data_3i7t_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 3i7t _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 ' 4' ' ' SER . . . . . . . . . . . . . 26.3 t . . . . . 0 N--CA 1.501 2.103 0 N-CA-C 114.084 1.142 . . . . 17.39 114.084 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 40.6 ttt180 -106.18 132.65 51.99 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 113.342 0.867 . . . . 12.38 113.342 -169.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 8.4 p -125.85 146.47 49.8 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 109.563 -0.532 . . . . 12.98 109.563 175.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 38.3 mtm -134.38 147.21 50.45 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-N 115.742 -0.663 . . . . 15.95 111.88 -175.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 94.3 t -116.38 130.49 71.08 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.022 0 N-CA-C 108.231 -1.026 . . . . 9.58 108.231 -177.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.0 t -121.17 150.18 41.67 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.565 -0.902 . . . . 13.82 108.565 177.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 86.3 p -102.93 -5.08 23.86 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 120.515 -0.474 . . . . 14.53 110.404 177.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 82.75 5.84 89.04 Favored Glycine 0 CA--C 1.528 0.856 0 C-N-CA 121.349 -0.453 . . . . 15.23 113.933 -179.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 52.5 p -70.37 155.76 40.24 Favored 'General case' 0 C--O 1.236 0.369 0 O-C-N 122.0 -0.706 . . . . 16.79 111.374 -176.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLU . . . . . 0.466 ' O ' ' CB ' ' A' ' 16' ' ' SER . 8.7 tp10 -63.82 -37.05 85.93 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.305 0.574 . . . . 24.23 111.524 176.529 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -59.65 -41.43 90.51 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.324 -0.853 . . . . 21.69 111.331 -178.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -64.06 -34.45 78.05 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 108.601 -0.888 . . . . 20.78 108.601 176.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' SER . . . . . 0.466 ' CB ' ' O ' ' A' ' 13' ' ' GLU . 8.6 t -61.44 -56.35 21.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 113.528 -1.669 . . . . 18.86 112.704 174.771 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.3 -34.86 79.33 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 114.256 1.206 . . . . 14.69 114.256 -177.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 84.3 t -100.34 -21.4 5.13 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 N-CA-C 114.064 1.135 . . . . 11.41 114.064 -173.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 72.29 69.15 1.44 Allowed Glycine 0 N--CA 1.467 0.759 0 N-CA-C 111.506 -0.637 . . . . 9.51 111.506 178.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 14.4 p90 -150.66 162.37 40.81 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 109.386 -0.598 . . . . 17.78 109.386 -178.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 74.9 m -108.87 154.92 21.43 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-O 121.104 0.478 . . . . 6.35 110.835 179.76 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ARG . . . . . 0.521 ' NH1' ' O ' ' A' ' 182' ' ' HOH . 16.3 mmm180 -66.42 -43.45 85.68 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.622 -0.51 . . . . 14.99 109.622 174.035 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -146.09 148.66 32.87 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 116.556 -0.293 . . . . 5.98 111.276 177.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 90.4 t -132.18 136.93 55.67 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.359 0 N-CA-C 108.392 -0.966 . . . . 5.78 108.392 173.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 32.2 ttt180 -121.46 128.28 51.97 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 123.78 0.832 . . . . 10.42 110.544 175.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -139.87 136.13 38.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 N-CA-C 107.234 -1.395 . . . . 12.06 107.234 165.001 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 54.52 -138.99 39.75 Favored Glycine 0 CA--C 1.523 0.56 0 C-N-CA 118.377 -1.868 . . . . 10.93 110.998 -168.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' PRO . . . . . 0.574 ' O ' ' N ' ' A' ' 121' ' ' VAL . 72.1 Cg_endo -91.92 -7.22 3.28 Favored 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 117.141 -1.439 . . . . 14.08 110.043 -174.169 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 32.1 tp -73.92 131.75 41.77 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 113.946 1.091 . . . . 16.46 113.946 177.308 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 59.5 t -126.71 120.69 56.67 Favored 'Isoleucine or valine' 0 C--O 1.243 0.743 0 N-CA-C 108.221 -1.029 . . . . 9.19 108.221 165.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 36.0 m -106.11 142.04 20.01 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 CA-C-O 121.215 0.531 . . . . 5.36 111.795 171.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 32.1 t -117.96 135.37 58.57 Favored 'Isoleucine or valine' 0 C--O 1.248 1.003 0 CA-C-N 115.752 -0.658 . . . . 5.62 109.591 -178.59 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.68 158.05 8.46 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 115.058 -0.973 . . . . 5.81 112.159 177.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -51.86 129.06 34.36 Favored Glycine 0 N--CA 1.467 0.747 0 N-CA-C 107.097 -2.401 . . . . 6.55 107.097 166.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 37.0 m -124.22 129.45 50.81 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 112.26 0.467 . . . . 8.47 112.26 -176.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 67.8 p -106.75 174.6 5.82 Favored 'General case' 0 C--O 1.245 0.859 0 CA-C-O 121.658 0.742 . . . . 7.79 110.063 173.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -131.57 151.7 19.83 Favored Glycine 0 CA--C 1.507 -0.455 0 C-N-CA 120.189 -1.005 . . . . 7.1 113.646 -174.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.2 m -76.79 166.28 23.57 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 108.872 -0.788 . . . . 9.31 108.872 169.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 120.01 154.65 9.48 Favored Glycine 0 C--N 1.32 -0.31 0 C-N-CA 120.262 -0.97 . . . . 10.23 111.179 -176.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -83.44 -29.55 27.97 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.855 0.687 . . . . 34.86 112.855 -172.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ASP . . . . . 0.485 ' CB ' ' O ' ' A' ' 218' ' ' HOH . 31.3 t0 -132.26 168.5 17.95 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 119.957 -0.697 . . . . 17.86 112.252 -173.277 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 2.5 tt -57.01 -41.2 76.98 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 113.481 0.919 . . . . 9.48 113.481 -169.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.26 -51.65 69.07 Favored 'General case' 0 C--O 1.218 -0.59 0 C-N-CA 119.363 -0.935 . . . . 7.97 111.909 178.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.76 -40.59 93.08 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.993 0.425 . . . . 7.44 111.599 -177.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 63.8 mt-30 -65.37 -39.69 92.59 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.176 -0.465 . . . . 6.93 111.657 179.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 24.6 m -62.8 -45.99 90.06 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 119.62 -0.832 . . . . 7.22 111.763 174.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 86.7 mtm-85 -59.82 -43.78 94.37 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 119.988 -0.685 . . . . 17.88 110.175 179.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -69.13 -35.9 76.88 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-N 116.186 -0.461 . . . . 9.9 111.676 -177.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.27 -38.61 91.65 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 120.283 -0.567 . . . . 6.62 109.521 176.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 85.6 mt -74.03 -32.57 63.4 Favored 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 120.53 -0.468 . . . . 7.14 111.188 -178.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ARG . . . . . 0.502 ' CD ' ' O ' ' A' ' 207' ' ' HOH . 0.0 OUTLIER -62.43 -42.9 99.8 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 120.593 -0.443 . . . . 31.95 110.538 174.668 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 76.9 mtt-85 -67.83 -38.76 83.63 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 121.072 0.463 . . . . 8.81 112.102 179.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 84.7 mt -56.26 -47.48 80.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 C-N-CA 119.921 -0.712 . . . . 5.54 112.072 171.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -57.15 -46.93 82.3 Favored 'General case' 0 C--O 1.225 -0.229 0 N-CA-C 111.757 0.28 . . . . 16.03 111.757 175.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 86.1 mt -59.73 -44.06 92.91 Favored 'Isoleucine or valine' 0 C--O 1.247 0.947 0 CA-C-O 121.051 0.453 . . . . 7.0 110.417 -179.542 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -66.81 -47.17 72.88 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.659 -0.497 . . . . 5.22 109.659 -179.113 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 73.2 mt -52.08 -49.14 64.15 Favored 'General case' 0 C--O 1.24 0.567 0 N-CA-C 113.217 0.821 . . . . 5.14 113.217 174.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -62.99 -37.68 95.36 Favored Glycine 0 N--CA 1.464 0.518 0 N-CA-C 110.663 -0.975 . . . . 6.21 110.663 -175.478 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -68.93 -16.09 63.66 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 114.671 1.36 . . . . 17.57 114.671 174.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -101.72 17.21 23.53 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.076 0.55 . . . . 8.56 111.986 172.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 69.9 25.69 75.27 Favored Glycine 0 CA--C 1.527 0.824 0 C-N-CA 120.361 -0.923 . . . . 7.49 115.16 178.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -126.82 164.73 20.74 Favored 'General case' 0 C--O 1.238 0.462 0 O-C-N 122.193 -0.592 . . . . 5.73 110.738 179.389 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 22.7 p -128.51 170.34 13.3 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 109.248 -0.649 . . . . 5.01 109.248 178.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 89.9 mt -54.29 -34.28 60.53 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 119.728 -0.789 . . . . 7.23 113.119 174.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.3 -12.0 18.36 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.956 0.725 . . . . 4.1 112.956 178.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -93.09 -13.46 28.52 Favored 'General case' 0 C--O 1.241 0.611 0 N-CA-C 112.576 0.584 . . . . 4.59 112.576 178.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 53.2 t -66.67 124.81 22.65 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.892 0 CA-C-N 115.851 -0.613 . . . . 4.37 111.663 -176.111 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 28.6 m -107.01 -22.38 4.99 Favored 'Isoleucine or valine' 0 C--O 1.239 0.547 0 C-N-CA 121.024 -0.27 . . . . 4.5 110.273 -178.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 52.7 ttm-85 -144.32 135.51 25.4 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 113.132 0.79 . . . . 10.38 113.132 178.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' THR . . . . . 0.662 ' OG1' ' CG2' ' A' ' 98' ' ' THR . 50.4 p -118.6 159.29 23.86 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 108.798 -0.815 . . . . 6.53 108.798 163.84 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 41.0 ttm105 -141.53 128.78 21.03 Favored 'General case' 0 CA--C 1.499 -0.987 0 N-CA-C 104.71 -2.33 . . . . 12.59 104.71 175.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 63.8 mt -119.87 120.1 62.22 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 O-C-N 124.525 1.14 . . . . 6.09 111.285 -171.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -102.12 127.9 48.83 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 109.551 -0.537 . . . . 15.38 109.551 171.17 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 16.7 m -125.1 153.03 32.04 Favored 'Isoleucine or valine' 0 C--O 1.239 0.541 0 O-C-N 123.292 0.37 . . . . 6.76 110.93 177.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 74.2 p -87.78 -16.09 35.11 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 119.055 -1.058 . . . . 7.63 111.167 177.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 62.2 t0 -141.46 95.84 2.89 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 120.505 -0.478 . . . . 12.53 110.56 175.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ILE . . . . . 0.461 ' N ' ' OE1' ' A' ' 102' ' ' GLU . 7.4 tt -70.65 -11.53 15.13 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-N 116.15 -0.477 . . . . 8.23 111.839 -173.283 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.5 p -67.08 -13.6 62.09 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 119.154 -1.018 . . . . 9.42 109.881 174.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 75.8 mtm180 -99.94 26.15 6.64 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 112.183 0.438 . . . . 15.64 112.183 177.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 55.8 p-90 -59.85 -27.51 66.72 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 113.439 0.903 . . . . 14.74 113.439 -175.361 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 35.1 mtt-85 -71.84 -37.4 70.27 Favored 'General case' 0 C--O 1.219 -0.519 0 N-CA-C 114.481 1.289 . . . . 21.75 114.481 -178.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -61.86 -39.4 91.74 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.01 -0.737 . . . . 17.19 109.01 176.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 86.7 t -74.11 -49.26 34.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.869 -0.605 . . . . 9.12 110.185 -179.122 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -52.42 -42.6 57.23 Favored Glycine 0 C--N 1.332 0.345 0 N-CA-C 114.914 0.726 . . . . 9.1 114.914 177.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -56.56 -44.29 80.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 117.138 0.469 . . . . 18.6 111.841 -179.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 94.4 t -67.99 -40.74 83.78 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 CA-C-N 116.017 -0.538 . . . . 6.5 112.086 178.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 63.5 t-80 -63.84 -37.9 89.09 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 108.312 -0.996 . . . . 7.05 108.312 178.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.89 -42.19 77.27 Favored 'General case' 0 C--O 1.227 -0.092 0 CA-C-N 115.197 -0.91 . . . . 10.06 111.313 -178.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLN . . . . . 0.612 ' OE1' ' O ' ' A' ' 196' ' ' HOH . 3.4 tp60 -63.11 -33.15 74.84 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 110.229 -0.286 . . . . 22.98 110.229 176.433 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -80.11 -36.73 34.95 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 112.256 0.465 . . . . 13.25 112.256 177.113 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -125.52 19.93 8.0 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 116.722 2.119 . . . . 13.4 116.722 -168.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -56.51 -38.79 82.31 Favored Glycine 0 CA--C 1.518 0.23 0 N-CA-C 114.459 0.544 . . . . 13.3 114.459 -178.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.8 mtmp? -86.42 -44.77 11.76 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 121.259 0.552 . . . . 17.48 110.962 178.137 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 15.0 mt -65.67 -52.44 50.44 Favored 'Isoleucine or valine' 0 C--O 1.247 0.961 0 CA-C-N 115.545 -0.752 . . . . 8.02 112.96 -175.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 6.9 mtp180 58.4 61.65 5.12 Favored Pre-proline 0 C--O 1.2 -1.535 0 N-CA-C 113.565 0.95 . . . . 35.03 113.565 172.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.25 168.28 16.35 Favored 'Trans proline' 0 C--N 1.31 -1.475 0 N-CA-C 107.067 -1.936 . . . . 5.52 107.067 171.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 4.6 m -74.43 153.42 6.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 N-CA-C 108.295 -1.002 . . . . 5.62 108.295 168.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' THR . . . . . 0.662 ' CG2' ' OG1' ' A' ' 70' ' ' THR 0.271 0.0 OUTLIER -139.24 175.67 9.36 Favored 'General case' 0 CA--C 1.5 -0.952 0 C-N-CA 119.784 -0.766 . . . . 11.76 112.347 170.016 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 14.7 m -141.77 152.97 44.25 Favored 'General case' 0 CA--C 1.5 -0.946 0 N-CA-C 106.315 -1.735 . . . . 9.11 106.315 165.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 49.4 ttm -137.64 121.16 17.2 Favored 'General case' 0 CA--C 1.504 -0.822 0 N-CA-C 107.772 -1.196 . . . . 13.05 107.772 173.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 27.0 m -132.74 153.14 37.46 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.565 0 C-N-CA 119.441 -0.904 . . . . 9.53 111.478 177.131 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' GLU . . . . . 0.461 ' OE1' ' N ' ' A' ' 77' ' ' ILE . 30.0 tt0 -89.3 132.89 34.71 Favored 'General case' 0 N--CA 1.436 -1.148 0 C-N-CA 119.261 -0.975 . . . . 11.86 110.26 179.161 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 24.3 m -113.4 160.33 12.95 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-N 116.287 -0.415 . . . . 11.26 111.027 173.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 20.0 p -66.9 -40.16 87.65 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 119.237 -0.985 . . . . 12.64 111.907 178.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -153.92 153.27 31.74 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 112.875 0.694 . . . . 11.63 112.875 -178.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 33.2 mt -103.2 -177.25 3.32 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 108.034 -1.098 . . . . 12.82 108.034 164.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 4.9 tp -57.21 -25.58 23.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 N-CA-C 114.93 1.456 . . . . 14.12 114.93 -171.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -138.51 148.92 60.91 Favored Pre-proline 0 N--CA 1.467 0.383 0 N-CA-C 109.093 -0.706 . . . . 12.85 109.093 177.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -67.7 -23.2 42.59 Favored 'Trans proline' 0 CA--C 1.535 0.543 0 N-CA-C 114.91 1.081 . . . . 13.03 114.91 -168.273 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' GLY . . . . . 0.464 ' N ' ' O ' ' A' ' 211' ' ' HOH . . . -85.43 -4.2 86.1 Favored Glycine 0 N--CA 1.466 0.655 0 C-N-CA 120.674 -0.775 . . . . 11.82 113.548 -179.932 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 75.1 mt -90.21 125.8 35.6 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.01 -0.737 . . . . 9.74 109.01 -175.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 88.7 mt -111.71 -12.58 13.85 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 113.395 0.887 . . . . 8.75 113.395 -165.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 7.4 p -156.09 138.9 6.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.529 -0.76 . . . . 6.91 109.374 -174.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 50.6 tt0 -132.56 138.83 47.59 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.026 -0.731 . . . . 14.64 109.026 171.663 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 41.9 mt -126.73 131.23 71.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 112.479 0.548 . . . . 7.99 112.479 -177.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -102.82 161.49 13.7 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.35 -0.386 . . . . 16.68 110.509 169.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -147.09 145.15 29.53 Favored 'General case' 0 C--O 1.241 0.624 0 C-N-CA 119.692 -0.803 . . . . 6.94 111.364 173.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -119.12 138.47 52.88 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 107.303 -1.369 . . . . 15.15 107.303 168.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -130.58 155.29 46.77 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.864 -0.607 . . . . 7.87 109.679 -179.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' TYR . . . . . . . . . . . . . 30.6 t80 -127.54 122.51 33.49 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.937 -0.574 . . . . 21.54 109.655 176.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' VAL . . . . . 0.574 ' N ' ' O ' ' A' ' 28' ' ' PRO . 95.7 t . . . . . 0 C--O 1.239 0.52 0 CA-C-N 116.141 -0.481 . . . . 20.0 111.9 179.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' IOD . . . . . 0.903 ' I ' ' I ' ' A' ' 157' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' IOD . . . . . 0.545 ' I ' ' O ' ' A' ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' IOD . . . . . 0.903 ' I ' ' I ' ' A' ' 154' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' HOH . . . . . 0.545 ' O ' ' I ' ' A' ' 156' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 180' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 181' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' HOH . . . . . 0.521 ' O ' ' NH1' ' A' ' 22' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 183' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 184' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 186' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 187' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 188' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 189' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 190' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 191' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 192' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 193' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 194' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 195' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 196' ' ' HOH . . . . . 0.612 ' O ' ' OE1' ' A' ' 89' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 197' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 198' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 199' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 200' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . 0.502 ' O ' ' CD ' ' A' ' 51' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . 0.464 ' O ' ' N ' ' A' ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . 0.485 ' O ' ' CB ' ' A' ' 41' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 26.3 t . . . . . 0 N--CA 1.501 2.103 0 N-CA-C 114.084 1.142 . . . . 17.390000000000001 114.084 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 40.6 ttt180 -106.18 132.65 51.99 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 113.342 0.867 . . . . 12.380000000000001 113.342 -169.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 8.4 p -125.85 146.47 49.8 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 109.563 -0.532 . . . . 12.98 109.563 175.821 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 38.3 mtm -134.38 147.21 50.45 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-N 115.742 -0.663 . . . . 15.949999999999999 111.88 -175.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 94.3 t -116.38 130.49 71.08 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.022 0 N-CA-C 108.231 -1.026 . . . . 9.5800000000000001 108.231 -177.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.0 t -121.17 150.18 41.67 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.565 -0.902 . . . . 13.82 108.565 177.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 86.3 p -102.93 -5.08 23.86 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 120.515 -0.474 . . . . 14.529999999999999 110.404 177.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 82.75 5.84 89.04 Favored Glycine 0 CA--C 1.528 0.856 0 C-N-CA 121.349 -0.453 . . . . 15.23 113.933 -179.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 52.5 p -70.37 155.76 40.24 Favored 'General case' 0 C--O 1.236 0.369 0 O-C-N 122.0 -0.706 . . . . 16.789999999999999 111.374 -176.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLU . . . . . 0.771 ' O ' ' HB3' ' A' ' 16' ' ' SER . 8.7 tp10 -63.82 -37.05 85.93 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.305 0.574 . . . . 24.23 111.524 176.529 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -59.65 -41.43 90.51 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.324 -0.853 . . . . 21.690000000000001 111.331 -178.315 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -64.06 -34.45 78.05 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 108.601 -0.888 . . . . 20.780000000000001 108.601 176.46 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' SER . . . . . 0.771 ' HB3' ' O ' ' A' ' 13' ' ' GLU . 8.6 t -61.44 -56.35 21.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 113.528 -1.669 . . . . 18.859999999999999 112.704 174.771 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.3 -34.86 79.33 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 114.256 1.206 . . . . 14.69 114.256 -177.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 84.3 t -100.34 -21.4 5.13 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 N-CA-C 114.064 1.135 . . . . 11.41 114.064 -173.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 72.29 69.15 1.44 Allowed Glycine 0 N--CA 1.467 0.759 0 N-CA-C 111.506 -0.637 . . . . 9.5099999999999998 111.506 178.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 14.4 p90 -150.66 162.37 40.81 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 109.386 -0.598 . . . . 17.780000000000001 109.386 -178.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 74.9 m -108.87 154.92 21.43 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-O 121.104 0.478 . . . . 6.3499999999999996 110.835 179.76 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 16.3 mmm180 -66.42 -43.45 85.68 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.622 -0.51 . . . . 14.99 109.622 174.035 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -146.09 148.66 32.87 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 116.556 -0.293 . . . . 5.9800000000000004 111.276 177.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 90.4 t -132.18 136.93 55.67 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.359 0 N-CA-C 108.392 -0.966 . . . . 5.7800000000000002 108.392 173.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ARG . . . . . 0.476 ' HB2' HG22 ' A' ' 30' ' ' VAL . 32.2 ttt180 -121.46 128.28 51.97 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 123.78 0.832 . . . . 10.42 110.544 175.463 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -139.87 136.13 38.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 N-CA-C 107.234 -1.395 . . . . 12.06 107.234 165.001 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 54.52 -138.99 39.75 Favored Glycine 0 CA--C 1.523 0.56 0 C-N-CA 118.377 -1.868 . . . . 10.93 110.998 -168.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -91.92 -7.22 3.28 Favored 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 117.141 -1.439 . . . . 14.08 110.043 -174.169 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 32.1 tp -73.92 131.75 41.77 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 113.946 1.091 . . . . 16.460000000000001 113.946 177.308 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' VAL . . . . . 0.476 HG22 ' HB2' ' A' ' 25' ' ' ARG . 59.5 t -126.71 120.69 56.67 Favored 'Isoleucine or valine' 0 C--O 1.243 0.743 0 N-CA-C 108.221 -1.029 . . . . 9.1899999999999995 108.221 165.712 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 36.0 m -106.11 142.04 20.01 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 CA-C-O 121.215 0.531 . . . . 5.3600000000000003 111.795 171.063 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 32.1 t -117.96 135.37 58.57 Favored 'Isoleucine or valine' 0 C--O 1.248 1.003 0 CA-C-N 115.752 -0.658 . . . . 5.6200000000000001 109.591 -178.59 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.68 158.05 8.46 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 115.058 -0.973 . . . . 5.8099999999999996 112.159 177.834 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -51.86 129.06 34.36 Favored Glycine 0 N--CA 1.467 0.747 0 N-CA-C 107.097 -2.401 . . . . 6.5499999999999998 107.097 166.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 37.0 m -124.22 129.45 50.81 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 112.26 0.467 . . . . 8.4700000000000006 112.26 -176.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 67.8 p -106.75 174.6 5.82 Favored 'General case' 0 C--O 1.245 0.859 0 CA-C-O 121.658 0.742 . . . . 7.79 110.063 173.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -131.57 151.7 19.83 Favored Glycine 0 CA--C 1.507 -0.455 0 C-N-CA 120.189 -1.005 . . . . 7.0999999999999996 113.646 -174.461 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.2 m -76.79 166.28 23.57 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 108.872 -0.788 . . . . 9.3100000000000005 108.872 169.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 120.01 154.65 9.48 Favored Glycine 0 C--N 1.32 -0.31 0 C-N-CA 120.262 -0.97 . . . . 10.23 111.179 -176.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -83.44 -29.55 27.97 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.855 0.687 . . . . 34.859999999999999 112.855 -172.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ASP . . . . . 0.915 ' HB3' ' O ' ' A' ' 218' ' ' HOH . 31.3 t0 -132.26 168.5 17.95 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 119.957 -0.697 . . . . 17.859999999999999 112.252 -173.277 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ILE . . . . . 0.405 HD13 ' CG2' ' A' ' 83' ' ' VAL . 2.5 tt -57.01 -41.2 76.98 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 113.481 0.919 . . . . 9.4800000000000004 113.481 -169.231 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.26 -51.65 69.07 Favored 'General case' 0 C--O 1.218 -0.59 0 C-N-CA 119.363 -0.935 . . . . 7.9699999999999998 111.909 178.613 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.76 -40.59 93.08 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.993 0.425 . . . . 7.4400000000000004 111.599 -177.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 63.8 mt-30 -65.37 -39.69 92.59 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.176 -0.465 . . . . 6.9299999999999997 111.657 179.34 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 24.6 m -62.8 -45.99 90.06 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 119.62 -0.832 . . . . 7.2199999999999998 111.763 174.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ARG . . . . . 0.472 ' HG2' HG13 ' A' ' 86' ' ' VAL . 86.7 mtm-85 -59.82 -43.78 94.37 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 119.988 -0.685 . . . . 17.879999999999999 110.175 179.729 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -69.13 -35.9 76.88 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-N 116.186 -0.461 . . . . 9.9000000000000004 111.676 -177.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.27 -38.61 91.65 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 120.283 -0.567 . . . . 6.6200000000000001 109.521 176.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 85.6 mt -74.03 -32.57 63.4 Favored 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 120.53 -0.468 . . . . 7.1399999999999997 111.188 -178.41 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ARG . . . . . 0.539 ' HD2' ' O ' ' A' ' 207' ' ' HOH . 0.0 OUTLIER -62.43 -42.9 99.8 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 120.593 -0.443 . . . . 31.949999999999999 110.538 174.668 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 76.9 mtt-85 -67.83 -38.76 83.63 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 121.072 0.463 . . . . 8.8100000000000005 112.102 179.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 84.7 mt -56.26 -47.48 80.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 C-N-CA 119.921 -0.712 . . . . 5.54 112.072 171.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -57.15 -46.93 82.3 Favored 'General case' 0 C--O 1.225 -0.229 0 N-CA-C 111.757 0.28 . . . . 16.030000000000001 111.757 175.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 86.1 mt -59.73 -44.06 92.91 Favored 'Isoleucine or valine' 0 C--O 1.247 0.947 0 CA-C-O 121.051 0.453 . . . . 7.0 110.417 -179.542 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -66.81 -47.17 72.88 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.659 -0.497 . . . . 5.2199999999999998 109.659 -179.113 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 73.2 mt -52.08 -49.14 64.15 Favored 'General case' 0 C--O 1.24 0.567 0 N-CA-C 113.217 0.821 . . . . 5.1399999999999997 113.217 174.581 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -62.99 -37.68 95.36 Favored Glycine 0 N--CA 1.464 0.518 0 N-CA-C 110.663 -0.975 . . . . 6.21 110.663 -175.478 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -68.93 -16.09 63.66 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 114.671 1.36 . . . . 17.57 114.671 174.288 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -101.72 17.21 23.53 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.076 0.55 . . . . 8.5600000000000005 111.986 172.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 69.9 25.69 75.27 Favored Glycine 0 CA--C 1.527 0.824 0 C-N-CA 120.361 -0.923 . . . . 7.4900000000000002 115.16 178.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -126.82 164.73 20.74 Favored 'General case' 0 C--O 1.238 0.462 0 O-C-N 122.193 -0.592 . . . . 5.7300000000000004 110.738 179.389 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 22.7 p -128.51 170.34 13.3 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 109.248 -0.649 . . . . 5.0099999999999998 109.248 178.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 89.9 mt -54.29 -34.28 60.53 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 119.728 -0.789 . . . . 7.2300000000000004 113.119 174.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.3 -12.0 18.36 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.956 0.725 . . . . 4.0999999999999996 112.956 178.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -93.09 -13.46 28.52 Favored 'General case' 0 C--O 1.241 0.611 0 N-CA-C 112.576 0.584 . . . . 4.5899999999999999 112.576 178.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 53.2 t -66.67 124.81 22.65 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.892 0 CA-C-N 115.851 -0.613 . . . . 4.3700000000000001 111.663 -176.111 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 28.6 m -107.01 -22.38 4.99 Favored 'Isoleucine or valine' 0 C--O 1.239 0.547 0 C-N-CA 121.024 -0.27 . . . . 4.5 110.273 -178.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 52.7 ttm-85 -144.32 135.51 25.4 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 113.132 0.79 . . . . 10.380000000000001 113.132 178.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' THR . . . . . 1.111 ' OG1' HG23 ' A' ' 98' ' ' THR . 50.4 p -118.6 159.29 23.86 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 108.798 -0.815 . . . . 6.5300000000000002 108.798 163.84 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ARG . . . . . 0.439 ' HD3' ' O ' ' A' ' 187' ' ' HOH . 41.0 ttm105 -141.53 128.78 21.03 Favored 'General case' 0 CA--C 1.499 -0.987 0 N-CA-C 104.71 -2.33 . . . . 12.59 104.71 175.677 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 63.8 mt -119.87 120.1 62.22 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 O-C-N 124.525 1.14 . . . . 6.0899999999999999 111.285 -171.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -102.12 127.9 48.83 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 109.551 -0.537 . . . . 15.380000000000001 109.551 171.17 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 16.7 m -125.1 153.03 32.04 Favored 'Isoleucine or valine' 0 C--O 1.239 0.541 0 O-C-N 123.292 0.37 . . . . 6.7599999999999998 110.93 177.466 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 74.2 p -87.78 -16.09 35.11 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 119.055 -1.058 . . . . 7.6299999999999999 111.167 177.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 62.2 t0 -141.46 95.84 2.89 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 120.505 -0.478 . . . . 12.529999999999999 110.56 175.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ILE . . . . . 0.455 ' HB ' ' HB2' ' A' ' 102' ' ' GLU . 7.4 tt -70.65 -11.53 15.13 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-N 116.15 -0.477 . . . . 8.2300000000000004 111.839 -173.283 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.5 p -67.08 -13.6 62.09 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 119.154 -1.018 . . . . 9.4199999999999999 109.881 174.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 75.8 mtm180 -99.94 26.15 6.64 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 112.183 0.438 . . . . 15.640000000000001 112.183 177.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 55.8 p-90 -59.85 -27.51 66.72 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 113.439 0.903 . . . . 14.74 113.439 -175.361 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 35.1 mtt-85 -71.84 -37.4 70.27 Favored 'General case' 0 C--O 1.219 -0.519 0 N-CA-C 114.481 1.289 . . . . 21.75 114.481 -178.007 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -61.86 -39.4 91.74 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.01 -0.737 . . . . 17.190000000000001 109.01 176.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' VAL . . . . . 0.405 ' CG2' HD13 ' A' ' 42' ' ' ILE . 86.7 t -74.11 -49.26 34.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.869 -0.605 . . . . 9.1199999999999992 110.185 -179.122 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -52.42 -42.6 57.23 Favored Glycine 0 C--N 1.332 0.345 0 N-CA-C 114.914 0.726 . . . . 9.0999999999999996 114.914 177.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -56.56 -44.29 80.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 117.138 0.469 . . . . 18.600000000000001 111.841 -179.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' VAL . . . . . 0.472 HG13 ' HG2' ' A' ' 47' ' ' ARG . 94.4 t -67.99 -40.74 83.78 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 CA-C-N 116.017 -0.538 . . . . 6.5 112.086 178.225 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 63.5 t-80 -63.84 -37.9 89.09 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 108.312 -0.996 . . . . 7.0499999999999998 108.312 178.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.89 -42.19 77.27 Favored 'General case' 0 C--O 1.227 -0.092 0 CA-C-N 115.197 -0.91 . . . . 10.06 111.313 -178.444 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLN . . . . . 0.612 ' OE1' ' O ' ' A' ' 196' ' ' HOH . 3.4 tp60 -63.11 -33.15 74.84 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 110.229 -0.286 . . . . 22.98 110.229 176.433 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -80.11 -36.73 34.95 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 112.256 0.465 . . . . 13.25 112.256 177.113 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -125.52 19.93 8.0 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 116.722 2.119 . . . . 13.4 116.722 -168.612 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -56.51 -38.79 82.31 Favored Glycine 0 CA--C 1.518 0.23 0 N-CA-C 114.459 0.544 . . . . 13.300000000000001 114.459 -178.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' LYS . . . . . 0.414 ' NZ ' ' HB2' ' A' ' 93' ' ' LYS . 1.8 mtmp? -86.42 -44.77 11.76 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 121.259 0.552 . . . . 17.48 110.962 178.137 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 15.0 mt -65.67 -52.44 50.44 Favored 'Isoleucine or valine' 0 C--O 1.247 0.961 0 CA-C-N 115.545 -0.752 . . . . 8.0199999999999996 112.96 -175.147 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 6.9 mtp180 58.4 61.65 5.12 Favored Pre-proline 0 C--O 1.2 -1.535 0 N-CA-C 113.565 0.95 . . . . 35.030000000000001 113.565 172.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.25 168.28 16.35 Favored 'Trans proline' 0 C--N 1.31 -1.475 0 N-CA-C 107.067 -1.936 . . . . 5.5199999999999996 107.067 171.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 4.6 m -74.43 153.42 6.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 N-CA-C 108.295 -1.002 . . . . 5.6200000000000001 108.295 168.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' THR . . . . . 1.111 HG23 ' OG1' ' A' ' 70' ' ' THR 0.271 0.0 OUTLIER -139.24 175.67 9.36 Favored 'General case' 0 CA--C 1.5 -0.952 0 C-N-CA 119.784 -0.766 . . . . 11.76 112.347 170.016 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 14.7 m -141.77 152.97 44.25 Favored 'General case' 0 CA--C 1.5 -0.946 0 N-CA-C 106.315 -1.735 . . . . 9.1099999999999994 106.315 165.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 49.4 ttm -137.64 121.16 17.2 Favored 'General case' 0 CA--C 1.504 -0.822 0 N-CA-C 107.772 -1.196 . . . . 13.050000000000001 107.772 173.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 27.0 m -132.74 153.14 37.46 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.565 0 C-N-CA 119.441 -0.904 . . . . 9.5299999999999994 111.478 177.131 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' GLU . . . . . 0.455 ' HB2' ' HB ' ' A' ' 77' ' ' ILE . 30.0 tt0 -89.3 132.89 34.71 Favored 'General case' 0 N--CA 1.436 -1.148 0 C-N-CA 119.261 -0.975 . . . . 11.859999999999999 110.26 179.161 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 24.3 m -113.4 160.33 12.95 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-N 116.287 -0.415 . . . . 11.26 111.027 173.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 20.0 p -66.9 -40.16 87.65 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 119.237 -0.985 . . . . 12.640000000000001 111.907 178.993 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -153.92 153.27 31.74 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 112.875 0.694 . . . . 11.630000000000001 112.875 -178.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 33.2 mt -103.2 -177.25 3.32 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 108.034 -1.098 . . . . 12.82 108.034 164.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 4.9 tp -57.21 -25.58 23.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 N-CA-C 114.93 1.456 . . . . 14.119999999999999 114.93 -171.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -138.51 148.92 60.91 Favored Pre-proline 0 N--CA 1.467 0.383 0 N-CA-C 109.093 -0.706 . . . . 12.85 109.093 177.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' PRO . . . . . 0.438 ' HD2' ' O ' ' A' ' 211' ' ' HOH . 2.0 Cg_endo -67.7 -23.2 42.59 Favored 'Trans proline' 0 CA--C 1.535 0.543 0 N-CA-C 114.91 1.081 . . . . 13.029999999999999 114.91 -168.273 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -85.43 -4.2 86.1 Favored Glycine 0 N--CA 1.466 0.655 0 C-N-CA 120.674 -0.775 . . . . 11.82 113.548 -179.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 75.1 mt -90.21 125.8 35.6 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.01 -0.737 . . . . 9.7400000000000002 109.01 -175.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 88.7 mt -111.71 -12.58 13.85 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 113.395 0.887 . . . . 8.75 113.395 -165.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 7.4 p -156.09 138.9 6.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.529 -0.76 . . . . 6.9100000000000001 109.374 -174.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 50.6 tt0 -132.56 138.83 47.59 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.026 -0.731 . . . . 14.640000000000001 109.026 171.663 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 41.9 mt -126.73 131.23 71.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 112.479 0.548 . . . . 7.9900000000000002 112.479 -177.418 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -102.82 161.49 13.7 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.35 -0.386 . . . . 16.68 110.509 169.037 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -147.09 145.15 29.53 Favored 'General case' 0 C--O 1.241 0.624 0 C-N-CA 119.692 -0.803 . . . . 6.9400000000000004 111.364 173.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -119.12 138.47 52.88 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 107.303 -1.369 . . . . 15.15 107.303 168.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -130.58 155.29 46.77 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.864 -0.607 . . . . 7.8700000000000001 109.679 -179.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' TYR . . . . . . . . . . . . . 30.6 t80 -127.54 122.51 33.49 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.937 -0.574 . . . . 21.539999999999999 109.655 176.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 95.7 t . . . . . 0 C--O 1.239 0.52 0 CA-C-N 116.141 -0.481 . . . . 20.0 111.9 179.329 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 151' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 152' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 153' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 154' ' ' IOD . . . . . 0.903 ' I ' ' I ' ' A' ' 157' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 155' ' ' IOD . . . . . 0.623 ' I ' ' HB3' ' A' ' 13' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 156' ' ' IOD . . . . . 0.545 ' I ' ' O ' ' A' ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 157' ' ' IOD . . . . . 0.903 ' I ' ' I ' ' A' ' 154' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 170' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 173' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 174' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 176' ' ' HOH . . . . . 0.545 ' O ' ' I ' ' A' ' 156' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 179' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 180' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 181' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 183' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 184' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 186' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 187' ' ' HOH . . . . . 0.439 ' O ' ' HD3' ' A' ' 71' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 188' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 189' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 190' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 191' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 192' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 193' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 194' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 195' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 196' ' ' HOH . . . . . 0.612 ' O ' ' OE1' ' A' ' 89' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 197' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 198' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 199' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 200' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . 0.539 ' O ' ' HD2' ' A' ' 51' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . 0.438 ' O ' ' HD2' ' A' ' 109' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . 0.915 ' O ' ' HB3' ' A' ' 41' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 26.3 t . . . . . 0 N--CA 1.501 2.103 0 N-CA-C 114.084 1.142 . . . . 17.39 114.084 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 40.6 ttt180 -106.18 132.65 51.99 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 113.342 0.867 . . . . 12.38 113.342 -169.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 8.4 p -125.85 146.47 49.8 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 109.563 -0.532 . . . . 12.98 109.563 175.821 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 38.3 mtm -134.38 147.21 50.45 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-N 115.742 -0.663 . . . . 15.95 111.88 -175.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 94.3 t -116.38 130.49 71.08 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.022 0 N-CA-C 108.231 -1.026 . . . . 9.58 108.231 -177.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.0 t -121.17 150.18 41.67 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.565 -0.902 . . . . 13.82 108.565 177.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 86.3 p -102.93 -5.08 23.86 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 120.515 -0.474 . . . . 14.53 110.404 177.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 82.75 5.84 89.04 Favored Glycine 0 CA--C 1.528 0.856 0 C-N-CA 121.349 -0.453 . . . . 15.23 113.933 -179.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 52.5 p -70.37 155.76 40.24 Favored 'General case' 0 C--O 1.236 0.369 0 O-C-N 122.0 -0.706 . . . . 16.79 111.374 -176.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.771 ' O ' ' HB3' ' A' ' 16' ' ' SER . 8.7 tp10 -63.82 -37.05 85.93 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.305 0.574 . . . . 24.23 111.524 176.529 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -59.65 -41.43 90.51 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.324 -0.853 . . . . 21.69 111.331 -178.315 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -64.06 -34.45 78.05 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 108.601 -0.888 . . . . 20.78 108.601 176.46 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' SER . . . . . 0.771 ' HB3' ' O ' ' A' ' 13' ' ' GLU . 8.6 t -61.44 -56.35 21.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 113.528 -1.669 . . . . 18.86 112.704 174.771 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.3 -34.86 79.33 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 114.256 1.206 . . . . 14.69 114.256 -177.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 84.3 t -100.34 -21.4 5.13 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 N-CA-C 114.064 1.135 . . . . 11.41 114.064 -173.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 72.29 69.15 1.44 Allowed Glycine 0 N--CA 1.467 0.759 0 N-CA-C 111.506 -0.637 . . . . 9.51 111.506 178.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 14.4 p90 -150.66 162.37 40.81 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 109.386 -0.598 . . . . 17.78 109.386 -178.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 74.9 m -108.87 154.92 21.43 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-O 121.104 0.478 . . . . 6.35 110.835 179.76 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 16.3 mmm180 -66.42 -43.45 85.68 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.622 -0.51 . . . . 14.99 109.622 174.035 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -146.09 148.66 32.87 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 116.556 -0.293 . . . . 5.98 111.276 177.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 90.4 t -132.18 136.93 55.67 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.359 0 N-CA-C 108.392 -0.966 . . . . 5.78 108.392 173.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.476 ' HB2' HG22 ' A' ' 30' ' ' VAL . 32.2 ttt180 -121.46 128.28 51.97 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 123.78 0.832 . . . . 10.42 110.544 175.463 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -139.87 136.13 38.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 N-CA-C 107.234 -1.395 . . . . 12.06 107.234 165.001 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 54.52 -138.99 39.75 Favored Glycine 0 CA--C 1.523 0.56 0 C-N-CA 118.377 -1.868 . . . . 10.93 110.998 -168.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -91.92 -7.22 3.28 Favored 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 117.141 -1.439 . . . . 14.08 110.043 -174.169 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 32.1 tp -73.92 131.75 41.77 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 113.946 1.091 . . . . 16.46 113.946 177.308 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.476 HG22 ' HB2' ' A' ' 25' ' ' ARG . 59.5 t -126.71 120.69 56.67 Favored 'Isoleucine or valine' 0 C--O 1.243 0.743 0 N-CA-C 108.221 -1.029 . . . . 9.19 108.221 165.712 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 36.0 m -106.11 142.04 20.01 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 CA-C-O 121.215 0.531 . . . . 5.36 111.795 171.063 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 32.1 t -117.96 135.37 58.57 Favored 'Isoleucine or valine' 0 C--O 1.248 1.003 0 CA-C-N 115.752 -0.658 . . . . 5.62 109.591 -178.59 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.68 158.05 8.46 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 115.058 -0.973 . . . . 5.81 112.159 177.834 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -51.86 129.06 34.36 Favored Glycine 0 N--CA 1.467 0.747 0 N-CA-C 107.097 -2.401 . . . . 6.55 107.097 166.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 37.0 m -124.22 129.45 50.81 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 112.26 0.467 . . . . 8.47 112.26 -176.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 67.8 p -106.75 174.6 5.82 Favored 'General case' 0 C--O 1.245 0.859 0 CA-C-O 121.658 0.742 . . . . 7.79 110.063 173.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -131.57 151.7 19.83 Favored Glycine 0 CA--C 1.507 -0.455 0 C-N-CA 120.189 -1.005 . . . . 7.1 113.646 -174.461 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.2 m -76.79 166.28 23.57 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 108.872 -0.788 . . . . 9.31 108.872 169.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 120.01 154.65 9.48 Favored Glycine 0 C--N 1.32 -0.31 0 C-N-CA 120.262 -0.97 . . . . 10.23 111.179 -176.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -83.44 -29.55 27.97 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.855 0.687 . . . . 34.86 112.855 -172.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.915 ' HB3' ' O ' ' A' ' 218' ' ' HOH . 31.3 t0 -132.26 168.5 17.95 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 119.957 -0.697 . . . . 17.86 112.252 -173.277 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.405 HD13 ' CG2' ' A' ' 83' ' ' VAL . 2.5 tt -57.01 -41.2 76.98 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 113.481 0.919 . . . . 9.48 113.481 -169.231 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.26 -51.65 69.07 Favored 'General case' 0 C--O 1.218 -0.59 0 C-N-CA 119.363 -0.935 . . . . 7.97 111.909 178.613 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.76 -40.59 93.08 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.993 0.425 . . . . 7.44 111.599 -177.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 63.8 mt-30 -65.37 -39.69 92.59 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.176 -0.465 . . . . 6.93 111.657 179.34 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 24.6 m -62.8 -45.99 90.06 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 119.62 -0.832 . . . . 7.22 111.763 174.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.472 ' HG2' HG13 ' A' ' 86' ' ' VAL . 86.7 mtm-85 -59.82 -43.78 94.37 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 119.988 -0.685 . . . . 17.88 110.175 179.729 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -69.13 -35.9 76.88 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-N 116.186 -0.461 . . . . 9.9 111.676 -177.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.27 -38.61 91.65 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 120.283 -0.567 . . . . 6.62 109.521 176.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 85.6 mt -74.03 -32.57 63.4 Favored 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 120.53 -0.468 . . . . 7.14 111.188 -178.41 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.539 ' HD2' ' O ' ' A' ' 207' ' ' HOH . 0.0 OUTLIER -62.43 -42.9 99.8 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 120.593 -0.443 . . . . 31.95 110.538 174.668 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 76.9 mtt-85 -67.83 -38.76 83.63 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 121.072 0.463 . . . . 8.81 112.102 179.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 84.7 mt -56.26 -47.48 80.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 C-N-CA 119.921 -0.712 . . . . 5.54 112.072 171.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -57.15 -46.93 82.3 Favored 'General case' 0 C--O 1.225 -0.229 0 N-CA-C 111.757 0.28 . . . . 16.03 111.757 175.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 86.1 mt -59.73 -44.06 92.91 Favored 'Isoleucine or valine' 0 C--O 1.247 0.947 0 CA-C-O 121.051 0.453 . . . . 7.0 110.417 -179.542 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -66.81 -47.17 72.88 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.659 -0.497 . . . . 5.22 109.659 -179.113 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 73.2 mt -52.08 -49.14 64.15 Favored 'General case' 0 C--O 1.24 0.567 0 N-CA-C 113.217 0.821 . . . . 5.14 113.217 174.581 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -62.99 -37.68 95.36 Favored Glycine 0 N--CA 1.464 0.518 0 N-CA-C 110.663 -0.975 . . . . 6.21 110.663 -175.478 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -68.93 -16.09 63.66 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 114.671 1.36 . . . . 17.57 114.671 174.288 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -101.72 17.21 23.53 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.076 0.55 . . . . 8.56 111.986 172.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 69.9 25.69 75.27 Favored Glycine 0 CA--C 1.527 0.824 0 C-N-CA 120.361 -0.923 . . . . 7.49 115.16 178.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -126.82 164.73 20.74 Favored 'General case' 0 C--O 1.238 0.462 0 O-C-N 122.193 -0.592 . . . . 5.73 110.738 179.389 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 22.7 p -128.51 170.34 13.3 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 109.248 -0.649 . . . . 5.01 109.248 178.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 89.9 mt -54.29 -34.28 60.53 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 119.728 -0.789 . . . . 7.23 113.119 174.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.3 -12.0 18.36 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.956 0.725 . . . . 4.1 112.956 178.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -93.09 -13.46 28.52 Favored 'General case' 0 C--O 1.241 0.611 0 N-CA-C 112.576 0.584 . . . . 4.59 112.576 178.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 53.2 t -66.67 124.81 22.65 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.892 0 CA-C-N 115.851 -0.613 . . . . 4.37 111.663 -176.111 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 28.6 m -107.01 -22.38 4.99 Favored 'Isoleucine or valine' 0 C--O 1.239 0.547 0 C-N-CA 121.024 -0.27 . . . . 4.5 110.273 -178.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 52.7 ttm-85 -144.32 135.51 25.4 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 113.132 0.79 . . . . 10.38 113.132 178.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' THR . . . . . 1.111 ' OG1' HG23 ' A' ' 98' ' ' THR . 50.4 p -118.6 159.29 23.86 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 108.798 -0.815 . . . . 6.53 108.798 163.84 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.439 ' HD3' ' O ' ' A' ' 187' ' ' HOH . 41.0 ttm105 -141.53 128.78 21.03 Favored 'General case' 0 CA--C 1.499 -0.987 0 N-CA-C 104.71 -2.33 . . . . 12.59 104.71 175.677 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 63.8 mt -119.87 120.1 62.22 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 O-C-N 124.525 1.14 . . . . 6.09 111.285 -171.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -102.12 127.9 48.83 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 109.551 -0.537 . . . . 15.38 109.551 171.17 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 16.7 m -125.1 153.03 32.04 Favored 'Isoleucine or valine' 0 C--O 1.239 0.541 0 O-C-N 123.292 0.37 . . . . 6.76 110.93 177.466 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 74.2 p -87.78 -16.09 35.11 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 119.055 -1.058 . . . . 7.63 111.167 177.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 62.2 t0 -141.46 95.84 2.89 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 120.505 -0.478 . . . . 12.53 110.56 175.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.455 ' HB ' ' HB2' ' A' ' 102' ' ' GLU . 7.4 tt -70.65 -11.53 15.13 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-N 116.15 -0.477 . . . . 8.23 111.839 -173.283 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.5 p -67.08 -13.6 62.09 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 119.154 -1.018 . . . . 9.42 109.881 174.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 75.8 mtm180 -99.94 26.15 6.64 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 112.183 0.438 . . . . 15.64 112.183 177.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 55.8 p-90 -59.85 -27.51 66.72 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 113.439 0.903 . . . . 14.74 113.439 -175.361 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 35.1 mtt-85 -71.84 -37.4 70.27 Favored 'General case' 0 C--O 1.219 -0.519 0 N-CA-C 114.481 1.289 . . . . 21.75 114.481 -178.007 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -61.86 -39.4 91.74 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.01 -0.737 . . . . 17.19 109.01 176.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.405 ' CG2' HD13 ' A' ' 42' ' ' ILE . 86.7 t -74.11 -49.26 34.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.869 -0.605 . . . . 9.12 110.185 -179.122 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -52.42 -42.6 57.23 Favored Glycine 0 C--N 1.332 0.345 0 N-CA-C 114.914 0.726 . . . . 9.1 114.914 177.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -56.56 -44.29 80.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 117.138 0.469 . . . . 18.6 111.841 -179.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.472 HG13 ' HG2' ' A' ' 47' ' ' ARG . 94.4 t -67.99 -40.74 83.78 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 CA-C-N 116.017 -0.538 . . . . 6.5 112.086 178.225 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 63.5 t-80 -63.84 -37.9 89.09 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 108.312 -0.996 . . . . 7.05 108.312 178.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.89 -42.19 77.27 Favored 'General case' 0 C--O 1.227 -0.092 0 CA-C-N 115.197 -0.91 . . . . 10.06 111.313 -178.444 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.612 ' OE1' ' O ' ' A' ' 196' ' ' HOH . 3.4 tp60 -63.11 -33.15 74.84 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 110.229 -0.286 . . . . 22.98 110.229 176.433 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -80.11 -36.73 34.95 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 112.256 0.465 . . . . 13.25 112.256 177.113 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -125.52 19.93 8.0 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 116.722 2.119 . . . . 13.4 116.722 -168.612 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -56.51 -38.79 82.31 Favored Glycine 0 CA--C 1.518 0.23 0 N-CA-C 114.459 0.544 . . . . 13.3 114.459 -178.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.414 ' NZ ' ' HB2' ' A' ' 93' ' ' LYS . 1.8 mtmp? -86.42 -44.77 11.76 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 121.259 0.552 . . . . 17.48 110.962 178.137 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 15.0 mt -65.67 -52.44 50.44 Favored 'Isoleucine or valine' 0 C--O 1.247 0.961 0 CA-C-N 115.545 -0.752 . . . . 8.02 112.96 -175.147 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 6.9 mtp180 58.4 61.65 5.12 Favored Pre-proline 0 C--O 1.2 -1.535 0 N-CA-C 113.565 0.95 . . . . 35.03 113.565 172.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.25 168.28 16.35 Favored 'Trans proline' 0 C--N 1.31 -1.475 0 N-CA-C 107.067 -1.936 . . . . 5.52 107.067 171.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 4.6 m -74.43 153.42 6.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 N-CA-C 108.295 -1.002 . . . . 5.62 108.295 168.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' THR . . . . . 1.111 HG23 ' OG1' ' A' ' 70' ' ' THR 0.271 0.0 OUTLIER -139.24 175.67 9.36 Favored 'General case' 0 CA--C 1.5 -0.952 0 C-N-CA 119.784 -0.766 . . . . 11.76 112.347 170.016 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 14.7 m -141.77 152.97 44.25 Favored 'General case' 0 CA--C 1.5 -0.946 0 N-CA-C 106.315 -1.735 . . . . 9.11 106.315 165.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 49.4 ttm -137.64 121.16 17.2 Favored 'General case' 0 CA--C 1.504 -0.822 0 N-CA-C 107.772 -1.196 . . . . 13.05 107.772 173.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 27.0 m -132.74 153.14 37.46 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.565 0 C-N-CA 119.441 -0.904 . . . . 9.53 111.478 177.131 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.455 ' HB2' ' HB ' ' A' ' 77' ' ' ILE . 30.0 tt0 -89.3 132.89 34.71 Favored 'General case' 0 N--CA 1.436 -1.148 0 C-N-CA 119.261 -0.975 . . . . 11.86 110.26 179.161 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 24.3 m -113.4 160.33 12.95 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-N 116.287 -0.415 . . . . 11.26 111.027 173.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 20.0 p -66.9 -40.16 87.65 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 119.237 -0.985 . . . . 12.64 111.907 178.993 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -153.92 153.27 31.74 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 112.875 0.694 . . . . 11.63 112.875 -178.469 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 33.2 mt -103.2 -177.25 3.32 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 108.034 -1.098 . . . . 12.82 108.034 164.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 4.9 tp -57.21 -25.58 23.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 N-CA-C 114.93 1.456 . . . . 14.12 114.93 -171.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -138.51 148.92 60.91 Favored Pre-proline 0 N--CA 1.467 0.383 0 N-CA-C 109.093 -0.706 . . . . 12.85 109.093 177.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.438 ' HD2' ' O ' ' A' ' 211' ' ' HOH . 2.0 Cg_endo -67.7 -23.2 42.59 Favored 'Trans proline' 0 CA--C 1.535 0.543 0 N-CA-C 114.91 1.081 . . . . 13.03 114.91 -168.273 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -85.43 -4.2 86.1 Favored Glycine 0 N--CA 1.466 0.655 0 C-N-CA 120.674 -0.775 . . . . 11.82 113.548 -179.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 75.1 mt -90.21 125.8 35.6 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.01 -0.737 . . . . 9.74 109.01 -175.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 88.7 mt -111.71 -12.58 13.85 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 113.395 0.887 . . . . 8.75 113.395 -165.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 7.4 p -156.09 138.9 6.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.529 -0.76 . . . . 6.91 109.374 -174.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 50.6 tt0 -132.56 138.83 47.59 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.026 -0.731 . . . . 14.64 109.026 171.663 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 41.9 mt -126.73 131.23 71.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 112.479 0.548 . . . . 7.99 112.479 -177.418 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -102.82 161.49 13.7 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.35 -0.386 . . . . 16.68 110.509 169.037 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -147.09 145.15 29.53 Favored 'General case' 0 C--O 1.241 0.624 0 C-N-CA 119.692 -0.803 . . . . 6.94 111.364 173.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -119.12 138.47 52.88 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 107.303 -1.369 . . . . 15.15 107.303 168.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -130.58 155.29 46.77 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.864 -0.607 . . . . 7.87 109.679 -179.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' TYR . . . . . . . . . . . . . 30.6 t80 -127.54 122.51 33.49 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.937 -0.574 . . . . 21.54 109.655 176.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 95.7 t . . . . . 0 C--O 1.239 0.52 0 CA-C-N 116.141 -0.481 . . . . 20.0 111.9 179.329 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' IOD . . . . . 0.903 ' I ' ' I ' ' A' ' 157' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' IOD . . . . . 0.623 ' I ' ' HB3' ' A' ' 13' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' IOD . . . . . 0.545 ' I ' ' O ' ' A' ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' IOD . . . . . 0.903 ' I ' ' I ' ' A' ' 154' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' HOH . . . . . 0.545 ' O ' ' I ' ' A' ' 156' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 180' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 181' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 183' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 184' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 186' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 187' ' ' HOH . . . . . 0.439 ' O ' ' HD3' ' A' ' 71' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 188' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 189' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 190' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 191' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 192' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 193' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 194' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 195' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 196' ' ' HOH . . . . . 0.612 ' O ' ' OE1' ' A' ' 89' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 197' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 198' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 199' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 200' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . 0.539 ' O ' ' HD2' ' A' ' 51' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . 0.438 ' O ' ' HD2' ' A' ' 109' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . 0.915 ' O ' ' HB3' ' A' ' 41' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_