data_1hyp_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 1hyp _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo . . . . . 0 N--CA 1.454 -0.826 0 N-CA-C 115.047 1.134 . . . . 19.68 115.047 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 70.9 p -59.13 -38.77 80.43 Favored 'General case' 0 N--CA 1.434 -1.242 0 CA-C-N 114.274 -1.33 . . . . 25.0 112.567 174.131 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 71.3 m -73.32 116.84 55.05 Favored Pre-proline 0 C--O 1.244 0.775 0 O-C-N 120.827 -1.171 . . . . 25.0 111.031 175.815 -62.335 -61.975 -78.049 104.621 2.052 101.199 -67.916 -64.414 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -70.38 170.19 17.9 Favored 'Trans proline' 0 C--N 1.321 -0.874 0 N-CA-C 108.855 -1.248 . . . . 20.3 108.855 173.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 53.4 t0 -73.46 109.45 6.99 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 104.968 -2.234 . . . . 32.78 104.968 176.278 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 54.7 mt -102.29 23.29 11.95 Favored 'General case' 0 CA--C 1.491 -1.305 0 CA-C-O 118.56 -0.733 . . . . 25.0 110.216 -176.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 57.4 m -53.77 -40.37 66.19 Favored 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 113.822 1.045 . . . . 26.28 113.822 175.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.2 tp -46.6 -34.82 2.43 Favored 'Isoleucine or valine' 0 C--O 1.254 1.302 0 CA-C-O 123.826 1.774 . . . . 27.77 114.756 175.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 89.7 m -70.29 -17.57 63.09 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 112.731 -2.031 . . . . 25.0 113.821 -179.484 -68.176 -69.787 95.54 107.061 2.011 100.264 83.439 162.444 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.3 mt -87.4 -16.54 34.63 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 118.833 -2.417 . . . . 25.0 111.74 -177.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 81.9 m-20 -58.07 -25.24 61.0 Favored 'General case' 0 C--O 1.202 -1.406 0 CA-C-N 124.232 3.196 . . . . 29.3 111.696 179.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 5.1 tt -68.03 -27.43 37.41 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.096 0 CA-C-N 121.464 1.938 . . . . 29.72 110.404 176.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.2 mp -69.92 -14.72 62.86 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 120.371 -1.456 . . . . 29.34 109.858 -179.275 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -107.07 7.22 37.61 Favored Glycine 0 N--CA 1.431 -1.646 0 CA-C-O 116.954 -2.026 . . . . 32.94 108.312 178.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 100.97 -14.0 58.79 Favored Glycine 0 C--N 1.34 0.805 0 CA-C-N 122.48 3.14 . . . . 32.49 117.034 179.583 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 23.0 t -76.88 124.94 28.48 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 121.862 2.831 . . . . 34.32 110.556 178.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 22.3 mt -100.95 11.37 39.74 Favored 'General case' 0 CA--C 1.5 -0.943 0 O-C-N 118.906 -2.371 . . . . 32.7 105.266 172.162 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -67.97 -36.4 86.18 Favored Glycine 0 N--CA 1.433 -1.535 0 CA-C-O 115.83 -2.65 . . . . 25.0 115.354 -173.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 66.2 p -107.09 19.62 20.16 Favored 'General case' 0 C--O 1.254 1.303 0 CA-C-N 122.99 3.395 . . . . 25.0 113.402 -175.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 90.4 t -61.57 -40.32 86.14 Favored 'Isoleucine or valine' 0 C--N 1.345 0.374 0 CA-C-O 116.927 -1.511 . . . . 25.0 111.779 -176.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -64.13 -41.57 97.15 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 124.802 3.456 . . . . 28.49 111.222 -177.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 84.1 m-20 -66.67 -44.12 82.69 Favored 'General case' 0 N--CA 1.427 -1.6 0 CA-C-N 110.988 -2.823 . . . . 25.0 110.504 178.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 2.8 t -61.37 -44.31 97.38 Favored 'General case' 0 C--O 1.246 0.9 0 CA-C-N 121.327 1.876 . . . . 25.0 112.613 176.02 162.444 83.439 95.54 100.264 2.011 107.061 -69.787 -68.176 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 62.2 m -68.47 -27.34 66.07 Favored 'General case' 0 C--O 1.25 1.131 0 N-CA-C 114.49 1.292 . . . . 25.0 114.49 -178.815 -56.649 -80.107 -85.263 101.126 1.981 109.222 -53.745 -73.2 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.64 -58.3 9.19 Favored 'General case' 0 C--O 1.246 0.876 0 C-N-CA 124.792 1.237 . . . . 25.0 110.789 174.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 54.1 mt -54.95 -51.34 66.42 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.371 1.248 . . . . 25.0 114.371 175.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 6.5 pt -66.18 -29.26 46.15 Favored 'Isoleucine or valine' 0 C--N 1.366 1.306 0 CA-C-O 122.937 1.351 . . . . 25.0 112.443 177.043 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.68 -25.58 75.38 Favored Glycine 0 CA--C 1.532 1.104 0 O-C-N 117.409 -3.307 . . . . 25.0 111.207 174.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -67.25 -14.26 63.75 Favored Glycine 0 CA--C 1.535 1.323 0 O-C-N 119.627 -2.102 . . . . 25.0 111.89 170.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -96.92 154.93 17.0 Favored 'General case' 0 N--CA 1.439 -1.008 0 N-CA-C 117.956 2.576 . . . . 25.0 117.956 -179.821 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -62.55 150.85 47.19 Favored Glycine 0 C--N 1.344 0.974 0 N-CA-C 106.532 -2.627 . . . . 25.0 106.532 167.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -49.12 -61.31 2.14 Favored 'General case' 0 C--N 1.305 -1.329 0 C-N-CA 127.157 2.183 . . . . 36.65 114.43 -177.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 2.4 mp -64.54 -31.62 54.38 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.863 0 CA-C-O 122.914 1.34 . . . . 28.4 111.289 177.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -71.1 -41.91 69.99 Favored 'General case' 0 N--CA 1.428 -1.544 0 CA-C-O 117.306 -1.33 . . . . 25.75 110.198 -174.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.66 -43.95 90.0 Favored 'General case' 0 C--N 1.347 0.478 0 O-C-N 124.609 1.193 . . . . 25.0 110.137 175.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 74.8 mt -64.41 -46.73 92.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 O-C-N 119.045 -2.284 . . . . 25.0 109.862 176.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 75.2 t -66.03 -37.0 78.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 O-C-N 118.029 -2.919 . . . . 25.0 111.498 -177.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 84.7 m -69.79 -40.34 76.05 Favored 'General case' 0 C--N 1.316 -0.884 0 O-C-N 120.923 -1.11 . . . . 25.0 111.0 179.227 -64.414 -67.916 -78.049 101.199 2.052 104.621 -61.975 -62.335 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.18 -39.74 93.71 Favored 'General case' 0 CA--C 1.508 -0.67 0 C-N-CA 125.021 1.328 . . . . 25.0 111.191 173.697 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 95.0 m -66.63 -35.77 80.98 Favored 'General case' 0 C--O 1.242 0.686 0 CA-C-O 117.8 -1.095 . . . . 25.0 112.889 179.391 -69.873 -89.876 -86.437 105.929 2.004 98.754 -62.062 -69.067 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -68.7 -39.55 80.42 Favored 'Isoleucine or valine' 0 C--N 1.358 0.971 0 CA-C-O 116.402 -1.761 . . . . 25.0 108.136 176.674 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -59.98 -38.81 83.62 Favored 'General case' 0 C--N 1.342 0.257 0 CA-C-N 123.05 2.659 . . . . 26.65 112.445 178.177 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 49.2 mt -67.7 -50.24 58.62 Favored 'General case' 0 C--O 1.255 1.376 0 C-N-CA 124.261 1.024 . . . . 25.0 111.414 179.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 12.4 mtm-85 -52.6 -43.56 65.43 Favored 'General case' 0 CA--C 1.495 -1.146 0 CA-C-O 117.9 -1.047 . . . . 37.4 110.33 171.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.04 -17.49 64.42 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 122.668 2.486 . . . . 25.0 113.416 -176.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 5.7 mt -79.33 -24.8 42.52 Favored 'General case' 0 CA--C 1.491 -1.293 0 O-C-N 119.888 -1.758 . . . . 25.0 113.773 175.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 98.35 20.37 20.4 Favored Glycine 0 N--CA 1.434 -1.496 0 CA-C-O 122.893 1.274 . . . . 25.0 109.988 -178.676 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 1.2 mm -66.89 124.09 21.37 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 N-CA-C 107.962 -1.125 . . . . 25.0 107.962 175.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.5 mp -83.25 -44.1 15.34 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 120.148 -1.595 . . . . 25.0 111.962 171.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 57.6 t-20 -91.51 92.78 8.67 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 122.966 2.621 . . . . 25.0 105.392 -178.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 22.9 mt -74.15 -41.15 61.98 Favored 'General case' 0 CA--C 1.504 -0.804 0 O-C-N 121.122 -0.987 . . . . 25.0 111.724 -172.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -68.17 -39.3 82.61 Favored 'General case' 0 CA--C 1.494 -1.2 0 N-CA-C 114.377 1.251 . . . . 25.0 114.377 -171.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.2 ttt180 -64.21 -40.17 95.51 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 122.699 0.399 . . . . 42.67 110.695 178.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 59.8 m-80 -75.96 -39.92 55.02 Favored 'General case' 0 CA--C 1.504 -0.794 0 O-C-N 119.48 -2.012 . . . . 25.0 111.758 178.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.6 tp -55.51 -46.56 76.98 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-O 123.334 1.54 . . . . 25.0 109.824 173.786 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -67.46 -36.63 81.54 Favored 'General case' 0 C--O 1.22 -0.488 0 O-C-N 120.259 -1.525 . . . . 25.0 108.722 -176.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 39.3 tp -59.64 -47.51 85.31 Favored 'General case' 0 C--O 1.252 1.192 0 CA-C-N 119.954 1.252 . . . . 25.0 109.554 178.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 64.5 mt -59.93 -45.76 94.79 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 CA-C-O 117.995 -1.003 . . . . 25.0 112.243 177.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.4 -35.3 79.97 Favored 'General case' 0 C--O 1.248 0.979 0 CA-C-N 120.533 1.515 . . . . 25.0 113.183 -178.901 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ASN . . . . . 0.514 ' ND2' ' H1 ' ' A' ' 124' ' ' HOH . 92.0 m-20 -69.28 -31.55 70.14 Favored 'General case' 0 CA--C 1.502 -0.891 0 CA-C-N 115.471 -0.786 . . . . 25.0 110.614 -179.632 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 9.1 p -67.12 -19.72 65.66 Favored 'General case' 0 N--CA 1.433 -1.29 0 CA-C-O 117.652 -1.166 . . . . 25.0 110.442 -178.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 64.1 m -76.64 -7.71 55.81 Favored 'General case' 0 C--N 1.369 1.431 0 CA-C-N 121.287 1.858 . . . . 25.16 115.607 -175.255 -73.2 -53.745 -85.263 109.222 1.981 101.126 -80.107 -56.649 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 110.77 50.36 0.65 Allowed Glycine 0 N--CA 1.444 -0.778 0 CA-C-O 113.806 -3.774 . . . . 31.95 119.372 169.116 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.4 165.96 10.71 Favored 'General case' 0 C--N 1.348 0.514 1 CA-C-N 125.799 4.799 . . . . 38.38 110.451 176.664 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 19.7 m -82.84 -8.93 59.54 Favored 'General case' 0 N--CA 1.424 -1.772 0 CA-C-N 112.38 -2.191 . . . . 30.28 108.158 177.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -130.4 129.99 22.92 Favored Pre-proline 0 N--CA 1.479 0.982 0 CA-C-O 112.477 -3.63 . . . . 46.14 106.507 -170.705 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -65.34 149.83 87.86 Favored 'Trans proline' 0 C--N 1.359 1.098 0 CA-C-N 128.074 3.919 . . . . 17.37 112.364 -179.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 17.6 t -79.37 146.44 32.86 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-N 121.866 2.121 . . . . 25.0 108.282 -178.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 25.6 p-10 -115.39 21.24 14.24 Favored 'General case' 0 CA--C 1.569 1.695 0 CA-C-O 123.206 1.479 . . . . 27.44 110.668 169.908 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.06 144.43 53.48 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-O 124.237 1.97 . . . . 25.0 115.426 178.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . 0.369 0.8 OUTLIER -122.15 139.61 53.54 Favored 'General case' 0 CA--C 1.552 1.039 0 CA-C-N 110.697 -2.956 . . . . 25.0 112.941 -177.049 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 96.6 m -78.12 137.53 60.95 Favored Pre-proline 0 N--CA 1.492 1.639 0 CA-C-N 119.115 0.871 . . . . 25.0 110.682 169.364 -69.067 -62.062 -86.437 98.754 2.004 105.929 -89.876 -69.873 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -61.12 117.72 4.53 Favored 'Trans proline' 0 CA--C 1.557 1.638 0 CA-C-N 122.374 1.883 . . . . 35.35 113.286 168.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.03 -66.44 1.08 Allowed 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 101.156 -3.646 . . . . 50.78 101.156 168.922 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . 0.269 0.6 OUTLIER . . . . . 0 C--N 1.353 0.751 3 O-C-N 134.998 7.686 . . . . 49.79 121.336 -172.35 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' HOH . . . . . 0.514 ' H1 ' ' ND2' ' A' ' 65' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo . . . . . 0 N--CA 1.454 -0.826 0 N-CA-C 115.047 1.134 . . . . 19.68 115.047 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 70.9 p -59.13 -38.77 80.43 Favored 'General case' 0 N--CA 1.434 -1.242 0 CA-C-N 114.274 -1.33 . . . . 14.24 112.567 174.131 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 71.3 m -73.32 116.84 55.05 Favored Pre-proline 0 C--O 1.244 0.775 0 O-C-N 120.827 -1.171 . . . . 16.28 111.031 175.815 -62.335 -61.975 -78.049 104.621 2.052 101.199 -67.916 -64.414 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -70.38 170.19 17.9 Favored 'Trans proline' 0 C--N 1.321 -0.874 0 N-CA-C 108.855 -1.248 . . . . 20.3 108.855 173.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 53.4 t0 -73.46 109.45 6.99 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 104.968 -2.234 . . . . 32.78 104.968 176.278 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LEU . . . . . 0.572 HD13 HD13 ' A' ' 44' ' ' LEU . 54.7 mt -102.29 23.29 11.95 Favored 'General case' 0 CA--C 1.491 -1.305 0 CA-C-O 118.56 -0.733 . . . . 22.82 110.216 -176.497 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 57.4 m -53.77 -40.37 66.19 Favored 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 113.822 1.045 . . . . 26.28 113.822 175.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.2 tp -46.6 -34.82 2.43 Favored 'Isoleucine or valine' 0 C--O 1.254 1.302 0 CA-C-O 123.826 1.774 . . . . 27.77 114.756 175.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 89.7 m -70.29 -17.57 63.09 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 112.731 -2.031 . . . . 14.66 113.821 -179.484 -68.176 -69.787 95.54 107.061 2.011 100.264 83.439 162.444 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.3 mt -87.4 -16.54 34.63 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 118.833 -2.417 . . . . 20.52 111.74 -177.444 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ASN . . . . . 0.438 ' HB3' ' HB3' ' A' ' 21' ' ' SER . 81.9 m-20 -58.07 -25.24 61.0 Favored 'General case' 0 C--O 1.202 -1.406 0 CA-C-N 124.232 3.196 . . . . 29.3 111.696 179.516 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 5.1 tt -68.03 -27.43 37.41 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.096 0 CA-C-N 121.464 1.938 . . . . 29.72 110.404 176.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LEU . . . . . 0.52 HD12 HD23 ' A' ' 62' ' ' LEU . 3.2 mp -69.92 -14.72 62.86 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 120.371 -1.456 . . . . 29.34 109.858 -179.275 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -107.07 7.22 37.61 Favored Glycine 0 N--CA 1.431 -1.646 0 CA-C-O 116.954 -2.026 . . . . 32.94 108.312 178.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 100.97 -14.0 58.79 Favored Glycine 0 C--N 1.34 0.805 0 CA-C-N 122.48 3.14 . . . . 32.49 117.034 179.583 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' SER . . . . . 0.438 ' HB3' ' HB3' ' A' ' 16' ' ' ASN . 23.0 t -76.88 124.94 28.48 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 121.862 2.831 . . . . 34.32 110.556 178.832 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 22.3 mt -100.95 11.37 39.74 Favored 'General case' 0 CA--C 1.5 -0.943 0 O-C-N 118.906 -2.371 . . . . 32.7 105.266 172.162 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -67.97 -36.4 86.18 Favored Glycine 0 N--CA 1.433 -1.535 0 CA-C-O 115.83 -2.65 . . . . 23.27 115.354 -173.387 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 66.2 p -107.09 19.62 20.16 Favored 'General case' 0 C--O 1.254 1.303 0 CA-C-N 122.99 3.395 . . . . 23.08 113.402 -175.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 90.4 t -61.57 -40.32 86.14 Favored 'Isoleucine or valine' 0 C--N 1.345 0.374 0 CA-C-O 116.927 -1.511 . . . . 15.92 111.779 -176.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -64.13 -41.57 97.15 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 124.802 3.456 . . . . 28.49 111.222 -177.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 84.1 m-20 -66.67 -44.12 82.69 Favored 'General case' 0 N--CA 1.427 -1.6 0 CA-C-N 110.988 -2.823 . . . . 20.13 110.504 178.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 2.8 t -61.37 -44.31 97.38 Favored 'General case' 0 C--O 1.246 0.9 0 CA-C-N 121.327 1.876 . . . . 14.38 112.613 176.02 162.444 83.439 95.54 100.264 2.011 107.061 -69.787 -68.176 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 62.2 m -68.47 -27.34 66.07 Favored 'General case' 0 C--O 1.25 1.131 0 N-CA-C 114.49 1.292 . . . . 16.99 114.49 -178.815 -56.649 -80.107 -85.263 101.126 1.981 109.222 -53.745 -73.2 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.64 -58.3 9.19 Favored 'General case' 0 C--O 1.246 0.876 0 C-N-CA 124.792 1.237 . . . . 13.05 110.789 174.085 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 54.1 mt -54.95 -51.34 66.42 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.371 1.248 . . . . 17.66 114.371 175.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 6.5 pt -66.18 -29.26 46.15 Favored 'Isoleucine or valine' 0 C--N 1.366 1.306 0 CA-C-O 122.937 1.351 . . . . 21.68 112.443 177.043 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.68 -25.58 75.38 Favored Glycine 0 CA--C 1.532 1.104 0 O-C-N 117.409 -3.307 . . . . 24.71 111.207 174.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -67.25 -14.26 63.75 Favored Glycine 0 CA--C 1.535 1.323 0 O-C-N 119.627 -2.102 . . . . 24.72 111.89 170.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -96.92 154.93 17.0 Favored 'General case' 0 N--CA 1.439 -1.008 0 N-CA-C 117.956 2.576 . . . . 17.68 117.956 -179.821 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -62.55 150.85 47.19 Favored Glycine 0 C--N 1.344 0.974 0 N-CA-C 106.532 -2.627 . . . . 19.96 106.532 167.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ASP . . . . . 0.531 ' HA ' ' O ' ' A' ' 130' ' ' HOH . 34.4 t0 -49.12 -61.31 2.14 Favored 'General case' 0 C--N 1.305 -1.329 0 C-N-CA 127.157 2.183 . . . . 36.65 114.43 -177.644 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 2.4 mp -64.54 -31.62 54.38 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.863 0 CA-C-O 122.914 1.34 . . . . 28.4 111.289 177.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -71.1 -41.91 69.99 Favored 'General case' 0 N--CA 1.428 -1.544 0 CA-C-O 117.306 -1.33 . . . . 25.75 110.198 -174.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.66 -43.95 90.0 Favored 'General case' 0 C--N 1.347 0.478 0 O-C-N 124.609 1.193 . . . . 11.68 110.137 175.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 74.8 mt -64.41 -46.73 92.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 O-C-N 119.045 -2.284 . . . . 13.98 109.862 176.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 75.2 t -66.03 -37.0 78.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 O-C-N 118.029 -2.919 . . . . 15.52 111.498 -177.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' CYS . . . . . 0.675 ' O ' HD13 ' A' ' 46' ' ' ILE . 84.7 m -69.79 -40.34 76.05 Favored 'General case' 0 C--N 1.316 -0.884 0 O-C-N 120.923 -1.11 . . . . 13.86 111.0 179.227 -64.414 -67.916 -78.049 101.199 2.052 104.621 -61.975 -62.335 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' LEU . . . . . 0.572 HD13 HD13 ' A' ' 11' ' ' LEU . 0.0 OUTLIER -62.18 -39.74 93.71 Favored 'General case' 0 CA--C 1.508 -0.67 0 C-N-CA 125.021 1.328 . . . . 16.27 111.191 173.697 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 95.0 m -66.63 -35.77 80.98 Favored 'General case' 0 C--O 1.242 0.686 0 CA-C-O 117.8 -1.095 . . . . 12.18 112.889 179.391 -69.873 -89.876 -86.437 105.929 2.004 98.754 -62.062 -69.067 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ILE . . . . . 0.675 HD13 ' O ' ' A' ' 43' ' ' CYS . 0.1 OUTLIER -68.7 -39.55 80.42 Favored 'Isoleucine or valine' 0 C--N 1.358 0.971 0 CA-C-O 116.402 -1.761 . . . . 20.57 108.136 176.674 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -59.98 -38.81 83.62 Favored 'General case' 0 C--N 1.342 0.257 0 CA-C-N 123.05 2.659 . . . . 26.65 112.445 178.177 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 49.2 mt -67.7 -50.24 58.62 Favored 'General case' 0 C--O 1.255 1.376 0 C-N-CA 124.261 1.024 . . . . 15.34 111.414 179.657 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 12.4 mtm-85 -52.6 -43.56 65.43 Favored 'General case' 0 CA--C 1.495 -1.146 0 CA-C-O 117.9 -1.047 . . . . 37.4 110.33 171.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.04 -17.49 64.42 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 122.668 2.486 . . . . 19.71 113.416 -176.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 5.7 mt -79.33 -24.8 42.52 Favored 'General case' 0 CA--C 1.491 -1.293 0 O-C-N 119.888 -1.758 . . . . 24.54 113.773 175.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 98.35 20.37 20.4 Favored Glycine 0 N--CA 1.434 -1.496 0 CA-C-O 122.893 1.274 . . . . 19.73 109.988 -178.676 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 1.2 mm -66.89 124.09 21.37 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 N-CA-C 107.962 -1.125 . . . . 21.83 107.962 175.657 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.5 mp -83.25 -44.1 15.34 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 120.148 -1.595 . . . . 24.59 111.962 171.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 57.6 t-20 -91.51 92.78 8.67 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 122.966 2.621 . . . . 14.25 105.392 -178.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 22.9 mt -74.15 -41.15 61.98 Favored 'General case' 0 CA--C 1.504 -0.804 0 O-C-N 121.122 -0.987 . . . . 15.98 111.724 -172.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -68.17 -39.3 82.61 Favored 'General case' 0 CA--C 1.494 -1.2 0 N-CA-C 114.377 1.251 . . . . 18.82 114.377 -171.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.2 ttt180 -64.21 -40.17 95.51 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 122.699 0.399 . . . . 42.67 110.695 178.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 59.8 m-80 -75.96 -39.92 55.02 Favored 'General case' 0 CA--C 1.504 -0.794 0 O-C-N 119.48 -2.012 . . . . 16.23 111.758 178.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.6 tp -55.51 -46.56 76.98 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-O 123.334 1.54 . . . . 10.31 109.824 173.786 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLN . . . . . 0.549 ' HB3' ' O ' ' A' ' 124' ' ' HOH . 70.8 mt-30 -67.46 -36.63 81.54 Favored 'General case' 0 C--O 1.22 -0.488 0 O-C-N 120.259 -1.525 . . . . 16.47 108.722 -176.704 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' LEU . . . . . 0.52 HD23 HD12 ' A' ' 18' ' ' LEU . 39.3 tp -59.64 -47.51 85.31 Favored 'General case' 0 C--O 1.252 1.192 0 CA-C-N 119.954 1.252 . . . . 15.14 109.554 178.623 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 64.5 mt -59.93 -45.76 94.79 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 CA-C-O 117.995 -1.003 . . . . 10.79 112.243 177.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.4 -35.3 79.97 Favored 'General case' 0 C--O 1.248 0.979 0 CA-C-N 120.533 1.515 . . . . 18.12 113.183 -178.901 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -69.28 -31.55 70.14 Favored 'General case' 0 CA--C 1.502 -0.891 0 CA-C-N 115.471 -0.786 . . . . 13.1 110.614 -179.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 9.1 p -67.12 -19.72 65.66 Favored 'General case' 0 N--CA 1.433 -1.29 0 CA-C-O 117.652 -1.166 . . . . 20.18 110.442 -178.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 64.1 m -76.64 -7.71 55.81 Favored 'General case' 0 C--N 1.369 1.431 0 CA-C-N 121.287 1.858 . . . . 25.16 115.607 -175.255 -73.2 -53.745 -85.263 109.222 1.981 101.126 -80.107 -56.649 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 110.77 50.36 0.65 Allowed Glycine 0 N--CA 1.444 -0.778 0 CA-C-O 113.806 -3.774 . . . . 31.95 119.372 169.116 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ARG . . . . . 0.58 ' NH1' ' HB3' ' A' ' 71' ' ' TYR . 0.0 OUTLIER -103.4 165.96 10.71 Favored 'General case' 0 C--N 1.348 0.514 1 CA-C-N 125.799 4.799 . . . . 38.38 110.451 176.664 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 19.7 m -82.84 -8.93 59.54 Favored 'General case' 0 N--CA 1.424 -1.772 0 CA-C-N 112.38 -2.191 . . . . 30.28 108.158 177.077 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' TYR . . . . . 0.58 ' HB3' ' NH1' ' A' ' 69' ' ' ARG . 0.0 OUTLIER -130.4 129.99 22.92 Favored Pre-proline 0 N--CA 1.479 0.982 0 CA-C-O 112.477 -3.63 . . . . 46.14 106.507 -170.705 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -65.34 149.83 87.86 Favored 'Trans proline' 0 C--N 1.359 1.098 0 CA-C-N 128.074 3.919 . . . . 17.37 112.364 -179.109 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' SER . . . . . 0.621 ' HB3' ' O ' ' A' ' 124' ' ' HOH . 17.6 t -79.37 146.44 32.86 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-N 121.866 2.121 . . . . 16.22 108.282 -178.924 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 25.6 p-10 -115.39 21.24 14.24 Favored 'General case' 0 CA--C 1.569 1.695 0 CA-C-O 123.206 1.479 . . . . 27.44 110.668 169.908 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.06 144.43 53.48 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-O 124.237 1.97 . . . . 17.81 115.426 178.821 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . 0.369 0.8 OUTLIER -122.15 139.61 53.54 Favored 'General case' 0 CA--C 1.552 1.039 0 CA-C-N 110.697 -2.956 . . . . 23.75 112.941 -177.049 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 96.6 m -78.12 137.53 60.95 Favored Pre-proline 0 N--CA 1.492 1.639 0 CA-C-N 119.115 0.871 . . . . 19.85 110.682 169.364 -69.067 -62.062 -86.437 98.754 2.004 105.929 -89.876 -69.873 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -61.12 117.72 4.53 Favored 'Trans proline' 0 CA--C 1.557 1.638 0 CA-C-N 122.374 1.883 . . . . 35.35 113.286 168.141 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.03 -66.44 1.08 Allowed 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 101.156 -3.646 . . . . 50.78 101.156 168.922 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . 0.269 0.6 OUTLIER . . . . . 0 C--N 1.353 0.751 3 O-C-N 134.998 7.686 . . . . 49.79 121.336 -172.35 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 124' ' ' HOH . . . . . 0.621 ' O ' ' HB3' ' A' ' 73' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 130' ' ' HOH . . . . . 0.531 ' O ' ' HA ' ' A' ' 37' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo . . . . . 0 N--CA 1.454 -0.826 0 N-CA-C 115.047 1.134 . . . . 19.68 115.047 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 70.9 p -59.13 -38.77 80.43 Favored 'General case' 0 N--CA 1.434 -1.242 0 CA-C-N 114.274 -1.33 . . . . 14.24 112.567 174.131 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 71.3 m -73.32 116.84 55.05 Favored Pre-proline 0 C--O 1.244 0.775 0 O-C-N 120.827 -1.171 . . . . 16.28 111.031 175.815 -62.335 -61.975 -78.049 104.621 2.052 101.199 -67.916 -64.414 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -70.38 170.19 17.9 Favored 'Trans proline' 0 C--N 1.321 -0.874 0 N-CA-C 108.855 -1.248 . . . . 20.3 108.855 173.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 53.4 t0 -73.46 109.45 6.99 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 104.968 -2.234 . . . . 32.78 104.968 176.278 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.572 HD13 HD13 ' A' ' 44' ' ' LEU . 54.7 mt -102.29 23.29 11.95 Favored 'General case' 0 CA--C 1.491 -1.305 0 CA-C-O 118.56 -0.733 . . . . 22.82 110.216 -176.497 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 57.4 m -53.77 -40.37 66.19 Favored 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 113.822 1.045 . . . . 26.28 113.822 175.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.2 tp -46.6 -34.82 2.43 Favored 'Isoleucine or valine' 0 C--O 1.254 1.302 0 CA-C-O 123.826 1.774 . . . . 27.77 114.756 175.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 89.7 m -70.29 -17.57 63.09 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 112.731 -2.031 . . . . 14.66 113.821 -179.484 -68.176 -69.787 95.54 107.061 2.011 100.264 83.439 162.444 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.3 mt -87.4 -16.54 34.63 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 118.833 -2.417 . . . . 20.52 111.74 -177.444 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.438 ' HB3' ' HB3' ' A' ' 21' ' ' SER . 81.9 m-20 -58.07 -25.24 61.0 Favored 'General case' 0 C--O 1.202 -1.406 0 CA-C-N 124.232 3.196 . . . . 29.3 111.696 179.516 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 5.1 tt -68.03 -27.43 37.41 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.096 0 CA-C-N 121.464 1.938 . . . . 29.72 110.404 176.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.52 HD12 HD23 ' A' ' 62' ' ' LEU . 3.2 mp -69.92 -14.72 62.86 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 120.371 -1.456 . . . . 29.34 109.858 -179.275 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -107.07 7.22 37.61 Favored Glycine 0 N--CA 1.431 -1.646 0 CA-C-O 116.954 -2.026 . . . . 32.94 108.312 178.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 100.97 -14.0 58.79 Favored Glycine 0 C--N 1.34 0.805 0 CA-C-N 122.48 3.14 . . . . 32.49 117.034 179.583 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' SER . . . . . 0.438 ' HB3' ' HB3' ' A' ' 16' ' ' ASN . 23.0 t -76.88 124.94 28.48 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 121.862 2.831 . . . . 34.32 110.556 178.832 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 22.3 mt -100.95 11.37 39.74 Favored 'General case' 0 CA--C 1.5 -0.943 0 O-C-N 118.906 -2.371 . . . . 32.7 105.266 172.162 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -67.97 -36.4 86.18 Favored Glycine 0 N--CA 1.433 -1.535 0 CA-C-O 115.83 -2.65 . . . . 23.27 115.354 -173.387 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 66.2 p -107.09 19.62 20.16 Favored 'General case' 0 C--O 1.254 1.303 0 CA-C-N 122.99 3.395 . . . . 23.08 113.402 -175.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 90.4 t -61.57 -40.32 86.14 Favored 'Isoleucine or valine' 0 C--N 1.345 0.374 0 CA-C-O 116.927 -1.511 . . . . 15.92 111.779 -176.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -64.13 -41.57 97.15 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 124.802 3.456 . . . . 28.49 111.222 -177.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 84.1 m-20 -66.67 -44.12 82.69 Favored 'General case' 0 N--CA 1.427 -1.6 0 CA-C-N 110.988 -2.823 . . . . 20.13 110.504 178.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 2.8 t -61.37 -44.31 97.38 Favored 'General case' 0 C--O 1.246 0.9 0 CA-C-N 121.327 1.876 . . . . 14.38 112.613 176.02 162.444 83.439 95.54 100.264 2.011 107.061 -69.787 -68.176 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 62.2 m -68.47 -27.34 66.07 Favored 'General case' 0 C--O 1.25 1.131 0 N-CA-C 114.49 1.292 . . . . 16.99 114.49 -178.815 -56.649 -80.107 -85.263 101.126 1.981 109.222 -53.745 -73.2 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.64 -58.3 9.19 Favored 'General case' 0 C--O 1.246 0.876 0 C-N-CA 124.792 1.237 . . . . 13.05 110.789 174.085 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 54.1 mt -54.95 -51.34 66.42 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.371 1.248 . . . . 17.66 114.371 175.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 6.5 pt -66.18 -29.26 46.15 Favored 'Isoleucine or valine' 0 C--N 1.366 1.306 0 CA-C-O 122.937 1.351 . . . . 21.68 112.443 177.043 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.68 -25.58 75.38 Favored Glycine 0 CA--C 1.532 1.104 0 O-C-N 117.409 -3.307 . . . . 24.71 111.207 174.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -67.25 -14.26 63.75 Favored Glycine 0 CA--C 1.535 1.323 0 O-C-N 119.627 -2.102 . . . . 24.72 111.89 170.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -96.92 154.93 17.0 Favored 'General case' 0 N--CA 1.439 -1.008 0 N-CA-C 117.956 2.576 . . . . 17.68 117.956 -179.821 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -62.55 150.85 47.19 Favored Glycine 0 C--N 1.344 0.974 0 N-CA-C 106.532 -2.627 . . . . 19.96 106.532 167.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.531 ' HA ' ' O ' ' A' ' 130' ' ' HOH . 34.4 t0 -49.12 -61.31 2.14 Favored 'General case' 0 C--N 1.305 -1.329 0 C-N-CA 127.157 2.183 . . . . 36.65 114.43 -177.644 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 2.4 mp -64.54 -31.62 54.38 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.863 0 CA-C-O 122.914 1.34 . . . . 28.4 111.289 177.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -71.1 -41.91 69.99 Favored 'General case' 0 N--CA 1.428 -1.544 0 CA-C-O 117.306 -1.33 . . . . 25.75 110.198 -174.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.66 -43.95 90.0 Favored 'General case' 0 C--N 1.347 0.478 0 O-C-N 124.609 1.193 . . . . 11.68 110.137 175.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 74.8 mt -64.41 -46.73 92.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 O-C-N 119.045 -2.284 . . . . 13.98 109.862 176.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 75.2 t -66.03 -37.0 78.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 O-C-N 118.029 -2.919 . . . . 15.52 111.498 -177.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.675 ' O ' HD13 ' A' ' 46' ' ' ILE . 84.7 m -69.79 -40.34 76.05 Favored 'General case' 0 C--N 1.316 -0.884 0 O-C-N 120.923 -1.11 . . . . 13.86 111.0 179.227 -64.414 -67.916 -78.049 101.199 2.052 104.621 -61.975 -62.335 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.572 HD13 HD13 ' A' ' 11' ' ' LEU . 0.0 OUTLIER -62.18 -39.74 93.71 Favored 'General case' 0 CA--C 1.508 -0.67 0 C-N-CA 125.021 1.328 . . . . 16.27 111.191 173.697 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 95.0 m -66.63 -35.77 80.98 Favored 'General case' 0 C--O 1.242 0.686 0 CA-C-O 117.8 -1.095 . . . . 12.18 112.889 179.391 -69.873 -89.876 -86.437 105.929 2.004 98.754 -62.062 -69.067 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.675 HD13 ' O ' ' A' ' 43' ' ' CYS . 0.1 OUTLIER -68.7 -39.55 80.42 Favored 'Isoleucine or valine' 0 C--N 1.358 0.971 0 CA-C-O 116.402 -1.761 . . . . 20.57 108.136 176.674 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -59.98 -38.81 83.62 Favored 'General case' 0 C--N 1.342 0.257 0 CA-C-N 123.05 2.659 . . . . 26.65 112.445 178.177 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 49.2 mt -67.7 -50.24 58.62 Favored 'General case' 0 C--O 1.255 1.376 0 C-N-CA 124.261 1.024 . . . . 15.34 111.414 179.657 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 12.4 mtm-85 -52.6 -43.56 65.43 Favored 'General case' 0 CA--C 1.495 -1.146 0 CA-C-O 117.9 -1.047 . . . . 37.4 110.33 171.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.04 -17.49 64.42 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 122.668 2.486 . . . . 19.71 113.416 -176.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 5.7 mt -79.33 -24.8 42.52 Favored 'General case' 0 CA--C 1.491 -1.293 0 O-C-N 119.888 -1.758 . . . . 24.54 113.773 175.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 98.35 20.37 20.4 Favored Glycine 0 N--CA 1.434 -1.496 0 CA-C-O 122.893 1.274 . . . . 19.73 109.988 -178.676 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 1.2 mm -66.89 124.09 21.37 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 N-CA-C 107.962 -1.125 . . . . 21.83 107.962 175.657 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.5 mp -83.25 -44.1 15.34 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 120.148 -1.595 . . . . 24.59 111.962 171.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 57.6 t-20 -91.51 92.78 8.67 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 122.966 2.621 . . . . 14.25 105.392 -178.507 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 22.9 mt -74.15 -41.15 61.98 Favored 'General case' 0 CA--C 1.504 -0.804 0 O-C-N 121.122 -0.987 . . . . 15.98 111.724 -172.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -68.17 -39.3 82.61 Favored 'General case' 0 CA--C 1.494 -1.2 0 N-CA-C 114.377 1.251 . . . . 18.82 114.377 -171.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.2 ttt180 -64.21 -40.17 95.51 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 122.699 0.399 . . . . 42.67 110.695 178.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 59.8 m-80 -75.96 -39.92 55.02 Favored 'General case' 0 CA--C 1.504 -0.794 0 O-C-N 119.48 -2.012 . . . . 16.23 111.758 178.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.6 tp -55.51 -46.56 76.98 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-O 123.334 1.54 . . . . 10.31 109.824 173.786 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.549 ' HB3' ' O ' ' A' ' 124' ' ' HOH . 70.8 mt-30 -67.46 -36.63 81.54 Favored 'General case' 0 C--O 1.22 -0.488 0 O-C-N 120.259 -1.525 . . . . 16.47 108.722 -176.704 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.52 HD23 HD12 ' A' ' 18' ' ' LEU . 39.3 tp -59.64 -47.51 85.31 Favored 'General case' 0 C--O 1.252 1.192 0 CA-C-N 119.954 1.252 . . . . 15.14 109.554 178.623 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 64.5 mt -59.93 -45.76 94.79 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 CA-C-O 117.995 -1.003 . . . . 10.79 112.243 177.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.4 -35.3 79.97 Favored 'General case' 0 C--O 1.248 0.979 0 CA-C-N 120.533 1.515 . . . . 18.12 113.183 -178.901 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -69.28 -31.55 70.14 Favored 'General case' 0 CA--C 1.502 -0.891 0 CA-C-N 115.471 -0.786 . . . . 13.1 110.614 -179.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 9.1 p -67.12 -19.72 65.66 Favored 'General case' 0 N--CA 1.433 -1.29 0 CA-C-O 117.652 -1.166 . . . . 20.18 110.442 -178.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 64.1 m -76.64 -7.71 55.81 Favored 'General case' 0 C--N 1.369 1.431 0 CA-C-N 121.287 1.858 . . . . 25.16 115.607 -175.255 -73.2 -53.745 -85.263 109.222 1.981 101.126 -80.107 -56.649 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 110.77 50.36 0.65 Allowed Glycine 0 N--CA 1.444 -0.778 0 CA-C-O 113.806 -3.774 . . . . 31.95 119.372 169.116 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.58 ' NH1' ' HB3' ' A' ' 71' ' ' TYR . 0.0 OUTLIER -103.4 165.96 10.71 Favored 'General case' 0 C--N 1.348 0.514 1 CA-C-N 125.799 4.799 . . . . 38.38 110.451 176.664 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 19.7 m -82.84 -8.93 59.54 Favored 'General case' 0 N--CA 1.424 -1.772 0 CA-C-N 112.38 -2.191 . . . . 30.28 108.158 177.077 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' TYR . . . . . 0.58 ' HB3' ' NH1' ' A' ' 69' ' ' ARG . 0.0 OUTLIER -130.4 129.99 22.92 Favored Pre-proline 0 N--CA 1.479 0.982 0 CA-C-O 112.477 -3.63 . . . . 46.14 106.507 -170.705 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -65.34 149.83 87.86 Favored 'Trans proline' 0 C--N 1.359 1.098 0 CA-C-N 128.074 3.919 . . . . 17.37 112.364 -179.109 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' SER . . . . . 0.621 ' HB3' ' O ' ' A' ' 124' ' ' HOH . 17.6 t -79.37 146.44 32.86 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-N 121.866 2.121 . . . . 16.22 108.282 -178.924 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 25.6 p-10 -115.39 21.24 14.24 Favored 'General case' 0 CA--C 1.569 1.695 0 CA-C-O 123.206 1.479 . . . . 27.44 110.668 169.908 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.06 144.43 53.48 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-O 124.237 1.97 . . . . 17.81 115.426 178.821 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . 0.369 0.8 OUTLIER -122.15 139.61 53.54 Favored 'General case' 0 CA--C 1.552 1.039 0 CA-C-N 110.697 -2.956 . . . . 23.75 112.941 -177.049 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 96.6 m -78.12 137.53 60.95 Favored Pre-proline 0 N--CA 1.492 1.639 0 CA-C-N 119.115 0.871 . . . . 19.85 110.682 169.364 -69.067 -62.062 -86.437 98.754 2.004 105.929 -89.876 -69.873 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -61.12 117.72 4.53 Favored 'Trans proline' 0 CA--C 1.557 1.638 0 CA-C-N 122.374 1.883 . . . . 35.35 113.286 168.141 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.03 -66.44 1.08 Allowed 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 101.156 -3.646 . . . . 50.78 101.156 168.922 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . 0.269 0.6 OUTLIER . . . . . 0 C--N 1.353 0.751 3 O-C-N 134.998 7.686 . . . . 49.79 121.336 -172.35 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' HOH . . . . . 0.621 ' O ' ' HB3' ' A' ' 73' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' HOH . . . . . 0.531 ' O ' ' HA ' ' A' ' 37' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_