data_5dcn_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 5dcn _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 ' -6' ' ' ASP . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.761 0.315 . . . . 96.79 111.622 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' -5' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -90.28 -10.94 42.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.263 -0.426 . . . . 107.35 110.828 -177.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' -4' ' ' TRP . . . . . . . . . . . . . 89.8 m95 -96.21 130.02 43.37 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.867 0.692 . . . . 66.78 112.867 -177.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' -3' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -86.81 111.66 20.96 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.199 -0.667 . . . . 87.56 109.199 170.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' -2' ' ' VAL . . . . . . . . . . . . . 8.1 t -87.67 110.83 21.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.791 0.329 . . . . 52.79 111.681 -176.76 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' -1' ' ' ILE . . . . . . . . . . . . . 41.0 mm -75.89 130.25 36.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.255 -0.43 . . . . 46.99 110.105 177.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -80.18 -52.41 4.58 Favored Glycine 0 C--N 1.332 0.313 0 N-CA-C 111.106 -0.798 . . . . 50.9 111.106 177.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 70.57 179.17 27.15 Favored Glycine 0 N--CA 1.451 -0.311 0 N-CA-C 114.687 0.635 . . . . 53.74 114.687 175.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -74.72 153.78 43.47 Favored 'Trans proline' 0 C--N 1.343 0.241 0 C-N-CA 123.329 2.686 . . . . 59.94 110.926 178.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 79.8 p -71.12 152.19 43.7 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.498 0.555 . . . . 76.8 112.498 -177.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -71.58 129.5 38.89 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.131 -0.486 . . . . 64.31 110.479 174.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -112.16 136.66 51.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.407 -0.36 . . . . 81.14 110.807 174.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 45.9 p -75.55 166.35 23.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.329 -0.396 . . . . 45.08 111.249 -179.17 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -57.88 -40.89 81.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.684 -0.689 . . . . 38.8 111.239 179.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -68.31 -25.6 65.21 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.358 0.503 . . . . 45.22 112.358 179.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -81.21 -23.45 38.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.779 0.324 . . . . 54.44 111.015 178.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 83.0 mtm-85 -90.19 -24.9 20.88 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 113.119 0.785 . . . . 73.58 113.119 -177.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 77.4 mtp85 -128.88 142.35 50.99 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.383 0.512 . . . . 82.5 112.383 179.606 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 19.2 p -68.41 156.92 36.89 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.276 -0.42 . . . . 47.03 110.28 179.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -55.99 -40.18 72.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.057 0.456 . . . . 44.66 109.82 177.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 68.5 tt0 -65.64 -40.17 92.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.634 -0.712 . . . . 58.47 111.965 179.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -62.39 -44.14 97.15 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.884 0.373 . . . . 65.55 111.055 176.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 18.2 mtm105 -67.39 -39.68 85.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.884 -0.598 . . . . 43.34 111.896 -177.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 25.5 t -59.9 -44.06 93.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 120.916 0.388 . . . . 48.44 110.239 175.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLU . . . . . 0.435 ' OE1' ' NH2' ' A' ' 21' ' ' ARG . 17.0 mm-40 -64.88 -43.52 92.65 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.497 0.555 . . . . 74.11 112.497 176.436 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -52.02 -53.87 36.68 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 122.976 0.51 . . . . 77.45 111.55 177.086 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 61.4 t -60.03 -45.55 95.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.387 -0.824 . . . . 39.32 111.481 177.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ARG . . . . . 0.435 ' NH2' ' OE1' ' A' ' 18' ' ' GLU . 4.9 ttp180 -53.14 -51.89 60.52 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.072 0.397 . . . . 51.66 112.072 -177.259 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.6 mt -61.99 -51.62 67.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.267 -0.424 . . . . 87.86 111.823 178.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 4.4 tp -65.78 -30.57 50.47 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 N-CA-C 113.132 0.79 . . . . 42.96 113.132 -173.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 2.8 mmp_? -77.54 -31.88 53.57 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 121.051 0.453 . . . . 76.37 111.146 -178.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -68.69 -36.32 78.35 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.716 -0.675 . . . . 83.41 110.173 174.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -84.04 -40.24 18.63 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.548 0.573 . . . . 84.94 112.548 -176.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' HIS . . . . . 0.475 ' ND1' ' O2 ' ' A' ' 203' ' ' SO4 . 70.2 m-70 -129.19 76.6 78.85 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.381 -0.372 . . . . 60.02 111.262 179.342 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -61.56 -22.23 73.97 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.986 2.458 . . . . 42.62 113.9 -175.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 43.2 p -93.44 6.54 47.83 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 113.169 0.803 . . . . 39.25 113.169 -178.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -109.98 149.4 30.01 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.701 0.286 . . . . 62.47 110.97 178.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 44.7 mm -105.93 124.3 36.47 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.22 -0.445 . . . . 43.82 110.159 177.663 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -74.42 107.39 2.44 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.465 2.11 . . . . 32.49 111.415 178.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 44.7 t -119.21 130.8 73.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 113.337 0.866 . . . . 35.08 113.337 -175.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 47.5 mm -98.77 121.06 48.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 N-CA-C 108.809 -0.812 . . . . 31.41 108.809 171.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 64.3 mt -119.11 119.35 60.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 120.694 0.283 . . . . 33.77 110.599 179.361 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -131.65 156.25 46.18 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.212 0.449 . . . . 39.29 112.212 -176.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 61.7 ttp180 -84.56 138.89 32.48 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.447 -0.575 . . . . 43.31 109.447 175.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -52.23 140.95 20.1 Favored 'General case' 0 C--N 1.33 -0.258 0 O-C-N 123.136 0.272 . . . . 74.2 110.83 176.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 11.1 ptpp? -60.24 -37.46 80.44 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 114.766 1.395 . . . . 71.67 114.766 -168.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -99.42 14.12 61.03 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 121.126 -0.559 . . . . 50.85 113.867 -178.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.1 tp10 -66.41 127.41 32.19 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.681 0.623 . . . . 49.01 112.681 -178.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 62.8 mmtt -120.95 5.52 10.41 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 113.224 0.824 . . . . 78.29 113.224 -176.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.8 tp60 -120.11 -30.06 4.75 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 114.288 1.218 . . . . 72.31 114.288 -175.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 90.3 mt -98.39 147.81 33.64 Favored Pre-proline 0 C--N 1.328 -0.354 0 N-CA-C 112.167 0.432 . . . . 42.05 112.167 -177.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -77.29 174.93 11.98 Favored 'Trans proline' 0 C--N 1.343 0.285 0 O-C-N 122.594 0.786 . . . . 50.59 111.28 -179.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 8.0 p -102.28 148.59 7.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 N-CA-C 109.804 -0.443 . . . . 43.24 109.804 179.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 64.2 mt -79.56 158.52 27.14 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.592 -0.521 . . . . 50.68 109.592 174.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 65.6 m-20 -84.61 -20.49 31.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.958 0.409 . . . . 56.32 111.241 -179.221 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 24.9 mmtp -118.13 166.98 11.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.951 -0.568 . . . . 85.48 109.915 177.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 87.5 m -122.05 -38.18 2.75 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.956 0.407 . . . . 61.4 110.204 176.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 45.8 mtpt -93.59 124.7 37.76 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.94 -0.573 . . . . 56.64 111.447 -178.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -123.19 142.6 50.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.054 -0.521 . . . . 53.34 111.754 -177.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 28.1 mt -108.05 112.39 24.93 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 108.419 -0.956 . . . . 46.65 108.419 171.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 53.3 t -109.39 125.64 30.96 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 115.976 -0.557 . . . . 34.45 110.608 -175.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -51.92 133.58 46.23 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.797 2.331 . . . . 43.64 110.821 175.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 53.2 p-10 -68.51 -11.54 60.0 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 116.099 1.888 . . . . 48.82 116.099 -169.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 42.2 p-80 -91.49 -17.82 25.12 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 113.547 0.943 . . . . 49.02 113.547 -174.388 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 3.8 m -68.71 156.33 7.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 C-N-CA 120.928 -0.309 . . . . 56.7 111.456 -177.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.7 p30 -102.4 173.78 6.2 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.54 -0.3 . . . . 45.15 111.804 174.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 78.8 mmm -64.08 -39.55 94.3 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.711 0.634 . . . . 51.04 112.711 -178.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 6.4 t -55.17 -45.22 75.73 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.904 0.383 . . . . 61.4 111.511 175.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 72.3 mt-10 -66.89 -38.81 86.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.939 -0.573 . . . . 49.89 111.416 179.206 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 28.5 tp -69.43 -44.29 71.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.381 -0.372 . . . . 34.9 111.778 179.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 65.3 mt -53.87 -46.59 64.08 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 116.321 -0.4 . . . . 43.38 111.258 176.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.46 -36.81 83.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.15 -0.477 . . . . 81.29 112.11 179.779 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 39.2 mt -62.83 -48.1 89.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.433 -0.349 . . . . 52.27 111.152 177.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 95.1 mt -60.76 -42.26 91.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.921 -0.581 . . . . 38.52 110.932 177.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ARG . . . . . 0.667 ' NH1' ' O ' ' A' ' 302' ' ' HOH . 15.9 ttt85 -59.87 -45.12 93.46 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.175 -0.466 . . . . 59.83 111.141 -178.965 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -65.72 -37.0 85.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.052 -0.522 . . . . 100.18 111.784 178.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ARG . . . . . 0.541 ' NE ' ' O ' ' A' ' 306' ' ' HOH . 70.8 mtt-85 -73.19 -24.51 60.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 63.81 111.617 179.172 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 64.8 mt -83.92 -6.13 59.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.102 -0.499 . . . . 44.57 109.977 172.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 55.62 50.03 15.27 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.827 -0.624 . . . . 87.61 112.254 -178.043 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 21.1 mt -105.12 152.68 22.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.611 -0.722 . . . . 75.31 109.058 174.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ASN . . . . . 0.657 ' O ' ' NE ' ' A' ' 68' ' ' ARG . 10.5 m-80 -69.81 -177.82 1.38 Allowed 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.497 -0.557 . . . . 83.66 109.497 171.801 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -86.31 2.78 46.06 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.298 -1.001 . . . . 82.14 108.298 168.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -86.87 -36.45 18.43 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 113.665 0.987 . . . . 61.02 113.665 179.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' GLN . . . . . 0.662 ' O ' ' NH2' ' A' ' 68' ' ' ARG . 1.1 mm-40 -66.1 142.01 57.93 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 113.237 0.829 . . . . 82.65 113.237 -172.233 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.55 129.99 43.1 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 108.812 -0.81 . . . . 39.68 108.812 176.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -153.57 124.07 7.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.928 0.394 . . . . 45.33 110.929 -175.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -129.19 144.95 51.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.793 -0.64 . . . . 44.51 109.676 178.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 32.9 tp -128.55 129.26 45.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.193 -0.458 . . . . 54.83 110.671 -177.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 32.5 mt -103.34 145.71 29.56 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.561 -0.533 . . . . 65.22 109.561 175.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 85.5 t -128.92 120.04 50.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 108.353 -0.98 . . . . 41.98 108.353 174.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 64.6 t30 55.56 36.61 27.52 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.126 0.489 . . . . 40.83 110.845 -175.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 74.41 3.05 64.9 Favored Glycine 0 N--CA 1.452 -0.267 0 CA-C-N 115.986 -0.552 . . . . 56.54 114.261 -179.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 33.1 m80 -100.24 145.3 28.24 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.053 0.39 . . . . 77.12 112.053 -176.186 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 74.7 m -51.5 139.08 20.88 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 107.907 -1.146 . . . . 90.44 107.907 170.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 36.8 tpp -50.19 127.32 16.73 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 113.155 0.798 . . . . 94.59 113.155 -174.374 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -69.42 177.14 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.984 -0.553 . . . . 83.57 110.971 178.318 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 42.5 t -52.05 120.71 5.69 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.529 -0.305 . . . . 83.13 110.676 176.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 34.2 m -62.11 -19.04 21.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 114.869 1.433 . . . . 73.12 114.869 -169.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 78.3 p -84.08 -3.27 57.95 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.089 0.403 . . . . 72.02 112.089 -179.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 25.7 m -69.44 124.88 91.42 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.463 -0.335 . . . . 57.05 110.24 177.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -68.21 138.36 42.99 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 120.61 0.874 . . . . 53.17 110.857 177.267 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 13.8 tt -60.13 -22.78 25.5 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 N-CA-C 112.988 0.736 . . . . 40.96 112.988 -174.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 22.8 t -59.61 -40.97 89.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.226 0.536 . . . . 72.53 109.729 175.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 72.4 tt0 -75.35 -37.21 60.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.649 -0.705 . . . . 73.59 111.977 179.259 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 94.9 t -65.15 -40.81 90.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.356 -0.383 . . . . 41.26 110.488 178.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 59.6 t80 -57.96 -48.71 79.15 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.929 -0.578 . . . . 44.78 111.119 -179.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -62.76 -29.67 70.86 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 114.044 1.127 . . . . 72.14 114.044 -176.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 87.9 p -99.25 -23.95 15.02 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 113.213 0.82 . . . . 55.78 113.213 -176.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -120.1 0.78 10.79 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 115.424 1.638 . . . . 68.06 115.424 -171.157 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 56.7 pttt -65.09 150.77 47.56 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 119.99 -0.684 . . . . 69.54 111.696 -179.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -73.51 171.16 13.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.767 -0.651 . . . . 44.13 109.563 179.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 9.9 tt0 -66.57 -25.27 66.55 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.926 -0.31 . . . . 74.33 110.362 177.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 42.3 p30 -79.22 -12.53 59.96 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 112.866 0.691 . . . . 40.53 112.866 179.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 104.71 -13.5 50.21 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 121.105 -0.569 . . . . 36.15 113.886 177.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -80.3 152.59 28.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.696 0.284 . . . . 38.39 110.693 176.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 49.9 tp -101.05 116.97 34.1 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 107.922 -1.14 . . . . 37.45 107.922 168.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -96.37 128.75 43.58 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 113.855 1.057 . . . . 37.63 113.855 -173.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' MET . . . . . . . . . . . . . 63.9 mtt -126.74 144.02 51.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.639 -0.71 . . . . 37.54 111.71 177.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 92.9 t -133.69 133.22 57.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 N-CA-C 108.749 -0.834 . . . . 31.0 108.749 179.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 54.0 p90 -115.62 148.36 39.72 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 112.777 0.658 . . . . 39.84 112.777 178.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -152.74 174.15 14.39 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.054 -0.521 . . . . 34.24 110.395 179.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 80.4 p -98.54 -7.68 27.86 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.01 0.433 . . . . 42.84 111.563 -179.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -124.16 155.31 38.69 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.386 -0.968 . . . . 86.27 108.386 174.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 21.5 pt-20 -84.51 -0.13 51.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.843 0.354 . . . . 83.16 111.712 -178.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' THR . . . . . 0.513 ' OG1' ' N ' ' A' ' 119' ' ' PHE . 2.5 p -78.0 -57.95 3.52 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.631 0.604 . . . . 103.21 112.631 -176.161 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' PHE . . . . . 0.513 ' N ' ' OG1' ' A' ' 118' ' ' THR . 23.9 m-85 . . . . . 0 N--CA 1.464 0.245 0 O-C-N 123.935 0.772 . . . . 110.17 109.949 -170.084 . . . . . . . . 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 . . . . . 0.475 ' O2 ' ' ND1' ' A' ' 27' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . 0.667 ' O ' ' NH1' ' A' ' 68' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 306' ' ' HOH . . . . . 0.541 ' O ' ' NE ' ' A' ' 70' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 347' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 348' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 349' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 350' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 351' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 352' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 353' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 354' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 355' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 356' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 357' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 358' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' -6' ' ' ASP . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.761 0.315 . . . . 96.790000000000006 111.622 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' -5' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -90.28 -10.94 42.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.263 -0.426 . . . . 107.34999999999999 110.828 -177.353 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' -4' ' ' TRP . . . . . . . . . . . . . 89.8 m95 -96.21 130.02 43.37 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.867 0.692 . . . . 66.780000000000001 112.867 -177.019 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' -3' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -86.81 111.66 20.96 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.199 -0.667 . . . . 87.560000000000002 109.199 170.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' -2' ' ' VAL . . . . . . . . . . . . . 8.1 t -87.67 110.83 21.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.791 0.329 . . . . 52.789999999999999 111.681 -176.76 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' -1' ' ' ILE . . . . . . . . . . . . . 41.0 mm -75.89 130.25 36.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.255 -0.43 . . . . 46.990000000000002 110.105 177.188 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -80.18 -52.41 4.58 Favored Glycine 0 C--N 1.332 0.313 0 N-CA-C 111.106 -0.798 . . . . 50.899999999999999 111.106 177.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 70.57 179.17 27.15 Favored Glycine 0 N--CA 1.451 -0.311 0 N-CA-C 114.687 0.635 . . . . 53.740000000000002 114.687 175.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -74.72 153.78 43.47 Favored 'Trans proline' 0 C--N 1.343 0.241 0 C-N-CA 123.329 2.686 . . . . 59.939999999999998 110.926 178.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 79.8 p -71.12 152.19 43.7 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.498 0.555 . . . . 76.799999999999997 112.498 -177.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -71.58 129.5 38.89 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.131 -0.486 . . . . 64.310000000000002 110.479 174.262 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -112.16 136.66 51.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.407 -0.36 . . . . 81.140000000000001 110.807 174.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 45.9 p -75.55 166.35 23.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.329 -0.396 . . . . 45.079999999999998 111.249 -179.17 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -57.88 -40.89 81.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.684 -0.689 . . . . 38.799999999999997 111.239 179.088 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -68.31 -25.6 65.21 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.358 0.503 . . . . 45.219999999999999 112.358 179.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -81.21 -23.45 38.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.779 0.324 . . . . 54.439999999999998 111.015 178.132 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 83.0 mtm-85 -90.19 -24.9 20.88 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 113.119 0.785 . . . . 73.579999999999998 113.119 -177.064 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 77.4 mtp85 -128.88 142.35 50.99 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.383 0.512 . . . . 82.5 112.383 179.606 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 19.2 p -68.41 156.92 36.89 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.276 -0.42 . . . . 47.030000000000001 110.28 179.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -55.99 -40.18 72.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.057 0.456 . . . . 44.659999999999997 109.82 177.202 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 68.5 tt0 -65.64 -40.17 92.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.634 -0.712 . . . . 58.469999999999999 111.965 179.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -62.39 -44.14 97.15 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.884 0.373 . . . . 65.549999999999997 111.055 176.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 18.2 mtm105 -67.39 -39.68 85.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.884 -0.598 . . . . 43.340000000000003 111.896 -177.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 25.5 t -59.9 -44.06 93.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 120.916 0.388 . . . . 48.439999999999998 110.239 175.567 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLU . . . . . 0.435 ' OE1' ' NH2' ' A' ' 21' ' ' ARG . 17.0 mm-40 -64.88 -43.52 92.65 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.497 0.555 . . . . 74.109999999999999 112.497 176.436 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -52.02 -53.87 36.68 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 122.976 0.51 . . . . 77.450000000000003 111.55 177.086 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 61.4 t -60.03 -45.55 95.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.387 -0.824 . . . . 39.32 111.481 177.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ARG . . . . . 0.435 ' NH2' ' OE1' ' A' ' 18' ' ' GLU . 4.9 ttp180 -53.14 -51.89 60.52 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.072 0.397 . . . . 53.780000000000001 112.072 -177.259 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.6 mt -61.99 -51.62 67.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.267 -0.424 . . . . 87.859999999999999 111.823 178.33 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 4.4 tp -65.78 -30.57 50.47 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 N-CA-C 113.132 0.79 . . . . 42.960000000000001 113.132 -173.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 2.8 mmp_? -77.54 -31.88 53.57 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 121.051 0.453 . . . . 76.370000000000005 111.146 -178.365 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -68.69 -36.32 78.35 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.716 -0.675 . . . . 83.409999999999997 110.173 174.446 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -84.04 -40.24 18.63 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.548 0.573 . . . . 84.939999999999998 112.548 -176.356 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' HIS . . . . . 0.475 ' ND1' ' O2 ' ' A' ' 203' ' ' SO4 . 70.2 m-70 -129.19 76.6 78.85 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.381 -0.372 . . . . 60.020000000000003 111.262 179.342 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -61.56 -22.23 73.97 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.986 2.458 . . . . 42.619999999999997 113.9 -175.334 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 43.2 p -93.44 6.54 47.83 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 113.169 0.803 . . . . 39.25 113.169 -178.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -109.98 149.4 30.01 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.701 0.286 . . . . 62.469999999999999 110.97 178.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 44.7 mm -105.93 124.3 36.47 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.22 -0.445 . . . . 43.82 110.159 177.663 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -74.42 107.39 2.44 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.465 2.11 . . . . 32.490000000000002 111.415 178.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 44.7 t -119.21 130.8 73.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 113.337 0.866 . . . . 35.079999999999998 113.337 -175.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 47.5 mm -98.77 121.06 48.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 N-CA-C 108.809 -0.812 . . . . 31.41 108.809 171.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 64.3 mt -119.11 119.35 60.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 120.694 0.283 . . . . 33.770000000000003 110.599 179.361 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -131.65 156.25 46.18 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.212 0.449 . . . . 39.289999999999999 112.212 -176.789 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 61.7 ttp180 -84.56 138.89 32.48 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.447 -0.575 . . . . 43.310000000000002 109.447 175.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -52.23 140.95 20.1 Favored 'General case' 0 C--N 1.33 -0.258 0 O-C-N 123.136 0.272 . . . . 74.200000000000003 110.83 176.613 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 11.1 ptpp? -60.24 -37.46 80.44 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 114.766 1.395 . . . . 71.670000000000002 114.766 -168.286 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -99.42 14.12 61.03 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 121.126 -0.559 . . . . 50.850000000000001 113.867 -178.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.1 tp10 -66.41 127.41 32.19 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.681 0.623 . . . . 49.009999999999998 112.681 -178.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 62.8 mmtt -120.95 5.52 10.41 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 113.224 0.824 . . . . 78.290000000000006 113.224 -176.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.8 tp60 -120.11 -30.06 4.75 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 114.288 1.218 . . . . 72.310000000000002 114.288 -175.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 90.3 mt -98.39 147.81 33.64 Favored Pre-proline 0 C--N 1.328 -0.354 0 N-CA-C 112.167 0.432 . . . . 42.049999999999997 112.167 -177.072 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' PRO . . . . . 0.424 ' HG2' HD22 ' A' ' 71' ' ' LEU . 98.8 Cg_endo -77.29 174.93 11.98 Favored 'Trans proline' 0 C--N 1.343 0.285 0 O-C-N 122.594 0.786 . . . . 50.590000000000003 111.28 -179.682 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 8.0 p -102.28 148.59 7.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 N-CA-C 109.804 -0.443 . . . . 43.240000000000002 109.804 179.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 64.2 mt -79.56 158.52 27.14 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.592 -0.521 . . . . 50.68 109.592 174.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 65.6 m-20 -84.61 -20.49 31.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.958 0.409 . . . . 56.32 111.241 -179.221 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 24.9 mmtp -118.13 166.98 11.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.951 -0.568 . . . . 85.480000000000004 109.915 177.481 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 87.5 m -122.05 -38.18 2.75 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.956 0.407 . . . . 61.399999999999999 110.204 176.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 45.8 mtpt -93.59 124.7 37.76 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.94 -0.573 . . . . 56.640000000000001 111.447 -178.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -123.19 142.6 50.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.054 -0.521 . . . . 53.340000000000003 111.754 -177.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 28.1 mt -108.05 112.39 24.93 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 108.419 -0.956 . . . . 46.649999999999999 108.419 171.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 53.3 t -109.39 125.64 30.96 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 115.976 -0.557 . . . . 34.450000000000003 110.608 -175.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -51.92 133.58 46.23 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.797 2.331 . . . . 43.640000000000001 110.821 175.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 53.2 p-10 -68.51 -11.54 60.0 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 116.099 1.888 . . . . 48.82 116.099 -169.3 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 42.2 p-80 -91.49 -17.82 25.12 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 113.547 0.943 . . . . 49.020000000000003 113.547 -174.388 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 3.8 m -68.71 156.33 7.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 C-N-CA 120.928 -0.309 . . . . 56.700000000000003 111.456 -177.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.7 p30 -102.4 173.78 6.2 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.54 -0.3 . . . . 45.149999999999999 111.804 174.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 78.8 mmm -64.08 -39.55 94.3 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.711 0.634 . . . . 51.039999999999999 112.711 -178.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' SER . . . . . 0.465 ' HB2' ' HB ' ' A' ' 91' ' ' VAL . 6.4 t -55.17 -45.22 75.73 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.904 0.383 . . . . 61.399999999999999 111.511 175.666 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 72.3 mt-10 -66.89 -38.81 86.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.939 -0.573 . . . . 49.890000000000001 111.416 179.206 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 28.5 tp -69.43 -44.29 71.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.381 -0.372 . . . . 34.899999999999999 111.778 179.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 65.3 mt -53.87 -46.59 64.08 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 116.321 -0.4 . . . . 43.380000000000003 111.258 176.75 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.46 -36.81 83.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.15 -0.477 . . . . 81.290000000000006 112.11 179.779 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 39.2 mt -62.83 -48.1 89.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.433 -0.349 . . . . 52.270000000000003 111.152 177.825 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 95.1 mt -60.76 -42.26 91.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.921 -0.581 . . . . 38.520000000000003 110.932 177.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ARG . . . . . 0.667 ' NH1' ' O ' ' A' ' 302' ' ' HOH . 15.9 ttt85 -59.87 -45.12 93.46 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.175 -0.466 . . . . 59.829999999999998 111.141 -178.965 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -65.72 -37.0 85.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.052 -0.522 . . . . 100.18000000000001 111.784 178.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 70.8 mtt-85 -73.19 -24.51 60.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 63.810000000000002 111.617 179.172 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' LEU . . . . . 0.424 HD22 ' HG2' ' A' ' 45' ' ' PRO . 64.8 mt -83.92 -6.13 59.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.102 -0.499 . . . . 44.57 109.977 172.884 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 55.62 50.03 15.27 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.827 -0.624 . . . . 87.609999999999999 112.254 -178.043 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 21.1 mt -105.12 152.68 22.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.611 -0.722 . . . . 75.310000000000002 109.058 174.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ASN . . . . . 0.53 ' O ' ' NE ' ' A' ' 68' ' ' ARG . 10.5 m-80 -69.81 -177.82 1.38 Allowed 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.497 -0.557 . . . . 83.659999999999997 109.497 171.801 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -86.31 2.78 46.06 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.298 -1.001 . . . . 82.140000000000001 108.298 168.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -86.87 -36.45 18.43 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 113.665 0.987 . . . . 61.020000000000003 113.665 179.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' GLN . . . . . 0.662 ' O ' ' NH2' ' A' ' 68' ' ' ARG . 1.1 mm-40 -66.1 142.01 57.93 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 113.237 0.829 . . . . 82.650000000000006 113.237 -172.233 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.55 129.99 43.1 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 108.812 -0.81 . . . . 39.68 108.812 176.027 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -153.57 124.07 7.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.928 0.394 . . . . 45.329999999999998 110.929 -175.143 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' PHE . . . . . 0.459 ' CE2' ' HB3' ' A' ' 117' ' ' GLU . 92.9 m-85 -129.19 144.95 51.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.793 -0.64 . . . . 44.509999999999998 109.676 178.761 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 32.9 tp -128.55 129.26 45.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.193 -0.458 . . . . 54.829999999999998 110.671 -177.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 32.5 mt -103.34 145.71 29.56 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.561 -0.533 . . . . 65.219999999999999 109.561 175.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' VAL . . . . . 0.53 HG22 ' HG2' ' A' ' 111' ' ' MET . 85.5 t -128.92 120.04 50.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 108.353 -0.98 . . . . 41.979999999999997 108.353 174.289 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 64.6 t30 55.56 36.61 27.52 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.126 0.489 . . . . 40.829999999999998 110.845 -175.282 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 74.41 3.05 64.9 Favored Glycine 0 N--CA 1.452 -0.267 0 CA-C-N 115.986 -0.552 . . . . 56.539999999999999 114.261 -179.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 33.1 m80 -100.24 145.3 28.24 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.053 0.39 . . . . 77.120000000000005 112.053 -176.186 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 74.7 m -51.5 139.08 20.88 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 107.907 -1.146 . . . . 90.439999999999998 107.907 170.101 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 36.8 tpp -50.19 127.32 16.73 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 113.155 0.798 . . . . 94.590000000000003 113.155 -174.374 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -69.42 177.14 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.984 -0.553 . . . . 83.569999999999993 110.971 178.318 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 42.5 t -52.05 120.71 5.69 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.529 -0.305 . . . . 83.129999999999995 110.676 176.825 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' VAL . . . . . 0.465 ' HB ' ' HB2' ' A' ' 61' ' ' SER . 34.2 m -62.11 -19.04 21.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 114.869 1.433 . . . . 73.120000000000005 114.869 -169.601 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 78.3 p -84.08 -3.27 57.95 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.089 0.403 . . . . 72.019999999999996 112.089 -179.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 25.7 m -69.44 124.88 91.42 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.463 -0.335 . . . . 57.049999999999997 110.24 177.633 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -68.21 138.36 42.99 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 120.61 0.874 . . . . 53.170000000000002 110.857 177.267 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 13.8 tt -60.13 -22.78 25.5 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 N-CA-C 112.988 0.736 . . . . 40.960000000000001 112.988 -174.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 22.8 t -59.61 -40.97 89.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.226 0.536 . . . . 72.530000000000001 109.729 175.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 72.4 tt0 -75.35 -37.21 60.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.649 -0.705 . . . . 73.590000000000003 111.977 179.259 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 94.9 t -65.15 -40.81 90.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.356 -0.383 . . . . 41.259999999999998 110.488 178.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 59.6 t80 -57.96 -48.71 79.15 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.929 -0.578 . . . . 44.780000000000001 111.119 -179.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -62.76 -29.67 70.86 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 114.044 1.127 . . . . 72.140000000000001 114.044 -176.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 87.9 p -99.25 -23.95 15.02 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 113.213 0.82 . . . . 55.780000000000001 113.213 -176.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -120.1 0.78 10.79 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 115.424 1.638 . . . . 68.060000000000002 115.424 -171.157 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 56.7 pttt -65.09 150.77 47.56 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 119.99 -0.684 . . . . 69.540000000000006 111.696 -179.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -73.51 171.16 13.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.767 -0.651 . . . . 44.130000000000003 109.563 179.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 9.9 tt0 -66.57 -25.27 66.55 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.926 -0.31 . . . . 74.329999999999998 110.362 177.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 42.3 p30 -79.22 -12.53 59.96 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 112.866 0.691 . . . . 40.530000000000001 112.866 179.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 104.71 -13.5 50.21 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 121.105 -0.569 . . . . 36.149999999999999 113.886 177.3 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -80.3 152.59 28.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.696 0.284 . . . . 38.390000000000001 110.693 176.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 49.9 tp -101.05 116.97 34.1 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 107.922 -1.14 . . . . 37.450000000000003 107.922 168.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -96.37 128.75 43.58 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 113.855 1.057 . . . . 37.630000000000003 113.855 -173.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' MET . . . . . 0.53 ' HG2' HG22 ' A' ' 83' ' ' VAL . 63.9 mtt -126.74 144.02 51.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.639 -0.71 . . . . 37.539999999999999 111.71 177.071 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 92.9 t -133.69 133.22 57.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 N-CA-C 108.749 -0.834 . . . . 31.0 108.749 179.821 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 54.0 p90 -115.62 148.36 39.72 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 112.777 0.658 . . . . 39.840000000000003 112.777 178.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -152.74 174.15 14.39 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.054 -0.521 . . . . 34.240000000000002 110.395 179.824 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 80.4 p -98.54 -7.68 27.86 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.01 0.433 . . . . 42.840000000000003 111.563 -179.228 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -124.16 155.31 38.69 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.386 -0.968 . . . . 86.269999999999996 108.386 174.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' GLU . . . . . 0.459 ' HB3' ' CE2' ' A' ' 80' ' ' PHE . 21.5 pt-20 -84.51 -0.13 51.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.843 0.354 . . . . 83.159999999999997 111.712 -178.49 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 118' ' ' THR . . . . . 0.513 ' OG1' ' N ' ' A' ' 119' ' ' PHE . 2.5 p -78.0 -57.95 3.52 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.631 0.604 . . . . 103.20999999999999 112.631 -176.161 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 119' ' ' PHE . . . . . 0.513 ' N ' ' OG1' ' A' ' 118' ' ' THR . 23.9 m-85 . . . . . 0 N--CA 1.464 0.245 0 O-C-N 123.935 0.772 . . . . 110.17 109.949 -170.084 . . . . . . . . 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 . . . . . 0.475 ' O2 ' ' ND1' ' A' ' 27' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 204' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . 0.667 ' O ' ' NH1' ' A' ' 68' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 347' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 348' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 349' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 350' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 351' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 352' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 353' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 354' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 355' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 356' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 357' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 358' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' -6' ' ' ASP . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.761 0.315 . . . . 96.790000000000006 111.622 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' -5' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -90.28 -10.94 42.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.263 -0.426 . . . . 107.34999999999999 110.828 -177.353 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' -4' ' ' TRP . . . . . . . . . . . . . 89.8 m95 -96.21 130.02 43.37 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.867 0.692 . . . . 66.780000000000001 112.867 -177.019 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' -3' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -86.81 111.66 20.96 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.199 -0.667 . . . . 87.560000000000002 109.199 170.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' -2' ' ' VAL . . . . . . . . . . . . . 8.1 t -87.67 110.83 21.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.791 0.329 . . . . 52.789999999999999 111.681 -176.76 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' -1' ' ' ILE . . . . . . . . . . . . . 41.0 mm -75.89 130.25 36.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.255 -0.43 . . . . 46.990000000000002 110.105 177.188 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -80.18 -52.41 4.58 Favored Glycine 0 C--N 1.332 0.313 0 N-CA-C 111.106 -0.798 . . . . 50.899999999999999 111.106 177.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 70.57 179.17 27.15 Favored Glycine 0 N--CA 1.451 -0.311 0 N-CA-C 114.687 0.635 . . . . 53.740000000000002 114.687 175.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -74.72 153.78 43.47 Favored 'Trans proline' 0 C--N 1.343 0.241 0 C-N-CA 123.329 2.686 . . . . 59.939999999999998 110.926 178.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 79.8 p -71.12 152.19 43.7 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.498 0.555 . . . . 76.799999999999997 112.498 -177.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -71.58 129.5 38.89 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.131 -0.486 . . . . 64.310000000000002 110.479 174.262 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -112.16 136.66 51.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.407 -0.36 . . . . 81.140000000000001 110.807 174.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 45.9 p -75.55 166.35 23.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.329 -0.396 . . . . 45.079999999999998 111.249 -179.17 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -57.88 -40.89 81.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.684 -0.689 . . . . 38.799999999999997 111.239 179.088 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -68.31 -25.6 65.21 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.358 0.503 . . . . 45.219999999999999 112.358 179.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -81.21 -23.45 38.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.779 0.324 . . . . 54.439999999999998 111.015 178.132 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 83.0 mtm-85 -90.19 -24.9 20.88 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 113.119 0.785 . . . . 73.579999999999998 113.119 -177.064 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 77.4 mtp85 -128.88 142.35 50.99 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.383 0.512 . . . . 82.5 112.383 179.606 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 19.2 p -68.41 156.92 36.89 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.276 -0.42 . . . . 47.030000000000001 110.28 179.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -55.99 -40.18 72.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.057 0.456 . . . . 44.659999999999997 109.82 177.202 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 68.5 tt0 -65.64 -40.17 92.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.634 -0.712 . . . . 58.469999999999999 111.965 179.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -62.39 -44.14 97.15 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.884 0.373 . . . . 65.549999999999997 111.055 176.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 18.2 mtm105 -67.39 -39.68 85.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.884 -0.598 . . . . 43.340000000000003 111.896 -177.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 25.5 t -59.9 -44.06 93.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 120.916 0.388 . . . . 48.439999999999998 110.239 175.567 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.435 ' OE1' ' NH2' ' A' ' 21' ' ' ARG . 17.0 mm-40 -64.88 -43.52 92.65 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.497 0.555 . . . . 74.109999999999999 112.497 176.436 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -52.02 -53.87 36.68 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 122.976 0.51 . . . . 77.450000000000003 111.55 177.086 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 61.4 t -60.03 -45.55 95.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.387 -0.824 . . . . 39.32 111.481 177.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.435 ' NH2' ' OE1' ' A' ' 18' ' ' GLU . 4.9 ttp180 -53.14 -51.89 60.52 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.072 0.397 . . . . 53.780000000000001 112.072 -177.259 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.6 mt -61.99 -51.62 67.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.267 -0.424 . . . . 87.859999999999999 111.823 178.33 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 4.4 tp -65.78 -30.57 50.47 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 N-CA-C 113.132 0.79 . . . . 42.960000000000001 113.132 -173.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 2.8 mmp_? -77.54 -31.88 53.57 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 121.051 0.453 . . . . 76.370000000000005 111.146 -178.365 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -68.69 -36.32 78.35 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.716 -0.675 . . . . 83.409999999999997 110.173 174.446 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -84.04 -40.24 18.63 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.548 0.573 . . . . 84.939999999999998 112.548 -176.356 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' HIS . . . . . 0.475 ' ND1' ' O2 ' ' A' ' 203' ' ' SO4 . 70.2 m-70 -129.19 76.6 78.85 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.381 -0.372 . . . . 60.020000000000003 111.262 179.342 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -61.56 -22.23 73.97 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.986 2.458 . . . . 42.619999999999997 113.9 -175.334 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 43.2 p -93.44 6.54 47.83 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 113.169 0.803 . . . . 39.25 113.169 -178.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -109.98 149.4 30.01 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.701 0.286 . . . . 62.469999999999999 110.97 178.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 44.7 mm -105.93 124.3 36.47 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.22 -0.445 . . . . 43.82 110.159 177.663 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -74.42 107.39 2.44 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.465 2.11 . . . . 32.490000000000002 111.415 178.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 44.7 t -119.21 130.8 73.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 113.337 0.866 . . . . 35.079999999999998 113.337 -175.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 47.5 mm -98.77 121.06 48.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 N-CA-C 108.809 -0.812 . . . . 31.41 108.809 171.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 64.3 mt -119.11 119.35 60.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 120.694 0.283 . . . . 33.770000000000003 110.599 179.361 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -131.65 156.25 46.18 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.212 0.449 . . . . 39.289999999999999 112.212 -176.789 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 61.7 ttp180 -84.56 138.89 32.48 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.447 -0.575 . . . . 43.310000000000002 109.447 175.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -52.23 140.95 20.1 Favored 'General case' 0 C--N 1.33 -0.258 0 O-C-N 123.136 0.272 . . . . 74.200000000000003 110.83 176.613 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 11.1 ptpp? -60.24 -37.46 80.44 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 114.766 1.395 . . . . 71.670000000000002 114.766 -168.286 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -99.42 14.12 61.03 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 121.126 -0.559 . . . . 50.850000000000001 113.867 -178.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.1 tp10 -66.41 127.41 32.19 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.681 0.623 . . . . 49.009999999999998 112.681 -178.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 62.8 mmtt -120.95 5.52 10.41 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 113.224 0.824 . . . . 78.290000000000006 113.224 -176.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.8 tp60 -120.11 -30.06 4.75 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 114.288 1.218 . . . . 72.310000000000002 114.288 -175.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 90.3 mt -98.39 147.81 33.64 Favored Pre-proline 0 C--N 1.328 -0.354 0 N-CA-C 112.167 0.432 . . . . 42.049999999999997 112.167 -177.072 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.424 ' HG2' HD22 ' A' ' 71' ' ' LEU . 98.8 Cg_endo -77.29 174.93 11.98 Favored 'Trans proline' 0 C--N 1.343 0.285 0 O-C-N 122.594 0.786 . . . . 50.590000000000003 111.28 -179.682 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 8.0 p -102.28 148.59 7.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 N-CA-C 109.804 -0.443 . . . . 43.240000000000002 109.804 179.432 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 64.2 mt -79.56 158.52 27.14 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.592 -0.521 . . . . 50.68 109.592 174.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 65.6 m-20 -84.61 -20.49 31.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.958 0.409 . . . . 56.32 111.241 -179.221 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 24.9 mmtp -118.13 166.98 11.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.951 -0.568 . . . . 85.480000000000004 109.915 177.481 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 87.5 m -122.05 -38.18 2.75 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.956 0.407 . . . . 61.399999999999999 110.204 176.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 45.8 mtpt -93.59 124.7 37.76 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.94 -0.573 . . . . 56.640000000000001 111.447 -178.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -123.19 142.6 50.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.054 -0.521 . . . . 53.340000000000003 111.754 -177.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 28.1 mt -108.05 112.39 24.93 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 108.419 -0.956 . . . . 46.649999999999999 108.419 171.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 53.3 t -109.39 125.64 30.96 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 115.976 -0.557 . . . . 34.450000000000003 110.608 -175.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -51.92 133.58 46.23 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.797 2.331 . . . . 43.640000000000001 110.821 175.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 53.2 p-10 -68.51 -11.54 60.0 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 116.099 1.888 . . . . 48.82 116.099 -169.3 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 42.2 p-80 -91.49 -17.82 25.12 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 113.547 0.943 . . . . 49.020000000000003 113.547 -174.388 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 3.8 m -68.71 156.33 7.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 C-N-CA 120.928 -0.309 . . . . 56.700000000000003 111.456 -177.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.7 p30 -102.4 173.78 6.2 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.54 -0.3 . . . . 45.149999999999999 111.804 174.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 78.8 mmm -64.08 -39.55 94.3 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.711 0.634 . . . . 51.039999999999999 112.711 -178.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' SER . . . . . 0.465 ' HB2' ' HB ' ' A' ' 91' ' ' VAL . 6.4 t -55.17 -45.22 75.73 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.904 0.383 . . . . 61.399999999999999 111.511 175.666 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 72.3 mt-10 -66.89 -38.81 86.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.939 -0.573 . . . . 49.890000000000001 111.416 179.206 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 28.5 tp -69.43 -44.29 71.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.381 -0.372 . . . . 34.899999999999999 111.778 179.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 65.3 mt -53.87 -46.59 64.08 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 116.321 -0.4 . . . . 43.380000000000003 111.258 176.75 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.46 -36.81 83.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.15 -0.477 . . . . 81.290000000000006 112.11 179.779 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 39.2 mt -62.83 -48.1 89.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.433 -0.349 . . . . 52.270000000000003 111.152 177.825 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 95.1 mt -60.76 -42.26 91.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.921 -0.581 . . . . 38.520000000000003 110.932 177.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.667 ' NH1' ' O ' ' A' ' 302' ' ' HOH . 15.9 ttt85 -59.87 -45.12 93.46 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.175 -0.466 . . . . 59.829999999999998 111.141 -178.965 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -65.72 -37.0 85.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.052 -0.522 . . . . 100.18000000000001 111.784 178.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 70.8 mtt-85 -73.19 -24.51 60.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 63.810000000000002 111.617 179.172 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.424 HD22 ' HG2' ' A' ' 45' ' ' PRO . 64.8 mt -83.92 -6.13 59.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.102 -0.499 . . . . 44.57 109.977 172.884 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 55.62 50.03 15.27 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.827 -0.624 . . . . 87.609999999999999 112.254 -178.043 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 21.1 mt -105.12 152.68 22.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.611 -0.722 . . . . 75.310000000000002 109.058 174.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.53 ' O ' ' NE ' ' A' ' 68' ' ' ARG . 10.5 m-80 -69.81 -177.82 1.38 Allowed 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.497 -0.557 . . . . 83.659999999999997 109.497 171.801 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -86.31 2.78 46.06 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.298 -1.001 . . . . 82.140000000000001 108.298 168.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -86.87 -36.45 18.43 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 113.665 0.987 . . . . 61.020000000000003 113.665 179.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.662 ' O ' ' NH2' ' A' ' 68' ' ' ARG . 1.1 mm-40 -66.1 142.01 57.93 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 113.237 0.829 . . . . 82.650000000000006 113.237 -172.233 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.55 129.99 43.1 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 108.812 -0.81 . . . . 39.68 108.812 176.027 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -153.57 124.07 7.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.928 0.394 . . . . 45.329999999999998 110.929 -175.143 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' PHE . . . . . 0.459 ' CE2' ' HB3' ' A' ' 117' ' ' GLU . 92.9 m-85 -129.19 144.95 51.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.793 -0.64 . . . . 44.509999999999998 109.676 178.761 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 32.9 tp -128.55 129.26 45.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.193 -0.458 . . . . 54.829999999999998 110.671 -177.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 32.5 mt -103.34 145.71 29.56 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.561 -0.533 . . . . 65.219999999999999 109.561 175.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.53 HG22 ' HG2' ' A' ' 111' ' ' MET . 85.5 t -128.92 120.04 50.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 108.353 -0.98 . . . . 41.979999999999997 108.353 174.289 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 64.6 t30 55.56 36.61 27.52 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.126 0.489 . . . . 40.829999999999998 110.845 -175.282 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 74.41 3.05 64.9 Favored Glycine 0 N--CA 1.452 -0.267 0 CA-C-N 115.986 -0.552 . . . . 56.539999999999999 114.261 -179.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 33.1 m80 -100.24 145.3 28.24 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.053 0.39 . . . . 77.120000000000005 112.053 -176.186 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 74.7 m -51.5 139.08 20.88 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 107.907 -1.146 . . . . 90.439999999999998 107.907 170.101 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 36.8 tpp -50.19 127.32 16.73 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 113.155 0.798 . . . . 94.590000000000003 113.155 -174.374 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -69.42 177.14 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.984 -0.553 . . . . 83.569999999999993 110.971 178.318 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 42.5 t -52.05 120.71 5.69 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.529 -0.305 . . . . 83.129999999999995 110.676 176.825 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.465 ' HB ' ' HB2' ' A' ' 61' ' ' SER . 34.2 m -62.11 -19.04 21.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 114.869 1.433 . . . . 73.120000000000005 114.869 -169.601 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 78.3 p -84.08 -3.27 57.95 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.089 0.403 . . . . 72.019999999999996 112.089 -179.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 25.7 m -69.44 124.88 91.42 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.463 -0.335 . . . . 57.049999999999997 110.24 177.633 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -68.21 138.36 42.99 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 120.61 0.874 . . . . 53.170000000000002 110.857 177.267 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 13.8 tt -60.13 -22.78 25.5 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 N-CA-C 112.988 0.736 . . . . 40.960000000000001 112.988 -174.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 22.8 t -59.61 -40.97 89.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.226 0.536 . . . . 72.530000000000001 109.729 175.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 72.4 tt0 -75.35 -37.21 60.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.649 -0.705 . . . . 73.590000000000003 111.977 179.259 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 94.9 t -65.15 -40.81 90.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.356 -0.383 . . . . 41.259999999999998 110.488 178.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 59.6 t80 -57.96 -48.71 79.15 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.929 -0.578 . . . . 44.780000000000001 111.119 -179.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -62.76 -29.67 70.86 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 114.044 1.127 . . . . 72.140000000000001 114.044 -176.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 87.9 p -99.25 -23.95 15.02 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 113.213 0.82 . . . . 55.780000000000001 113.213 -176.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -120.1 0.78 10.79 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 115.424 1.638 . . . . 68.060000000000002 115.424 -171.157 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 56.7 pttt -65.09 150.77 47.56 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 119.99 -0.684 . . . . 69.540000000000006 111.696 -179.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -73.51 171.16 13.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.767 -0.651 . . . . 44.130000000000003 109.563 179.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 9.9 tt0 -66.57 -25.27 66.55 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.926 -0.31 . . . . 74.329999999999998 110.362 177.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 42.3 p30 -79.22 -12.53 59.96 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 112.866 0.691 . . . . 40.530000000000001 112.866 179.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 104.71 -13.5 50.21 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 121.105 -0.569 . . . . 36.149999999999999 113.886 177.3 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -80.3 152.59 28.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.696 0.284 . . . . 38.390000000000001 110.693 176.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 49.9 tp -101.05 116.97 34.1 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 107.922 -1.14 . . . . 37.450000000000003 107.922 168.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -96.37 128.75 43.58 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 113.855 1.057 . . . . 37.630000000000003 113.855 -173.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' MET . . . . . 0.53 ' HG2' HG22 ' A' ' 83' ' ' VAL . 63.9 mtt -126.74 144.02 51.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.639 -0.71 . . . . 37.539999999999999 111.71 177.071 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 92.9 t -133.69 133.22 57.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 N-CA-C 108.749 -0.834 . . . . 31.0 108.749 179.821 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 54.0 p90 -115.62 148.36 39.72 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 112.777 0.658 . . . . 39.840000000000003 112.777 178.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -152.74 174.15 14.39 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.054 -0.521 . . . . 34.240000000000002 110.395 179.824 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 80.4 p -98.54 -7.68 27.86 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.01 0.433 . . . . 42.840000000000003 111.563 -179.228 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -124.16 155.31 38.69 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.386 -0.968 . . . . 86.269999999999996 108.386 174.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' GLU . . . . . 0.459 ' HB3' ' CE2' ' A' ' 80' ' ' PHE . 21.5 pt-20 -84.51 -0.13 51.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.843 0.354 . . . . 83.159999999999997 111.712 -178.49 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' THR . . . . . 0.513 ' OG1' ' N ' ' A' ' 119' ' ' PHE . 2.5 p -78.0 -57.95 3.52 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.631 0.604 . . . . 103.20999999999999 112.631 -176.161 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' PHE . . . . . 0.513 ' N ' ' OG1' ' A' ' 118' ' ' THR . 23.9 m-85 . . . . . 0 N--CA 1.464 0.245 0 O-C-N 123.935 0.772 . . . . 110.17 109.949 -170.084 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' SO4 . . . . . 0.475 ' O2 ' ' ND1' ' A' ' 27' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . 0.667 ' O ' ' NH1' ' A' ' 68' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 347' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 348' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 349' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 350' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 351' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 352' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 353' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 354' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 355' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 356' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 357' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 358' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_