.31 41.64 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 117.761 2.504 . . . . 37.55 117.761 179.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 52.6 p -123.68 147.15 47.68 Favored 'General case' 0 C--O 1.246 0.871 0 N-CA-C 106.831 -1.544 . . . . 29.0 106.831 176.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' PHE . . . . . 0.984 ' CZ ' ' CD1' ' A' ' 86' ' ' LEU . 5.4 p90 . . . . . 0 C--O 1.252 1.186 0 O-C-N 125.591 1.807 . . . . 46.05 111.832 -170.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 201' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 528' ' ' HOH . . . . . 0.655 ' O ' ' HD2' ' A' ' 28' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 533' ' ' HOH . . . . . 0.514 ' O ' ' HG2' ' A' ' 104' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 535' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 536' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 537' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 538' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 539' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 540' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 541' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 542' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 543' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 544' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 545' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 546' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 547' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 548' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 549' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 550' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 551' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 552' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 553' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 554' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 555' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 556' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 557' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 558' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 559' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 560' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 561' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 562' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 563' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 564' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 565' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 566' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 567' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 568' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 569' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 570' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 571' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 572' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 573' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 574' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 575' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 576' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 577' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 578' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 579' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 580' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 581' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 582' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 583' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 584' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 585' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 586' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 587' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 588' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 589' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 590' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 591' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 592' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 593' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 594' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 595' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 596' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 597' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 598' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 599' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 600' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 601' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 602' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 603' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 604' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 605' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 606' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 607' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 608' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.9 t . . . . . 0 C--O 1.266 1.972 0 N-CA-C 105.737 -1.949 . . . . 29.91 105.737 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -61.59 -3.64 3.65 Favored 'Trans proline' 0 C--O 1.165 -3.172 0 CA-C-O 115.519 -1.95 . . . . 25.550000000000001 112.187 171.159 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 59.6 tt0 -66.03 -26.01 67.32 Favored 'General case' 0 C--O 1.2 -1.522 0 CA-C-N 120.983 1.72 . . . . 20.809999999999999 108.675 175.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -107.05 151.46 40.7 Favored Pre-proline 0 C--O 1.294 3.412 0 O-C-N 125.039 1.462 . . . . 19.699999999999999 112.083 -172.092 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 8.7 Cg_endo -70.9 153.43 63.69 Favored 'Trans proline' 0 N--CA 1.452 -0.919 0 O-C-N 125.013 2.06 . . . . 17.07 107.934 -177.269 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 77.7 p -69.09 153.28 44.01 Favored 'General case' 0 C--O 1.263 1.777 0 CA-C-O 122.14 0.971 . . . . 26.760000000000002 113.122 173.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -69.24 135.5 50.63 Favored 'General case' 0 CA--C 1.556 1.192 0 CA-C-N 114.6 -1.182 . . . . 26.129999999999999 110.302 176.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 17.9 mtpt -108.4 140.94 40.97 Favored 'General case' 0 C--O 1.266 1.972 0 N-CA-C 105.803 -1.925 . . . . 37.509999999999998 105.803 -176.17 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 36.9 p -91.0 171.05 9.54 Favored 'General case' 0 N--CA 1.501 2.12 0 C-N-CA 116.967 -1.893 . . . . 16.140000000000001 112.051 179.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -55.92 -41.9 75.26 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.142 -0.974 . . . . 18.260000000000002 112.566 177.391 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -69.77 -21.64 63.41 Favored 'General case' 0 N--CA 1.441 -0.901 0 C-N-CA 118.892 -1.123 . . . . 13.1 111.554 -179.044 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -83.07 -17.21 43.98 Favored 'General case' 0 C--O 1.279 2.618 0 O-C-N 124.476 1.11 . . . . 32.060000000000002 109.421 175.161 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 91.2 mtm-85 -90.54 -23.67 20.84 Favored 'General case' 0 CA--C 1.563 1.463 0 CA-C-N 121.321 1.873 . . . . 30.48 109.636 -174.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 27.8 mmt-85 -139.2 134.54 32.88 Favored 'General case' 0 CA--C 1.467 -2.238 0 N-CA-C 107.915 -1.142 . . . . 47.659999999999997 107.915 -169.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 62.3 p -76.18 162.37 28.03 Favored 'General case' 0 C--O 1.272 2.256 0 C-N-CA 119.382 -0.927 . . . . 14.73 109.273 -174.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -50.2 -45.91 54.04 Favored 'General case' 0 C--O 1.204 -1.341 0 CA-C-O 118.922 -0.561 . . . . 12.75 110.773 177.483 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 61.5 mp0 -72.83 -29.17 63.02 Favored 'General case' 0 N--CA 1.44 -0.944 0 O-C-N 123.903 0.752 . . . . 23.190000000000001 109.807 -171.76 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -66.06 -46.09 79.02 Favored 'General case' 0 C--O 1.257 1.497 0 N-CA-C 113.219 0.822 . . . . 23.41 113.219 170.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.566 ' HD2' ' OD2' ' A' ' 110' ' ' ASP . 20.1 mtm180 -62.23 -42.35 99.24 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 124.593 1.183 . . . . 13.23 111.952 178.291 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 40.6 t -53.64 -51.34 44.07 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.009 0 CA-C-O 118.509 -0.758 . . . . 14.17 108.979 178.496 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 45.0 tp10 -66.35 -36.81 83.83 Favored 'General case' 0 C--O 1.204 -1.301 0 O-C-N 126.155 2.159 . . . . 24.25 109.159 -174.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . 0.264 99.7 m-20 -61.3 -45.99 92.15 Favored 'General case' 0 CA--C 1.576 1.963 0 N-CA-C 107.576 -1.268 . . . . 27.399999999999999 107.576 179.627 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 43.6 t -67.44 -39.09 81.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 C-N-CA 120.489 -0.484 . . . . 11.58 110.037 -177.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 64.5 ttp85 -53.39 -46.09 69.53 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 123.311 0.382 . . . . 32.890000000000001 111.042 175.273 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 98.2 mt -64.19 -47.46 79.7 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 124.631 1.207 . . . . 26.949999999999999 113.966 176.489 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 86.8 mt -59.28 -42.57 87.56 Favored 'Isoleucine or valine' 0 C--O 1.271 2.236 0 O-C-N 120.842 -1.161 . . . . 17.32 112.356 177.651 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.655 ' HD2' ' O ' ' A' ' 528' ' ' HOH . 30.6 mmm180 -63.9 -39.57 94.48 Favored 'General case' 0 C--O 1.211 -0.96 0 O-C-N 121.121 -0.987 . . . . 38.289999999999999 111.388 -177.712 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -72.48 -46.4 55.03 Favored 'General case' 0 C--O 1.259 1.595 0 C-N-CA 123.679 0.791 . . . . 45.329999999999998 111.636 176.087 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -78.96 -26.08 43.49 Favored 'General case' 0 C--O 1.265 1.898 0 N-CA-C 113.507 0.929 . . . . 23.73 113.507 -173.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.546 ' HD2' ' O2 ' ' A' ' 202' ' ' SO4 . 66.6 m80 -141.5 69.13 26.13 Favored Pre-proline 0 C--O 1.272 2.289 0 N-CA-C 108.915 -0.772 . . . . 16.539999999999999 108.915 -171.937 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -66.75 -21.04 51.95 Favored 'Trans proline' 0 CA--C 1.552 1.411 0 C-N-CA 121.599 1.533 . . . . 16.32 114.758 -165.44 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 65.2 p -99.16 5.79 46.67 Favored 'General case' 0 C--O 1.27 2.173 0 CA-C-O 118.287 -0.863 . . . . 12.84 110.65 -177.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -101.93 141.29 35.01 Favored 'General case' 0 CA--C 1.502 -0.901 0 CA-C-O 123.911 1.815 . . . . 21.100000000000001 110.588 175.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 29.7 mm -97.68 132.18 25.53 Favored Pre-proline 0 C--O 1.273 2.296 0 CA-C-N 113.41 -1.723 . . . . 10.539999999999999 109.281 173.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -86.45 113.68 1.17 Allowed 'Trans proline' 0 N--CA 1.488 1.187 0 O-C-N 123.745 1.392 . . . . 10.43 111.077 -177.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 22.4 t -124.19 133.15 70.09 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.631 0 O-C-N 125.431 1.707 . . . . 9.5600000000000005 109.442 -169.16 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 44.9 mm -106.89 121.2 59.37 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 N-CA-C 106.96 -1.496 . . . . 7.79 106.96 174.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 73.7 mt -119.93 125.23 74.06 Favored 'Isoleucine or valine' 0 C--O 1.259 1.579 0 N-CA-C 107.276 -1.379 . . . . 9.1899999999999995 107.276 -177.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -140.87 148.79 41.05 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 115.321 -0.854 . . . . 14.220000000000001 109.865 -173.162 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 55.5 ttp180 -73.59 137.23 44.15 Favored 'General case' 0 C--O 1.301 3.805 0 CA-C-N 114.524 -1.216 . . . . 10.51 109.105 175.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -50.91 136.97 21.75 Favored 'General case' 0 C--O 1.258 1.551 0 CA-C-N 113.182 -1.826 . . . . 36.840000000000003 111.67 173.846 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 18.3 pttm -59.26 -34.38 72.16 Favored 'General case' 0 N--CA 1.487 1.397 0 CA-C-N 115.263 -0.88 . . . . 41.700000000000003 112.503 -172.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -89.84 11.86 69.16 Favored Glycine 0 CA--C 1.537 1.408 0 C-N-CA 118.536 -1.792 . . . . 17.02 117.568 177.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.2 tp10 -72.15 131.71 43.16 Favored 'General case' 0 CA--C 1.485 -1.543 0 O-C-N 120.295 -1.709 . . . . 13.69 113.49 -172.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 66.0 mmtt -121.77 -1.93 9.38 Favored 'General case' 0 N--CA 1.442 -0.869 0 N-CA-C 116.039 1.866 . . . . 34.340000000000003 116.039 -177.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 61.5 mt-30 -107.15 -36.87 6.44 Favored 'General case' 0 C--O 1.286 3.009 0 CA-C-O 123.961 1.838 . . . . 34.590000000000003 115.427 175.794 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 75.1 mt -93.87 150.63 38.91 Favored Pre-proline 0 N--CA 1.406 -2.638 0 O-C-N 119.053 -2.279 . . . . 11.960000000000001 111.721 -172.192 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -80.77 168.32 17.74 Favored 'Trans proline' 0 CA--C 1.547 1.15 0 C-N-CA 122.287 1.992 . . . . 10.9 109.37 -177.136 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.3 p -77.31 146.32 8.7 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.621 0 CA-C-N 113.508 -1.678 . . . . 18.010000000000002 109.105 -179.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 31.6 tp -85.51 144.25 28.05 Favored 'General case' 0 C--O 1.198 -1.635 0 CA-C-O 117.88 -1.057 . . . . 18.050000000000001 111.746 -177.522 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 49.0 p-10 -87.27 16.4 5.29 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.962 1.255 . . . . 29.710000000000001 112.499 -170.262 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 45.7 tttt -161.35 147.33 14.2 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 102.072 -3.307 . . . . 30.739999999999998 102.072 -176.003 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 91.1 m -111.42 -40.27 4.43 Favored 'General case' 0 C--O 1.207 -1.154 0 N-CA-C 113.545 0.943 . . . . 18.149999999999999 113.545 173.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 33.8 ttpt -106.56 121.58 44.59 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 119.243 -0.983 . . . . 27.82 112.503 -174.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -118.1 140.22 50.09 Favored 'General case' 0 CA--C 1.485 -1.541 0 C-N-CA 123.4 0.68 . . . . 14.98 110.399 -173.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 69.1 mt -102.79 100.69 10.71 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 105.36 -2.089 . . . . 17.879999999999999 105.36 170.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 38.2 t -95.79 124.29 52.99 Favored Pre-proline 0 C--O 1.241 0.639 0 O-C-N 123.817 0.698 . . . . 11.34 110.217 -174.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_exo -54.77 137.25 74.3 Favored 'Trans proline' 0 CA--C 1.546 1.107 0 C-N-CA 117.113 -1.458 . . . . 10.02 109.502 176.605 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 53.6 p-10 -66.47 -15.91 63.72 Favored 'General case' 0 C--O 1.213 -0.847 0 N-CA-C 115.612 1.708 . . . . 16.129999999999999 115.612 -168.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 30.5 p80 -87.3 -5.01 59.08 Favored 'General case' 0 C--O 1.242 0.706 0 CA-C-O 117.391 -1.29 . . . . 15.529999999999999 112.04 178.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 47.7 t -71.99 137.59 23.3 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.053 0 CA-C-N 119.45 1.023 . . . . 10.59 109.71 -177.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 16.7 p30 -100.26 174.57 6.07 Favored 'General case' 0 C--N 1.314 -0.969 0 C-N-CA 118.848 -1.141 . . . . 18.870000000000001 112.245 178.309 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 38.9 mmt -72.27 -28.56 63.2 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 115.573 -2.451 . . . . 17.510000000000002 112.466 -171.02 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.1 p -63.69 -42.98 97.94 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 106.995 -1.483 . . . . 21.960000000000001 106.995 179.069 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -62.86 -42.89 99.93 Favored 'General case' 0 CA--C 1.566 1.569 0 CA-C-N 114.025 -1.443 . . . . 15.869999999999999 113.686 178.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 30.0 tp -64.85 -41.26 95.85 Favored 'General case' 0 N--CA 1.485 1.282 0 CA-C-O 116.402 -1.761 . . . . 11.039999999999999 110.777 178.185 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 74.4 mt -56.45 -43.91 78.99 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.732 0 O-C-N 124.841 1.338 . . . . 11.31 111.001 173.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 44.2 tttp -63.65 -39.46 94.39 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 117.819 -1.552 . . . . 29.989999999999998 109.973 -179.004 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 38.8 mt -63.13 -44.68 99.56 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 O-C-N 125.184 1.552 . . . . 16.670000000000002 112.293 -178.438 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 44.1 mm -73.84 -35.55 43.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 118.529 -1.269 . . . . 14.4 110.819 179.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 78.2 mtp85 -62.47 -35.36 79.08 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 118.245 -1.382 . . . . 10.369999999999999 108.379 177.648 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 34.5 ttm180 -67.49 -44.06 79.41 Favored 'General case' 0 N--CA 1.486 1.349 0 O-C-N 124.885 1.366 . . . . 19.100000000000001 110.777 179.418 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 15.2 mtt180 -60.76 -37.42 81.76 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 123.533 0.52 . . . . 21.66 110.834 179.242 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 81.6 mt -81.82 -6.02 58.71 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 114.586 1.328 . . . . 12.970000000000001 114.586 -179.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 63.27 39.03 9.94 Favored 'General case' 0 C--O 1.26 1.643 0 C-N-CA 124.635 1.174 . . . . 36.039999999999999 110.965 178.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 63.1 mt -76.52 149.87 36.66 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 117.529 -1.668 . . . . 16.879999999999999 109.967 -173.78 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.785 ' H ' HE21 ' A' ' 81' ' ' GLN . 45.5 m-20 -84.6 160.49 20.42 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-N 114.343 -1.299 . . . . 36.960000000000001 108.654 168.162 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.86 -15.5 59.09 Favored 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 112.866 0.691 . . . . 21.649999999999999 112.866 178.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -76.77 -10.64 59.52 Favored 'General case' 0 CA--C 1.508 -0.673 0 N-CA-C 115.538 1.681 . . . . 32.009999999999998 115.538 176.496 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.785 HE21 ' H ' ' A' ' 78' ' ' ASN . 49.9 mt-30 -97.74 126.19 42.95 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 113.237 0.829 . . . . 26.09 113.237 -175.348 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -77.42 151.82 34.59 Favored 'General case' 0 C--O 1.254 1.33 0 CA-C-N 114.088 -1.415 . . . . 10.82 107.803 177.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 30.8 t80 -154.9 128.54 8.59 Favored 'General case' 0 C--O 1.282 2.776 0 N-CA-C 107.275 -1.38 . . . . 9.0999999999999996 107.275 -178.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -126.25 138.29 53.61 Favored 'General case' 0 CA--C 1.497 -1.062 0 O-C-N 125.068 1.48 . . . . 15.0 111.545 176.483 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 41.6 tp -115.48 114.16 24.65 Favored 'General case' 0 N--CA 1.429 -1.502 0 N-CA-C 106.359 -1.719 . . . . 15.41 106.359 -175.164 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.984 ' CD1' ' CZ ' ' A' ' 123' ' ' PHE . 23.1 mt -111.06 140.77 45.32 Favored 'General case' 0 N--CA 1.533 3.725 0 O-C-N 121.875 -0.516 . . . . 15.52 109.92 -171.804 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 73.7 t -125.65 125.3 68.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 N-CA-C 105.42 -2.067 . . . . 12.33 105.42 173.291 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 24.4 m120 41.15 50.68 3.34 Favored 'General case' 0 C--O 1.182 -2.496 0 O-C-N 124.292 0.995 . . . . 14.359999999999999 113.629 179.85 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 81.6 7.85 87.66 Favored Glycine 0 C--O 1.252 1.27 0 N-CA-C 117.966 1.946 . . . . 15.65 117.966 174.037 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.62 ' HD2' ' O ' ' A' ' 508' ' ' HOH . 37.0 p-80 -140.06 157.09 46.19 Favored 'General case' 0 N--CA 1.424 -1.759 0 C-N-CA 117.837 -1.545 . . . . 14.35 112.374 176.919 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 39.3 t -85.47 139.24 31.65 Favored 'General case' 0 C--O 1.275 2.4 0 CA-C-O 123.72 1.724 . . . . 16.68 112.583 -170.007 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 32.5 mmt -92.51 -8.4 44.6 Favored 'General case' 0 C--O 1.261 1.687 0 N-CA-C 115.412 1.634 . . . . 24.140000000000001 115.412 -174.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.55 HG13 ' N ' ' A' ' 94' ' ' SER . 4.8 p -49.39 -42.04 15.84 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.911 0 N-CA-C 120.43 3.493 . . . . 32.25 120.43 176.727 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' SER . . . . . 0.55 ' N ' HG13 ' A' ' 93' ' ' VAL . 8.1 m -88.29 5.9 39.62 Favored 'General case' 0 C--N 1.317 -0.843 0 O-C-N 120.67 -1.269 . . . . 38.240000000000002 113.364 -177.312 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 58.3 t -66.3 -46.09 88.01 Favored 'Isoleucine or valine' 0 C--O 1.253 1.251 0 CA-C-O 122.684 1.23 . . . . 37.579999999999998 110.759 -175.282 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . 0.457 0.0 OUTLIER 23.81 -2.16 0.0 OUTLIER 'General case' 0 N--CA 1.424 -1.744 2 N-CA-C 126.258 5.651 . . . . 39.859999999999999 126.258 -156.428 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 19.5 p -56.93 163.93 2.59 Favored Pre-proline 1 N--CA 1.542 4.149 0 CA-C-N 125.076 3.58 . . . . 33.590000000000003 103.288 168.473 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -66.84 159.93 49.19 Favored 'Trans proline' 0 CA--C 1.489 -1.749 0 O-C-N 123.967 1.509 . . . . 27.350000000000001 108.266 176.38 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 16.0 tt -62.44 -23.61 32.81 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.046 0 CA-C-N 114.464 -1.244 . . . . 13.59 112.163 174.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 78.1 p -53.79 -37.82 63.88 Favored 'General case' 0 C--O 1.247 0.969 0 O-C-N 118.847 -2.408 . . . . 20.390000000000001 114.858 172.31 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 -77.12 -38.81 51.38 Favored 'General case' 0 CA--C 1.489 -1.371 0 O-C-N 124.613 1.195 . . . . 41.0 110.93 179.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 93.5 t -59.29 -39.45 78.91 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.115 0 C-N-CA 117.823 -1.551 . . . . 14.17 108.865 174.648 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -60.24 -47.16 87.15 Favored 'General case' 0 N--CA 1.457 -0.104 0 CA-C-N 119.135 0.88 . . . . 13.31 110.297 -179.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.514 ' HG2' ' O ' ' A' ' 533' ' ' HOH . 62.0 mm-40 -62.75 -39.14 93.2 Favored 'General case' 0 C--O 1.246 0.872 0 CA-C-N 114.986 -1.006 . . . . 38.469999999999999 109.602 -173.173 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 58.1 m -77.3 -32.64 55.54 Favored 'General case' 0 C--O 1.255 1.372 0 N-CA-C 114.811 1.411 . . . . 24.91 114.811 -178.306 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.555 ' OE2' ' HE1' ' A' ' 90' ' ' HIS . 40.3 mm-40 -122.22 -7.11 8.81 Favored 'General case' 0 C--O 1.261 1.662 0 N-CA-C 115.104 1.52 . . . . 11.92 115.104 -159.873 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 60.1 pttt -63.23 149.48 45.39 Favored 'General case' 0 C--O 1.266 1.928 0 CA-C-O 123.593 1.663 . . . . 36.469999999999999 109.007 -170.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -67.89 159.47 30.43 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 113.254 -1.793 . . . . 10.279999999999999 109.599 175.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.473 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 67.9 tt0 -54.45 -33.57 59.85 Favored 'General case' 0 C--O 1.267 2.017 0 CA-C-N 112.459 -2.155 . . . . 29.109999999999999 112.716 169.598 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ASP . . . . . 0.566 ' OD2' ' HD2' ' A' ' 20' ' ' ARG . 49.1 p30 -73.47 -7.55 52.24 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 115.856 -2.338 . . . . 12.25 113.107 178.87 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 98.02 -12.16 63.96 Favored Glycine 0 C--N 1.351 1.411 0 N-CA-C 117.845 1.898 . . . . 10.359999999999999 117.845 -179.259 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 -87.17 153.24 21.66 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 117.796 -1.562 . . . . 9.3800000000000008 108.953 172.76 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 50.3 tp -96.54 119.55 35.23 Favored 'General case' 0 C--O 1.255 1.351 0 N-CA-C 106.357 -1.72 . . . . 9.5999999999999996 106.357 168.386 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 58.3 m-85 -96.47 134.33 39.78 Favored 'General case' 0 C--O 1.282 2.784 0 CA-C-N 113.702 -1.59 . . . . 8.6099999999999994 114.298 177.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 24.6 mtt -128.78 149.74 50.59 Favored 'General case' 0 C--O 1.248 1.026 0 CA-C-N 113.841 -1.527 . . . . 14.43 110.79 172.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 90.1 t -129.12 133.83 65.14 Favored 'Isoleucine or valine' 0 C--O 1.26 1.608 0 N-CA-C 105.774 -1.936 . . . . 14.33 105.774 -179.021 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 54.8 p90 -112.4 153.45 27.3 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 116.391 -2.124 . . . . 8.0600000000000005 110.045 178.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -159.37 164.28 34.83 Favored 'General case' 0 N--CA 1.485 1.278 0 CA-C-N 114.41 -1.268 . . . . 8.6899999999999995 109.037 -177.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 75.6 p -81.91 -3.74 54.91 Favored 'General case' 0 CA--C 1.573 1.861 0 CA-C-N 114.826 -1.079 . . . . 15.56 111.229 178.936 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -135.56 159.62 41.05 Favored 'General case' 0 N--CA 1.485 1.278 0 O-C-N 119.813 -1.805 . . . . 36.130000000000003 108.31 174.584 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -79.56 -30.31 41.64 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 117.761 2.504 . . . . 37.549999999999997 117.761 179.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 52.6 p -123.68 147.15 47.68 Favored 'General case' 0 C--O 1.246 0.871 0 N-CA-C 106.831 -1.544 . . . . 29.0 106.831 176.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' PHE . . . . . 0.984 ' CZ ' ' CD1' ' A' ' 86' ' ' LEU . 5.4 p90 . . . . . 0 C--O 1.252 1.186 0 O-C-N 125.591 1.807 . . . . 46.049999999999997 111.832 -170.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' SO4 . . . . . 0.546 ' O2 ' ' HD2' ' A' ' 31' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 508' ' ' HOH . . . . . 0.62 ' O ' ' HD2' ' A' ' 90' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 528' ' ' HOH . . . . . 0.655 ' O ' ' HD2' ' A' ' 28' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 533' ' ' HOH . . . . . 0.514 ' O ' ' HG2' ' A' ' 104' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 535' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 536' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 537' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 538' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 539' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 540' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 541' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 542' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 543' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 544' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 545' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 546' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 547' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 548' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 549' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 550' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 551' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 552' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 553' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 554' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 555' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 556' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 557' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 558' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 559' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 560' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 561' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 562' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 563' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 564' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 565' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 566' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 567' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 568' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 569' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 570' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 571' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 572' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 573' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 574' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 575' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 576' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 577' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 578' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 579' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 580' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 581' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 582' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 583' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 584' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 585' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 586' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 587' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 588' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 589' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 590' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 591' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 592' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 593' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 594' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 595' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 596' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 597' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 598' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 599' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 600' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 601' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 602' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 603' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 604' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 605' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 606' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 607' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 608' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_