data_6w9q_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 6w9q _Structure_validation_residue.Date_analyzed 2020-04-03 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 ' -9' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.207 -1.145 0 CA-C-O 115.431 -2.223 . . . . 85.76 110.577 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' -8' ' ' LEU . . . . . . . . . . . . . 27.4 mt -45.81 133.53 8.3 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 125.582 1.801 . . . . 62.73 113.932 -173.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' -7' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -140.82 155.73 46.3 Favored 'General case' 0 N--CA 1.483 1.191 0 O-C-N 124.723 1.265 . . . . 71.28 110.495 -179.467 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' -6' ' ' VAL . . . . . . . . . . . . . 31.6 m -140.09 152.01 21.85 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 N-CA-C 107.031 -1.47 . . . . 49.7 107.031 176.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' -5' ' ' LEU . . . . . . . . . . . . . 28.3 mt -92.46 111.46 23.05 Favored 'General case' 0 C--O 1.193 -1.878 0 N-CA-C 107.622 -1.251 . . . . 65.07 107.622 179.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' -4' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -74.73 130.64 39.85 Favored 'General case' 0 C--N 1.312 -1.059 0 O-C-N 124.587 1.179 . . . . 80.48 110.891 177.1 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' -3' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -79.76 83.78 5.66 Favored 'General case' 0 N--CA 1.465 0.275 0 N-CA-C 107.625 -1.25 . . . . 89.47 107.625 175.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 159.98 -176.54 36.68 Favored Glycine 0 N--CA 1.442 -0.922 0 CA-C-N 115.194 -0.912 . . . . 82.23 112.644 -175.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_exo -79.27 -27.4 8.37 Favored 'Cis proline' 0 N--CA 1.474 0.343 0 N-CA-C 115.394 1.267 . . . . 104.44 115.394 7.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -126.43 177.52 17.18 Favored Glycine 0 N--CA 1.447 -0.6 0 CA-C-O 121.854 0.697 . . . . 105.1 112.246 -175.478 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 49.3 m-80 51.06 -141.94 0.74 Allowed 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 114.502 -0.849 . . . . 150.44 110.956 174.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -115.96 61.64 0.71 Allowed 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 107.318 -1.364 . . . . 106.71 107.318 162.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -101.83 163.35 12.3 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.453 0.645 . . . . 100.49 109.664 176.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 98.0 mt -126.34 126.45 43.93 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 107.568 -1.271 . . . . 64.31 107.568 -175.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.3 m -122.15 126.77 26.17 Favored Pre-proline 0 N--CA 1.443 -0.791 0 CA-C-N 116.721 -0.218 . . . . 65.13 110.609 178.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_exo -69.86 124.36 10.96 Favored 'Trans proline' 0 N--CA 1.474 0.367 0 C-N-CA 120.774 0.983 . . . . 59.14 109.913 173.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 10.8 m -124.45 158.28 31.51 Favored 'Isoleucine or valine' 0 C--N 1.341 0.212 0 N-CA-C 108.613 -0.884 . . . . 62.36 108.613 172.56 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.25 134.47 39.8 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.343 -0.844 . . . . 60.95 110.659 -176.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 27.7 tp -93.18 92.65 7.85 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 106.713 -1.588 . . . . 60.44 106.713 167.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 80.1 mtt85 -78.39 162.22 26.59 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 122.059 0.933 . . . . 108.59 111.572 -170.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 62.9 mt-30 -127.46 135.66 50.72 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 114.691 -1.141 . . . . 91.02 108.24 -169.269 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.4 ptt? -146.57 149.18 33.07 Favored 'General case' 0 C--O 1.193 -1.89 0 C-N-CA 117.638 -1.625 . . . . 71.8 108.74 176.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.4 t -70.28 149.82 47.02 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 124.848 1.342 . . . . 85.08 108.921 176.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 23.3 p -160.9 165.67 29.7 Favored 'General case' 0 CA--C 1.519 -0.243 0 C-N-CA 117.908 -1.517 . . . . 69.17 110.315 175.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -102.37 126.21 49.31 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 114.741 -1.118 . . . . 72.47 109.754 -174.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -129.04 171.28 12.52 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 108.546 -0.909 . . . . 71.62 108.546 178.663 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -175.91 -177.97 45.35 Favored Glycine 0 N--CA 1.452 -0.25 0 N-CA-C 110.823 -0.911 . . . . 65.77 110.823 177.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 80.8 p -76.82 -29.6 56.02 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 115.013 -0.593 . . . . 78.17 112.549 -179.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 32.9 p -129.13 168.81 15.58 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 123.659 0.784 . . . . 97.39 109.039 173.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 42.6 mt-30 -58.56 -40.95 84.52 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 115.549 -0.751 . . . . 102.58 110.712 175.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.7 p -65.87 -28.66 69.13 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 120.034 -0.666 . . . . 101.63 111.303 176.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.36 -21.35 63.81 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 113.22 0.822 . . . . 101.03 113.22 -173.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 71.4 m -65.52 88.44 0.09 Allowed 'General case' 0 C--O 1.206 -1.195 0 O-C-N 124.582 1.176 . . . . 95.06 109.93 -177.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' THR . . . . . 0.593 ' OG1' ' N ' ' A' ' 25' ' ' ASP . 72.3 p -90.2 -93.74 0.12 Allowed 'General case' 0 C--O 1.204 -1.3 0 O-C-N 125.568 1.793 . . . . 119.66 111.075 -177.057 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ASP . . . . . 0.593 ' N ' ' OG1' ' A' ' 24' ' ' THR . 98.5 m-20 -103.65 -176.74 3.17 Favored 'General case' 0 N--CA 1.481 1.125 0 O-C-N 124.305 1.003 . . . . 144.93 110.277 -178.276 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -75.94 110.8 10.69 Favored 'General case' 0 C--N 1.329 -0.311 0 O-C-N 125.586 1.804 . . . . 94.44 109.584 -171.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 39.1 p-10 -134.6 24.86 3.73 Favored 'General case' 0 C--O 1.24 0.558 0 C-N-CA 119.983 -0.687 . . . . 77.96 112.17 -179.07 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -159.75 170.87 20.6 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 118.966 0.803 . . . . 64.64 109.29 178.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -123.91 121.09 34.42 Favored 'General case' 0 C--O 1.19 -2.047 0 N-CA-C 107.466 -1.309 . . . . 82.37 107.466 178.846 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -98.59 128.74 45.01 Favored 'General case' 0 C--N 1.317 -0.835 0 O-C-N 124.736 1.272 . . . . 55.82 109.286 179.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -93.79 129.98 39.97 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.855 -0.794 . . . . 64.91 108.855 172.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 43.9 p90 -141.18 156.43 45.93 Favored 'General case' 0 CA--C 1.523 -0.071 0 C-N-CA 119.133 -1.027 . . . . 65.24 112.182 -175.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -103.88 149.17 25.33 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.44 -1.255 . . . . 79.04 108.818 166.021 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 25.7 p -89.69 133.83 34.46 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 107.886 -1.153 . . . . 82.89 107.886 165.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 6.4 t -146.4 178.71 8.05 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.696 0.76 . . . . 106.93 110.518 -165.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -60.37 -21.66 62.39 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 114.942 -1.026 . . . . 131.18 112.238 179.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -90.11 -30.71 12.0 Favored Glycine 0 N--CA 1.449 -0.448 0 N-CA-C 111.444 -0.662 . . . . 114.69 111.444 173.061 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 138.46 -120.33 1.95 Allowed Glycine 0 CA--C 1.52 0.35 0 N-CA-C 111.856 -0.498 . . . . 103.83 111.856 -178.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.02 120.54 26.25 Favored 'General case' 0 C--O 1.205 -1.259 0 N-CA-C 106.083 -1.821 . . . . 104.73 106.083 175.046 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -109.35 114.39 28.01 Favored 'General case' 0 C--N 1.308 -1.201 0 N-CA-C 107.359 -1.348 . . . . 82.35 107.359 173.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.8 t -92.68 130.56 41.61 Favored 'Isoleucine or valine' 0 C--O 1.238 0.485 0 N-CA-C 109.476 -0.564 . . . . 56.68 109.476 -178.441 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.1 mp -103.42 -40.58 6.31 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 113.318 0.859 . . . . 62.91 113.318 -178.908 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -153.45 159.18 42.27 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.82 -0.807 . . . . 48.52 108.82 -176.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 8.2 mp -113.42 145.31 41.35 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 114.645 -1.161 . . . . 55.11 108.886 169.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 18.4 tp -115.52 129.07 56.41 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 107.944 -1.132 . . . . 62.24 107.944 169.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 38.7 t -148.62 164.14 35.19 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.598 0.713 . . . . 65.51 110.71 -178.157 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -83.26 -27.69 29.7 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 114.872 -1.058 . . . . 93.79 111.396 170.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 6.5 mp -80.25 150.14 30.15 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.009 -0.676 . . . . 88.35 110.188 -177.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -109.99 0.81 18.67 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 112.951 0.722 . . . . 97.57 112.951 -179.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -98.24 5.2 48.63 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 124.152 0.981 . . . . 110.38 112.962 -174.502 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 76.0 mt -72.93 136.39 45.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.253 0.549 . . . . 69.65 110.699 -169.162 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -131.21 -8.63 3.8 Favored 'General case' 0 C--O 1.183 -2.417 0 CA-C-O 117.465 -1.255 . . . . 129.63 108.022 173.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 91.0 m95 -143.25 148.39 36.34 Favored 'General case' 0 C--O 1.187 -2.234 0 CA-C-O 118.01 -0.995 . . . . 80.86 109.959 -176.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -131.81 149.65 52.39 Favored 'General case' 0 C--O 1.187 -2.229 0 O-C-N 126.246 2.216 . . . . 61.74 106.868 177.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 6.9 ttp85 -132.52 131.92 42.1 Favored 'General case' 0 C--O 1.195 -1.812 0 C-N-CA 118.899 -1.121 . . . . 99.14 109.566 -175.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -128.31 132.97 24.65 Favored Pre-proline 0 C--O 1.188 -2.143 0 O-C-N 124.796 1.31 . . . . 70.97 109.215 179.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -81.49 139.29 11.34 Favored 'Trans proline' 0 C--O 1.17 -2.901 0 N-CA-C 105.587 -2.505 . . . . 87.29 105.587 175.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 13.8 mttt -63.7 143.53 57.76 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 123.745 0.653 . . . . 112.09 109.775 177.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 4.2 p -45.42 -62.34 1.31 Allowed 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 125.077 1.351 . . . . 137.25 109.644 177.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -42.4 -52.23 4.67 Favored 'General case' 0 N--CA 1.485 1.294 0 O-C-N 126.127 2.142 . . . . 150.14 110.381 176.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 111.28 9.12 22.47 Favored Glycine 0 N--CA 1.478 1.437 0 N-CA-C 110.608 -0.997 . . . . 114.33 110.608 -178.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 11.7 p -89.28 14.84 10.09 Favored 'General case' 0 C--O 1.209 -1.037 0 CA-C-O 116.808 -1.568 . . . . 104.82 111.636 -176.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 152.75 -178.01 30.13 Favored Glycine 0 C--O 1.216 -0.996 0 C-N-CA 118.956 -1.592 . . . . 83.85 113.227 179.749 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 4.1 p -129.79 157.41 42.29 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.76 0.791 . . . . 104.32 110.06 178.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 36.6 mt -120.99 133.9 66.13 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.446 0 CA-C-N 114.039 -1.437 . . . . 83.4 109.514 179.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 63.6 m-85 -110.78 119.0 37.68 Favored 'General case' 0 C--O 1.192 -1.941 0 N-CA-C 105.622 -1.992 . . . . 79.55 105.622 176.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 13.2 m -111.71 139.48 47.13 Favored 'General case' 0 C--O 1.189 -2.116 0 O-C-N 124.441 1.088 . . . . 75.81 109.852 -178.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -82.02 135.69 35.32 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 125.429 1.706 . . . . 93.69 109.707 -178.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 75.6 mt -102.76 151.55 22.27 Favored 'General case' 0 N--CA 1.484 1.274 0 O-C-N 124.647 1.217 . . . . 65.37 109.874 -179.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -83.18 167.98 25.64 Favored Pre-proline 0 N--CA 1.48 1.046 0 O-C-N 124.775 1.297 . . . . 88.59 108.408 175.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -59.31 136.05 69.56 Favored 'Trans proline' 0 C--O 1.204 -1.179 0 N-CA-C 106.393 -2.195 . . . . 77.08 106.393 176.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -70.61 172.81 12.75 Favored 'Trans proline' 0 C--O 1.205 -1.162 0 N-CA-C 118.017 2.276 . . . . 63.07 118.017 -174.154 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 62.8 m -126.81 138.31 53.33 Favored 'General case' 0 C--O 1.177 -2.73 0 N-CA-C 106.276 -1.75 . . . . 87.4 106.276 175.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.1 ptm180 -108.17 141.38 39.99 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 124.808 1.318 . . . . 102.78 109.682 -175.5 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 50.1 p90 -146.38 167.07 24.49 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 107.603 -1.258 . . . . 65.23 107.603 167.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 13.8 t -109.7 139.13 34.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 107.433 -1.321 . . . . 76.1 107.433 179.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 10.1 t -143.04 139.27 30.47 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 106.999 -1.482 . . . . 98.02 106.999 178.124 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -83.61 100.36 10.78 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 107.295 -1.372 . . . . 133.18 107.295 -175.505 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.6 p -88.92 168.09 16.53 Favored Pre-proline 0 C--O 1.237 0.415 0 C-N-CA 123.237 0.615 . . . . 115.56 109.914 -177.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_exo -55.54 -26.28 53.76 Favored 'Trans proline' 0 C--O 1.238 0.503 0 N-CA-C 114.145 0.787 . . . . 124.73 114.145 177.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -96.13 15.13 21.66 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 118.643 0.656 . . . . 138.97 112.729 175.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 104.62 -178.47 24.09 Favored Glycine 0 N--CA 1.446 -0.649 0 CA-C-N 118.26 0.482 . . . . 98.59 112.385 178.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -69.82 137.24 34.8 Favored 'Trans proline' 0 C--O 1.233 0.242 0 CA-C-O 121.519 0.549 . . . . 90.85 111.686 -176.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 8.7 mttt -141.06 148.3 39.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.559 -0.746 . . . . 99.9 109.409 177.234 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 11.0 p -77.23 135.49 26.4 Favored 'Isoleucine or valine' 0 C--O 1.239 0.512 0 N-CA-C 108.766 -0.827 . . . . 77.92 108.766 169.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 28.7 mmtt -121.74 148.91 44.02 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 107.52 -1.289 . . . . 78.68 107.52 172.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -114.67 132.25 56.46 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 108.333 -0.988 . . . . 77.04 108.333 -179.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 45.8 tp -108.41 116.46 32.01 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.274 -1.009 . . . . 55.16 108.274 -178.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 67.6 m-85 -107.94 112.28 24.8 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 109.335 -0.617 . . . . 57.91 109.335 -179.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 35.2 m-85 -74.96 142.48 43.92 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.431 -0.508 . . . . 61.25 110.19 169.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 35.3 mm -56.14 136.98 18.34 Favored 'Isoleucine or valine' 0 C--O 1.24 0.601 0 CA-C-N 115.734 -0.667 . . . . 66.67 109.919 172.285 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 3.1 tmtt? -58.74 128.87 39.37 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.283 -0.567 . . . . 108.79 109.505 -179.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 87.12 4.55 81.4 Favored Glycine 0 N--CA 1.444 -0.82 0 CA-C-O 118.905 -0.941 . . . . 71.28 115.346 -179.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 24.8 tp -64.2 133.02 52.04 Favored 'General case' 0 C--O 1.198 -1.61 0 C-N-CA 118.687 -1.205 . . . . 66.01 108.419 -177.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 45.6 p30 -71.7 161.8 30.42 Favored 'General case' 0 C--O 1.196 -1.748 0 O-C-N 124.324 1.015 . . . . 69.32 111.064 -178.074 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -63.94 -32.23 73.69 Favored 'General case' 0 C--O 1.176 -2.806 0 CA-C-O 117.622 -1.18 . . . . 69.19 112.023 -176.769 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 16.8 tp -67.43 -46.69 72.39 Favored 'General case' 0 C--O 1.173 -2.937 0 C-N-CA 117.93 -1.508 . . . . 62.87 109.266 -178.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 70.2 m-20 -69.18 -35.01 75.81 Favored 'General case' 0 C--N 1.318 -0.79 0 C-N-CA 118.979 -1.088 . . . . 60.17 111.327 -179.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.3 ttm180 -59.26 -45.05 92.23 Favored 'General case' 0 C--O 1.179 -2.651 0 N-CA-C 108.255 -1.017 . . . . 96.83 108.255 175.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -67.28 -39.54 92.06 Favored Glycine 0 C--O 1.178 -3.348 0 CA-C-O 118.691 -1.06 . . . . 45.65 111.926 179.112 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 4.5 mtp -56.93 -45.66 82.57 Favored 'General case' 0 C--O 1.174 -2.87 0 CA-C-N 117.97 0.885 . . . . 88.92 109.593 -179.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 46.1 t -63.85 -46.67 93.63 Favored 'Isoleucine or valine' 0 C--O 1.17 -3.101 0 CA-C-O 118.833 -0.603 . . . . 46.4 110.284 179.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 21.7 mt -61.48 -39.03 89.46 Favored 'General case' 0 C--O 1.186 -2.242 0 CA-C-O 118.096 -0.954 . . . . 48.66 110.369 -177.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -75.87 -37.45 38.89 Favored Glycine 0 C--O 1.188 -2.771 0 CA-C-O 118.7 -1.056 . . . . 47.9 111.326 178.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 46.9 t -69.01 -39.42 79.3 Favored 'General case' 0 C--N 1.31 -1.12 0 C-N-CA 120.357 -0.537 . . . . 40.93 111.044 -176.388 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 73.5 mt -78.99 -11.17 60.0 Favored 'General case' 0 CA--C 1.508 -0.637 0 C-N-CA 119.155 -1.018 . . . . 53.27 113.159 -176.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -63.98 -44.86 91.43 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 112.887 0.699 . . . . 50.03 112.887 -161.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -63.91 -31.96 73.33 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 119.3 -0.96 . . . . 47.6 112.129 -178.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' THR . . . . . 0.515 ' CG2' ' O ' ' A' ' 302' ' ' HOH . 30.5 p -81.51 -29.44 33.58 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 119.528 -0.869 . . . . 61.91 112.557 -178.568 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 87.1 t -62.04 -42.5 95.18 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 CA-C-N 119.25 0.932 . . . . 59.33 110.224 170.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 19.9 tpt180 -69.92 -31.09 68.67 Favored 'General case' 0 C--O 1.244 0.807 0 C-N-CA 123.946 0.898 . . . . 65.32 112.984 -174.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 13.8 tp -67.83 146.77 53.37 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 123.462 0.705 . . . . 80.0 109.928 -178.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 . . . . . 0 C--O 1.238 0.485 0 CA-C-N 115.675 -0.693 . . . . 93.74 112.61 -177.437 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . 0.515 ' O ' ' CG2' ' A' ' 109' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' -9' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.207 -1.145 0 CA-C-O 115.431 -2.223 . . . . 85.760000000000005 110.577 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' -8' ' ' LEU . . . . . . . . . . . . . 27.4 mt -45.81 133.53 8.3 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 125.582 1.801 . . . . 62.729999999999997 113.932 -173.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' -7' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -140.82 155.73 46.3 Favored 'General case' 0 N--CA 1.483 1.191 0 O-C-N 124.723 1.265 . . . . 71.280000000000001 110.495 -179.467 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' -6' ' ' VAL . . . . . . . . . . . . . 31.6 m -140.09 152.01 21.85 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 N-CA-C 107.031 -1.47 . . . . 49.700000000000003 107.031 176.644 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' -5' ' ' LEU . . . . . . . . . . . . . 28.3 mt -92.46 111.46 23.05 Favored 'General case' 0 C--O 1.193 -1.878 0 N-CA-C 107.622 -1.251 . . . . 65.069999999999993 107.622 179.383 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' -4' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -74.73 130.64 39.85 Favored 'General case' 0 C--N 1.312 -1.059 0 O-C-N 124.587 1.179 . . . . 80.480000000000004 110.891 177.1 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' -3' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -79.76 83.78 5.66 Favored 'General case' 0 N--CA 1.465 0.275 0 N-CA-C 107.625 -1.25 . . . . 89.469999999999999 107.625 175.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 159.98 -176.54 36.68 Favored Glycine 0 N--CA 1.442 -0.922 0 CA-C-N 115.194 -0.912 . . . . 82.230000000000004 112.644 -175.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_exo -79.27 -27.4 8.37 Favored 'Cis proline' 0 N--CA 1.474 0.343 0 N-CA-C 115.394 1.267 . . . . 104.44 115.394 7.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -126.43 177.52 17.18 Favored Glycine 0 N--CA 1.447 -0.6 0 CA-C-O 121.854 0.697 . . . . 105.09999999999999 112.246 -175.478 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 49.3 m-80 51.06 -141.94 0.74 Allowed 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 114.502 -0.849 . . . . 150.44 110.956 174.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -115.96 61.64 0.71 Allowed 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 107.318 -1.364 . . . . 106.70999999999999 107.318 162.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -101.83 163.35 12.3 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.453 0.645 . . . . 100.48999999999999 109.664 176.059 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 98.0 mt -126.34 126.45 43.93 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 107.568 -1.271 . . . . 64.310000000000002 107.568 -175.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.3 m -122.15 126.77 26.17 Favored Pre-proline 0 N--CA 1.443 -0.791 0 CA-C-N 116.721 -0.218 . . . . 65.129999999999995 110.609 178.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_exo -69.86 124.36 10.96 Favored 'Trans proline' 0 N--CA 1.474 0.367 0 C-N-CA 120.774 0.983 . . . . 59.140000000000001 109.913 173.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 10.8 m -124.45 158.28 31.51 Favored 'Isoleucine or valine' 0 C--N 1.341 0.212 0 N-CA-C 108.613 -0.884 . . . . 62.359999999999999 108.613 172.56 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.25 134.47 39.8 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.343 -0.844 . . . . 60.950000000000003 110.659 -176.846 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 27.7 tp -93.18 92.65 7.85 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 106.713 -1.588 . . . . 60.439999999999998 106.713 167.396 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 80.1 mtt85 -78.39 162.22 26.59 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 122.059 0.933 . . . . 108.59 111.572 -170.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 62.9 mt-30 -127.46 135.66 50.72 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 114.691 -1.141 . . . . 91.019999999999996 108.24 -169.269 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.4 ptt? -146.57 149.18 33.07 Favored 'General case' 0 C--O 1.193 -1.89 0 C-N-CA 117.638 -1.625 . . . . 71.799999999999997 108.74 176.109 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.4 t -70.28 149.82 47.02 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 124.848 1.342 . . . . 85.079999999999998 108.921 176.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 23.3 p -160.9 165.67 29.7 Favored 'General case' 0 CA--C 1.519 -0.243 0 C-N-CA 117.908 -1.517 . . . . 69.170000000000002 110.315 175.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -102.37 126.21 49.31 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 114.741 -1.118 . . . . 72.469999999999999 109.754 -174.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -129.04 171.28 12.52 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 108.546 -0.909 . . . . 71.620000000000005 108.546 178.663 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -175.91 -177.97 45.35 Favored Glycine 0 N--CA 1.452 -0.25 0 N-CA-C 110.823 -0.911 . . . . 65.769999999999996 110.823 177.383 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 80.8 p -76.82 -29.6 56.02 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 115.013 -0.593 . . . . 78.170000000000002 112.549 -179.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' THR . . . . . 0.416 ' H ' ' HB3' ' A' ' 22' ' ' ALA . 32.9 p -129.13 168.81 15.58 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 123.659 0.784 . . . . 97.390000000000001 109.039 173.508 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 42.6 mt-30 -58.56 -40.95 84.52 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 115.549 -0.751 . . . . 102.58 110.712 175.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.7 p -65.87 -28.66 69.13 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 120.034 -0.666 . . . . 101.63 111.303 176.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ALA . . . . . 0.514 ' O ' HG23 ' A' ' 24' ' ' THR . . . -69.36 -21.35 63.81 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 113.22 0.822 . . . . 101.03 113.22 -173.555 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 71.4 m -65.52 88.44 0.09 Allowed 'General case' 0 C--O 1.206 -1.195 0 O-C-N 124.582 1.176 . . . . 95.060000000000002 109.93 -177.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' THR . . . . . 0.519 ' OG1' ' N ' ' A' ' 25' ' ' ASP . 72.3 p -90.2 -93.74 0.12 Allowed 'General case' 0 C--O 1.204 -1.3 0 O-C-N 125.568 1.793 . . . . 119.66 111.075 -177.057 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ASP . . . . . 0.519 ' N ' ' OG1' ' A' ' 24' ' ' THR . 98.5 m-20 -103.65 -176.74 3.17 Favored 'General case' 0 N--CA 1.481 1.125 0 O-C-N 124.305 1.003 . . . . 144.93000000000001 110.277 -178.276 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -75.94 110.8 10.69 Favored 'General case' 0 C--N 1.329 -0.311 0 O-C-N 125.586 1.804 . . . . 94.439999999999998 109.584 -171.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 39.1 p-10 -134.6 24.86 3.73 Favored 'General case' 0 C--O 1.24 0.558 0 C-N-CA 119.983 -0.687 . . . . 77.959999999999994 112.17 -179.07 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -159.75 170.87 20.6 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 118.966 0.803 . . . . 64.640000000000001 109.29 178.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -123.91 121.09 34.42 Favored 'General case' 0 C--O 1.19 -2.047 0 N-CA-C 107.466 -1.309 . . . . 82.370000000000005 107.466 178.846 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -98.59 128.74 45.01 Favored 'General case' 0 C--N 1.317 -0.835 0 O-C-N 124.736 1.272 . . . . 55.82 109.286 179.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -93.79 129.98 39.97 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.855 -0.794 . . . . 64.909999999999997 108.855 172.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' TYR . . . . . 0.438 ' CD2' ' HG3' ' A' ' 39' ' ' ARG . 43.9 p90 -141.18 156.43 45.93 Favored 'General case' 0 CA--C 1.523 -0.071 0 C-N-CA 119.133 -1.027 . . . . 65.239999999999995 112.182 -175.653 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -103.88 149.17 25.33 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.44 -1.255 . . . . 79.040000000000006 108.818 166.021 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 25.7 p -89.69 133.83 34.46 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 107.886 -1.153 . . . . 82.890000000000001 107.886 165.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' THR . . . . . 0.705 HG23 ' H ' ' A' ' 37' ' ' GLY . 6.4 t -146.4 178.71 8.05 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.696 0.76 . . . . 106.93000000000001 110.518 -165.046 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -60.37 -21.66 62.39 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 114.942 -1.026 . . . . 131.18000000000001 112.238 179.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLY . . . . . 0.705 ' H ' HG23 ' A' ' 35' ' ' THR . . . -90.11 -30.71 12.0 Favored Glycine 0 N--CA 1.449 -0.448 0 N-CA-C 111.444 -0.662 . . . . 114.69 111.444 173.061 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 138.46 -120.33 1.95 Allowed Glycine 0 CA--C 1.52 0.35 0 N-CA-C 111.856 -0.498 . . . . 103.83 111.856 -178.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ARG . . . . . 0.438 ' HG3' ' CD2' ' A' ' 32' ' ' TYR . 0.0 OUTLIER -84.02 120.54 26.25 Favored 'General case' 0 C--O 1.205 -1.259 0 N-CA-C 106.083 -1.821 . . . . 104.73 106.083 175.046 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -109.35 114.39 28.01 Favored 'General case' 0 C--N 1.308 -1.201 0 N-CA-C 107.359 -1.348 . . . . 82.349999999999994 107.359 173.291 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' VAL . . . . . 0.42 ' O ' HG13 ' A' ' 91' ' ' ILE . 61.8 t -92.68 130.56 41.61 Favored 'Isoleucine or valine' 0 C--O 1.238 0.485 0 N-CA-C 109.476 -0.564 . . . . 56.68 109.476 -178.441 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.1 mp -103.42 -40.58 6.31 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 113.318 0.859 . . . . 62.909999999999997 113.318 -178.908 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -153.45 159.18 42.27 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.82 -0.807 . . . . 48.520000000000003 108.82 -176.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 8.2 mp -113.42 145.31 41.35 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 114.645 -1.161 . . . . 55.109999999999999 108.886 169.323 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 18.4 tp -115.52 129.07 56.41 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 107.944 -1.132 . . . . 62.240000000000002 107.944 169.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 38.7 t -148.62 164.14 35.19 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.598 0.713 . . . . 65.510000000000005 110.71 -178.157 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -83.26 -27.69 29.7 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 114.872 -1.058 . . . . 93.790000000000006 111.396 170.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 6.5 mp -80.25 150.14 30.15 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.009 -0.676 . . . . 88.349999999999994 110.188 -177.809 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -109.99 0.81 18.67 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 112.951 0.722 . . . . 97.569999999999993 112.951 -179.138 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -98.24 5.2 48.63 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 124.152 0.981 . . . . 110.38 112.962 -174.502 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' LEU . . . . . 0.426 ' HB2' ' CZ ' ' A' ' 89' ' ' TYR . 76.0 mt -72.93 136.39 45.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.253 0.549 . . . . 69.650000000000006 110.699 -169.162 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -131.21 -8.63 3.8 Favored 'General case' 0 C--O 1.183 -2.417 0 CA-C-O 117.465 -1.255 . . . . 129.63 108.022 173.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 91.0 m95 -143.25 148.39 36.34 Favored 'General case' 0 C--O 1.187 -2.234 0 CA-C-O 118.01 -0.995 . . . . 80.859999999999999 109.959 -176.471 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -131.81 149.65 52.39 Favored 'General case' 0 C--O 1.187 -2.229 0 O-C-N 126.246 2.216 . . . . 61.740000000000002 106.868 177.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ARG . . . . . 0.516 ' HD3' ' CE1' ' A' ' 66' ' ' TYR . 6.9 ttp85 -132.52 131.92 42.1 Favored 'General case' 0 C--O 1.195 -1.812 0 C-N-CA 118.899 -1.121 . . . . 99.140000000000001 109.566 -175.216 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -128.31 132.97 24.65 Favored Pre-proline 0 C--O 1.188 -2.143 0 O-C-N 124.796 1.31 . . . . 70.969999999999999 109.215 179.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -81.49 139.29 11.34 Favored 'Trans proline' 0 C--O 1.17 -2.901 0 N-CA-C 105.587 -2.505 . . . . 87.290000000000006 105.587 175.292 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' LYS . . . . . 0.482 ' HD2' ' CA ' ' A' ' 63' ' ' GLY . 13.8 mttt -63.7 143.53 57.76 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 123.745 0.653 . . . . 112.09 109.775 177.522 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 4.2 p -45.42 -62.34 1.31 Allowed 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 125.077 1.351 . . . . 137.25 109.644 177.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASP . . . . . 0.494 ' HB3' HG23 ' A' ' 62' ' ' THR . 98.5 m-20 -42.4 -52.23 4.67 Favored 'General case' 0 N--CA 1.485 1.294 0 O-C-N 126.127 2.142 . . . . 150.13999999999999 110.381 176.9 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 111.28 9.12 22.47 Favored Glycine 0 N--CA 1.478 1.437 0 N-CA-C 110.608 -0.997 . . . . 114.33 110.608 -178.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' THR . . . . . 0.494 HG23 ' HB3' ' A' ' 60' ' ' ASP . 11.7 p -89.28 14.84 10.09 Favored 'General case' 0 C--O 1.209 -1.037 0 CA-C-O 116.808 -1.568 . . . . 104.81999999999999 111.636 -176.854 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLY . . . . . 0.482 ' CA ' ' HD2' ' A' ' 58' ' ' LYS . . . 152.75 -178.01 30.13 Favored Glycine 0 C--O 1.216 -0.996 0 C-N-CA 118.956 -1.592 . . . . 83.849999999999994 113.227 179.749 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 4.1 p -129.79 157.41 42.29 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.76 0.791 . . . . 104.31999999999999 110.06 178.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 36.6 mt -120.99 133.9 66.13 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.446 0 CA-C-N 114.039 -1.437 . . . . 83.400000000000006 109.514 179.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' TYR . . . . . 0.516 ' CE1' ' HD3' ' A' ' 55' ' ' ARG . 63.6 m-85 -110.78 119.0 37.68 Favored 'General case' 0 C--O 1.192 -1.941 0 N-CA-C 105.622 -1.992 . . . . 79.549999999999997 105.622 176.144 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 13.2 m -111.71 139.48 47.13 Favored 'General case' 0 C--O 1.189 -2.116 0 O-C-N 124.441 1.088 . . . . 75.810000000000002 109.852 -178.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -82.02 135.69 35.32 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 125.429 1.706 . . . . 93.689999999999998 109.707 -178.41 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 75.6 mt -102.76 151.55 22.27 Favored 'General case' 0 N--CA 1.484 1.274 0 O-C-N 124.647 1.217 . . . . 65.370000000000005 109.874 -179.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -83.18 167.98 25.64 Favored Pre-proline 0 N--CA 1.48 1.046 0 O-C-N 124.775 1.297 . . . . 88.590000000000003 108.408 175.9 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -59.31 136.05 69.56 Favored 'Trans proline' 0 C--O 1.204 -1.179 0 N-CA-C 106.393 -2.195 . . . . 77.079999999999998 106.393 176.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' PRO . . . . . 0.411 ' HB3' ' CE2' ' A' ' 89' ' ' TYR . 87.1 Cg_endo -70.61 172.81 12.75 Favored 'Trans proline' 0 C--O 1.205 -1.162 0 N-CA-C 118.017 2.276 . . . . 63.07 118.017 -174.154 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 62.8 m -126.81 138.31 53.33 Favored 'General case' 0 C--O 1.177 -2.73 0 N-CA-C 106.276 -1.75 . . . . 87.400000000000006 106.276 175.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.1 ptm180 -108.17 141.38 39.99 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 124.808 1.318 . . . . 102.78 109.682 -175.5 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 50.1 p90 -146.38 167.07 24.49 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 107.603 -1.258 . . . . 65.230000000000004 107.603 167.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 13.8 t -109.7 139.13 34.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 107.433 -1.321 . . . . 76.099999999999994 107.433 179.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 10.1 t -143.04 139.27 30.47 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 106.999 -1.482 . . . . 98.019999999999996 106.999 178.124 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -83.61 100.36 10.78 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 107.295 -1.372 . . . . 133.18000000000001 107.295 -175.505 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.6 p -88.92 168.09 16.53 Favored Pre-proline 0 C--O 1.237 0.415 0 C-N-CA 123.237 0.615 . . . . 115.56 109.914 -177.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_exo -55.54 -26.28 53.76 Favored 'Trans proline' 0 C--O 1.238 0.503 0 N-CA-C 114.145 0.787 . . . . 124.73 114.145 177.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -96.13 15.13 21.66 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 118.643 0.656 . . . . 138.97 112.729 175.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 104.62 -178.47 24.09 Favored Glycine 0 N--CA 1.446 -0.649 0 CA-C-N 118.26 0.482 . . . . 98.590000000000003 112.385 178.179 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -69.82 137.24 34.8 Favored 'Trans proline' 0 C--O 1.233 0.242 0 CA-C-O 121.519 0.549 . . . . 90.849999999999994 111.686 -176.31 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 8.7 mttt -141.06 148.3 39.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.559 -0.746 . . . . 99.900000000000006 109.409 177.234 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 11.0 p -77.23 135.49 26.4 Favored 'Isoleucine or valine' 0 C--O 1.239 0.512 0 N-CA-C 108.766 -0.827 . . . . 77.920000000000002 108.766 169.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 28.7 mmtt -121.74 148.91 44.02 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 107.52 -1.289 . . . . 78.680000000000007 107.52 172.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -114.67 132.25 56.46 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 108.333 -0.988 . . . . 77.040000000000006 108.333 -179.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 45.8 tp -108.41 116.46 32.01 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.274 -1.009 . . . . 55.159999999999997 108.274 -178.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' TYR . . . . . 0.426 ' CZ ' ' HB2' ' A' ' 51' ' ' LEU . 67.6 m-85 -107.94 112.28 24.8 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 109.335 -0.617 . . . . 57.909999999999997 109.335 -179.724 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 35.2 m-85 -74.96 142.48 43.92 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.431 -0.508 . . . . 61.25 110.19 169.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 41' ' ' VAL . 35.3 mm -56.14 136.98 18.34 Favored 'Isoleucine or valine' 0 C--O 1.24 0.601 0 CA-C-N 115.734 -0.667 . . . . 66.670000000000002 109.919 172.285 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 3.1 tmtt? -58.74 128.87 39.37 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.283 -0.567 . . . . 108.79000000000001 109.505 -179.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 87.12 4.55 81.4 Favored Glycine 0 N--CA 1.444 -0.82 0 CA-C-O 118.905 -0.941 . . . . 71.280000000000001 115.346 -179.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 24.8 tp -64.2 133.02 52.04 Favored 'General case' 0 C--O 1.198 -1.61 0 C-N-CA 118.687 -1.205 . . . . 66.010000000000005 108.419 -177.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 45.6 p30 -71.7 161.8 30.42 Favored 'General case' 0 C--O 1.196 -1.748 0 O-C-N 124.324 1.015 . . . . 69.319999999999993 111.064 -178.074 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -63.94 -32.23 73.69 Favored 'General case' 0 C--O 1.176 -2.806 0 CA-C-O 117.622 -1.18 . . . . 69.189999999999998 112.023 -176.769 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 16.8 tp -67.43 -46.69 72.39 Favored 'General case' 0 C--O 1.173 -2.937 0 C-N-CA 117.93 -1.508 . . . . 62.869999999999997 109.266 -178.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 70.2 m-20 -69.18 -35.01 75.81 Favored 'General case' 0 C--N 1.318 -0.79 0 C-N-CA 118.979 -1.088 . . . . 60.170000000000002 111.327 -179.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.3 ttm180 -59.26 -45.05 92.23 Favored 'General case' 0 C--O 1.179 -2.651 0 N-CA-C 108.255 -1.017 . . . . 96.829999999999998 108.255 175.461 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -67.28 -39.54 92.06 Favored Glycine 0 C--O 1.178 -3.348 0 CA-C-O 118.691 -1.06 . . . . 45.649999999999999 111.926 179.112 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 4.5 mtp -56.93 -45.66 82.57 Favored 'General case' 0 C--O 1.174 -2.87 0 CA-C-N 117.97 0.885 . . . . 88.920000000000002 109.593 -179.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 46.1 t -63.85 -46.67 93.63 Favored 'Isoleucine or valine' 0 C--O 1.17 -3.101 0 CA-C-O 118.833 -0.603 . . . . 46.399999999999999 110.284 179.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 21.7 mt -61.48 -39.03 89.46 Favored 'General case' 0 C--O 1.186 -2.242 0 CA-C-O 118.096 -0.954 . . . . 48.659999999999997 110.369 -177.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -75.87 -37.45 38.89 Favored Glycine 0 C--O 1.188 -2.771 0 CA-C-O 118.7 -1.056 . . . . 47.899999999999999 111.326 178.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 46.9 t -69.01 -39.42 79.3 Favored 'General case' 0 C--N 1.31 -1.12 0 C-N-CA 120.357 -0.537 . . . . 40.93 111.044 -176.388 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 73.5 mt -78.99 -11.17 60.0 Favored 'General case' 0 CA--C 1.508 -0.637 0 C-N-CA 119.155 -1.018 . . . . 53.270000000000003 113.159 -176.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -63.98 -44.86 91.43 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 112.887 0.699 . . . . 50.030000000000001 112.887 -161.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -63.91 -31.96 73.33 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 119.3 -0.96 . . . . 47.600000000000001 112.129 -178.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' THR . . . . . 0.962 HG23 ' O ' ' A' ' 302' ' ' HOH . 30.5 p -81.51 -29.44 33.58 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 119.528 -0.869 . . . . 61.909999999999997 112.557 -178.568 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 87.1 t -62.04 -42.5 95.18 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 CA-C-N 119.25 0.932 . . . . 59.329999999999998 110.224 170.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 19.9 tpt180 -69.92 -31.09 68.67 Favored 'General case' 0 C--O 1.244 0.807 0 C-N-CA 123.946 0.898 . . . . 65.319999999999993 112.984 -174.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 13.8 tp -67.83 146.77 53.37 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 123.462 0.705 . . . . 80.0 109.928 -178.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 . . . . . 0 C--O 1.238 0.485 0 CA-C-N 115.675 -0.693 . . . . 93.739999999999995 112.61 -177.437 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . 0.962 ' O ' HG23 ' A' ' 109' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' -9' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.207 -1.145 0 CA-C-O 115.431 -2.223 . . . . 85.760000000000005 110.577 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' -8' ' ' LEU . . . . . . . . . . . . . 27.4 mt -45.81 133.53 8.3 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 125.582 1.801 . . . . 62.729999999999997 113.932 -173.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' -7' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -140.82 155.73 46.3 Favored 'General case' 0 N--CA 1.483 1.191 0 O-C-N 124.723 1.265 . . . . 71.280000000000001 110.495 -179.467 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' -6' ' ' VAL . . . . . . . . . . . . . 31.6 m -140.09 152.01 21.85 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 N-CA-C 107.031 -1.47 . . . . 49.700000000000003 107.031 176.644 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' -5' ' ' LEU . . . . . . . . . . . . . 28.3 mt -92.46 111.46 23.05 Favored 'General case' 0 C--O 1.193 -1.878 0 N-CA-C 107.622 -1.251 . . . . 65.069999999999993 107.622 179.383 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' -4' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -74.73 130.64 39.85 Favored 'General case' 0 C--N 1.312 -1.059 0 O-C-N 124.587 1.179 . . . . 80.480000000000004 110.891 177.1 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' -3' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -79.76 83.78 5.66 Favored 'General case' 0 N--CA 1.465 0.275 0 N-CA-C 107.625 -1.25 . . . . 89.469999999999999 107.625 175.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 159.98 -176.54 36.68 Favored Glycine 0 N--CA 1.442 -0.922 0 CA-C-N 115.194 -0.912 . . . . 82.230000000000004 112.644 -175.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_exo -79.27 -27.4 8.37 Favored 'Cis proline' 0 N--CA 1.474 0.343 0 N-CA-C 115.394 1.267 . . . . 104.44 115.394 7.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -126.43 177.52 17.18 Favored Glycine 0 N--CA 1.447 -0.6 0 CA-C-O 121.854 0.697 . . . . 105.09999999999999 112.246 -175.478 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 49.3 m-80 51.06 -141.94 0.74 Allowed 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 114.502 -0.849 . . . . 150.44 110.956 174.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -115.96 61.64 0.71 Allowed 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 107.318 -1.364 . . . . 106.70999999999999 107.318 162.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -101.83 163.35 12.3 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.453 0.645 . . . . 100.48999999999999 109.664 176.059 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 98.0 mt -126.34 126.45 43.93 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 107.568 -1.271 . . . . 64.310000000000002 107.568 -175.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.3 m -122.15 126.77 26.17 Favored Pre-proline 0 N--CA 1.443 -0.791 0 CA-C-N 116.721 -0.218 . . . . 65.129999999999995 110.609 178.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_exo -69.86 124.36 10.96 Favored 'Trans proline' 0 N--CA 1.474 0.367 0 C-N-CA 120.774 0.983 . . . . 59.140000000000001 109.913 173.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 10.8 m -124.45 158.28 31.51 Favored 'Isoleucine or valine' 0 C--N 1.341 0.212 0 N-CA-C 108.613 -0.884 . . . . 62.359999999999999 108.613 172.56 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.25 134.47 39.8 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.343 -0.844 . . . . 60.950000000000003 110.659 -176.846 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 27.7 tp -93.18 92.65 7.85 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 106.713 -1.588 . . . . 60.439999999999998 106.713 167.396 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 80.1 mtt85 -78.39 162.22 26.59 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 122.059 0.933 . . . . 108.59 111.572 -170.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 62.9 mt-30 -127.46 135.66 50.72 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 114.691 -1.141 . . . . 91.019999999999996 108.24 -169.269 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.4 ptt? -146.57 149.18 33.07 Favored 'General case' 0 C--O 1.193 -1.89 0 C-N-CA 117.638 -1.625 . . . . 71.799999999999997 108.74 176.109 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.4 t -70.28 149.82 47.02 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 124.848 1.342 . . . . 85.079999999999998 108.921 176.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 23.3 p -160.9 165.67 29.7 Favored 'General case' 0 CA--C 1.519 -0.243 0 C-N-CA 117.908 -1.517 . . . . 69.170000000000002 110.315 175.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -102.37 126.21 49.31 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 114.741 -1.118 . . . . 72.469999999999999 109.754 -174.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -129.04 171.28 12.52 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 108.546 -0.909 . . . . 71.620000000000005 108.546 178.663 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -175.91 -177.97 45.35 Favored Glycine 0 N--CA 1.452 -0.25 0 N-CA-C 110.823 -0.911 . . . . 65.769999999999996 110.823 177.383 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 80.8 p -76.82 -29.6 56.02 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 115.013 -0.593 . . . . 78.170000000000002 112.549 -179.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' THR . . . . . 0.416 ' H ' ' HB3' ' A' ' 22' ' ' ALA . 32.9 p -129.13 168.81 15.58 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 123.659 0.784 . . . . 97.390000000000001 109.039 173.508 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 42.6 mt-30 -58.56 -40.95 84.52 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 115.549 -0.751 . . . . 102.58 110.712 175.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.7 p -65.87 -28.66 69.13 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 120.034 -0.666 . . . . 101.63 111.303 176.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.514 ' O ' HG23 ' A' ' 24' ' ' THR . . . -69.36 -21.35 63.81 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 113.22 0.822 . . . . 101.03 113.22 -173.555 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 71.4 m -65.52 88.44 0.09 Allowed 'General case' 0 C--O 1.206 -1.195 0 O-C-N 124.582 1.176 . . . . 95.060000000000002 109.93 -177.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' THR . . . . . 0.519 ' OG1' ' N ' ' A' ' 25' ' ' ASP . 72.3 p -90.2 -93.74 0.12 Allowed 'General case' 0 C--O 1.204 -1.3 0 O-C-N 125.568 1.793 . . . . 119.66 111.075 -177.057 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.519 ' N ' ' OG1' ' A' ' 24' ' ' THR . 98.5 m-20 -103.65 -176.74 3.17 Favored 'General case' 0 N--CA 1.481 1.125 0 O-C-N 124.305 1.003 . . . . 144.93000000000001 110.277 -178.276 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -75.94 110.8 10.69 Favored 'General case' 0 C--N 1.329 -0.311 0 O-C-N 125.586 1.804 . . . . 94.439999999999998 109.584 -171.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 39.1 p-10 -134.6 24.86 3.73 Favored 'General case' 0 C--O 1.24 0.558 0 C-N-CA 119.983 -0.687 . . . . 77.959999999999994 112.17 -179.07 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -159.75 170.87 20.6 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 118.966 0.803 . . . . 64.640000000000001 109.29 178.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -123.91 121.09 34.42 Favored 'General case' 0 C--O 1.19 -2.047 0 N-CA-C 107.466 -1.309 . . . . 82.370000000000005 107.466 178.846 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -98.59 128.74 45.01 Favored 'General case' 0 C--N 1.317 -0.835 0 O-C-N 124.736 1.272 . . . . 55.82 109.286 179.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -93.79 129.98 39.97 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.855 -0.794 . . . . 64.909999999999997 108.855 172.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.438 ' CD2' ' HG3' ' A' ' 39' ' ' ARG . 43.9 p90 -141.18 156.43 45.93 Favored 'General case' 0 CA--C 1.523 -0.071 0 C-N-CA 119.133 -1.027 . . . . 65.239999999999995 112.182 -175.653 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -103.88 149.17 25.33 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.44 -1.255 . . . . 79.040000000000006 108.818 166.021 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 25.7 p -89.69 133.83 34.46 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 107.886 -1.153 . . . . 82.890000000000001 107.886 165.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' THR . . . . . 0.705 HG23 ' H ' ' A' ' 37' ' ' GLY . 6.4 t -146.4 178.71 8.05 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.696 0.76 . . . . 106.93000000000001 110.518 -165.046 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -60.37 -21.66 62.39 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 114.942 -1.026 . . . . 131.18000000000001 112.238 179.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.705 ' H ' HG23 ' A' ' 35' ' ' THR . . . -90.11 -30.71 12.0 Favored Glycine 0 N--CA 1.449 -0.448 0 N-CA-C 111.444 -0.662 . . . . 114.69 111.444 173.061 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 138.46 -120.33 1.95 Allowed Glycine 0 CA--C 1.52 0.35 0 N-CA-C 111.856 -0.498 . . . . 103.83 111.856 -178.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.438 ' HG3' ' CD2' ' A' ' 32' ' ' TYR . 0.0 OUTLIER -84.02 120.54 26.25 Favored 'General case' 0 C--O 1.205 -1.259 0 N-CA-C 106.083 -1.821 . . . . 104.73 106.083 175.046 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -109.35 114.39 28.01 Favored 'General case' 0 C--N 1.308 -1.201 0 N-CA-C 107.359 -1.348 . . . . 82.349999999999994 107.359 173.291 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.42 ' O ' HG13 ' A' ' 91' ' ' ILE . 61.8 t -92.68 130.56 41.61 Favored 'Isoleucine or valine' 0 C--O 1.238 0.485 0 N-CA-C 109.476 -0.564 . . . . 56.68 109.476 -178.441 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.1 mp -103.42 -40.58 6.31 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 113.318 0.859 . . . . 62.909999999999997 113.318 -178.908 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -153.45 159.18 42.27 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.82 -0.807 . . . . 48.520000000000003 108.82 -176.432 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 8.2 mp -113.42 145.31 41.35 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 114.645 -1.161 . . . . 55.109999999999999 108.886 169.323 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 18.4 tp -115.52 129.07 56.41 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 107.944 -1.132 . . . . 62.240000000000002 107.944 169.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 38.7 t -148.62 164.14 35.19 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.598 0.713 . . . . 65.510000000000005 110.71 -178.157 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -83.26 -27.69 29.7 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 114.872 -1.058 . . . . 93.790000000000006 111.396 170.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 6.5 mp -80.25 150.14 30.15 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.009 -0.676 . . . . 88.349999999999994 110.188 -177.809 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -109.99 0.81 18.67 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 112.951 0.722 . . . . 97.569999999999993 112.951 -179.138 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -98.24 5.2 48.63 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 124.152 0.981 . . . . 110.38 112.962 -174.502 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.426 ' HB2' ' CZ ' ' A' ' 89' ' ' TYR . 76.0 mt -72.93 136.39 45.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.253 0.549 . . . . 69.650000000000006 110.699 -169.162 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -131.21 -8.63 3.8 Favored 'General case' 0 C--O 1.183 -2.417 0 CA-C-O 117.465 -1.255 . . . . 129.63 108.022 173.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 91.0 m95 -143.25 148.39 36.34 Favored 'General case' 0 C--O 1.187 -2.234 0 CA-C-O 118.01 -0.995 . . . . 80.859999999999999 109.959 -176.471 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -131.81 149.65 52.39 Favored 'General case' 0 C--O 1.187 -2.229 0 O-C-N 126.246 2.216 . . . . 61.740000000000002 106.868 177.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.516 ' HD3' ' CE1' ' A' ' 66' ' ' TYR . 6.9 ttp85 -132.52 131.92 42.1 Favored 'General case' 0 C--O 1.195 -1.812 0 C-N-CA 118.899 -1.121 . . . . 99.140000000000001 109.566 -175.216 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -128.31 132.97 24.65 Favored Pre-proline 0 C--O 1.188 -2.143 0 O-C-N 124.796 1.31 . . . . 70.969999999999999 109.215 179.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -81.49 139.29 11.34 Favored 'Trans proline' 0 C--O 1.17 -2.901 0 N-CA-C 105.587 -2.505 . . . . 87.290000000000006 105.587 175.292 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.482 ' HD2' ' CA ' ' A' ' 63' ' ' GLY . 13.8 mttt -63.7 143.53 57.76 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 123.745 0.653 . . . . 112.09 109.775 177.522 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 4.2 p -45.42 -62.34 1.31 Allowed 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 125.077 1.351 . . . . 137.25 109.644 177.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.494 ' HB3' HG23 ' A' ' 62' ' ' THR . 98.5 m-20 -42.4 -52.23 4.67 Favored 'General case' 0 N--CA 1.485 1.294 0 O-C-N 126.127 2.142 . . . . 150.13999999999999 110.381 176.9 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 111.28 9.12 22.47 Favored Glycine 0 N--CA 1.478 1.437 0 N-CA-C 110.608 -0.997 . . . . 114.33 110.608 -178.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' THR . . . . . 0.494 HG23 ' HB3' ' A' ' 60' ' ' ASP . 11.7 p -89.28 14.84 10.09 Favored 'General case' 0 C--O 1.209 -1.037 0 CA-C-O 116.808 -1.568 . . . . 104.81999999999999 111.636 -176.854 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.482 ' CA ' ' HD2' ' A' ' 58' ' ' LYS . . . 152.75 -178.01 30.13 Favored Glycine 0 C--O 1.216 -0.996 0 C-N-CA 118.956 -1.592 . . . . 83.849999999999994 113.227 179.749 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 4.1 p -129.79 157.41 42.29 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.76 0.791 . . . . 104.31999999999999 110.06 178.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 36.6 mt -120.99 133.9 66.13 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.446 0 CA-C-N 114.039 -1.437 . . . . 83.400000000000006 109.514 179.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' TYR . . . . . 0.516 ' CE1' ' HD3' ' A' ' 55' ' ' ARG . 63.6 m-85 -110.78 119.0 37.68 Favored 'General case' 0 C--O 1.192 -1.941 0 N-CA-C 105.622 -1.992 . . . . 79.549999999999997 105.622 176.144 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 13.2 m -111.71 139.48 47.13 Favored 'General case' 0 C--O 1.189 -2.116 0 O-C-N 124.441 1.088 . . . . 75.810000000000002 109.852 -178.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -82.02 135.69 35.32 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 125.429 1.706 . . . . 93.689999999999998 109.707 -178.41 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 75.6 mt -102.76 151.55 22.27 Favored 'General case' 0 N--CA 1.484 1.274 0 O-C-N 124.647 1.217 . . . . 65.370000000000005 109.874 -179.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -83.18 167.98 25.64 Favored Pre-proline 0 N--CA 1.48 1.046 0 O-C-N 124.775 1.297 . . . . 88.590000000000003 108.408 175.9 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -59.31 136.05 69.56 Favored 'Trans proline' 0 C--O 1.204 -1.179 0 N-CA-C 106.393 -2.195 . . . . 77.079999999999998 106.393 176.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.411 ' HB3' ' CE2' ' A' ' 89' ' ' TYR . 87.1 Cg_endo -70.61 172.81 12.75 Favored 'Trans proline' 0 C--O 1.205 -1.162 0 N-CA-C 118.017 2.276 . . . . 63.07 118.017 -174.154 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 62.8 m -126.81 138.31 53.33 Favored 'General case' 0 C--O 1.177 -2.73 0 N-CA-C 106.276 -1.75 . . . . 87.400000000000006 106.276 175.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.1 ptm180 -108.17 141.38 39.99 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 124.808 1.318 . . . . 102.78 109.682 -175.5 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 50.1 p90 -146.38 167.07 24.49 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 107.603 -1.258 . . . . 65.230000000000004 107.603 167.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 13.8 t -109.7 139.13 34.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 107.433 -1.321 . . . . 76.099999999999994 107.433 179.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 10.1 t -143.04 139.27 30.47 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 106.999 -1.482 . . . . 98.019999999999996 106.999 178.124 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -83.61 100.36 10.78 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 107.295 -1.372 . . . . 133.18000000000001 107.295 -175.505 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.6 p -88.92 168.09 16.53 Favored Pre-proline 0 C--O 1.237 0.415 0 C-N-CA 123.237 0.615 . . . . 115.56 109.914 -177.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_exo -55.54 -26.28 53.76 Favored 'Trans proline' 0 C--O 1.238 0.503 0 N-CA-C 114.145 0.787 . . . . 124.73 114.145 177.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -96.13 15.13 21.66 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 118.643 0.656 . . . . 138.97 112.729 175.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 104.62 -178.47 24.09 Favored Glycine 0 N--CA 1.446 -0.649 0 CA-C-N 118.26 0.482 . . . . 98.590000000000003 112.385 178.179 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -69.82 137.24 34.8 Favored 'Trans proline' 0 C--O 1.233 0.242 0 CA-C-O 121.519 0.549 . . . . 90.849999999999994 111.686 -176.31 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 8.7 mttt -141.06 148.3 39.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.559 -0.746 . . . . 99.900000000000006 109.409 177.234 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 11.0 p -77.23 135.49 26.4 Favored 'Isoleucine or valine' 0 C--O 1.239 0.512 0 N-CA-C 108.766 -0.827 . . . . 77.920000000000002 108.766 169.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 28.7 mmtt -121.74 148.91 44.02 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 107.52 -1.289 . . . . 78.680000000000007 107.52 172.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -114.67 132.25 56.46 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 108.333 -0.988 . . . . 77.040000000000006 108.333 -179.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 45.8 tp -108.41 116.46 32.01 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.274 -1.009 . . . . 55.159999999999997 108.274 -178.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' TYR . . . . . 0.426 ' CZ ' ' HB2' ' A' ' 51' ' ' LEU . 67.6 m-85 -107.94 112.28 24.8 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 109.335 -0.617 . . . . 57.909999999999997 109.335 -179.724 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 35.2 m-85 -74.96 142.48 43.92 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.431 -0.508 . . . . 61.25 110.19 169.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 41' ' ' VAL . 35.3 mm -56.14 136.98 18.34 Favored 'Isoleucine or valine' 0 C--O 1.24 0.601 0 CA-C-N 115.734 -0.667 . . . . 66.670000000000002 109.919 172.285 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 3.1 tmtt? -58.74 128.87 39.37 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.283 -0.567 . . . . 108.79000000000001 109.505 -179.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 87.12 4.55 81.4 Favored Glycine 0 N--CA 1.444 -0.82 0 CA-C-O 118.905 -0.941 . . . . 71.280000000000001 115.346 -179.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 24.8 tp -64.2 133.02 52.04 Favored 'General case' 0 C--O 1.198 -1.61 0 C-N-CA 118.687 -1.205 . . . . 66.010000000000005 108.419 -177.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 45.6 p30 -71.7 161.8 30.42 Favored 'General case' 0 C--O 1.196 -1.748 0 O-C-N 124.324 1.015 . . . . 69.319999999999993 111.064 -178.074 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -63.94 -32.23 73.69 Favored 'General case' 0 C--O 1.176 -2.806 0 CA-C-O 117.622 -1.18 . . . . 69.189999999999998 112.023 -176.769 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 16.8 tp -67.43 -46.69 72.39 Favored 'General case' 0 C--O 1.173 -2.937 0 C-N-CA 117.93 -1.508 . . . . 62.869999999999997 109.266 -178.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 70.2 m-20 -69.18 -35.01 75.81 Favored 'General case' 0 C--N 1.318 -0.79 0 C-N-CA 118.979 -1.088 . . . . 60.170000000000002 111.327 -179.432 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.3 ttm180 -59.26 -45.05 92.23 Favored 'General case' 0 C--O 1.179 -2.651 0 N-CA-C 108.255 -1.017 . . . . 96.829999999999998 108.255 175.461 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -67.28 -39.54 92.06 Favored Glycine 0 C--O 1.178 -3.348 0 CA-C-O 118.691 -1.06 . . . . 45.649999999999999 111.926 179.112 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 4.5 mtp -56.93 -45.66 82.57 Favored 'General case' 0 C--O 1.174 -2.87 0 CA-C-N 117.97 0.885 . . . . 88.920000000000002 109.593 -179.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 46.1 t -63.85 -46.67 93.63 Favored 'Isoleucine or valine' 0 C--O 1.17 -3.101 0 CA-C-O 118.833 -0.603 . . . . 46.399999999999999 110.284 179.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 21.7 mt -61.48 -39.03 89.46 Favored 'General case' 0 C--O 1.186 -2.242 0 CA-C-O 118.096 -0.954 . . . . 48.659999999999997 110.369 -177.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -75.87 -37.45 38.89 Favored Glycine 0 C--O 1.188 -2.771 0 CA-C-O 118.7 -1.056 . . . . 47.899999999999999 111.326 178.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 46.9 t -69.01 -39.42 79.3 Favored 'General case' 0 C--N 1.31 -1.12 0 C-N-CA 120.357 -0.537 . . . . 40.93 111.044 -176.388 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 73.5 mt -78.99 -11.17 60.0 Favored 'General case' 0 CA--C 1.508 -0.637 0 C-N-CA 119.155 -1.018 . . . . 53.270000000000003 113.159 -176.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -63.98 -44.86 91.43 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 112.887 0.699 . . . . 50.030000000000001 112.887 -161.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -63.91 -31.96 73.33 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 119.3 -0.96 . . . . 47.600000000000001 112.129 -178.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' THR . . . . . 0.962 HG23 ' O ' ' A' ' 302' ' ' HOH . 30.5 p -81.51 -29.44 33.58 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 119.528 -0.869 . . . . 61.909999999999997 112.557 -178.568 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 87.1 t -62.04 -42.5 95.18 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 CA-C-N 119.25 0.932 . . . . 59.329999999999998 110.224 170.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 19.9 tpt180 -69.92 -31.09 68.67 Favored 'General case' 0 C--O 1.244 0.807 0 C-N-CA 123.946 0.898 . . . . 65.319999999999993 112.984 -174.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 13.8 tp -67.83 146.77 53.37 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 123.462 0.705 . . . . 80.0 109.928 -178.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 . . . . . 0 C--O 1.238 0.485 0 CA-C-N 115.675 -0.693 . . . . 93.739999999999995 112.61 -177.437 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . 0.962 ' O ' HG23 ' A' ' 109' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_