data_6st7_residue ############################ # Computer software used # ############################ save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 6st7 _Structure_validation_residue.Date_analyzed 2020-10-02 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 ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.746 0.308 . . . . 196.34 110.98 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 10.7 pm0 -140.95 130.18 23.56 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 109.359 -0.608 . . . . 191.67 109.359 178.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -168.97 162.03 10.93 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 108.218 -1.03 . . . . 152.69 108.218 175.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 92.3 p -68.39 151.13 97.42 Favored Pre-proline 0 N--CA 1.453 -0.317 0 CA-C-N 115.388 -0.824 . . . . 137.73 110.605 -177.24 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_exo -62.6 -27.16 76.16 Favored 'Trans proline' 0 C--O 1.238 0.478 0 N-CA-C 113.411 0.504 . . . . 140.93 113.411 177.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -66.2 -47.75 72.87 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 118.283 0.492 . . . . 137.97 111.054 177.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 21.0 m -67.04 -34.84 78.56 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.368 -0.533 . . . . 142.24 111.263 179.412 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.38 -33.93 76.24 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.447 -0.501 . . . . 123.57 111.561 176.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -74.35 -34.25 63.34 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 111.94 0.348 . . . . 117.12 111.94 176.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 38.9 mmt -68.91 -40.89 78.86 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.381 -0.528 . . . . 133.61 111.188 177.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.22 -38.6 90.93 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 120.461 -0.495 . . . . 103.19 111.181 178.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 26.6 tp10 -68.06 -32.03 72.08 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.414 -0.514 . . . . 130.16 111.419 175.505 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 55.9 tt0 -68.98 -47.35 65.8 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.525 -0.47 . . . . 119.82 111.022 178.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 61.9 mtm-85 -64.58 -30.77 71.79 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.298 -0.561 . . . . 136.19 111.65 178.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 53.7 t60 -69.73 -47.04 64.53 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.511 -0.476 . . . . 116.69 111.032 -179.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 61.1 mm-40 -68.77 -35.4 77.01 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.387 -0.525 . . . . 125.64 111.475 -179.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -66.87 -36.68 82.86 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.148 -0.621 . . . . 99.74 111.203 177.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 51.8 t-105 -72.72 -40.17 66.34 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.195 -0.602 . . . . 100.58 111.208 176.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 62.4 mt -67.07 -26.7 66.86 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 120.291 -0.564 . . . . 106.65 111.65 177.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 72.6 ttt180 -77.38 -31.11 54.02 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.312 -0.555 . . . . 110.56 111.797 176.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -68.64 -46.83 68.14 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.539 -0.464 . . . . 97.12 111.163 178.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 7.4 p -65.62 -32.57 58.79 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 C-N-CA 120.331 -0.548 . . . . 111.33 110.646 179.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -72.16 -37.48 69.35 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.175 -0.61 . . . . 117.44 111.018 175.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 50.9 tp -65.0 -39.28 93.22 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.444 -0.502 . . . . 102.21 111.049 175.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 33.3 tp -72.32 -32.36 66.47 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.417 -0.513 . . . . 106.87 111.604 179.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -63.33 -46.71 85.39 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.595 -0.442 . . . . 129.55 110.981 178.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ASN . . . . . 0.574 ' O ' ' ND2' ' A' ' 32' ' ' ASN . 76.8 m-20 -68.28 -21.95 64.77 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 112.215 0.45 . . . . 124.76 112.215 177.43 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.66 -38.61 70.66 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.333 -0.547 . . . . 107.13 111.237 177.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -65.15 -36.16 83.36 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.35 -0.54 . . . . 114.49 111.126 175.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 -72.6 -18.74 61.58 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 112.373 0.509 . . . . 136.23 112.373 179.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ASN . . . . . 0.574 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 40.9 m-80 -109.38 11.42 25.16 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 112.582 0.586 . . . . 128.81 112.582 178.623 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.4 t0 56.23 42.47 27.97 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.441 0.639 . . . . 140.28 111.232 179.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 90.2 mt -124.86 18.41 8.58 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.091 -0.504 . . . . 103.09 111.729 178.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.4 p-80 -70.52 -45.39 65.65 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.765 -0.374 . . . . 100.49 111.356 -177.441 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 92.6 mt -60.29 -48.23 94.58 Favored Pre-proline 0 C--O 1.245 0.83 0 CA-C-O 118.289 -0.862 . . . . 97.05 112.896 -178.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -68.36 -28.37 33.09 Favored 'Trans proline' 0 C--O 1.237 0.427 0 CA-C-N 121.493 1.569 . . . . 96.68 113.232 176.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 67.0 tp -70.23 -42.38 72.33 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.174 -0.61 . . . . 95.99 111.208 178.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.6 mt -65.37 -31.03 71.93 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.384 -0.526 . . . . 85.43 111.594 179.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 7.6 m-20 -69.33 -23.66 63.81 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 120.618 -0.433 . . . . 110.41 111.933 174.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 39.3 tp -86.51 -36.52 18.94 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.716 -0.393 . . . . 80.75 111.556 178.478 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 83.9 mmm -83.66 -29.47 27.61 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 113.328 0.862 . . . . 88.85 113.328 -175.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 79.4 mt -114.35 147.12 39.64 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.266 0.555 . . . . 99.99 110.787 -174.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 32.0 p -80.9 160.14 66.98 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 115.47 -0.786 . . . . 94.52 109.913 173.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -56.32 -34.6 94.38 Favored 'Trans proline' 0 C--O 1.238 0.51 0 N-CA-C 113.733 0.628 . . . . 87.83 113.733 177.36 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -72.6 -32.74 66.19 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.12 -0.632 . . . . 111.14 111.732 178.159 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -73.21 -32.9 65.07 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.256 -0.578 . . . . 87.52 111.67 178.045 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 86.3 mtm-85 -69.47 -38.97 77.97 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.1 -0.64 . . . . 89.01 111.173 177.131 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 79.9 tt0 -67.22 -37.78 84.18 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.263 -0.575 . . . . 121.74 111.095 177.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.69 -43.25 99.22 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.561 -0.456 . . . . 84.55 111.174 178.08 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 88.3 mt -65.14 -35.14 80.18 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.448 -0.501 . . . . 77.49 111.373 177.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -65.95 -37.91 93.67 Favored Glycine 0 C--N 1.335 0.493 0 C-N-CA 119.954 -1.117 . . . . 89.59 112.666 177.908 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 82.8 p -75.2 -33.38 61.4 Favored 'General case' 0 C--O 1.236 0.39 0 O-C-N 122.222 -0.576 . . . . 107.53 111.69 178.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -63.79 -33.0 74.69 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.531 -0.468 . . . . 88.7 111.761 179.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 92.7 t -63.49 -41.17 91.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 C-N-CA 120.416 -0.513 . . . . 111.09 110.222 174.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 42.6 ttp85 -68.38 -37.21 80.18 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.481 -0.488 . . . . 121.34 111.192 177.123 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 65.8 mt -63.88 -40.11 87.87 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 C-N-CA 120.586 -0.446 . . . . 92.3 110.368 178.17 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.3 mp -64.13 -38.95 83.78 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 O-C-N 121.918 -0.489 . . . . 93.79 110.346 176.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -65.8 -43.6 88.19 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.378 -0.529 . . . . 124.13 111.335 179.184 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -68.36 -29.68 68.46 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.406 -0.518 . . . . 115.16 111.616 179.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 65.9 mt -72.49 -43.37 63.74 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 120.198 -0.601 . . . . 95.98 111.165 175.124 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 81.2 mt -65.6 -45.55 82.78 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.54 -0.464 . . . . 106.33 111.06 178.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 39.1 mtt85 -65.71 -33.85 76.84 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.145 -0.622 . . . . 132.76 111.637 176.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -70.65 -41.12 65.36 Favored Glycine 0 C--N 1.334 0.418 0 C-N-CA 119.999 -1.096 . . . . 100.05 112.563 177.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -73.76 -33.01 64.1 Favored 'General case' 0 C--O 1.237 0.407 0 O-C-N 122.241 -0.564 . . . . 139.95 111.741 179.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 49.5 ttm -72.72 -38.14 67.57 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.161 -0.616 . . . . 113.47 111.272 179.219 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 88.0 p -66.73 -29.29 69.24 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.298 -0.561 . . . . 126.22 111.618 179.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -74.76 -28.03 60.59 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.494 -0.483 . . . . 149.94 111.855 176.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 40.1 mtm105 -73.04 -35.74 66.79 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.118 -0.633 . . . . 135.52 111.08 175.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -68.41 -39.46 81.6 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.349 -0.541 . . . . 133.19 111.342 -177.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.9 pp -71.89 -30.25 65.2 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 119.683 -0.807 . . . . 128.64 111.307 175.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.7 tttm -69.05 -38.31 79.05 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.413 -0.515 . . . . 130.38 111.079 174.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 13.3 m-20 -76.68 -38.55 54.29 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.83 -0.348 . . . . 113.6 111.745 179.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 47.5 tt0 -69.81 -35.68 75.03 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.282 -0.567 . . . . 154.98 111.326 -179.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.6 mp -70.46 -38.31 74.45 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 120.11 -0.636 . . . . 132.26 111.191 175.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -69.98 -39.96 73.87 Favored Glycine 0 C--N 1.334 0.448 0 C-N-CA 119.998 -1.096 . . . . 118.74 112.617 177.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.35 -33.2 73.86 Favored 'General case' 0 C--O 1.236 0.358 0 O-C-N 122.244 -0.562 . . . . 107.4 111.549 176.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.36 -29.39 74.94 Favored Glycine 0 C--N 1.336 0.538 0 C-N-CA 120.196 -1.002 . . . . 110.87 113.001 177.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 59.7 mt -84.3 -35.96 11.31 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 O-C-N 122.25 -0.559 . . . . 114.54 110.515 175.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.74 -33.13 73.39 Favored 'General case' 0 C--O 1.236 0.389 0 O-C-N 121.939 -0.476 . . . . 108.88 111.795 179.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 14.2 t -75.1 -25.24 58.36 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.078 -0.649 . . . . 110.45 111.935 179.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 55.7 mt -70.37 -39.52 76.62 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 C-N-CA 120.289 -0.564 . . . . 106.29 110.354 176.02 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 60.8 p -68.69 -36.25 78.25 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 121.857 -0.527 . . . . 121.28 111.253 179.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 44.9 mtp180 -66.27 -41.17 90.26 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.111 -0.635 . . . . 106.9 111.178 177.041 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.69 -29.85 74.19 Favored Glycine 0 C--N 1.334 0.465 0 C-N-CA 120.194 -1.003 . . . . 91.37 112.913 175.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 43.9 t -72.39 -44.32 62.67 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 117.309 0.554 . . . . 106.8 111.171 177.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 -67.07 -40.73 87.1 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.398 -0.521 . . . . 108.01 111.258 179.407 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 59.2 m -67.0 -29.81 69.75 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.377 -0.529 . . . . 95.2 111.604 178.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 25.8 tp -72.6 -31.73 65.41 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 120.31 -0.556 . . . . 96.0 111.472 177.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -71.42 -35.09 70.85 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.409 -0.516 . . . . 100.6 111.494 176.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -79.3 -7.53 58.38 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 113.124 0.787 . . . . 92.89 113.124 -179.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -71.2 148.09 93.73 Favored Pre-proline 0 N--CA 1.452 -0.37 0 CA-C-N 118.367 0.53 . . . . 93.55 110.392 -179.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -65.74 161.94 36.79 Favored 'Trans proline' 0 C--N 1.331 -0.351 0 CA-C-O 122.006 0.753 . . . . 102.63 111.598 178.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 30.7 m -67.64 -31.98 54.86 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 CA-C-N 114.949 -1.023 . . . . 119.32 111.14 -176.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -64.89 -33.24 75.55 Favored 'General case' 0 C--O 1.236 0.386 0 O-C-N 121.736 -0.602 . . . . 145.3 111.624 -179.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 64.1 tp -77.84 -45.15 25.17 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 120.668 -0.413 . . . . 107.64 111.258 177.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 57.5 mtp85 -62.62 -46.2 89.35 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.683 -0.407 . . . . 104.5 111.327 -178.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -64.54 -31.81 73.19 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.077 -0.649 . . . . 142.15 111.523 178.349 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 76.8 t90 -71.62 -36.67 70.85 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.147 -0.621 . . . . 113.34 111.125 176.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 92.5 mt -66.79 -34.35 77.63 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.387 -0.525 . . . . 116.13 111.565 176.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -71.15 -25.48 62.57 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.362 -0.535 . . . . 126.46 111.577 176.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -74.54 -19.77 60.22 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.423 -0.511 . . . . 135.69 112.161 175.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 2.5 t -101.43 43.46 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.395 0 N-CA-C 107.874 -1.158 . . . . 112.94 107.874 173.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 8.4 tt -130.0 90.08 2.91 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 106.631 -1.618 . . . . 125.43 106.631 178.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.8 mm? . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.459 . . . . 154.54 110.788 -178.688 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' TRP . . . . . . . . . . . . . 20.0 t-105 . . . . . 0 N--CA 1.456 -0.125 0 N-CA-C 110.217 -0.29 . . . . 113.63 110.217 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' IPA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' IPA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.746 0.308 . . . . 196.34 110.98 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 10.7 pm0 -140.95 130.18 23.56 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 109.359 -0.608 . . . . 191.66999999999999 109.359 178.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -168.97 162.03 10.93 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 108.218 -1.03 . . . . 152.69 108.218 175.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 92.3 p -68.39 151.13 97.42 Favored Pre-proline 0 N--CA 1.453 -0.317 0 CA-C-N 115.388 -0.824 . . . . 137.72999999999999 110.605 -177.24 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_exo -62.6 -27.16 76.16 Favored 'Trans proline' 0 C--O 1.238 0.478 0 N-CA-C 113.411 0.504 . . . . 140.93000000000001 113.411 177.543 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -66.2 -47.75 72.87 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 118.283 0.492 . . . . 137.97 111.054 177.821 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 21.0 m -67.04 -34.84 78.56 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.368 -0.533 . . . . 142.24000000000001 111.263 179.412 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.38 -33.93 76.24 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.447 -0.501 . . . . 123.56999999999999 111.561 176.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -74.35 -34.25 63.34 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 111.94 0.348 . . . . 117.12 111.94 176.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 38.9 mmt -68.91 -40.89 78.86 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.381 -0.528 . . . . 133.61000000000001 111.188 177.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.22 -38.6 90.93 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 120.461 -0.495 . . . . 103.19 111.181 178.446 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 26.6 tp10 -68.06 -32.03 72.08 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.414 -0.514 . . . . 130.16 111.419 175.505 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 55.9 tt0 -68.98 -47.35 65.8 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.525 -0.47 . . . . 119.81999999999999 111.022 178.293 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 61.9 mtm-85 -64.58 -30.77 71.79 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.298 -0.561 . . . . 136.19 111.65 178.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 53.7 t60 -69.73 -47.04 64.53 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.511 -0.476 . . . . 116.69 111.032 -179.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 61.1 mm-40 -68.77 -35.4 77.01 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.387 -0.525 . . . . 125.64 111.475 -179.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -66.87 -36.68 82.86 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.148 -0.621 . . . . 99.739999999999995 111.203 177.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 51.8 t-105 -72.72 -40.17 66.34 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.195 -0.602 . . . . 100.58 111.208 176.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 62.4 mt -67.07 -26.7 66.86 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 120.291 -0.564 . . . . 106.65000000000001 111.65 177.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 72.6 ttt180 -77.38 -31.11 54.02 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.312 -0.555 . . . . 110.56 111.797 176.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -68.64 -46.83 68.14 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.539 -0.464 . . . . 97.120000000000005 111.163 178.187 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 7.4 p -65.62 -32.57 58.79 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 C-N-CA 120.331 -0.548 . . . . 111.33 110.646 179.422 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -72.16 -37.48 69.35 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.175 -0.61 . . . . 117.44 111.018 175.155 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 50.9 tp -65.0 -39.28 93.22 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.444 -0.502 . . . . 102.20999999999999 111.049 175.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 33.3 tp -72.32 -32.36 66.47 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.417 -0.513 . . . . 106.87 111.604 179.058 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -63.33 -46.71 85.39 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.595 -0.442 . . . . 129.55000000000001 110.981 178.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -68.28 -21.95 64.77 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 112.215 0.45 . . . . 124.76000000000001 112.215 177.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.66 -38.61 70.66 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.333 -0.547 . . . . 107.13 111.237 177.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -65.15 -36.16 83.36 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.35 -0.54 . . . . 114.48999999999999 111.126 175.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 -72.6 -18.74 61.58 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 112.373 0.509 . . . . 136.22999999999999 112.373 179.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 -109.38 11.42 25.16 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 112.582 0.586 . . . . 128.81 112.582 178.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.4 t0 56.23 42.47 27.97 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.441 0.639 . . . . 140.28 111.232 179.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 90.2 mt -124.86 18.41 8.58 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.091 -0.504 . . . . 103.09 111.729 178.079 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.4 p-80 -70.52 -45.39 65.65 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.765 -0.374 . . . . 100.48999999999999 111.356 -177.441 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 92.6 mt -60.29 -48.23 94.58 Favored Pre-proline 0 C--O 1.245 0.83 0 CA-C-O 118.289 -0.862 . . . . 97.049999999999997 112.896 -178.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -68.36 -28.37 33.09 Favored 'Trans proline' 0 C--O 1.237 0.427 0 CA-C-N 121.493 1.569 . . . . 96.680000000000007 113.232 176.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 67.0 tp -70.23 -42.38 72.33 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.174 -0.61 . . . . 95.989999999999995 111.208 178.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.6 mt -65.37 -31.03 71.93 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.384 -0.526 . . . . 85.430000000000007 111.594 179.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 7.6 m-20 -69.33 -23.66 63.81 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 120.618 -0.433 . . . . 110.41 111.933 174.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 39.3 tp -86.51 -36.52 18.94 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.716 -0.393 . . . . 80.75 111.556 178.478 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 83.9 mmm -83.66 -29.47 27.61 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 113.328 0.862 . . . . 88.849999999999994 113.328 -175.999 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 79.4 mt -114.35 147.12 39.64 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.266 0.555 . . . . 99.989999999999995 110.787 -174.18 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 32.0 p -80.9 160.14 66.98 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 115.47 -0.786 . . . . 94.519999999999996 109.913 173.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -56.32 -34.6 94.38 Favored 'Trans proline' 0 C--O 1.238 0.51 0 N-CA-C 113.733 0.628 . . . . 87.829999999999998 113.733 177.36 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -72.6 -32.74 66.19 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.12 -0.632 . . . . 111.14 111.732 178.159 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -73.21 -32.9 65.07 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.256 -0.578 . . . . 87.519999999999996 111.67 178.045 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 86.3 mtm-85 -69.47 -38.97 77.97 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.1 -0.64 . . . . 89.010000000000005 111.173 177.131 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 79.9 tt0 -67.22 -37.78 84.18 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.263 -0.575 . . . . 121.73999999999999 111.095 177.188 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.69 -43.25 99.22 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.561 -0.456 . . . . 84.549999999999997 111.174 178.08 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 88.3 mt -65.14 -35.14 80.18 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.448 -0.501 . . . . 77.489999999999995 111.373 177.763 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -65.95 -37.91 93.67 Favored Glycine 0 C--N 1.335 0.493 0 C-N-CA 119.954 -1.117 . . . . 89.590000000000003 112.666 177.908 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 82.8 p -75.2 -33.38 61.4 Favored 'General case' 0 C--O 1.236 0.39 0 O-C-N 122.222 -0.576 . . . . 107.53 111.69 178.638 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -63.79 -33.0 74.69 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.531 -0.468 . . . . 88.700000000000003 111.761 179.899 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 92.7 t -63.49 -41.17 91.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 C-N-CA 120.416 -0.513 . . . . 111.09 110.222 174.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 42.6 ttp85 -68.38 -37.21 80.18 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.481 -0.488 . . . . 121.34 111.192 177.123 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 65.8 mt -63.88 -40.11 87.87 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 C-N-CA 120.586 -0.446 . . . . 92.299999999999997 110.368 178.17 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.3 mp -64.13 -38.95 83.78 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 O-C-N 121.918 -0.489 . . . . 93.790000000000006 110.346 176.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -65.8 -43.6 88.19 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.378 -0.529 . . . . 124.13 111.335 179.184 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -68.36 -29.68 68.46 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.406 -0.518 . . . . 115.16 111.616 179.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 65.9 mt -72.49 -43.37 63.74 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 120.198 -0.601 . . . . 95.980000000000004 111.165 175.124 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 81.2 mt -65.6 -45.55 82.78 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.54 -0.464 . . . . 106.33 111.06 178.738 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 39.1 mtt85 -65.71 -33.85 76.84 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.145 -0.622 . . . . 132.75999999999999 111.637 176.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -70.65 -41.12 65.36 Favored Glycine 0 C--N 1.334 0.418 0 C-N-CA 119.999 -1.096 . . . . 100.05 112.563 177.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -73.76 -33.01 64.1 Favored 'General case' 0 C--O 1.237 0.407 0 O-C-N 122.241 -0.564 . . . . 139.94999999999999 111.741 179.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 49.5 ttm -72.72 -38.14 67.57 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.161 -0.616 . . . . 113.47 111.272 179.219 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 88.0 p -66.73 -29.29 69.24 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.298 -0.561 . . . . 126.22 111.618 179.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -74.76 -28.03 60.59 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.494 -0.483 . . . . 149.94 111.855 176.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 40.1 mtm105 -73.04 -35.74 66.79 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.118 -0.633 . . . . 135.52000000000001 111.08 175.16 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -68.41 -39.46 81.6 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.349 -0.541 . . . . 133.19 111.342 -177.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.9 pp -71.89 -30.25 65.2 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 119.683 -0.807 . . . . 128.63999999999999 111.307 175.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.7 tttm -69.05 -38.31 79.05 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.413 -0.515 . . . . 130.38 111.079 174.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 13.3 m-20 -76.68 -38.55 54.29 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.83 -0.348 . . . . 113.59999999999999 111.745 179.775 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 47.5 tt0 -69.81 -35.68 75.03 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.282 -0.567 . . . . 154.97999999999999 111.326 -179.026 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.6 mp -70.46 -38.31 74.45 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 120.11 -0.636 . . . . 132.25999999999999 111.191 175.121 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -69.98 -39.96 73.87 Favored Glycine 0 C--N 1.334 0.448 0 C-N-CA 119.998 -1.096 . . . . 118.73999999999999 112.617 177.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.35 -33.2 73.86 Favored 'General case' 0 C--O 1.236 0.358 0 O-C-N 122.244 -0.562 . . . . 107.40000000000001 111.549 176.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.36 -29.39 74.94 Favored Glycine 0 C--N 1.336 0.538 0 C-N-CA 120.196 -1.002 . . . . 110.87 113.001 177.044 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 59.7 mt -84.3 -35.96 11.31 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 O-C-N 122.25 -0.559 . . . . 114.54000000000001 110.515 175.464 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.74 -33.13 73.39 Favored 'General case' 0 C--O 1.236 0.389 0 O-C-N 121.939 -0.476 . . . . 108.88 111.795 179.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 14.2 t -75.1 -25.24 58.36 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.078 -0.649 . . . . 110.45 111.935 179.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 55.7 mt -70.37 -39.52 76.62 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 C-N-CA 120.289 -0.564 . . . . 106.29000000000001 110.354 176.02 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 60.8 p -68.69 -36.25 78.25 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 121.857 -0.527 . . . . 121.28 111.253 179.117 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 44.9 mtp180 -66.27 -41.17 90.26 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.111 -0.635 . . . . 106.90000000000001 111.178 177.041 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.69 -29.85 74.19 Favored Glycine 0 C--N 1.334 0.465 0 C-N-CA 120.194 -1.003 . . . . 91.370000000000005 112.913 175.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 43.9 t -72.39 -44.32 62.67 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 117.309 0.554 . . . . 106.8 111.171 177.289 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 -67.07 -40.73 87.1 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.398 -0.521 . . . . 108.01000000000001 111.258 179.407 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 59.2 m -67.0 -29.81 69.75 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.377 -0.529 . . . . 95.200000000000003 111.604 178.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 25.8 tp -72.6 -31.73 65.41 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 120.31 -0.556 . . . . 96.0 111.472 177.578 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -71.42 -35.09 70.85 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.409 -0.516 . . . . 100.59999999999999 111.494 176.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -79.3 -7.53 58.38 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 113.124 0.787 . . . . 92.890000000000001 113.124 -179.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -71.2 148.09 93.73 Favored Pre-proline 0 N--CA 1.452 -0.37 0 CA-C-N 118.367 0.53 . . . . 93.549999999999997 110.392 -179.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -65.74 161.94 36.79 Favored 'Trans proline' 0 C--N 1.331 -0.351 0 CA-C-O 122.006 0.753 . . . . 102.63 111.598 178.09 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 30.7 m -67.64 -31.98 54.86 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 CA-C-N 114.949 -1.023 . . . . 119.31999999999999 111.14 -176.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -64.89 -33.24 75.55 Favored 'General case' 0 C--O 1.236 0.386 0 O-C-N 121.736 -0.602 . . . . 145.30000000000001 111.624 -179.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 64.1 tp -77.84 -45.15 25.17 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 120.668 -0.413 . . . . 107.64 111.258 177.169 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 57.5 mtp85 -62.62 -46.2 89.35 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.683 -0.407 . . . . 104.5 111.327 -178.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -64.54 -31.81 73.19 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.077 -0.649 . . . . 142.15000000000001 111.523 178.349 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 76.8 t90 -71.62 -36.67 70.85 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.147 -0.621 . . . . 113.34 111.125 176.353 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 92.5 mt -66.79 -34.35 77.63 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.387 -0.525 . . . . 116.13 111.565 176.127 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -71.15 -25.48 62.57 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.362 -0.535 . . . . 126.45999999999999 111.577 176.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -74.54 -19.77 60.22 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.423 -0.511 . . . . 135.69 112.161 175.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 2.5 t -101.43 43.46 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.395 0 N-CA-C 107.874 -1.158 . . . . 112.94 107.874 173.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 8.4 tt -130.0 90.08 2.91 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 106.631 -1.618 . . . . 125.43000000000001 106.631 178.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.8 mm? . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.459 . . . . 154.53999999999999 110.788 -178.688 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' TRP . . . . . . . . . . . . . 20.0 t-105 . . . . . 0 N--CA 1.456 -0.125 0 N-CA-C 110.217 -0.29 . . . . 113.63 110.217 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' IPA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' IPA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.746 0.308 . . . . 196.34 110.98 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 10.7 pm0 -140.95 130.18 23.56 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 109.359 -0.608 . . . . 191.67 109.359 178.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -168.97 162.03 10.93 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 108.218 -1.03 . . . . 152.69 108.218 175.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 92.3 p -68.39 151.13 97.42 Favored Pre-proline 0 N--CA 1.453 -0.317 0 CA-C-N 115.388 -0.824 . . . . 137.73 110.605 -177.24 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_exo -62.6 -27.16 76.16 Favored 'Trans proline' 0 C--O 1.238 0.478 0 N-CA-C 113.411 0.504 . . . . 140.93 113.411 177.543 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -66.2 -47.75 72.87 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 118.283 0.492 . . . . 137.97 111.054 177.821 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 21.0 m -67.04 -34.84 78.56 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.368 -0.533 . . . . 142.24 111.263 179.412 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.38 -33.93 76.24 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.447 -0.501 . . . . 123.57 111.561 176.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -74.35 -34.25 63.34 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 111.94 0.348 . . . . 117.12 111.94 176.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 38.9 mmt -68.91 -40.89 78.86 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.381 -0.528 . . . . 133.61 111.188 177.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.22 -38.6 90.93 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 120.461 -0.495 . . . . 103.19 111.181 178.446 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 26.6 tp10 -68.06 -32.03 72.08 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.414 -0.514 . . . . 130.16 111.419 175.505 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 55.9 tt0 -68.98 -47.35 65.8 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.525 -0.47 . . . . 119.82 111.022 178.293 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 61.9 mtm-85 -64.58 -30.77 71.79 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.298 -0.561 . . . . 136.19 111.65 178.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 53.7 t60 -69.73 -47.04 64.53 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.511 -0.476 . . . . 116.69 111.032 -179.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 61.1 mm-40 -68.77 -35.4 77.01 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.387 -0.525 . . . . 125.64 111.475 -179.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -66.87 -36.68 82.86 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.148 -0.621 . . . . 99.74 111.203 177.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 51.8 t-105 -72.72 -40.17 66.34 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.195 -0.602 . . . . 100.58 111.208 176.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 62.4 mt -67.07 -26.7 66.86 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 120.291 -0.564 . . . . 106.65 111.65 177.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 72.6 ttt180 -77.38 -31.11 54.02 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.312 -0.555 . . . . 110.56 111.797 176.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -68.64 -46.83 68.14 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.539 -0.464 . . . . 97.12 111.163 178.187 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 7.4 p -65.62 -32.57 58.79 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 C-N-CA 120.331 -0.548 . . . . 111.33 110.646 179.422 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -72.16 -37.48 69.35 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.175 -0.61 . . . . 117.44 111.018 175.155 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 50.9 tp -65.0 -39.28 93.22 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.444 -0.502 . . . . 102.21 111.049 175.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 33.3 tp -72.32 -32.36 66.47 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.417 -0.513 . . . . 106.87 111.604 179.058 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -63.33 -46.71 85.39 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.595 -0.442 . . . . 129.55 110.981 178.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -68.28 -21.95 64.77 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 112.215 0.45 . . . . 124.76 112.215 177.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.66 -38.61 70.66 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.333 -0.547 . . . . 107.13 111.237 177.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -65.15 -36.16 83.36 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.35 -0.54 . . . . 114.49 111.126 175.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 -72.6 -18.74 61.58 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 112.373 0.509 . . . . 136.23 112.373 179.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 -109.38 11.42 25.16 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 112.582 0.586 . . . . 128.81 112.582 178.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.4 t0 56.23 42.47 27.97 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.441 0.639 . . . . 140.28 111.232 179.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 90.2 mt -124.86 18.41 8.58 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.091 -0.504 . . . . 103.09 111.729 178.079 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.4 p-80 -70.52 -45.39 65.65 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.765 -0.374 . . . . 100.49 111.356 -177.441 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 92.6 mt -60.29 -48.23 94.58 Favored Pre-proline 0 C--O 1.245 0.83 0 CA-C-O 118.289 -0.862 . . . . 97.05 112.896 -178.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -68.36 -28.37 33.09 Favored 'Trans proline' 0 C--O 1.237 0.427 0 CA-C-N 121.493 1.569 . . . . 96.68 113.232 176.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 67.0 tp -70.23 -42.38 72.33 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.174 -0.61 . . . . 95.99 111.208 178.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.6 mt -65.37 -31.03 71.93 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.384 -0.526 . . . . 85.43 111.594 179.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 7.6 m-20 -69.33 -23.66 63.81 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 120.618 -0.433 . . . . 110.41 111.933 174.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 39.3 tp -86.51 -36.52 18.94 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.716 -0.393 . . . . 80.75 111.556 178.478 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 83.9 mmm -83.66 -29.47 27.61 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 113.328 0.862 . . . . 88.85 113.328 -175.999 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 79.4 mt -114.35 147.12 39.64 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.266 0.555 . . . . 99.99 110.787 -174.18 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 32.0 p -80.9 160.14 66.98 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 115.47 -0.786 . . . . 94.52 109.913 173.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -56.32 -34.6 94.38 Favored 'Trans proline' 0 C--O 1.238 0.51 0 N-CA-C 113.733 0.628 . . . . 87.83 113.733 177.36 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -72.6 -32.74 66.19 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.12 -0.632 . . . . 111.14 111.732 178.159 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -73.21 -32.9 65.07 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.256 -0.578 . . . . 87.52 111.67 178.045 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 86.3 mtm-85 -69.47 -38.97 77.97 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.1 -0.64 . . . . 89.01 111.173 177.131 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 79.9 tt0 -67.22 -37.78 84.18 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.263 -0.575 . . . . 121.74 111.095 177.188 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.69 -43.25 99.22 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.561 -0.456 . . . . 84.55 111.174 178.08 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 88.3 mt -65.14 -35.14 80.18 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.448 -0.501 . . . . 77.49 111.373 177.763 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -65.95 -37.91 93.67 Favored Glycine 0 C--N 1.335 0.493 0 C-N-CA 119.954 -1.117 . . . . 89.59 112.666 177.908 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 82.8 p -75.2 -33.38 61.4 Favored 'General case' 0 C--O 1.236 0.39 0 O-C-N 122.222 -0.576 . . . . 107.53 111.69 178.638 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -63.79 -33.0 74.69 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.531 -0.468 . . . . 88.7 111.761 179.899 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 92.7 t -63.49 -41.17 91.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 C-N-CA 120.416 -0.513 . . . . 111.09 110.222 174.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 42.6 ttp85 -68.38 -37.21 80.18 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.481 -0.488 . . . . 121.34 111.192 177.123 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 65.8 mt -63.88 -40.11 87.87 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 C-N-CA 120.586 -0.446 . . . . 92.3 110.368 178.17 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.3 mp -64.13 -38.95 83.78 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 O-C-N 121.918 -0.489 . . . . 93.79 110.346 176.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -65.8 -43.6 88.19 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.378 -0.529 . . . . 124.13 111.335 179.184 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -68.36 -29.68 68.46 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.406 -0.518 . . . . 115.16 111.616 179.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 65.9 mt -72.49 -43.37 63.74 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 120.198 -0.601 . . . . 95.98 111.165 175.124 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 81.2 mt -65.6 -45.55 82.78 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.54 -0.464 . . . . 106.33 111.06 178.738 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 39.1 mtt85 -65.71 -33.85 76.84 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.145 -0.622 . . . . 132.76 111.637 176.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -70.65 -41.12 65.36 Favored Glycine 0 C--N 1.334 0.418 0 C-N-CA 119.999 -1.096 . . . . 100.05 112.563 177.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -73.76 -33.01 64.1 Favored 'General case' 0 C--O 1.237 0.407 0 O-C-N 122.241 -0.564 . . . . 139.95 111.741 179.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 49.5 ttm -72.72 -38.14 67.57 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.161 -0.616 . . . . 113.47 111.272 179.219 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 88.0 p -66.73 -29.29 69.24 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.298 -0.561 . . . . 126.22 111.618 179.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -74.76 -28.03 60.59 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.494 -0.483 . . . . 149.94 111.855 176.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 40.1 mtm105 -73.04 -35.74 66.79 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.118 -0.633 . . . . 135.52 111.08 175.16 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -68.41 -39.46 81.6 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.349 -0.541 . . . . 133.19 111.342 -177.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.9 pp -71.89 -30.25 65.2 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 119.683 -0.807 . . . . 128.64 111.307 175.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.7 tttm -69.05 -38.31 79.05 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.413 -0.515 . . . . 130.38 111.079 174.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 13.3 m-20 -76.68 -38.55 54.29 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.83 -0.348 . . . . 113.6 111.745 179.775 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 47.5 tt0 -69.81 -35.68 75.03 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.282 -0.567 . . . . 154.98 111.326 -179.026 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.6 mp -70.46 -38.31 74.45 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 120.11 -0.636 . . . . 132.26 111.191 175.121 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -69.98 -39.96 73.87 Favored Glycine 0 C--N 1.334 0.448 0 C-N-CA 119.998 -1.096 . . . . 118.74 112.617 177.066 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.35 -33.2 73.86 Favored 'General case' 0 C--O 1.236 0.358 0 O-C-N 122.244 -0.562 . . . . 107.4 111.549 176.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.36 -29.39 74.94 Favored Glycine 0 C--N 1.336 0.538 0 C-N-CA 120.196 -1.002 . . . . 110.87 113.001 177.044 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 59.7 mt -84.3 -35.96 11.31 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 O-C-N 122.25 -0.559 . . . . 114.54 110.515 175.464 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.74 -33.13 73.39 Favored 'General case' 0 C--O 1.236 0.389 0 O-C-N 121.939 -0.476 . . . . 108.88 111.795 179.574 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 14.2 t -75.1 -25.24 58.36 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.078 -0.649 . . . . 110.45 111.935 179.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 55.7 mt -70.37 -39.52 76.62 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 C-N-CA 120.289 -0.564 . . . . 106.29 110.354 176.02 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 60.8 p -68.69 -36.25 78.25 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 121.857 -0.527 . . . . 121.28 111.253 179.117 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 44.9 mtp180 -66.27 -41.17 90.26 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.111 -0.635 . . . . 106.9 111.178 177.041 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.69 -29.85 74.19 Favored Glycine 0 C--N 1.334 0.465 0 C-N-CA 120.194 -1.003 . . . . 91.37 112.913 175.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 43.9 t -72.39 -44.32 62.67 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 117.309 0.554 . . . . 106.8 111.171 177.289 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 -67.07 -40.73 87.1 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.398 -0.521 . . . . 108.01 111.258 179.407 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 59.2 m -67.0 -29.81 69.75 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.377 -0.529 . . . . 95.2 111.604 178.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 25.8 tp -72.6 -31.73 65.41 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 120.31 -0.556 . . . . 96.0 111.472 177.578 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -71.42 -35.09 70.85 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.409 -0.516 . . . . 100.6 111.494 176.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -79.3 -7.53 58.38 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 113.124 0.787 . . . . 92.89 113.124 -179.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -71.2 148.09 93.73 Favored Pre-proline 0 N--CA 1.452 -0.37 0 CA-C-N 118.367 0.53 . . . . 93.55 110.392 -179.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -65.74 161.94 36.79 Favored 'Trans proline' 0 C--N 1.331 -0.351 0 CA-C-O 122.006 0.753 . . . . 102.63 111.598 178.09 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 30.7 m -67.64 -31.98 54.86 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 CA-C-N 114.949 -1.023 . . . . 119.32 111.14 -176.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -64.89 -33.24 75.55 Favored 'General case' 0 C--O 1.236 0.386 0 O-C-N 121.736 -0.602 . . . . 145.3 111.624 -179.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 64.1 tp -77.84 -45.15 25.17 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 120.668 -0.413 . . . . 107.64 111.258 177.169 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 57.5 mtp85 -62.62 -46.2 89.35 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.683 -0.407 . . . . 104.5 111.327 -178.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -64.54 -31.81 73.19 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.077 -0.649 . . . . 142.15 111.523 178.349 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 76.8 t90 -71.62 -36.67 70.85 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.147 -0.621 . . . . 113.34 111.125 176.353 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 92.5 mt -66.79 -34.35 77.63 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.387 -0.525 . . . . 116.13 111.565 176.127 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -71.15 -25.48 62.57 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.362 -0.535 . . . . 126.46 111.577 176.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -74.54 -19.77 60.22 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.423 -0.511 . . . . 135.69 112.161 175.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 2.5 t -101.43 43.46 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.395 0 N-CA-C 107.874 -1.158 . . . . 112.94 107.874 173.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 8.4 tt -130.0 90.08 2.91 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 106.631 -1.618 . . . . 125.43 106.631 178.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.8 mm? . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.459 . . . . 154.54 110.788 -178.688 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' TRP . . . . . . . . . . . . . 20.0 t-105 . . . . . 0 N--CA 1.456 -0.125 0 N-CA-C 110.217 -0.29 . . . . 113.63 110.217 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' IPA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' IPA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_