data_6lty_residue ############################ # Computer software used # ############################ 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 6lty _Structure_validation_residue.Date_analyzed 2020-07-10 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 ' 36' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.519 3.001 0 N-CA-C 107.601 -1.259 . . . . 139.87 107.601 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.4 tp -64.04 -157.08 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.895 0 C-N-CA 127.151 2.18 . . . . 161.31 110.661 -165.345 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -170.85 17.36 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.231 0 N-CA-C 115.152 1.538 . . . . 154.38 115.152 172.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 2.6 m170 -126.13 -124.25 0.24 Allowed 'General case' 0 N--CA 1.493 1.694 0 CA-C-N 121.519 1.963 . . . . 202.91 110.662 -164.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 71.7 mmt-85 -67.13 147.24 53.37 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 125.042 1.464 . . . . 192.39 109.714 -170.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 66.3 mt -58.88 -52.43 65.77 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 107.245 -1.391 . . . . 170.66 107.245 173.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -43.5 -44.3 5.91 Favored 'General case' 0 C--O 1.259 1.558 0 N-CA-C 107.268 -1.382 . . . . 131.1 107.268 -179.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -48.88 -49.13 41.16 Favored 'General case' 0 C--O 1.256 1.432 0 O-C-N 125.865 1.978 . . . . 199.64 109.537 -179.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.3 tp -73.2 -42.44 58.26 Favored 'Isoleucine or valine' 0 C--O 1.272 2.242 0 CA-C-O 117.971 -1.014 . . . . 163.95 109.503 -176.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ARG . . . . . 0.614 ' NH1' ' OE2' ' A' ' 71' ' ' GLU . 8.2 ttp-105 -52.18 -65.37 0.57 Allowed 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 105.866 -1.902 . . . . 144.55 105.866 173.654 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 8.4 ttpp -38.75 -56.62 1.32 Allowed 'General case' 0 C--O 1.257 1.463 0 O-C-N 126.72 2.512 . . . . 160.66 104.863 178.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -50.26 -46.34 54.92 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 126.195 1.798 . . . . 118.19 111.911 -179.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 11.2 mp -62.86 -167.44 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.786 0 CA-C-N 120.294 1.406 . . . . 133.02 108.412 174.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLY . . . . . 0.412 ' O ' ' N ' ' A' ' 51' ' ' ALA . . . -47.03 154.18 1.02 Allowed Glycine 0 C--O 1.26 1.747 0 N-CA-C 110.063 -1.215 . . . . 143.43 110.063 161.726 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -69.32 46.31 0.06 Allowed 'General case' 0 C--O 1.263 1.773 0 C-N-CA 124.558 1.143 . . . . 187.91 110.133 -173.781 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ALA . . . . . 0.412 ' N ' ' O ' ' A' ' 49' ' ' GLY . . . -50.69 150.2 2.94 Favored 'General case' 0 C--O 1.271 2.214 0 C-N-CA 126.432 1.893 . . . . 165.72 108.471 170.931 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 32.6 mtm105 -112.45 147.23 36.93 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 125.081 1.488 . . . . 170.57 109.041 -178.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -62.09 -7.05 3.47 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 123.724 0.64 . . . . 149.95 109.408 179.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.1 -53.79 7.79 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-O 117.74 -1.124 . . . . 163.45 110.652 173.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 16.2 p-10 -92.1 -5.04 53.49 Favored 'General case' 0 C--O 1.271 2.231 0 CA-C-O 117.869 -1.062 . . . . 142.03 110.139 -173.483 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' VAL . . . . . 0.456 ' O ' ' C ' ' A' ' 57' ' ' ALA . 0.8 OUTLIER -73.84 -64.68 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 N-CA-C 104.21 -2.515 . . . . 149.27 104.21 153.74 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ALA . . . . . 0.493 ' O ' ' N ' ' A' ' 61' ' ' GLY . . . -32.98 -45.77 0.14 Allowed 'General case' 0 C--O 1.266 1.946 0 N-CA-C 107.522 -1.288 . . . . 139.03 107.522 -175.682 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ALA . . . . . 0.421 ' N ' ' O ' ' A' ' 56' ' ' VAL . . . -58.18 -63.81 1.13 Allowed 'General case' 0 C--O 1.255 1.363 0 C-N-CA 126.335 1.854 . . . . 124.82 109.356 -177.622 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 14.5 mt -56.35 -13.63 2.34 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 124.742 1.217 . . . . 121.33 110.138 176.013 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 5.4 ttm -103.87 -14.25 16.09 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-O 118.194 -0.908 . . . . 164.14 109.125 175.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 57' ' ' ALA . . . 62.63 18.03 58.38 Favored Glycine 0 N--CA 1.478 1.464 0 C-N-CA 124.437 1.018 . . . . 151.37 112.987 175.477 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 18.8 m -111.98 170.28 3.92 Favored 'Isoleucine or valine' 0 C--O 1.285 2.948 0 N-CA-C 108.521 -0.918 . . . . 132.15 108.521 170.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' SER . . . . . 0.484 ' N ' ' OP2' ' C' ' 14' ' ' ' DC' . 11.3 p -54.82 165.51 0.61 Allowed 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 107.552 -1.277 . . . . 144.21 107.552 -177.207 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -93.27 1.08 57.16 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 107.494 -1.299 . . . . 169.42 107.494 174.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -72.01 -70.71 0.32 Allowed 'General case' 0 C--O 1.248 1.017 0 C-N-CA 127.235 2.214 . . . . 176.49 108.685 165.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ARG . . . . . 0.633 ' NH2' ' OP2' ' C' ' 12' ' ' ' DA' . 54.6 tpt85 -35.37 -55.0 0.66 Allowed 'General case' 0 N--CA 1.485 1.292 0 O-C-N 125.324 1.64 . . . . 182.69 108.407 179.575 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 49.1 t -48.17 -47.68 13.26 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 O-C-N 124.696 1.248 . . . . 167.71 109.179 -174.191 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' SER . . . . . 0.531 ' O ' ' N ' ' A' ' 71' ' ' GLU . 0.0 OUTLIER -54.29 -68.49 0.18 Allowed 'General case' 0 C--O 1.264 1.83 0 CA-C-O 116.785 -1.579 . . . . 144.72 107.423 168.844 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 35.2 mttp -45.42 -21.39 0.09 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 124.573 1.17 . . . . 162.19 110.225 -176.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LEU . . . . . 0.418 ' N ' ' O ' ' A' ' 68' ' ' SER . 0.2 OUTLIER -70.63 -61.59 1.71 Allowed 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 107.54 -1.281 . . . . 128.49 107.54 172.635 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' GLU . . . . . 0.614 ' OE2' ' NH1' ' A' ' 45' ' ' ARG . 48.2 mt-10 -77.12 -14.13 59.84 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 124.51 1.132 . . . . 141.29 110.204 -172.91 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 71.7 m -88.95 -5.86 57.67 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 124.231 1.012 . . . . 148.17 109.409 171.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -83.89 172.33 49.74 Favored Glycine 0 C--O 1.254 1.405 0 O-C-N 124.265 0.978 . . . . 132.84 111.512 -177.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 51.5 t0 -89.33 104.09 16.67 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 126.723 2.009 . . . . 180.59 108.865 167.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -32.72 -53.0 0.33 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 124.636 1.21 . . . . 131.58 110.465 174.406 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.1 p -48.78 -39.84 26.69 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 117.007 -1.473 . . . . 165.85 109.097 -173.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 75.9 m80 -100.66 56.55 0.89 Allowed 'General case' 0 N--CA 1.493 1.722 0 O-C-N 126.185 2.178 . . . . 129.46 111.05 177.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 21.2 m -141.8 146.63 36.12 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 126.613 1.965 . . . . 127.85 107.026 177.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -81.37 136.0 35.7 Favored 'General case' 0 C--O 1.263 1.8 0 O-C-N 124.975 1.422 . . . . 150.34 107.97 -172.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.1 mt -50.17 -36.92 32.29 Favored 'General case' 0 C--O 1.255 1.382 0 O-C-N 124.348 1.03 . . . . 137.76 109.608 -172.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' GLY . . . . . 0.421 ' O ' ' N ' ' A' ' 85' ' ' ALA . . . -73.96 -37.24 50.58 Favored Glycine 0 C--O 1.256 1.475 0 CA-C-O 117.401 -1.777 . . . . 119.09 111.604 177.893 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' THR . . . . . 0.559 ' OG1' ' OP1' ' C' ' 12' ' ' ' DA' . 5.9 m -47.68 -56.53 7.07 Favored 'General case' 0 N--CA 1.485 1.291 0 N-CA-C 103.583 -2.747 . . . . 100.54 103.583 -177.046 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 31.8 tp -56.31 -64.96 0.69 Allowed 'General case' 0 N--CA 1.477 0.885 0 CA-C-N 112.928 -1.942 . . . . 142.11 108.841 177.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -40.5 -33.89 0.3 Allowed 'General case' 0 C--O 1.271 2.23 0 O-C-N 125.382 1.676 . . . . 135.85 110.16 -179.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ALA . . . . . 0.421 ' N ' ' O ' ' A' ' 81' ' ' GLY . . . -75.03 -58.1 3.49 Favored 'General case' 0 C--O 1.264 1.844 0 O-C-N 125.498 1.749 . . . . 126.46 107.63 179.471 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' TYR . . . . . 0.525 ' OH ' ' OE2' ' A' ' 71' ' ' GLU . 90.4 t80 -47.9 -52.07 20.79 Favored 'General case' 0 C--N 1.255 -3.522 0 C-N-CA 126.289 1.836 . . . . 137.22 107.275 179.661 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 4.8 p -67.88 -32.68 57.49 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.847 0 O-C-N 127.546 3.029 . . . . 139.92 111.476 -174.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.91 -46.5 84.55 Favored 'General case' 0 C--O 1.257 1.482 0 O-C-N 124.657 1.223 . . . . 103.95 107.923 174.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -57.04 -29.88 63.77 Favored 'General case' 0 C--O 1.25 1.099 0 O-C-N 125.734 1.896 . . . . 138.36 109.901 -176.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 8.1 mp -88.65 10.98 18.73 Favored 'General case' 0 C--O 1.273 2.291 0 O-C-N 124.029 0.83 . . . . 137.31 110.666 179.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 68.45 35.81 82.56 Favored Glycine 0 C--O 1.262 1.883 0 N-CA-C 110.059 -1.216 . . . . 128.16 110.059 -177.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -114.63 170.08 13.13 Favored Glycine 0 N--CA 1.473 1.121 0 CA-C-O 116.334 -2.37 . . . . 114.65 110.165 178.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 -126.01 97.72 5.22 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 125.513 1.525 . . . . 123.27 109.842 -179.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.4 tp -54.18 128.47 31.16 Favored 'General case' 0 N--CA 1.49 1.53 0 CA-C-O 117.346 -1.311 . . . . 111.22 110.088 176.047 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 6.3 ttm180 -129.75 102.74 6.46 Favored 'General case' 0 C--O 1.262 1.749 0 O-C-N 125.772 1.92 . . . . 191.53 107.84 -174.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 36.3 mm -99.54 115.68 40.97 Favored 'Isoleucine or valine' 0 C--O 1.266 1.932 0 N-CA-C 106.36 -1.719 . . . . 123.02 106.36 -178.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 61.1 t -113.93 147.29 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 O-C-N 126.224 2.203 . . . . 129.28 108.153 167.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -119.39 82.23 1.84 Allowed 'General case' 0 C--O 1.261 1.689 0 O-C-N 126.641 2.463 . . . . 131.15 107.684 169.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -80.42 129.16 34.33 Favored 'General case' 0 C--O 1.266 1.951 0 C-N-CA 124.4 1.08 . . . . 152.44 110.616 -175.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' PHE . . . . . 0.495 ' CE1' ' CD1' ' B' ' 48' ' ' LEU . 92.4 m-85 -116.91 82.95 1.89 Allowed 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 126.931 2.092 . . . . 123.75 108.889 178.878 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 46.41 -131.27 11.51 Favored Glycine 0 C--O 1.251 1.197 0 O-C-N 120.564 -1.335 . . . . 151.41 111.977 -173.25 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -45.28 -49.05 12.88 Favored 'General case' 0 C--O 1.259 1.575 0 C-N-CA 125.185 1.394 . . . . 161.7 110.609 -166.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 -95.81 160.99 14.2 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 124.78 1.3 . . . . 181.72 110.037 177.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 10.5 p -133.16 166.03 23.4 Favored 'General case' 0 C--O 1.272 2.286 0 C-N-CA 125.359 1.464 . . . . 166.11 109.695 172.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 59.8 t -130.27 103.89 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 125.177 1.548 . . . . 152.3 107.636 177.224 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -72.38 122.7 21.64 Favored 'General case' 0 C--O 1.259 1.593 0 N-CA-C 107.454 -1.314 . . . . 133.01 107.454 171.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -79.13 131.1 36.12 Favored 'General case' 0 C--O 1.265 1.869 0 O-C-N 124.84 1.338 . . . . 136.43 108.433 177.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' THR . . . . . 0.473 ' OG1' ' O ' ' A' ' 108' ' ' THR . 0.6 OUTLIER -143.83 99.68 3.45 Favored 'General case' 0 N--CA 1.493 1.712 0 C-N-CA 126.706 2.002 . . . . 185.28 108.221 -177.972 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -139.18 87.01 2.17 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 125.014 1.326 . . . . 231.63 108.809 -179.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -130.04 106.01 8.35 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 124.655 1.222 . . . . 235.05 111.196 -170.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -155.56 109.16 2.79 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 127.607 2.363 . . . . 213.18 108.442 171.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 9.5 m80 -28.89 143.9 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.072 0 C-N-CA 127.264 2.226 . . . . 205.83 112.739 -176.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HIS . . . . . . . . . . . . . 37.3 t60 . . . . . 0 N--CA 1.496 1.874 0 C-N-CA 125.431 1.492 . . . . 189.11 109.91 179.234 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 5.6 p . . . . . 0 N--CA 1.517 2.913 0 CA-C-O 118.471 -0.776 . . . . 166.09 110.326 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 5.3 tt 169.02 122.02 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.839 0 C-N-CA 128.379 2.672 . . . . 158.84 106.231 -175.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' ALA . . . . . . . . . . . . . . . -153.52 148.74 26.92 Favored 'General case' 0 N--CA 1.491 1.602 0 CA-C-N 120.082 1.31 . . . . 174.61 111.948 -174.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -99.63 -15.78 18.45 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 126.197 1.799 . . . . 201.44 109.983 176.285 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 35.6 mmt180 -121.61 124.24 43.86 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 125.917 1.687 . . . . 238.74 110.48 -172.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 87.7 mt -62.36 -42.68 99.6 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 124.261 0.976 . . . . 150.71 109.514 -178.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.01 -42.41 69.07 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 117.064 -1.446 . . . . 144.7 108.402 177.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -63.88 -31.9 73.24 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 124.088 0.867 . . . . 178.77 110.668 -169.407 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 2.0 pt -75.29 -40.51 43.14 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 CA-C-O 116.218 -1.848 . . . . 152.02 109.737 175.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' ARG . . . . . 0.592 ' NH1' ' OE2' ' B' ' 71' ' ' GLU . 8.0 ttp-105 -55.98 -41.44 74.79 Favored 'General case' 0 N--CA 1.5 2.042 0 CA-C-N 119.681 1.128 . . . . 161.25 109.74 -179.745 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 21.9 mmtp -63.04 -42.24 99.69 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.342 1.057 . . . . 167.52 108.455 175.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.26 -21.34 66.28 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.591 1.156 . . . . 139.13 110.521 172.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' LEU . . . . . 0.495 ' CD1' ' CE1' ' A' ' 100' ' ' PHE . 6.4 mt -103.03 69.55 1.04 Allowed 'General case' 0 C--O 1.261 1.682 0 C-N-CA 124.124 0.97 . . . . 159.01 109.063 -178.614 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . 55.37 -166.86 3.02 Favored Glycine 0 C--O 1.254 1.391 0 O-C-N 124.081 0.863 . . . . 146.96 111.154 -178.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' HIS . . . . . 0.485 ' CG ' ' O ' ' B' ' 50' ' ' HIS . 85.1 t60 -77.0 30.56 0.13 Allowed 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 124.999 1.319 . . . . 237.36 110.052 -176.322 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -53.96 124.11 14.51 Favored 'General case' 0 C--O 1.281 2.714 0 N-CA-C 107.553 -1.277 . . . . 137.77 107.553 -177.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . . 13.6 ttp-105 -93.05 159.44 15.3 Favored 'General case' 0 N--CA 1.483 1.202 0 O-C-N 124.26 0.975 . . . . 170.85 110.644 179.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -74.82 -22.67 58.58 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-O 117.307 -1.33 . . . . 146.75 110.34 -175.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -92.9 -15.6 26.18 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 127.103 2.161 . . . . 139.82 110.24 -176.314 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -86.44 -49.4 7.64 Favored 'General case' 0 C--O 1.269 2.092 0 O-C-N 125.676 1.86 . . . . 142.69 108.07 173.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' VAL . . . . . . . . . . . . . 40.4 t -68.04 -20.28 25.65 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 O-C-N 124.299 0.999 . . . . 126.9 108.708 177.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.94 -52.34 44.24 Favored 'General case' 0 C--O 1.272 2.276 0 CA-C-O 118.145 -0.931 . . . . 127.1 109.201 168.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.34 -45.38 93.68 Favored 'General case' 0 N--CA 1.483 1.223 0 O-C-N 126.218 2.199 . . . . 121.49 110.884 -166.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 8.9 mp -70.12 -22.29 63.02 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 117.832 -1.08 . . . . 136.08 109.846 -178.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 81.2 mtp -96.07 7.45 46.35 Favored 'General case' 0 C--O 1.253 1.279 0 C-N-CA 123.974 0.91 . . . . 130.0 109.719 -175.407 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 62.5 19.91 60.69 Favored Glycine 0 C--O 1.259 1.715 0 CA-C-O 117.889 -1.506 . . . . 114.58 114.319 172.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' VAL . . . . . . . . . . . . . 34.8 m -130.97 179.08 4.64 Favored 'Isoleucine or valine' 0 C--O 1.271 2.195 0 C-N-CA 125.176 1.39 . . . . 134.53 108.422 -176.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 82.5 p -75.62 160.76 29.76 Favored 'General case' 0 C--O 1.264 1.863 0 C-N-CA 126.68 1.992 . . . . 149.82 110.346 -177.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 8.8 tm0? -64.94 -40.59 95.25 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 125.478 1.736 . . . . 129.57 110.148 168.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' ALA . . . . . . . . . . . . . . . -41.51 -66.52 0.33 Allowed 'General case' 0 C--O 1.255 1.369 0 C-N-CA 124.328 1.051 . . . . 155.56 108.534 171.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' ARG . . . . . 0.531 ' NH2' " O5'" ' D' ' 14' ' ' ' DC' . 21.5 tpt180 -44.19 -43.97 7.48 Favored 'General case' 0 C--O 1.256 1.424 0 O-C-N 125.338 1.648 . . . . 188.22 109.955 -176.701 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' VAL . . . . . . . . . . . . . 48.5 t -68.94 -41.23 81.83 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.927 0 O-C-N 124.23 0.956 . . . . 145.57 111.514 -170.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.25 -56.48 18.18 Favored 'General case' 0 C--O 1.272 2.262 0 N-CA-C 108.642 -0.873 . . . . 170.19 108.642 173.004 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -48.31 -20.82 0.43 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 124.54 1.15 . . . . 172.59 108.966 174.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 2.0 tt -76.23 -56.74 4.37 Favored 'General case' 0 C--O 1.247 0.937 0 CA-C-O 117.941 -1.028 . . . . 137.36 108.333 178.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' GLU . . . . . 0.592 ' OE2' ' NH1' ' B' ' 45' ' ' ARG . 10.8 mt-10 -84.11 -12.72 54.57 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 125.231 1.582 . . . . 145.78 110.148 -169.473 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' SER . . . . . . . . . . . . . 1.2 m -73.6 -41.02 63.4 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 126.045 2.091 . . . . 191.72 109.259 162.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' GLY . . . . . . . . . . . . . . . -51.54 150.43 7.33 Favored Glycine 0 C--O 1.262 1.905 0 O-C-N 124.567 1.167 . . . . 141.04 113.468 -175.36 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -64.82 117.1 7.03 Favored 'General case' 0 C--O 1.257 1.481 0 N-CA-C 106.617 -1.623 . . . . 171.83 106.617 161.298 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 8.8 mp -51.99 -47.75 64.74 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 125.954 2.034 . . . . 172.78 110.084 171.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' SER . . . . . . . . . . . . . 12.1 t -50.54 -30.31 12.73 Favored 'General case' 0 N--CA 1.486 1.328 0 O-C-N 124.395 1.059 . . . . 109.49 108.658 176.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 74.3 m80 -111.59 52.08 0.76 Allowed 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 105.764 -1.939 . . . . 142.06 105.764 176.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' THR . . . . . . . . . . . . . 9.9 m -128.19 134.28 49.02 Favored 'General case' 0 C--O 1.273 2.292 0 C-N-CA 126.522 1.929 . . . . 120.08 108.521 160.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -73.83 139.53 45.17 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 105.169 -2.16 . . . . 181.27 105.169 170.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' LEU . . . . . 0.437 ' O ' ' N ' ' B' ' 84' ' ' GLN . 0.2 OUTLIER -67.64 -30.52 70.1 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 125.619 1.825 . . . . 143.63 107.68 -169.062 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.14 -60.34 6.75 Favored Glycine 0 N--CA 1.474 1.182 0 O-C-N 125.068 1.48 . . . . 106.68 110.469 168.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' THR . . . . . . . . . . . . . 1.3 m -57.95 -29.48 65.21 Favored 'General case' 0 C--O 1.268 2.037 0 CA-C-O 117.159 -1.401 . . . . 126.46 107.429 -178.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 10.9 tp -71.59 -59.89 2.52 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 125.359 1.662 . . . . 110.33 110.69 174.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' GLN . . . . . 0.437 ' N ' ' O ' ' B' ' 80' ' ' LEU . 3.4 tp60 -39.73 -63.88 0.54 Allowed 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 125.544 1.538 . . . . 139.63 109.287 171.997 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -36.62 -40.77 0.27 Allowed 'General case' 0 C--O 1.272 2.281 0 CA-C-O 116.983 -1.484 . . . . 120.72 110.499 178.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' TYR . . . . . 0.511 ' O ' ' N ' ' B' ' 89' ' ' ALA . 24.5 t80 -75.52 -66.88 0.72 Allowed 'General case' 0 N--CA 1.492 1.642 0 CA-C-O 115.903 -1.999 . . . . 132.29 109.302 -175.456 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 24.1 m -52.45 -36.84 22.47 Favored 'Isoleucine or valine' 0 C--O 1.288 3.086 0 O-C-N 125.395 1.684 . . . . 117.9 107.727 -175.1 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.58 -50.58 65.27 Favored 'General case' 0 N--CA 1.483 1.212 0 O-C-N 126.43 2.331 . . . . 104.54 108.923 169.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' ALA . . . . . 0.511 ' N ' ' O ' ' B' ' 86' ' ' TYR . . . -58.36 -24.68 60.56 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 126.713 2.508 . . . . 106.81 111.004 -179.176 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 44.7 mt -101.19 5.12 42.5 Favored 'General case' 0 C--O 1.259 1.575 0 O-C-N 124.124 0.89 . . . . 130.49 108.652 179.651 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' GLY . . . . . . . . . . . . . . . 77.1 21.82 72.76 Favored Glycine 0 N--CA 1.48 1.625 0 CA-C-O 116.266 -2.408 . . . . 140.13 114.133 169.766 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' GLY . . . . . . . . . . . . . . . -110.42 164.41 12.26 Favored Glycine 0 N--CA 1.484 1.892 0 C-N-CA 127.13 2.3 . . . . 146.81 110.369 165.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -121.47 129.71 53.13 Favored 'General case' 0 N--CA 1.496 1.856 0 CA-C-N 119.174 1.487 . . . . 167.13 110.013 -174.042 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 22.7 tp -77.4 114.9 16.7 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 127.492 2.317 . . . . 143.24 110.156 -168.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' ARG . . . . . . . . . . . . . 22.0 ttt180 -108.88 105.61 15.24 Favored 'General case' 0 C--O 1.275 2.429 0 O-C-N 124.381 1.05 . . . . 193.1 108.435 -173.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 61.6 mt -99.42 100.43 10.43 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 125.478 1.736 . . . . 101.01 109.15 -175.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' VAL . . . . . . . . . . . . . 16.9 t -99.72 137.57 26.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 124.612 1.195 . . . . 132.12 108.075 178.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -112.35 98.2 7.13 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.266 1.427 . . . . 113.27 107.78 169.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' GLU . . . . . 0.439 ' O ' ' CD1' ' B' ' 100' ' ' PHE . 37.2 mt-10 -77.78 169.78 17.7 Favored 'General case' 0 N--CA 1.488 1.473 0 CA-C-O 116.859 -1.543 . . . . 164.87 110.254 -176.698 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' PHE . . . . . 0.439 ' CD1' ' O ' ' B' ' 99' ' ' GLU . 98.6 m-85 -169.31 37.2 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.819 0 O-C-N 125.292 1.62 . . . . 129.05 113.245 -178.056 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 88.86 -46.88 3.34 Favored Glycine 0 N--CA 1.484 1.894 0 CA-C-N 120.465 1.484 . . . . 133.32 112.108 171.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 10.6 tm-20 -137.66 -72.04 0.43 Allowed 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 106.893 -1.521 . . . . 176.08 106.893 159.162 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -43.89 119.11 1.62 Allowed 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 105.705 -1.961 . . . . 192.77 105.705 179.712 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' THR . . . . . . . . . . . . . 3.0 m -118.6 166.93 12.12 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-O 114.85 -2.5 . . . . 126.23 104.496 177.13 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' VAL . . . . . . . . . . . . . 46.8 t -147.32 109.35 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 126.226 2.204 . . . . 105.91 109.708 -177.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' GLU . . . . . 0.463 ' OE1' ' N ' ' B' ' 107' ' ' LEU . 0.2 OUTLIER -84.67 141.89 30.29 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 105.785 -1.932 . . . . 113.65 105.785 178.236 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' LEU . . . . . 0.463 ' N ' ' OE1' ' B' ' 106' ' ' GLU . 3.6 mm? -111.65 113.09 25.24 Favored 'General case' 0 C--O 1.275 2.417 0 C-N-CA 123.501 0.72 . . . . 128.86 109.471 -169.704 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' THR . . . . . . . . . . . . . 11.9 p -122.33 75.78 1.27 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 126.143 2.152 . . . . 161.81 107.661 -159.91 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -136.54 115.79 12.59 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 124.892 1.37 . . . . 169.07 109.733 -171.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' LEU . . . . . 0.446 ' O ' ' CB ' ' B' ' 111' ' ' GLU . 5.9 mp -135.38 166.67 22.63 Favored 'General case' 0 N--CA 1.499 1.983 0 C-N-CA 125.141 1.377 . . . . 201.17 110.254 -178.248 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' GLU . . . . . 0.446 ' CB ' ' O ' ' B' ' 110' ' ' LEU . 85.1 tt0 114.82 91.49 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.995 0 C-N-CA 127.287 2.235 . . . . 191.54 109.543 -179.827 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 -84.6 163.35 19.36 Favored 'General case' 0 N--CA 1.496 1.867 0 C-N-CA 125.845 1.658 . . . . 219.42 110.454 177.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.495 1.789 0 C-N-CA 125.299 1.44 . . . . 204.9 108.881 169.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 1' ' ' ' DC' . . . . . 0.418 ' C6 ' ' C5 ' ' C' ' 2' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.537 0.864 0 C1'-O4'-C4' 104.637 -3.616 . . . . 224.98 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 2' ' ' ' DC' . . . . . 0.418 ' C5 ' ' C6 ' ' C' ' 1' ' ' ' DC' . . . . . . . . 0 P--O3' 1.628 1.779 0 C3'-C2'-C1' 100.877 -1.302 . . . . 185.43 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 3' ' ' ' DA' . . . . . 0.694 ' N1 ' ' N2 ' ' D' ' 19' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.453 0.656 0 C2'-C3'-O3' 114.439 1.422 . . . . 232.77 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 4' ' ' ' DC' . . . . . 0.473 ' C5 ' ' C4 ' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.511 -0.659 0 C3'-C2'-C1' 99.581 -2.228 . . . . 206.96 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.578 -2.384 0 C3'-C2'-C1' 98.305 -3.139 . . . . 212.23 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 6' ' ' ' DA' . . . . . 0.626 ' N1 ' ' N3 ' ' D' ' 15' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.429 0.695 0 C4'-C3'-C2' 101.64 -1.56 . . . . 259.35 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 7' ' ' ' DG' . . . . . 0.627 ' N2 ' ' N3 ' ' D' ' 14' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.537 0.947 0 N19-C1'-C2' 116.109 1.193 . . . . 239.16 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.633 2.205 0 C3'-C2'-C1' 105.693 2.138 . . . . 260.94 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.535 0.711 0 C4'-C3'-O3' 116.627 2.876 . . . . 229.8 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 10' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--OP2 1.496 0.634 0 P-O3'-C3' 122.282 2.152 . . . . 227.8 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--OP1 1.515 1.763 0 C2'-C3'-O3' 118.735 3.013 . . . . 210.99 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 12' ' ' ' DA' . . . . . 0.72 ' N6 ' ' O4 ' ' D' ' 9' ' ' ' DT' . . . . . . . . 0 P--O3' 1.652 3.751 0 C5'-C4'-C3' 111.732 -1.979 . . . . 184.8 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 13' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.626 1.611 0 C4'-C3'-C2' 100.5 -2.7 . . . . 209.57 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 14' ' ' ' DC' . . . . . 0.484 ' OP2' ' N ' ' A' ' 63' ' ' SER . . . . . . . . 0 P--O3' 1.621 1.17 0 P-O3'-C3' 121.93 1.859 . . . . 187.88 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.589 -0.445 0 N19-C1'-C2' 116.236 1.272 . . . . 203.2 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.514 -0.369 0 P-O3'-C3' 120.948 1.04 . . . . 218.88 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.59 -1.388 0 O5'-P-OP1 111.285 1.098 . . . . 269.61 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 18' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.618 0.909 0 C3'-C2'-C1' 100.322 -1.698 . . . . 237.0 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 19' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.422 -0.719 0 C4'-C3'-O3' 106.877 -1.556 . . . . 240.24 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.574 -2.746 0 C1'-O4'-C4' 105.703 -2.855 . . . . 217.66 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.406 -1.075 0 C1'-O4'-C4' 106.19 -2.507 . . . . 210.01 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 2' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.825 0 O5'-C5'-C4' 112.01 1.293 . . . . 169.34 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.62 1.082 0 C1'-O4'-C4' 106.25 -2.464 . . . . 185.29 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 4' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.63 1.911 0 C2'-C3'-O3' 114.198 1.333 . . . . 200.44 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.582 -2.11 0 C3'-C2'-C1' 99.778 -2.087 . . . . 219.91 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 6' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.522 -0.596 0 C2'-C3'-O3' 115.51 1.819 . . . . 230.17 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.454 0.755 0 C3'-C2'-C1' 100.104 -1.854 . . . . 250.23 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 8' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.603 -0.364 0 P-O3'-C3' 120.406 0.588 . . . . 270.76 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 9' ' ' ' DT' . . . . . 0.72 ' O4 ' ' N6 ' ' C' ' 12' ' ' ' DA' . . . . . . . . 0 P--O3' 1.596 -0.906 0 C3'-C2'-C1' 99.907 -1.995 . . . . 249.23 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 10' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.452 0.541 0 O4'-C1'-C2' 104.957 -1.039 . . . . 284.12 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.597 -0.854 0 N19-C1'-C2' 117.017 1.76 . . . . 234.11 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.597 -0.867 0 C4'-C3'-O3' 113.536 1.471 . . . . 222.05 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 13' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.639 2.658 0 C2'-C3'-O3' 115.842 1.941 . . . . 231.6 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 14' ' ' ' DC' . . . . . 0.627 ' N3 ' ' N2 ' ' C' ' 7' ' ' ' DG' . . . . . . . . 0 P--O5' 1.604 1.059 0 O5'-C5'-C4' 113.279 2.199 . . . . 196.51 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 15' ' ' ' DT' . . . . . 0.626 ' N3 ' ' N1 ' ' C' ' 6' ' ' ' DA' . . . . . . . . 0 P--O3' 1.617 0.859 0 C4'-C3'-C2' 100.934 -2.266 . . . . 227.82 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 16' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.521 -0.736 0 O5'-P-OP1 102.482 -1.937 . . . . 210.67 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.592 -1.254 0 N19-C1'-C2' 116.286 1.304 . . . . 235.36 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 18' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.425 -0.486 0 C4'-C3'-O3' 108.274 -0.921 . . . . 221.55 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 19' ' ' ' DG' . . . . . 0.694 ' N2 ' ' N1 ' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 P--O3' 1.589 -1.531 0 C3'-C2'-C1' 99.89 -2.007 . . . . 235.54 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.59 -1.438 0 C3'-C2'-C1' 100.673 -1.448 . . . . 246.52 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.519 3.001 0 N-CA-C 107.601 -1.259 . . . . 139.87 107.601 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LEU . . . . . 0.419 ' HG ' ' H ' ' A' ' 38' ' ' ALA . 5.4 tp -64.04 -157.08 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.895 0 C-N-CA 127.151 2.18 . . . . 161.31 110.661 -165.345 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ALA . . . . . 0.49 ' HA ' ' O ' ' B' ' 106' ' ' GLU . . . -170.85 17.36 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.231 0 N-CA-C 115.152 1.538 . . . . 154.38 115.152 172.654 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' HIS . . . . . 0.425 ' HB2' ' OE2' ' A' ' 43' ' ' GLU . 2.6 m170 -126.13 -124.25 0.24 Allowed 'General case' 0 N--CA 1.493 1.694 0 CA-C-N 121.519 1.963 . . . . 202.91 110.662 -164.491 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ARG . . . . . 0.467 ' O ' ' HB2' ' A' ' 43' ' ' GLU . 71.7 mmt-85 -67.13 147.24 53.37 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 125.042 1.464 . . . . 192.39 109.714 -170.528 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' LEU . . . . . 0.589 ' O ' HG22 ' A' ' 44' ' ' ILE . 66.3 mt -58.88 -52.43 65.77 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 107.245 -1.391 . . . . 170.66 107.245 173.338 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -43.5 -44.3 5.91 Favored 'General case' 0 C--O 1.259 1.558 0 N-CA-C 107.268 -1.382 . . . . 131.1 107.268 -179.051 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLU . . . . . 0.467 ' HB2' ' O ' ' A' ' 40' ' ' ARG . 1.9 tt0 -48.88 -49.13 41.16 Favored 'General case' 0 C--O 1.256 1.432 0 O-C-N 125.865 1.978 . . . . 199.64 109.537 -179.126 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ILE . . . . . 0.633 HD13 HG21 ' B' ' 105' ' ' VAL . 1.3 tp -73.2 -42.44 58.26 Favored 'Isoleucine or valine' 0 C--O 1.272 2.242 0 CA-C-O 117.971 -1.014 . . . . 163.95 109.503 -176.507 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ARG . . . . . 0.595 ' NH1' ' OE2' ' A' ' 71' ' ' GLU . 8.2 ttp-105 -52.18 -65.37 0.57 Allowed 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 105.866 -1.902 . . . . 144.55 105.866 173.654 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 8.4 ttpp -38.75 -56.62 1.32 Allowed 'General case' 0 C--O 1.257 1.463 0 O-C-N 126.72 2.512 . . . . 160.66 104.863 178.662 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ALA . . . . . 0.488 ' HB3' HD12 ' A' ' 44' ' ' ILE . . . -50.26 -46.34 54.92 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 126.195 1.798 . . . . 118.19 111.911 -179.091 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LEU . . . . . 0.404 HD13 ' O ' ' A' ' 44' ' ' ILE . 11.2 mp -62.86 -167.44 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.786 0 CA-C-N 120.294 1.406 . . . . 133.02 108.412 174.213 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -47.03 154.18 1.02 Allowed Glycine 0 C--O 1.26 1.747 0 N-CA-C 110.063 -1.215 . . . . 143.43 110.063 161.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -69.32 46.31 0.06 Allowed 'General case' 0 C--O 1.263 1.773 0 C-N-CA 124.558 1.143 . . . . 187.91 110.133 -173.781 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -50.69 150.2 2.94 Favored 'General case' 0 C--O 1.271 2.214 0 C-N-CA 126.432 1.893 . . . . 165.72 108.471 170.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 32.6 mtm105 -112.45 147.23 36.93 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 125.081 1.488 . . . . 170.57 109.041 -178.386 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' GLN . . . . . 0.439 ' O ' ' HB2' ' A' ' 57' ' ' ALA . 13.5 pt20 -62.09 -7.05 3.47 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 123.724 0.64 . . . . 149.95 109.408 179.923 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ALA . . . . . 0.596 ' HA ' ' HG2' ' A' ' 64' ' ' GLN . . . -76.1 -53.79 7.79 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-O 117.74 -1.124 . . . . 163.45 110.652 173.118 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 16.2 p-10 -92.1 -5.04 53.49 Favored 'General case' 0 C--O 1.271 2.231 0 CA-C-O 117.869 -1.062 . . . . 142.03 110.139 -173.483 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' VAL . . . . . 0.456 ' O ' ' C ' ' A' ' 57' ' ' ALA . 0.8 OUTLIER -73.84 -64.68 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 N-CA-C 104.21 -2.515 . . . . 149.27 104.21 153.74 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ALA . . . . . 0.493 ' O ' ' N ' ' A' ' 61' ' ' GLY . . . -32.98 -45.77 0.14 Allowed 'General case' 0 C--O 1.266 1.946 0 N-CA-C 107.522 -1.288 . . . . 139.03 107.522 -175.682 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ALA . . . . . 0.421 ' N ' ' O ' ' A' ' 56' ' ' VAL . . . -58.18 -63.81 1.13 Allowed 'General case' 0 C--O 1.255 1.363 0 C-N-CA 126.335 1.854 . . . . 124.82 109.356 -177.622 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 14.5 mt -56.35 -13.63 2.34 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 124.742 1.217 . . . . 121.33 110.138 176.013 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' MET . . . . . 0.409 ' HE1' ' HD1' ' A' ' 86' ' ' TYR . 5.4 ttm -103.87 -14.25 16.09 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-O 118.194 -0.908 . . . . 164.14 109.125 175.734 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 57' ' ' ALA . . . 62.63 18.03 58.38 Favored Glycine 0 N--CA 1.478 1.464 0 C-N-CA 124.437 1.018 . . . . 151.37 112.987 175.477 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 18.8 m -111.98 170.28 3.92 Favored 'Isoleucine or valine' 0 C--O 1.285 2.948 0 N-CA-C 108.521 -0.918 . . . . 132.15 108.521 170.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 11.3 p -54.82 165.51 0.61 Allowed 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 107.552 -1.277 . . . . 144.21 107.552 -177.207 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' GLN . . . . . 0.596 ' HG2' ' HA ' ' A' ' 54' ' ' ALA . 6.8 mt-30 -93.27 1.08 57.16 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 107.494 -1.299 . . . . 169.42 107.494 174.449 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -72.01 -70.71 0.32 Allowed 'General case' 0 C--O 1.248 1.017 0 C-N-CA 127.235 2.214 . . . . 176.49 108.685 165.085 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ARG . . . . . 0.633 ' NH2' ' OP2' ' C' ' 12' ' ' ' DA' . 54.6 tpt85 -35.37 -55.0 0.66 Allowed 'General case' 0 N--CA 1.485 1.292 0 O-C-N 125.324 1.64 . . . . 182.69 108.407 179.575 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' VAL . . . . . 0.468 HG21 ' HB2' ' A' ' 57' ' ' ALA . 49.1 t -48.17 -47.68 13.26 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 O-C-N 124.696 1.248 . . . . 167.71 109.179 -174.191 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' SER . . . . . 0.643 ' HB2' ' OP2' ' D' ' 4' ' ' ' DT' . 0.0 OUTLIER -54.29 -68.49 0.18 Allowed 'General case' 0 C--O 1.264 1.83 0 CA-C-O 116.785 -1.579 . . . . 144.72 107.423 168.844 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 35.2 mttp -45.42 -21.39 0.09 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 124.573 1.17 . . . . 162.19 110.225 -176.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LEU . . . . . 0.542 HD21 ' CG2' ' A' ' 82' ' ' THR . 0.2 OUTLIER -70.63 -61.59 1.71 Allowed 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 107.54 -1.281 . . . . 128.49 107.54 172.635 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 71' ' ' GLU . . . . . 0.595 ' OE2' ' NH1' ' A' ' 45' ' ' ARG . 48.2 mt-10 -77.12 -14.13 59.84 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 124.51 1.132 . . . . 141.29 110.204 -172.91 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 71.7 m -88.95 -5.86 57.67 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 124.231 1.012 . . . . 148.17 109.409 171.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -83.89 172.33 49.74 Favored Glycine 0 C--O 1.254 1.405 0 O-C-N 124.265 0.978 . . . . 132.84 111.512 -177.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 51.5 t0 -89.33 104.09 16.67 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 126.723 2.009 . . . . 180.59 108.865 167.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' LEU . . . . . 0.505 HD11 HD12 ' B' ' 107' ' ' LEU . 0.3 OUTLIER -32.72 -53.0 0.33 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 124.636 1.21 . . . . 131.58 110.465 174.406 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.1 p -48.78 -39.84 26.69 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 117.007 -1.473 . . . . 165.85 109.097 -173.363 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 75.9 m80 -100.66 56.55 0.89 Allowed 'General case' 0 N--CA 1.493 1.722 0 O-C-N 126.185 2.178 . . . . 129.46 111.05 177.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' THR . . . . . 0.494 ' O ' ' HA ' ' B' ' 79' ' ' GLU . 21.2 m -141.8 146.63 36.12 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 126.613 1.965 . . . . 127.85 107.026 177.85 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' GLU . . . . . 0.597 ' OE1' ' HA ' ' B' ' 77' ' ' HIS . 2.7 mt-10 -81.37 136.0 35.7 Favored 'General case' 0 C--O 1.263 1.8 0 O-C-N 124.975 1.422 . . . . 150.34 107.97 -172.65 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LEU . . . . . 0.612 HD12 ' HB ' ' B' ' 78' ' ' THR . 5.1 mt -50.17 -36.92 32.29 Favored 'General case' 0 C--O 1.255 1.382 0 O-C-N 124.348 1.03 . . . . 137.76 109.608 -172.88 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' GLY . . . . . 0.557 ' HA2' ' HB3' ' A' ' 84' ' ' GLN . . . -73.96 -37.24 50.58 Favored Glycine 0 C--O 1.256 1.475 0 CA-C-O 117.401 -1.777 . . . . 119.09 111.604 177.893 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' THR . . . . . 0.542 ' CG2' HD21 ' A' ' 70' ' ' LEU . 5.9 m -47.68 -56.53 7.07 Favored 'General case' 0 N--CA 1.485 1.291 0 N-CA-C 103.583 -2.747 . . . . 100.54 103.583 -177.046 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 31.8 tp -56.31 -64.96 0.69 Allowed 'General case' 0 N--CA 1.477 0.885 0 CA-C-N 112.928 -1.942 . . . . 142.11 108.841 177.127 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLN . . . . . 0.557 ' HB3' ' HA2' ' A' ' 81' ' ' GLY . 51.2 tt0 -40.5 -33.89 0.3 Allowed 'General case' 0 C--O 1.271 2.23 0 O-C-N 125.382 1.676 . . . . 135.85 110.16 -179.799 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ALA . . . . . 0.539 ' HB3' ' O ' ' A' ' 82' ' ' THR . . . -75.03 -58.1 3.49 Favored 'General case' 0 C--O 1.264 1.844 0 O-C-N 125.498 1.749 . . . . 126.46 107.63 179.471 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' TYR . . . . . 0.409 ' HD1' ' HE1' ' A' ' 60' ' ' MET . 90.4 t80 -47.9 -52.07 20.79 Favored 'General case' 0 C--N 1.255 -3.522 0 C-N-CA 126.289 1.836 . . . . 137.22 107.275 179.661 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' VAL . . . . . 0.736 HG11 ' HB2' ' A' ' 94' ' ' LEU . 4.8 p -67.88 -32.68 57.49 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.847 0 O-C-N 127.546 3.029 . . . . 139.92 111.476 -174.294 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.91 -46.5 84.55 Favored 'General case' 0 C--O 1.257 1.482 0 O-C-N 124.657 1.223 . . . . 103.95 107.923 174.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -57.04 -29.88 63.77 Favored 'General case' 0 C--O 1.25 1.099 0 O-C-N 125.734 1.896 . . . . 138.36 109.901 -176.591 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 8.1 mp -88.65 10.98 18.73 Favored 'General case' 0 C--O 1.273 2.291 0 O-C-N 124.029 0.83 . . . . 137.31 110.666 179.082 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 68.45 35.81 82.56 Favored Glycine 0 C--O 1.262 1.883 0 N-CA-C 110.059 -1.216 . . . . 128.16 110.059 -177.264 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -114.63 170.08 13.13 Favored Glycine 0 N--CA 1.473 1.121 0 CA-C-O 116.334 -2.37 . . . . 114.65 110.165 178.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 -126.01 97.72 5.22 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 125.513 1.525 . . . . 123.27 109.842 -179.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' LEU . . . . . 0.736 ' HB2' HG11 ' A' ' 87' ' ' VAL . 10.4 tp -54.18 128.47 31.16 Favored 'General case' 0 N--CA 1.49 1.53 0 CA-C-O 117.346 -1.311 . . . . 111.22 110.088 176.047 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 6.3 ttm180 -129.75 102.74 6.46 Favored 'General case' 0 C--O 1.262 1.749 0 O-C-N 125.772 1.92 . . . . 191.53 107.84 -174.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ILE . . . . . 0.527 ' CD1' HG12 ' B' ' 96' ' ' ILE . 36.3 mm -99.54 115.68 40.97 Favored 'Isoleucine or valine' 0 C--O 1.266 1.932 0 N-CA-C 106.36 -1.719 . . . . 123.02 106.36 -178.31 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 61.1 t -113.93 147.29 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 O-C-N 126.224 2.203 . . . . 129.28 108.153 167.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -119.39 82.23 1.84 Allowed 'General case' 0 C--O 1.261 1.689 0 O-C-N 126.641 2.463 . . . . 131.15 107.684 169.34 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -80.42 129.16 34.33 Favored 'General case' 0 C--O 1.266 1.951 0 C-N-CA 124.4 1.08 . . . . 152.44 110.616 -175.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' PHE . . . . . 0.77 ' CD1' HD11 ' B' ' 48' ' ' LEU . 92.4 m-85 -116.91 82.95 1.89 Allowed 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 126.931 2.092 . . . . 123.75 108.889 178.878 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 46.41 -131.27 11.51 Favored Glycine 0 C--O 1.251 1.197 0 O-C-N 120.564 -1.335 . . . . 151.41 111.977 -173.25 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -45.28 -49.05 12.88 Favored 'General case' 0 C--O 1.259 1.575 0 C-N-CA 125.185 1.394 . . . . 161.7 110.609 -166.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 -95.81 160.99 14.2 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 124.78 1.3 . . . . 181.72 110.037 177.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 10.5 p -133.16 166.03 23.4 Favored 'General case' 0 C--O 1.272 2.286 0 C-N-CA 125.359 1.464 . . . . 166.11 109.695 172.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 59.8 t -130.27 103.89 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 125.177 1.548 . . . . 152.3 107.636 177.224 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -72.38 122.7 21.64 Favored 'General case' 0 C--O 1.259 1.593 0 N-CA-C 107.454 -1.314 . . . . 133.01 107.454 171.53 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' LEU . . . . . 0.409 HD12 ' CD2' ' B' ' 75' ' ' LEU . 1.1 mm? -79.13 131.1 36.12 Favored 'General case' 0 C--O 1.265 1.869 0 O-C-N 124.84 1.338 . . . . 136.43 108.433 177.266 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 108' ' ' THR . . . . . 0.473 ' O ' ' OG1' ' A' ' 108' ' ' THR . 0.6 OUTLIER -143.83 99.68 3.45 Favored 'General case' 0 N--CA 1.493 1.712 0 C-N-CA 126.706 2.002 . . . . 185.28 108.221 -177.972 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -139.18 87.01 2.17 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 125.014 1.326 . . . . 231.63 108.809 -179.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' LEU . . . . . 0.401 ' C ' HD13 ' A' ' 110' ' ' LEU . 3.0 tm? -130.04 106.01 8.35 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 124.655 1.222 . . . . 235.05 111.196 -170.742 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -155.56 109.16 2.79 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 127.607 2.363 . . . . 213.18 108.442 171.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 9.5 m80 -28.89 143.9 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.072 0 C-N-CA 127.264 2.226 . . . . 205.83 112.739 -176.661 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HIS . . . . . . . . . . . . . 37.3 t60 . . . . . 0 N--CA 1.496 1.874 0 C-N-CA 125.431 1.492 . . . . 189.11 109.91 179.234 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 36' ' ' VAL . . . . . 0.513 HG22 ' O ' ' B' ' 36' ' ' VAL . 5.6 p . . . . . 0 N--CA 1.517 2.913 0 CA-C-O 118.471 -0.776 . . . . 166.09 110.326 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 5.3 tt 169.02 122.02 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.839 0 C-N-CA 128.379 2.672 . . . . 158.84 106.231 -175.051 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' ALA . . . . . . . . . . . . . . . -153.52 148.74 26.92 Favored 'General case' 0 N--CA 1.491 1.602 0 CA-C-N 120.082 1.31 . . . . 174.61 111.948 -174.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -99.63 -15.78 18.45 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 126.197 1.799 . . . . 201.44 109.983 176.285 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 35.6 mmt180 -121.61 124.24 43.86 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 125.917 1.687 . . . . 238.74 110.48 -172.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' LEU . . . . . 0.553 ' HB2' ' HG2' ' B' ' 71' ' ' GLU . 87.7 mt -62.36 -42.68 99.6 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 124.261 0.976 . . . . 150.71 109.514 -178.713 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.01 -42.41 69.07 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 117.064 -1.446 . . . . 144.7 108.402 177.709 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -63.88 -31.9 73.24 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 124.088 0.867 . . . . 178.77 110.668 -169.407 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' ILE . . . . . 0.483 HG12 ' O ' ' B' ' 41' ' ' LEU . 2.0 pt -75.29 -40.51 43.14 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 CA-C-O 116.218 -1.848 . . . . 152.02 109.737 175.875 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 45' ' ' ARG . . . . . 0.726 ' HG3' ' HB3' ' B' ' 51' ' ' ALA . 8.0 ttp-105 -55.98 -41.44 74.79 Favored 'General case' 0 N--CA 1.5 2.042 0 CA-C-N 119.681 1.128 . . . . 161.25 109.74 -179.745 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 21.9 mmtp -63.04 -42.24 99.69 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.342 1.057 . . . . 167.52 108.455 175.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.26 -21.34 66.28 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.591 1.156 . . . . 139.13 110.521 172.581 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' LEU . . . . . 0.77 HD11 ' CD1' ' A' ' 100' ' ' PHE . 6.4 mt -103.03 69.55 1.04 Allowed 'General case' 0 C--O 1.261 1.682 0 C-N-CA 124.124 0.97 . . . . 159.01 109.063 -178.614 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . 55.37 -166.86 3.02 Favored Glycine 0 C--O 1.254 1.391 0 O-C-N 124.081 0.863 . . . . 146.96 111.154 -178.789 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' HIS . . . . . 0.485 ' CG ' ' O ' ' B' ' 50' ' ' HIS . 85.1 t60 -77.0 30.56 0.13 Allowed 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 124.999 1.319 . . . . 237.36 110.052 -176.322 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 51' ' ' ALA . . . . . 0.726 ' HB3' ' HG3' ' B' ' 45' ' ' ARG . . . -53.96 124.11 14.51 Favored 'General case' 0 C--O 1.281 2.714 0 N-CA-C 107.553 -1.277 . . . . 137.77 107.553 -177.253 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . . 13.6 ttp-105 -93.05 159.44 15.3 Favored 'General case' 0 N--CA 1.483 1.202 0 O-C-N 124.26 0.975 . . . . 170.85 110.644 179.128 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' GLN . . . . . 0.461 HE22 " H3'" ' C' ' 1' ' ' ' DC' . 3.4 tt0 -74.82 -22.67 58.58 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-O 117.307 -1.33 . . . . 146.75 110.34 -175.654 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -92.9 -15.6 26.18 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 127.103 2.161 . . . . 139.82 110.24 -176.314 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -86.44 -49.4 7.64 Favored 'General case' 0 C--O 1.269 2.092 0 O-C-N 125.676 1.86 . . . . 142.69 108.07 173.679 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' VAL . . . . . . . . . . . . . 40.4 t -68.04 -20.28 25.65 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 O-C-N 124.299 0.999 . . . . 126.9 108.708 177.372 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.94 -52.34 44.24 Favored 'General case' 0 C--O 1.272 2.276 0 CA-C-O 118.145 -0.931 . . . . 127.1 109.201 168.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.34 -45.38 93.68 Favored 'General case' 0 N--CA 1.483 1.223 0 O-C-N 126.218 2.199 . . . . 121.49 110.884 -166.179 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 8.9 mp -70.12 -22.29 63.02 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 117.832 -1.08 . . . . 136.08 109.846 -178.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 81.2 mtp -96.07 7.45 46.35 Favored 'General case' 0 C--O 1.253 1.279 0 C-N-CA 123.974 0.91 . . . . 130.0 109.719 -175.407 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 62.5 19.91 60.69 Favored Glycine 0 C--O 1.259 1.715 0 CA-C-O 117.889 -1.506 . . . . 114.58 114.319 172.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' VAL . . . . . . . . . . . . . 34.8 m -130.97 179.08 4.64 Favored 'Isoleucine or valine' 0 C--O 1.271 2.195 0 C-N-CA 125.176 1.39 . . . . 134.53 108.422 -176.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 82.5 p -75.62 160.76 29.76 Favored 'General case' 0 C--O 1.264 1.863 0 C-N-CA 126.68 1.992 . . . . 149.82 110.346 -177.056 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -64.94 -40.59 95.25 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 125.478 1.736 . . . . 129.57 110.148 168.367 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' ALA . . . . . . . . . . . . . . . -41.51 -66.52 0.33 Allowed 'General case' 0 C--O 1.255 1.369 0 C-N-CA 124.328 1.051 . . . . 155.56 108.534 171.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' ARG . . . . . 0.531 ' NH2' " O5'" ' D' ' 14' ' ' ' DC' . 21.5 tpt180 -44.19 -43.97 7.48 Favored 'General case' 0 C--O 1.256 1.424 0 O-C-N 125.338 1.648 . . . . 188.22 109.955 -176.701 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 67' ' ' VAL . . . . . . . . . . . . . 48.5 t -68.94 -41.23 81.83 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.927 0 O-C-N 124.23 0.956 . . . . 145.57 111.514 -170.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.25 -56.48 18.18 Favored 'General case' 0 C--O 1.272 2.262 0 N-CA-C 108.642 -0.873 . . . . 170.19 108.642 173.004 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 69' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -48.31 -20.82 0.43 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 124.54 1.15 . . . . 172.59 108.966 174.391 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 2.0 tt -76.23 -56.74 4.37 Favored 'General case' 0 C--O 1.247 0.937 0 CA-C-O 117.941 -1.028 . . . . 137.36 108.333 178.057 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' GLU . . . . . 0.553 ' HG2' ' HB2' ' B' ' 41' ' ' LEU . 10.8 mt-10 -84.11 -12.72 54.57 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 125.231 1.582 . . . . 145.78 110.148 -169.473 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 72' ' ' SER . . . . . . . . . . . . . 1.2 m -73.6 -41.02 63.4 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 126.045 2.091 . . . . 191.72 109.259 162.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' GLY . . . . . . . . . . . . . . . -51.54 150.43 7.33 Favored Glycine 0 C--O 1.262 1.905 0 O-C-N 124.567 1.167 . . . . 141.04 113.468 -175.36 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -64.82 117.1 7.03 Favored 'General case' 0 C--O 1.257 1.481 0 N-CA-C 106.617 -1.623 . . . . 171.83 106.617 161.298 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' LEU . . . . . 0.409 ' CD2' HD12 ' A' ' 107' ' ' LEU . 8.8 mp -51.99 -47.75 64.74 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 125.954 2.034 . . . . 172.78 110.084 171.593 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 76' ' ' SER . . . . . . . . . . . . . 12.1 t -50.54 -30.31 12.73 Favored 'General case' 0 N--CA 1.486 1.328 0 O-C-N 124.395 1.059 . . . . 109.49 108.658 176.561 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' HIS . . . . . 0.597 ' HA ' ' OE1' ' A' ' 79' ' ' GLU . 74.3 m80 -111.59 52.08 0.76 Allowed 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 105.764 -1.939 . . . . 142.06 105.764 176.911 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 78' ' ' THR . . . . . 0.612 ' HB ' HD12 ' A' ' 80' ' ' LEU . 9.9 m -128.19 134.28 49.02 Favored 'General case' 0 C--O 1.273 2.292 0 C-N-CA 126.522 1.929 . . . . 120.08 108.521 160.974 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 79' ' ' GLU . . . . . 0.494 ' HA ' ' O ' ' A' ' 78' ' ' THR . 18.3 mt-10 -73.83 139.53 45.17 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 105.169 -2.16 . . . . 181.27 105.169 170.516 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 80' ' ' LEU . . . . . 0.556 ' H ' HD23 ' B' ' 80' ' ' LEU . 0.2 OUTLIER -67.64 -30.52 70.1 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 125.619 1.825 . . . . 143.63 107.68 -169.062 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.14 -60.34 6.75 Favored Glycine 0 N--CA 1.474 1.182 0 O-C-N 125.068 1.48 . . . . 106.68 110.469 168.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' THR . . . . . . . . . . . . . 1.3 m -57.95 -29.48 65.21 Favored 'General case' 0 C--O 1.268 2.037 0 CA-C-O 117.159 -1.401 . . . . 126.46 107.429 -178.518 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' LEU . . . . . 0.477 ' HB3' ' O ' ' B' ' 80' ' ' LEU . 10.9 tp -71.59 -59.89 2.52 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 125.359 1.662 . . . . 110.33 110.69 174.266 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 84' ' ' GLN . . . . . 0.541 ' HA ' ' OE1' ' B' ' 84' ' ' GLN . 3.4 tp60 -39.73 -63.88 0.54 Allowed 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 125.544 1.538 . . . . 139.63 109.287 171.997 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -36.62 -40.77 0.27 Allowed 'General case' 0 C--O 1.272 2.281 0 CA-C-O 116.983 -1.484 . . . . 120.72 110.499 178.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' TYR . . . . . 0.558 ' O ' ' HB3' ' B' ' 89' ' ' ALA . 24.5 t80 -75.52 -66.88 0.72 Allowed 'General case' 0 N--CA 1.492 1.642 0 CA-C-O 115.903 -1.999 . . . . 132.29 109.302 -175.456 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 87' ' ' VAL . . . . . 0.513 HG21 ' HB2' ' B' ' 94' ' ' LEU . 24.1 m -52.45 -36.84 22.47 Favored 'Isoleucine or valine' 0 C--O 1.288 3.086 0 O-C-N 125.395 1.684 . . . . 117.9 107.727 -175.1 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.58 -50.58 65.27 Favored 'General case' 0 N--CA 1.483 1.212 0 O-C-N 126.43 2.331 . . . . 104.54 108.923 169.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' ALA . . . . . 0.558 ' HB3' ' O ' ' B' ' 86' ' ' TYR . . . -58.36 -24.68 60.56 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 126.713 2.508 . . . . 106.81 111.004 -179.176 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 44.7 mt -101.19 5.12 42.5 Favored 'General case' 0 C--O 1.259 1.575 0 O-C-N 124.124 0.89 . . . . 130.49 108.652 179.651 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' GLY . . . . . . . . . . . . . . . 77.1 21.82 72.76 Favored Glycine 0 N--CA 1.48 1.625 0 CA-C-O 116.266 -2.408 . . . . 140.13 114.133 169.766 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' GLY . . . . . . . . . . . . . . . -110.42 164.41 12.26 Favored Glycine 0 N--CA 1.484 1.892 0 C-N-CA 127.13 2.3 . . . . 146.81 110.369 165.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -121.47 129.71 53.13 Favored 'General case' 0 N--CA 1.496 1.856 0 CA-C-N 119.174 1.487 . . . . 167.13 110.013 -174.042 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 94' ' ' LEU . . . . . 0.513 ' HB2' HG21 ' B' ' 87' ' ' VAL . 22.7 tp -77.4 114.9 16.7 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 127.492 2.317 . . . . 143.24 110.156 -168.722 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 95' ' ' ARG . . . . . . . . . . . . . 22.0 ttt180 -108.88 105.61 15.24 Favored 'General case' 0 C--O 1.275 2.429 0 O-C-N 124.381 1.05 . . . . 193.1 108.435 -173.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' ILE . . . . . 0.527 HG12 ' CD1' ' A' ' 96' ' ' ILE . 61.6 mt -99.42 100.43 10.43 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 125.478 1.736 . . . . 101.01 109.15 -175.539 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 97' ' ' VAL . . . . . . . . . . . . . 16.9 t -99.72 137.57 26.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 124.612 1.195 . . . . 132.12 108.075 178.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -112.35 98.2 7.13 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.266 1.427 . . . . 113.27 107.78 169.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' GLU . . . . . 0.618 ' HA ' HG23 ' B' ' 104' ' ' THR . 37.2 mt-10 -77.78 169.78 17.7 Favored 'General case' 0 N--CA 1.488 1.473 0 CA-C-O 116.859 -1.543 . . . . 164.87 110.254 -176.698 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 100' ' ' PHE . . . . . 0.712 ' HB2' ' O ' ' B' ' 103' ' ' ASN . 98.6 m-85 -169.31 37.2 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.819 0 O-C-N 125.292 1.62 . . . . 129.05 113.245 -178.056 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 88.86 -46.88 3.34 Favored Glycine 0 N--CA 1.484 1.894 0 CA-C-N 120.465 1.484 . . . . 133.32 112.108 171.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 10.6 tm-20 -137.66 -72.04 0.43 Allowed 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 106.893 -1.521 . . . . 176.08 106.893 159.162 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 103' ' ' ASN . . . . . 0.712 ' O ' ' HB2' ' B' ' 100' ' ' PHE . 0.8 OUTLIER -43.89 119.11 1.62 Allowed 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 105.705 -1.961 . . . . 192.77 105.705 179.712 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 104' ' ' THR . . . . . 0.618 HG23 ' HA ' ' B' ' 99' ' ' GLU . 3.0 m -118.6 166.93 12.12 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-O 114.85 -2.5 . . . . 126.23 104.496 177.13 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 105' ' ' VAL . . . . . 0.633 HG21 HD13 ' A' ' 44' ' ' ILE . 46.8 t -147.32 109.35 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 126.226 2.204 . . . . 105.91 109.708 -177.759 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 106' ' ' GLU . . . . . 0.49 ' O ' ' HA ' ' A' ' 38' ' ' ALA . 0.2 OUTLIER -84.67 141.89 30.29 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 105.785 -1.932 . . . . 113.65 105.785 178.236 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 107' ' ' LEU . . . . . 0.505 HD12 HD11 ' A' ' 75' ' ' LEU . 3.6 mm? -111.65 113.09 25.24 Favored 'General case' 0 C--O 1.275 2.417 0 C-N-CA 123.501 0.72 . . . . 128.86 109.471 -169.704 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 108' ' ' THR . . . . . . . . . . . . . 11.9 p -122.33 75.78 1.27 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 126.143 2.152 . . . . 161.81 107.661 -159.91 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -136.54 115.79 12.59 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 124.892 1.37 . . . . 169.07 109.733 -171.414 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' LEU . . . . . 0.446 ' O ' ' CB ' ' B' ' 111' ' ' GLU . 5.9 mp -135.38 166.67 22.63 Favored 'General case' 0 N--CA 1.499 1.983 0 C-N-CA 125.141 1.377 . . . . 201.17 110.254 -178.248 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 111' ' ' GLU . . . . . 0.446 ' CB ' ' O ' ' B' ' 110' ' ' LEU . 85.1 tt0 114.82 91.49 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.995 0 C-N-CA 127.287 2.235 . . . . 191.54 109.543 -179.827 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 112' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 -84.6 163.35 19.36 Favored 'General case' 0 N--CA 1.496 1.867 0 C-N-CA 125.845 1.658 . . . . 219.42 110.454 177.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.495 1.789 0 C-N-CA 125.299 1.44 . . . . 204.9 108.881 169.674 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 1' ' ' ' DC' . . . . . 0.481 ' H6 ' ' C5 ' ' C' ' 2' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.537 0.864 0 C1'-O4'-C4' 104.637 -3.616 . . . . 224.98 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 2' ' ' ' DC' . . . . . 0.481 ' C5 ' ' H6 ' ' C' ' 1' ' ' ' DC' . . . . . . . . 0 P--O3' 1.628 1.779 0 C3'-C2'-C1' 100.877 -1.302 . . . . 185.43 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 3' ' ' ' DA' . . . . . 0.694 ' N1 ' ' N2 ' ' D' ' 19' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.453 0.656 0 C2'-C3'-O3' 114.439 1.422 . . . . 232.77 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 4' ' ' ' DC' . . . . . 0.488 H2'' H5'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 C3'--C2' 1.511 -0.659 0 C3'-C2'-C1' 99.581 -2.228 . . . . 206.96 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 5' ' ' ' DG' . . . . . 0.514 H2'' " C5'" ' C' ' 6' ' ' ' DA' . . . . . . . . 0 P--O3' 1.578 -2.384 0 C3'-C2'-C1' 98.305 -3.139 . . . . 212.23 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 6' ' ' ' DA' . . . . . 0.514 " C5'" H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.429 0.695 0 C4'-C3'-C2' 101.64 -1.56 . . . . 259.35 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.537 0.947 0 N19-C1'-C2' 116.109 1.193 . . . . 239.16 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 8' ' ' ' DA' . . . . . 0.728 " H2'" ' C6 ' ' C' ' 9' ' ' ' DT' . . . . . . . . 0 P--O3' 1.633 2.205 0 C3'-C2'-C1' 105.693 2.138 . . . . 260.94 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 9' ' ' ' DT' . . . . . 0.728 ' C6 ' " H2'" ' C' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.535 0.711 0 C4'-C3'-O3' 116.627 2.876 . . . . 229.8 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 10' ' ' ' DA' . . . . . 0.409 " H1'" ' C4 ' ' C' ' 11' ' ' ' DT' . . . . . . . . 0 P--OP2 1.496 0.634 0 P-O3'-C3' 122.282 2.152 . . . . 227.8 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 11' ' ' ' DT' . . . . . 0.409 ' C4 ' " H1'" ' C' ' 10' ' ' ' DA' . . . . . . . . 0 P--OP1 1.515 1.763 0 C2'-C3'-O3' 118.735 3.013 . . . . 210.99 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 12' ' ' ' DA' . . . . . 0.72 ' N6 ' ' O4 ' ' D' ' 9' ' ' ' DT' . . . . . . . . 0 P--O3' 1.652 3.751 0 C5'-C4'-C3' 111.732 -1.979 . . . . 184.8 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 13' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.626 1.611 0 C4'-C3'-C2' 100.5 -2.7 . . . . 209.57 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.621 1.17 0 P-O3'-C3' 121.93 1.859 . . . . 187.88 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.589 -0.445 0 N19-C1'-C2' 116.236 1.272 . . . . 203.2 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.514 -0.369 0 P-O3'-C3' 120.948 1.04 . . . . 218.88 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.59 -1.388 0 O5'-P-OP1 111.285 1.098 . . . . 269.61 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 18' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.618 0.909 0 C3'-C2'-C1' 100.322 -1.698 . . . . 237.0 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 19' ' ' ' DA' . . . . . 0.72 H2'' ' H8 ' ' C' ' 20' ' ' ' DG' . . . . . . . . 0 O3'--C3' 1.422 -0.719 0 C4'-C3'-O3' 106.877 -1.556 . . . . 240.24 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 20' ' ' ' DG' . . . . . 0.72 ' H8 ' H2'' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 P--O3' 1.574 -2.746 0 C1'-O4'-C4' 105.703 -2.855 . . . . 217.66 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.406 -1.075 0 C1'-O4'-C4' 106.19 -2.507 . . . . 210.01 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 2' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.825 0 O5'-C5'-C4' 112.01 1.293 . . . . 169.34 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.62 1.082 0 C1'-O4'-C4' 106.25 -2.464 . . . . 185.29 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 4' ' ' ' DT' . . . . . 0.643 ' OP2' ' HB2' ' A' ' 68' ' ' SER . . . . . . . . 0 P--O3' 1.63 1.911 0 C2'-C3'-O3' 114.198 1.333 . . . . 200.44 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 5' ' ' ' DA' . . . . . 0.425 H2'' ' OP2' ' D' ' 6' ' ' ' DG' . . . . . . . . 0 P--O3' 1.582 -2.11 0 C3'-C2'-C1' 99.778 -2.087 . . . . 219.91 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 6' ' ' ' DG' . . . . . 0.577 " H2'" ' C8 ' ' D' ' 7' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.522 -0.596 0 C2'-C3'-O3' 115.51 1.819 . . . . 230.17 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 7' ' ' ' DG' . . . . . 0.577 ' C8 ' " H2'" ' D' ' 6' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.454 0.755 0 C3'-C2'-C1' 100.104 -1.854 . . . . 250.23 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 8' ' ' ' DT' . . . . . 0.444 H5'' H2'' ' D' ' 7' ' ' ' DG' . . . . . . . . 0 P--O3' 1.603 -0.364 0 P-O3'-C3' 120.406 0.588 . . . . 270.76 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 9' ' ' ' DT' . . . . . 0.72 ' O4 ' ' N6 ' ' C' ' 12' ' ' ' DA' . . . . . . . . 0 P--O3' 1.596 -0.906 0 C3'-C2'-C1' 99.907 -1.995 . . . . 249.23 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 10' ' ' ' DA' . . . . . 0.402 H2'' ' C5 ' ' D' ' 11' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.452 0.541 0 O4'-C1'-C2' 104.957 -1.039 . . . . 284.12 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 11' ' ' ' DT' . . . . . 0.402 ' C5 ' H2'' ' D' ' 10' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.854 0 N19-C1'-C2' 117.017 1.76 . . . . 234.11 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.597 -0.867 0 C4'-C3'-O3' 113.536 1.471 . . . . 222.05 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 13' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.639 2.658 0 C2'-C3'-O3' 115.842 1.941 . . . . 231.6 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 14' ' ' ' DC' . . . . . 0.531 " O5'" ' NH2' ' B' ' 66' ' ' ARG . . . . . . . . 0 P--O5' 1.604 1.059 0 O5'-C5'-C4' 113.279 2.199 . . . . 196.51 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 15' ' ' ' DT' . . . . . 0.509 ' H73' ' HD3' ' B' ' 66' ' ' ARG . . . . . . . . 0 P--O3' 1.617 0.859 0 C4'-C3'-C2' 100.934 -2.266 . . . . 227.82 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 16' ' ' ' DC' . . . . . 0.475 " H2'" ' C8 ' ' D' ' 17' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.521 -0.736 0 O5'-P-OP1 102.482 -1.937 . . . . 210.67 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 17' ' ' ' DG' . . . . . 0.475 ' C8 ' " H2'" ' D' ' 16' ' ' ' DC' . . . . . . . . 0 P--O3' 1.592 -1.254 0 N19-C1'-C2' 116.286 1.304 . . . . 235.36 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 18' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.425 -0.486 0 C4'-C3'-O3' 108.274 -0.921 . . . . 221.55 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 19' ' ' ' DG' . . . . . 0.694 ' N2 ' ' N1 ' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 P--O3' 1.589 -1.531 0 C3'-C2'-C1' 99.89 -2.007 . . . . 235.54 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.59 -1.438 0 C3'-C2'-C1' 100.673 -1.448 . . . . 246.52 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.519 3.001 0 N-CA-C 107.601 -1.259 . . . . 139.87 107.601 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.419 ' HG ' ' H ' ' A' ' 38' ' ' ALA . 5.4 tp -64.04 -157.08 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.895 0 C-N-CA 127.151 2.18 . . . . 161.31 110.661 -165.345 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.49 ' HA ' ' O ' ' B' ' 106' ' ' GLU . . . -170.85 17.36 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.231 0 N-CA-C 115.152 1.538 . . . . 154.38 115.152 172.654 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.425 ' HB2' ' OE2' ' A' ' 43' ' ' GLU . 2.6 m170 -126.13 -124.25 0.24 Allowed 'General case' 0 N--CA 1.493 1.694 0 CA-C-N 121.519 1.963 . . . . 202.91 110.662 -164.491 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.467 ' O ' ' HB2' ' A' ' 43' ' ' GLU . 71.7 mmt-85 -67.13 147.24 53.37 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 125.042 1.464 . . . . 192.39 109.714 -170.528 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.589 ' O ' HG22 ' A' ' 44' ' ' ILE . 66.3 mt -58.88 -52.43 65.77 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 107.245 -1.391 . . . . 170.66 107.245 173.338 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -43.5 -44.3 5.91 Favored 'General case' 0 C--O 1.259 1.558 0 N-CA-C 107.268 -1.382 . . . . 131.1 107.268 -179.051 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.467 ' HB2' ' O ' ' A' ' 40' ' ' ARG . 1.9 tt0 -48.88 -49.13 41.16 Favored 'General case' 0 C--O 1.256 1.432 0 O-C-N 125.865 1.978 . . . . 199.64 109.537 -179.126 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.633 HD13 HG21 ' B' ' 105' ' ' VAL . 1.3 tp -73.2 -42.44 58.26 Favored 'Isoleucine or valine' 0 C--O 1.272 2.242 0 CA-C-O 117.971 -1.014 . . . . 163.95 109.503 -176.507 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.595 ' NH1' ' OE2' ' A' ' 71' ' ' GLU . 8.2 ttp-105 -52.18 -65.37 0.57 Allowed 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 105.866 -1.902 . . . . 144.55 105.866 173.654 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 8.4 ttpp -38.75 -56.62 1.32 Allowed 'General case' 0 C--O 1.257 1.463 0 O-C-N 126.72 2.512 . . . . 160.66 104.863 178.662 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.488 ' HB3' HD12 ' A' ' 44' ' ' ILE . . . -50.26 -46.34 54.92 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 126.195 1.798 . . . . 118.19 111.911 -179.091 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.404 HD13 ' O ' ' A' ' 44' ' ' ILE . 11.2 mp -62.86 -167.44 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.786 0 CA-C-N 120.294 1.406 . . . . 133.02 108.412 174.213 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -47.03 154.18 1.02 Allowed Glycine 0 C--O 1.26 1.747 0 N-CA-C 110.063 -1.215 . . . . 143.43 110.063 161.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -69.32 46.31 0.06 Allowed 'General case' 0 C--O 1.263 1.773 0 C-N-CA 124.558 1.143 . . . . 187.91 110.133 -173.781 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -50.69 150.2 2.94 Favored 'General case' 0 C--O 1.271 2.214 0 C-N-CA 126.432 1.893 . . . . 165.72 108.471 170.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 32.6 mtm105 -112.45 147.23 36.93 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 125.081 1.488 . . . . 170.57 109.041 -178.386 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.439 ' O ' ' HB2' ' A' ' 57' ' ' ALA . 13.5 pt20 -62.09 -7.05 3.47 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 123.724 0.64 . . . . 149.95 109.408 179.923 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.596 ' HA ' ' HG2' ' A' ' 64' ' ' GLN . . . -76.1 -53.79 7.79 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-O 117.74 -1.124 . . . . 163.45 110.652 173.118 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 16.2 p-10 -92.1 -5.04 53.49 Favored 'General case' 0 C--O 1.271 2.231 0 CA-C-O 117.869 -1.062 . . . . 142.03 110.139 -173.483 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.456 ' O ' ' C ' ' A' ' 57' ' ' ALA . 0.8 OUTLIER -73.84 -64.68 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 N-CA-C 104.21 -2.515 . . . . 149.27 104.21 153.74 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.493 ' O ' ' N ' ' A' ' 61' ' ' GLY . . . -32.98 -45.77 0.14 Allowed 'General case' 0 C--O 1.266 1.946 0 N-CA-C 107.522 -1.288 . . . . 139.03 107.522 -175.682 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.421 ' N ' ' O ' ' A' ' 56' ' ' VAL . . . -58.18 -63.81 1.13 Allowed 'General case' 0 C--O 1.255 1.363 0 C-N-CA 126.335 1.854 . . . . 124.82 109.356 -177.622 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 14.5 mt -56.35 -13.63 2.34 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 124.742 1.217 . . . . 121.33 110.138 176.013 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' MET . . . . . 0.409 ' HE1' ' HD1' ' A' ' 86' ' ' TYR . 5.4 ttm -103.87 -14.25 16.09 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-O 118.194 -0.908 . . . . 164.14 109.125 175.734 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 57' ' ' ALA . . . 62.63 18.03 58.38 Favored Glycine 0 N--CA 1.478 1.464 0 C-N-CA 124.437 1.018 . . . . 151.37 112.987 175.477 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 18.8 m -111.98 170.28 3.92 Favored 'Isoleucine or valine' 0 C--O 1.285 2.948 0 N-CA-C 108.521 -0.918 . . . . 132.15 108.521 170.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 11.3 p -54.82 165.51 0.61 Allowed 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 107.552 -1.277 . . . . 144.21 107.552 -177.207 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.596 ' HG2' ' HA ' ' A' ' 54' ' ' ALA . 6.8 mt-30 -93.27 1.08 57.16 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 107.494 -1.299 . . . . 169.42 107.494 174.449 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -72.01 -70.71 0.32 Allowed 'General case' 0 C--O 1.248 1.017 0 C-N-CA 127.235 2.214 . . . . 176.49 108.685 165.085 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.633 ' NH2' ' OP2' ' C' ' 12' ' ' ' DA' . 54.6 tpt85 -35.37 -55.0 0.66 Allowed 'General case' 0 N--CA 1.485 1.292 0 O-C-N 125.324 1.64 . . . . 182.69 108.407 179.575 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.468 HG21 ' HB2' ' A' ' 57' ' ' ALA . 49.1 t -48.17 -47.68 13.26 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 O-C-N 124.696 1.248 . . . . 167.71 109.179 -174.191 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' SER . . . . . 0.643 ' HB2' ' OP2' ' D' ' 4' ' ' ' DT' . 0.0 OUTLIER -54.29 -68.49 0.18 Allowed 'General case' 0 C--O 1.264 1.83 0 CA-C-O 116.785 -1.579 . . . . 144.72 107.423 168.844 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 35.2 mttp -45.42 -21.39 0.09 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 124.573 1.17 . . . . 162.19 110.225 -176.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.542 HD21 ' CG2' ' A' ' 82' ' ' THR . 0.2 OUTLIER -70.63 -61.59 1.71 Allowed 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 107.54 -1.281 . . . . 128.49 107.54 172.635 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.595 ' OE2' ' NH1' ' A' ' 45' ' ' ARG . 48.2 mt-10 -77.12 -14.13 59.84 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 124.51 1.132 . . . . 141.29 110.204 -172.91 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 71.7 m -88.95 -5.86 57.67 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 124.231 1.012 . . . . 148.17 109.409 171.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -83.89 172.33 49.74 Favored Glycine 0 C--O 1.254 1.405 0 O-C-N 124.265 0.978 . . . . 132.84 111.512 -177.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 51.5 t0 -89.33 104.09 16.67 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 126.723 2.009 . . . . 180.59 108.865 167.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.505 HD11 HD12 ' B' ' 107' ' ' LEU . 0.3 OUTLIER -32.72 -53.0 0.33 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 124.636 1.21 . . . . 131.58 110.465 174.406 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.1 p -48.78 -39.84 26.69 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 117.007 -1.473 . . . . 165.85 109.097 -173.363 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 75.9 m80 -100.66 56.55 0.89 Allowed 'General case' 0 N--CA 1.493 1.722 0 O-C-N 126.185 2.178 . . . . 129.46 111.05 177.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' THR . . . . . 0.494 ' O ' ' HA ' ' B' ' 79' ' ' GLU . 21.2 m -141.8 146.63 36.12 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 126.613 1.965 . . . . 127.85 107.026 177.85 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.597 ' OE1' ' HA ' ' B' ' 77' ' ' HIS . 2.7 mt-10 -81.37 136.0 35.7 Favored 'General case' 0 C--O 1.263 1.8 0 O-C-N 124.975 1.422 . . . . 150.34 107.97 -172.65 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.612 HD12 ' HB ' ' B' ' 78' ' ' THR . 5.1 mt -50.17 -36.92 32.29 Favored 'General case' 0 C--O 1.255 1.382 0 O-C-N 124.348 1.03 . . . . 137.76 109.608 -172.88 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.557 ' HA2' ' HB3' ' A' ' 84' ' ' GLN . . . -73.96 -37.24 50.58 Favored Glycine 0 C--O 1.256 1.475 0 CA-C-O 117.401 -1.777 . . . . 119.09 111.604 177.893 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' THR . . . . . 0.542 ' CG2' HD21 ' A' ' 70' ' ' LEU . 5.9 m -47.68 -56.53 7.07 Favored 'General case' 0 N--CA 1.485 1.291 0 N-CA-C 103.583 -2.747 . . . . 100.54 103.583 -177.046 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 31.8 tp -56.31 -64.96 0.69 Allowed 'General case' 0 N--CA 1.477 0.885 0 CA-C-N 112.928 -1.942 . . . . 142.11 108.841 177.127 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.557 ' HB3' ' HA2' ' A' ' 81' ' ' GLY . 51.2 tt0 -40.5 -33.89 0.3 Allowed 'General case' 0 C--O 1.271 2.23 0 O-C-N 125.382 1.676 . . . . 135.85 110.16 -179.799 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.539 ' HB3' ' O ' ' A' ' 82' ' ' THR . . . -75.03 -58.1 3.49 Favored 'General case' 0 C--O 1.264 1.844 0 O-C-N 125.498 1.749 . . . . 126.46 107.63 179.471 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.409 ' HD1' ' HE1' ' A' ' 60' ' ' MET . 90.4 t80 -47.9 -52.07 20.79 Favored 'General case' 0 C--N 1.255 -3.522 0 C-N-CA 126.289 1.836 . . . . 137.22 107.275 179.661 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.736 HG11 ' HB2' ' A' ' 94' ' ' LEU . 4.8 p -67.88 -32.68 57.49 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.847 0 O-C-N 127.546 3.029 . . . . 139.92 111.476 -174.294 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.91 -46.5 84.55 Favored 'General case' 0 C--O 1.257 1.482 0 O-C-N 124.657 1.223 . . . . 103.95 107.923 174.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -57.04 -29.88 63.77 Favored 'General case' 0 C--O 1.25 1.099 0 O-C-N 125.734 1.896 . . . . 138.36 109.901 -176.591 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 8.1 mp -88.65 10.98 18.73 Favored 'General case' 0 C--O 1.273 2.291 0 O-C-N 124.029 0.83 . . . . 137.31 110.666 179.082 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 68.45 35.81 82.56 Favored Glycine 0 C--O 1.262 1.883 0 N-CA-C 110.059 -1.216 . . . . 128.16 110.059 -177.264 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -114.63 170.08 13.13 Favored Glycine 0 N--CA 1.473 1.121 0 CA-C-O 116.334 -2.37 . . . . 114.65 110.165 178.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 -126.01 97.72 5.22 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 125.513 1.525 . . . . 123.27 109.842 -179.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.736 ' HB2' HG11 ' A' ' 87' ' ' VAL . 10.4 tp -54.18 128.47 31.16 Favored 'General case' 0 N--CA 1.49 1.53 0 CA-C-O 117.346 -1.311 . . . . 111.22 110.088 176.047 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 6.3 ttm180 -129.75 102.74 6.46 Favored 'General case' 0 C--O 1.262 1.749 0 O-C-N 125.772 1.92 . . . . 191.53 107.84 -174.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.527 ' CD1' HG12 ' B' ' 96' ' ' ILE . 36.3 mm -99.54 115.68 40.97 Favored 'Isoleucine or valine' 0 C--O 1.266 1.932 0 N-CA-C 106.36 -1.719 . . . . 123.02 106.36 -178.31 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 61.1 t -113.93 147.29 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 O-C-N 126.224 2.203 . . . . 129.28 108.153 167.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -119.39 82.23 1.84 Allowed 'General case' 0 C--O 1.261 1.689 0 O-C-N 126.641 2.463 . . . . 131.15 107.684 169.34 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -80.42 129.16 34.33 Favored 'General case' 0 C--O 1.266 1.951 0 C-N-CA 124.4 1.08 . . . . 152.44 110.616 -175.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' PHE . . . . . 0.77 ' CD1' HD11 ' B' ' 48' ' ' LEU . 92.4 m-85 -116.91 82.95 1.89 Allowed 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 126.931 2.092 . . . . 123.75 108.889 178.878 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 46.41 -131.27 11.51 Favored Glycine 0 C--O 1.251 1.197 0 O-C-N 120.564 -1.335 . . . . 151.41 111.977 -173.25 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -45.28 -49.05 12.88 Favored 'General case' 0 C--O 1.259 1.575 0 C-N-CA 125.185 1.394 . . . . 161.7 110.609 -166.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 -95.81 160.99 14.2 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 124.78 1.3 . . . . 181.72 110.037 177.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 10.5 p -133.16 166.03 23.4 Favored 'General case' 0 C--O 1.272 2.286 0 C-N-CA 125.359 1.464 . . . . 166.11 109.695 172.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 59.8 t -130.27 103.89 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 125.177 1.548 . . . . 152.3 107.636 177.224 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -72.38 122.7 21.64 Favored 'General case' 0 C--O 1.259 1.593 0 N-CA-C 107.454 -1.314 . . . . 133.01 107.454 171.53 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.409 HD12 ' CD2' ' B' ' 75' ' ' LEU . 1.1 mm? -79.13 131.1 36.12 Favored 'General case' 0 C--O 1.265 1.869 0 O-C-N 124.84 1.338 . . . . 136.43 108.433 177.266 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' THR . . . . . 0.473 ' O ' ' OG1' ' A' ' 108' ' ' THR . 0.6 OUTLIER -143.83 99.68 3.45 Favored 'General case' 0 N--CA 1.493 1.712 0 C-N-CA 126.706 2.002 . . . . 185.28 108.221 -177.972 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -139.18 87.01 2.17 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 125.014 1.326 . . . . 231.63 108.809 -179.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.401 ' C ' HD13 ' A' ' 110' ' ' LEU . 3.0 tm? -130.04 106.01 8.35 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 124.655 1.222 . . . . 235.05 111.196 -170.742 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -155.56 109.16 2.79 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 127.607 2.363 . . . . 213.18 108.442 171.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 9.5 m80 -28.89 143.9 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.072 0 C-N-CA 127.264 2.226 . . . . 205.83 112.739 -176.661 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HIS . . . . . . . . . . . . . 37.3 t60 . . . . . 0 N--CA 1.496 1.874 0 C-N-CA 125.431 1.492 . . . . 189.11 109.91 179.234 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' VAL . . . . . 0.513 HG22 ' O ' ' B' ' 36' ' ' VAL . 5.6 p . . . . . 0 N--CA 1.517 2.913 0 CA-C-O 118.471 -0.776 . . . . 166.09 110.326 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 5.3 tt 169.02 122.02 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.839 0 C-N-CA 128.379 2.672 . . . . 158.84 106.231 -175.051 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' ALA . . . . . . . . . . . . . . . -153.52 148.74 26.92 Favored 'General case' 0 N--CA 1.491 1.602 0 CA-C-N 120.082 1.31 . . . . 174.61 111.948 -174.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -99.63 -15.78 18.45 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 126.197 1.799 . . . . 201.44 109.983 176.285 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 35.6 mmt180 -121.61 124.24 43.86 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 125.917 1.687 . . . . 238.74 110.48 -172.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' LEU . . . . . 0.553 ' HB2' ' HG2' ' B' ' 71' ' ' GLU . 87.7 mt -62.36 -42.68 99.6 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 124.261 0.976 . . . . 150.71 109.514 -178.713 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.01 -42.41 69.07 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 117.064 -1.446 . . . . 144.7 108.402 177.709 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -63.88 -31.9 73.24 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 124.088 0.867 . . . . 178.77 110.668 -169.407 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.483 HG12 ' O ' ' B' ' 41' ' ' LEU . 2.0 pt -75.29 -40.51 43.14 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 CA-C-O 116.218 -1.848 . . . . 152.02 109.737 175.875 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' ARG . . . . . 0.726 ' HG3' ' HB3' ' B' ' 51' ' ' ALA . 8.0 ttp-105 -55.98 -41.44 74.79 Favored 'General case' 0 N--CA 1.5 2.042 0 CA-C-N 119.681 1.128 . . . . 161.25 109.74 -179.745 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 21.9 mmtp -63.04 -42.24 99.69 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.342 1.057 . . . . 167.52 108.455 175.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.26 -21.34 66.28 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.591 1.156 . . . . 139.13 110.521 172.581 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' LEU . . . . . 0.77 HD11 ' CD1' ' A' ' 100' ' ' PHE . 6.4 mt -103.03 69.55 1.04 Allowed 'General case' 0 C--O 1.261 1.682 0 C-N-CA 124.124 0.97 . . . . 159.01 109.063 -178.614 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . 55.37 -166.86 3.02 Favored Glycine 0 C--O 1.254 1.391 0 O-C-N 124.081 0.863 . . . . 146.96 111.154 -178.789 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' HIS . . . . . 0.485 ' CG ' ' O ' ' B' ' 50' ' ' HIS . 85.1 t60 -77.0 30.56 0.13 Allowed 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 124.999 1.319 . . . . 237.36 110.052 -176.322 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' ALA . . . . . 0.726 ' HB3' ' HG3' ' B' ' 45' ' ' ARG . . . -53.96 124.11 14.51 Favored 'General case' 0 C--O 1.281 2.714 0 N-CA-C 107.553 -1.277 . . . . 137.77 107.553 -177.253 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . . 13.6 ttp-105 -93.05 159.44 15.3 Favored 'General case' 0 N--CA 1.483 1.202 0 O-C-N 124.26 0.975 . . . . 170.85 110.644 179.128 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' GLN . . . . . 0.566 HE21 ' NH2' ' B' ' 45' ' ' ARG . 5.7 tt0 -74.82 -22.67 58.58 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-O 117.307 -1.33 . . . . 146.75 110.34 -175.654 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -92.9 -15.6 26.18 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 127.103 2.161 . . . . 139.82 110.24 -176.314 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -86.44 -49.4 7.64 Favored 'General case' 0 C--O 1.269 2.092 0 O-C-N 125.676 1.86 . . . . 142.69 108.07 173.679 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' VAL . . . . . . . . . . . . . 40.4 t -68.04 -20.28 25.65 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 O-C-N 124.299 0.999 . . . . 126.9 108.708 177.372 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.94 -52.34 44.24 Favored 'General case' 0 C--O 1.272 2.276 0 CA-C-O 118.145 -0.931 . . . . 127.1 109.201 168.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.34 -45.38 93.68 Favored 'General case' 0 N--CA 1.483 1.223 0 O-C-N 126.218 2.199 . . . . 121.49 110.884 -166.179 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 8.9 mp -70.12 -22.29 63.02 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 117.832 -1.08 . . . . 136.08 109.846 -178.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 81.2 mtp -96.07 7.45 46.35 Favored 'General case' 0 C--O 1.253 1.279 0 C-N-CA 123.974 0.91 . . . . 130.0 109.719 -175.407 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 62.5 19.91 60.69 Favored Glycine 0 C--O 1.259 1.715 0 CA-C-O 117.889 -1.506 . . . . 114.58 114.319 172.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' VAL . . . . . . . . . . . . . 34.8 m -130.97 179.08 4.64 Favored 'Isoleucine or valine' 0 C--O 1.271 2.195 0 C-N-CA 125.176 1.39 . . . . 134.53 108.422 -176.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 82.5 p -75.62 160.76 29.76 Favored 'General case' 0 C--O 1.264 1.863 0 C-N-CA 126.68 1.992 . . . . 149.82 110.346 -177.056 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 8.8 tm0? -64.94 -40.59 95.25 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 125.478 1.736 . . . . 129.57 110.148 168.367 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' ALA . . . . . . . . . . . . . . . -41.51 -66.52 0.33 Allowed 'General case' 0 C--O 1.255 1.369 0 C-N-CA 124.328 1.051 . . . . 155.56 108.534 171.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' ARG . . . . . 0.531 ' NH2' " O5'" ' D' ' 14' ' ' ' DC' . 21.5 tpt180 -44.19 -43.97 7.48 Favored 'General case' 0 C--O 1.256 1.424 0 O-C-N 125.338 1.648 . . . . 188.22 109.955 -176.701 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' VAL . . . . . . . . . . . . . 48.5 t -68.94 -41.23 81.83 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.927 0 O-C-N 124.23 0.956 . . . . 145.57 111.514 -170.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.25 -56.48 18.18 Favored 'General case' 0 C--O 1.272 2.262 0 N-CA-C 108.642 -0.873 . . . . 170.19 108.642 173.004 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -48.31 -20.82 0.43 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 124.54 1.15 . . . . 172.59 108.966 174.391 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 2.0 tt -76.23 -56.74 4.37 Favored 'General case' 0 C--O 1.247 0.937 0 CA-C-O 117.941 -1.028 . . . . 137.36 108.333 178.057 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' GLU . . . . . 0.553 ' HG2' ' HB2' ' B' ' 41' ' ' LEU . 10.8 mt-10 -84.11 -12.72 54.57 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 125.231 1.582 . . . . 145.78 110.148 -169.473 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' SER . . . . . . . . . . . . . 1.2 m -73.6 -41.02 63.4 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 126.045 2.091 . . . . 191.72 109.259 162.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' GLY . . . . . . . . . . . . . . . -51.54 150.43 7.33 Favored Glycine 0 C--O 1.262 1.905 0 O-C-N 124.567 1.167 . . . . 141.04 113.468 -175.36 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -64.82 117.1 7.03 Favored 'General case' 0 C--O 1.257 1.481 0 N-CA-C 106.617 -1.623 . . . . 171.83 106.617 161.298 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' LEU . . . . . 0.409 ' CD2' HD12 ' A' ' 107' ' ' LEU . 8.8 mp -51.99 -47.75 64.74 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 125.954 2.034 . . . . 172.78 110.084 171.593 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' SER . . . . . . . . . . . . . 12.1 t -50.54 -30.31 12.73 Favored 'General case' 0 N--CA 1.486 1.328 0 O-C-N 124.395 1.059 . . . . 109.49 108.658 176.561 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' HIS . . . . . 0.597 ' HA ' ' OE1' ' A' ' 79' ' ' GLU . 74.3 m80 -111.59 52.08 0.76 Allowed 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 105.764 -1.939 . . . . 142.06 105.764 176.911 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' THR . . . . . 0.612 ' HB ' HD12 ' A' ' 80' ' ' LEU . 9.9 m -128.19 134.28 49.02 Favored 'General case' 0 C--O 1.273 2.292 0 C-N-CA 126.522 1.929 . . . . 120.08 108.521 160.974 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' GLU . . . . . 0.494 ' HA ' ' O ' ' A' ' 78' ' ' THR . 18.3 mt-10 -73.83 139.53 45.17 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 105.169 -2.16 . . . . 181.27 105.169 170.516 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' LEU . . . . . 0.556 ' H ' HD23 ' B' ' 80' ' ' LEU . 0.2 OUTLIER -67.64 -30.52 70.1 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 125.619 1.825 . . . . 143.63 107.68 -169.062 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.14 -60.34 6.75 Favored Glycine 0 N--CA 1.474 1.182 0 O-C-N 125.068 1.48 . . . . 106.68 110.469 168.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' THR . . . . . . . . . . . . . 1.3 m -57.95 -29.48 65.21 Favored 'General case' 0 C--O 1.268 2.037 0 CA-C-O 117.159 -1.401 . . . . 126.46 107.429 -178.518 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.477 ' HB3' ' O ' ' B' ' 80' ' ' LEU . 10.9 tp -71.59 -59.89 2.52 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 125.359 1.662 . . . . 110.33 110.69 174.266 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' GLN . . . . . 0.541 ' HA ' ' OE1' ' B' ' 84' ' ' GLN . 3.4 tp60 -39.73 -63.88 0.54 Allowed 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 125.544 1.538 . . . . 139.63 109.287 171.997 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -36.62 -40.77 0.27 Allowed 'General case' 0 C--O 1.272 2.281 0 CA-C-O 116.983 -1.484 . . . . 120.72 110.499 178.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' TYR . . . . . 0.558 ' O ' ' HB3' ' B' ' 89' ' ' ALA . 24.5 t80 -75.52 -66.88 0.72 Allowed 'General case' 0 N--CA 1.492 1.642 0 CA-C-O 115.903 -1.999 . . . . 132.29 109.302 -175.456 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' VAL . . . . . 0.513 HG21 ' HB2' ' B' ' 94' ' ' LEU . 24.1 m -52.45 -36.84 22.47 Favored 'Isoleucine or valine' 0 C--O 1.288 3.086 0 O-C-N 125.395 1.684 . . . . 117.9 107.727 -175.1 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.58 -50.58 65.27 Favored 'General case' 0 N--CA 1.483 1.212 0 O-C-N 126.43 2.331 . . . . 104.54 108.923 169.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' ALA . . . . . 0.558 ' HB3' ' O ' ' B' ' 86' ' ' TYR . . . -58.36 -24.68 60.56 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 126.713 2.508 . . . . 106.81 111.004 -179.176 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 44.7 mt -101.19 5.12 42.5 Favored 'General case' 0 C--O 1.259 1.575 0 O-C-N 124.124 0.89 . . . . 130.49 108.652 179.651 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' GLY . . . . . . . . . . . . . . . 77.1 21.82 72.76 Favored Glycine 0 N--CA 1.48 1.625 0 CA-C-O 116.266 -2.408 . . . . 140.13 114.133 169.766 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' GLY . . . . . . . . . . . . . . . -110.42 164.41 12.26 Favored Glycine 0 N--CA 1.484 1.892 0 C-N-CA 127.13 2.3 . . . . 146.81 110.369 165.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -121.47 129.71 53.13 Favored 'General case' 0 N--CA 1.496 1.856 0 CA-C-N 119.174 1.487 . . . . 167.13 110.013 -174.042 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' LEU . . . . . 0.513 ' HB2' HG21 ' B' ' 87' ' ' VAL . 22.7 tp -77.4 114.9 16.7 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 127.492 2.317 . . . . 143.24 110.156 -168.722 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' ARG . . . . . . . . . . . . . 22.0 ttt180 -108.88 105.61 15.24 Favored 'General case' 0 C--O 1.275 2.429 0 O-C-N 124.381 1.05 . . . . 193.1 108.435 -173.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' ILE . . . . . 0.527 HG12 ' CD1' ' A' ' 96' ' ' ILE . 61.6 mt -99.42 100.43 10.43 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 125.478 1.736 . . . . 101.01 109.15 -175.539 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' VAL . . . . . . . . . . . . . 16.9 t -99.72 137.57 26.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 124.612 1.195 . . . . 132.12 108.075 178.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -112.35 98.2 7.13 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.266 1.427 . . . . 113.27 107.78 169.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' GLU . . . . . 0.618 ' HA ' HG23 ' B' ' 104' ' ' THR . 37.2 mt-10 -77.78 169.78 17.7 Favored 'General case' 0 N--CA 1.488 1.473 0 CA-C-O 116.859 -1.543 . . . . 164.87 110.254 -176.698 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' PHE . . . . . 0.712 ' HB2' ' O ' ' B' ' 103' ' ' ASN . 98.6 m-85 -169.31 37.2 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.819 0 O-C-N 125.292 1.62 . . . . 129.05 113.245 -178.056 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 88.86 -46.88 3.34 Favored Glycine 0 N--CA 1.484 1.894 0 CA-C-N 120.465 1.484 . . . . 133.32 112.108 171.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 10.6 tm-20 -137.66 -72.04 0.43 Allowed 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 106.893 -1.521 . . . . 176.08 106.893 159.162 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' ASN . . . . . 0.712 ' O ' ' HB2' ' B' ' 100' ' ' PHE . 0.8 OUTLIER -43.89 119.11 1.62 Allowed 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 105.705 -1.961 . . . . 192.77 105.705 179.712 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' THR . . . . . 0.618 HG23 ' HA ' ' B' ' 99' ' ' GLU . 3.0 m -118.6 166.93 12.12 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-O 114.85 -2.5 . . . . 126.23 104.496 177.13 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' VAL . . . . . 0.633 HG21 HD13 ' A' ' 44' ' ' ILE . 46.8 t -147.32 109.35 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 126.226 2.204 . . . . 105.91 109.708 -177.759 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' GLU . . . . . 0.49 ' O ' ' HA ' ' A' ' 38' ' ' ALA . 0.2 OUTLIER -84.67 141.89 30.29 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 105.785 -1.932 . . . . 113.65 105.785 178.236 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' LEU . . . . . 0.505 HD12 HD11 ' A' ' 75' ' ' LEU . 3.6 mm? -111.65 113.09 25.24 Favored 'General case' 0 C--O 1.275 2.417 0 C-N-CA 123.501 0.72 . . . . 128.86 109.471 -169.704 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' THR . . . . . . . . . . . . . 11.9 p -122.33 75.78 1.27 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 126.143 2.152 . . . . 161.81 107.661 -159.91 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -136.54 115.79 12.59 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 124.892 1.37 . . . . 169.07 109.733 -171.414 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' LEU . . . . . 0.446 ' O ' ' CB ' ' B' ' 111' ' ' GLU . 5.9 mp -135.38 166.67 22.63 Favored 'General case' 0 N--CA 1.499 1.983 0 C-N-CA 125.141 1.377 . . . . 201.17 110.254 -178.248 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' GLU . . . . . 0.446 ' CB ' ' O ' ' B' ' 110' ' ' LEU . 85.1 tt0 114.82 91.49 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.995 0 C-N-CA 127.287 2.235 . . . . 191.54 109.543 -179.827 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 -84.6 163.35 19.36 Favored 'General case' 0 N--CA 1.496 1.867 0 C-N-CA 125.845 1.658 . . . . 219.42 110.454 177.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.495 1.789 0 C-N-CA 125.299 1.44 . . . . 204.9 108.881 169.674 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 1' ' ' ' DC' . . . . . 0.481 ' H6 ' ' C5 ' ' C' ' 2' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.537 0.864 0 C1'-O4'-C4' 104.637 -3.616 . . . . 224.98 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 2' ' ' ' DC' . . . . . 0.481 ' C5 ' ' H6 ' ' C' ' 1' ' ' ' DC' . . . . . . . . 0 P--O3' 1.628 1.779 0 C3'-C2'-C1' 100.877 -1.302 . . . . 185.43 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 3' ' ' ' DA' . . . . . 0.694 ' N1 ' ' N2 ' ' D' ' 19' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.453 0.656 0 C2'-C3'-O3' 114.439 1.422 . . . . 232.77 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 4' ' ' ' DC' . . . . . 0.488 H2'' H5'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 C3'--C2' 1.511 -0.659 0 C3'-C2'-C1' 99.581 -2.228 . . . . 206.96 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 5' ' ' ' DG' . . . . . 0.514 H2'' " C5'" ' C' ' 6' ' ' ' DA' . . . . . . . . 0 P--O3' 1.578 -2.384 0 C3'-C2'-C1' 98.305 -3.139 . . . . 212.23 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 6' ' ' ' DA' . . . . . 0.514 " C5'" H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.429 0.695 0 C4'-C3'-C2' 101.64 -1.56 . . . . 259.35 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.537 0.947 0 N19-C1'-C2' 116.109 1.193 . . . . 239.16 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 8' ' ' ' DA' . . . . . 0.728 " H2'" ' C6 ' ' C' ' 9' ' ' ' DT' . . . . . . . . 0 P--O3' 1.633 2.205 0 C3'-C2'-C1' 105.693 2.138 . . . . 260.94 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 9' ' ' ' DT' . . . . . 0.728 ' C6 ' " H2'" ' C' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.535 0.711 0 C4'-C3'-O3' 116.627 2.876 . . . . 229.8 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 10' ' ' ' DA' . . . . . 0.409 " H1'" ' C4 ' ' C' ' 11' ' ' ' DT' . . . . . . . . 0 P--OP2 1.496 0.634 0 P-O3'-C3' 122.282 2.152 . . . . 227.8 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 11' ' ' ' DT' . . . . . 0.409 ' C4 ' " H1'" ' C' ' 10' ' ' ' DA' . . . . . . . . 0 P--OP1 1.515 1.763 0 C2'-C3'-O3' 118.735 3.013 . . . . 210.99 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 12' ' ' ' DA' . . . . . 0.72 ' N6 ' ' O4 ' ' D' ' 9' ' ' ' DT' . . . . . . . . 0 P--O3' 1.652 3.751 0 C5'-C4'-C3' 111.732 -1.979 . . . . 184.8 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 13' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.626 1.611 0 C4'-C3'-C2' 100.5 -2.7 . . . . 209.57 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.621 1.17 0 P-O3'-C3' 121.93 1.859 . . . . 187.88 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.589 -0.445 0 N19-C1'-C2' 116.236 1.272 . . . . 203.2 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.514 -0.369 0 P-O3'-C3' 120.948 1.04 . . . . 218.88 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.59 -1.388 0 O5'-P-OP1 111.285 1.098 . . . . 269.61 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 18' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.618 0.909 0 C3'-C2'-C1' 100.322 -1.698 . . . . 237.0 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 19' ' ' ' DA' . . . . . 0.72 H2'' ' H8 ' ' C' ' 20' ' ' ' DG' . . . . . . . . 0 O3'--C3' 1.422 -0.719 0 C4'-C3'-O3' 106.877 -1.556 . . . . 240.24 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 20' ' ' ' DG' . . . . . 0.72 ' H8 ' H2'' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 P--O3' 1.574 -2.746 0 C1'-O4'-C4' 105.703 -2.855 . . . . 217.66 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.406 -1.075 0 C1'-O4'-C4' 106.19 -2.507 . . . . 210.01 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 2' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.825 0 O5'-C5'-C4' 112.01 1.293 . . . . 169.34 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.62 1.082 0 C1'-O4'-C4' 106.25 -2.464 . . . . 185.29 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 4' ' ' ' DT' . . . . . 0.643 ' OP2' ' HB2' ' A' ' 68' ' ' SER . . . . . . . . 0 P--O3' 1.63 1.911 0 C2'-C3'-O3' 114.198 1.333 . . . . 200.44 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 5' ' ' ' DA' . . . . . 0.425 H2'' ' OP2' ' D' ' 6' ' ' ' DG' . . . . . . . . 0 P--O3' 1.582 -2.11 0 C3'-C2'-C1' 99.778 -2.087 . . . . 219.91 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 6' ' ' ' DG' . . . . . 0.577 " H2'" ' C8 ' ' D' ' 7' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.522 -0.596 0 C2'-C3'-O3' 115.51 1.819 . . . . 230.17 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 7' ' ' ' DG' . . . . . 0.577 ' C8 ' " H2'" ' D' ' 6' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.454 0.755 0 C3'-C2'-C1' 100.104 -1.854 . . . . 250.23 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 8' ' ' ' DT' . . . . . 0.444 H5'' H2'' ' D' ' 7' ' ' ' DG' . . . . . . . . 0 P--O3' 1.603 -0.364 0 P-O3'-C3' 120.406 0.588 . . . . 270.76 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 9' ' ' ' DT' . . . . . 0.72 ' O4 ' ' N6 ' ' C' ' 12' ' ' ' DA' . . . . . . . . 0 P--O3' 1.596 -0.906 0 C3'-C2'-C1' 99.907 -1.995 . . . . 249.23 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 10' ' ' ' DA' . . . . . 0.402 H2'' ' C5 ' ' D' ' 11' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.452 0.541 0 O4'-C1'-C2' 104.957 -1.039 . . . . 284.12 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 11' ' ' ' DT' . . . . . 0.402 ' C5 ' H2'' ' D' ' 10' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.854 0 N19-C1'-C2' 117.017 1.76 . . . . 234.11 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.597 -0.867 0 C4'-C3'-O3' 113.536 1.471 . . . . 222.05 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 13' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.639 2.658 0 C2'-C3'-O3' 115.842 1.941 . . . . 231.6 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 14' ' ' ' DC' . . . . . 0.531 " O5'" ' NH2' ' B' ' 66' ' ' ARG . . . . . . . . 0 P--O5' 1.604 1.059 0 O5'-C5'-C4' 113.279 2.199 . . . . 196.51 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 15' ' ' ' DT' . . . . . 0.509 ' H73' ' HD3' ' B' ' 66' ' ' ARG . . . . . . . . 0 P--O3' 1.617 0.859 0 C4'-C3'-C2' 100.934 -2.266 . . . . 227.82 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 16' ' ' ' DC' . . . . . 0.475 " H2'" ' C8 ' ' D' ' 17' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.521 -0.736 0 O5'-P-OP1 102.482 -1.937 . . . . 210.67 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 17' ' ' ' DG' . . . . . 0.475 ' C8 ' " H2'" ' D' ' 16' ' ' ' DC' . . . . . . . . 0 P--O3' 1.592 -1.254 0 N19-C1'-C2' 116.286 1.304 . . . . 235.36 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 18' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.425 -0.486 0 C4'-C3'-O3' 108.274 -0.921 . . . . 221.55 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 19' ' ' ' DG' . . . . . 0.694 ' N2 ' ' N1 ' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 P--O3' 1.589 -1.531 0 C3'-C2'-C1' 99.89 -2.007 . . . . 235.54 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.59 -1.438 0 C3'-C2'-C1' 100.673 -1.448 . . . . 246.52 . . . . . . . . . . 0 0 . 1 stop_ save_