data_4w81_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 4w81 _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 ' -1' ' ' MET . . . . . . . . . . . . . 73.9 mtp . . . . . 0 N--CA 1.493 1.722 0 CA-C-O 120.569 0.223 . . . . 39.4 110.584 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 0' ' ' ALA . . . . . . . . . . . . . . . -63.56 148.01 49.94 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.196 -0.456 . . . . 28.18 112.178 -179.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -73.0 132.52 43.51 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.02 0.438 . . . . 28.54 111.206 179.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 91.3 t -137.2 131.21 45.28 Favored 'Isoleucine or valine' 0 C--O 1.235 0.311 0 N-CA-C 107.84 -1.17 . . . . 18.66 107.84 176.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -109.9 98.56 7.84 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.247 -0.433 . . . . 20.01 111.646 -179.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 95.3 mt -87.64 136.2 33.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.339 -0.391 . . . . 14.79 109.997 177.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 37.6 t -129.03 118.87 47.83 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 N-CA-C 111.725 0.268 . . . . 13.57 111.725 -175.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.9 mp0 -90.28 147.4 23.53 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 120.792 0.329 . . . . 13.42 110.906 177.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 24.8 m -140.18 158.94 43.25 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 115.918 -0.583 . . . . 13.7 109.989 177.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 110.38 -14.99 30.28 Favored Glycine 0 N--CA 1.453 -0.175 0 N-CA-C 115.068 0.787 . . . . 15.13 115.068 171.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -50.81 152.32 4.86 Favored Glycine 0 C--N 1.333 0.365 0 C-N-CA 120.984 -0.627 . . . . 16.28 111.654 177.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 178.26 174.67 44.74 Favored Glycine 0 C--O 1.235 0.19 0 C-N-CA 121.14 -0.552 . . . . 17.3 113.987 -178.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 39.0 tp -93.18 114.72 27.29 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.017 -0.592 . . . . 19.01 110.324 178.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 6.5 m -127.27 178.02 5.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 N-CA-C 112.6 0.593 . . . . 20.2 112.6 178.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 57.6 mt-30 -109.07 157.53 18.62 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.745 -0.661 . . . . 26.54 110.738 179.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.57 131.84 47.22 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.026 -0.534 . . . . 21.12 109.71 172.442 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 98.74 -17.55 58.16 Favored Glycine 0 CA--C 1.52 0.375 0 CA-C-N 116.29 -0.414 . . . . 21.13 113.827 -178.325 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -75.06 170.0 16.88 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 113.681 0.993 . . . . 21.81 113.681 -179.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 34.6 m -116.46 149.52 39.36 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 114.733 -1.121 . . . . 18.68 109.267 171.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 32.4 tp -151.31 132.3 14.27 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 108.033 -1.099 . . . . 16.86 108.033 178.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 24.1 ttp180 -106.91 128.47 54.34 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 121.002 0.429 . . . . 21.82 111.781 179.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 38.4 mt -104.99 147.94 27.26 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.445 -0.798 . . . . 13.65 109.131 175.642 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 89.9 p -130.77 162.31 29.8 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.236 -0.653 . . . . 13.1 109.236 176.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -152.87 135.11 14.96 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-N 116.297 -0.41 . . . . 11.7 110.683 178.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 13.1 t -139.05 171.93 13.59 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 108.683 -0.858 . . . . 13.16 108.683 179.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -104.17 148.81 25.87 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.438 -0.505 . . . . 13.0 110.042 177.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.9 t -100.62 96.69 7.52 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.75 -0.463 . . . . 13.6 109.75 177.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 94.4 -121.28 6.67 Favored Glycine 0 C--N 1.329 0.194 0 N-CA-C 109.501 -1.44 . . . . 12.77 109.501 -175.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 46.1 ttm105 -54.71 132.77 46.42 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.908 0.385 . . . . 11.58 111.314 179.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.8 t -133.69 -167.53 1.96 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.092 -0.504 . . . . 12.36 110.145 -178.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -116.92 163.4 16.25 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 114.006 1.113 . . . . 13.83 114.006 179.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 30.6 t -137.65 124.87 21.69 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 106.346 -1.724 . . . . 16.18 106.346 170.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 47.5 mtp180 63.41 42.8 6.46 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 113.065 0.765 . . . . 25.08 113.065 -178.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -102.18 150.27 23.45 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.082 -0.508 . . . . 15.73 110.383 174.532 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 94.3 t -83.27 115.03 24.97 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 N-CA-C 107.487 -1.301 . . . . 13.36 107.487 171.663 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 90.0 mmm -104.72 149.25 25.76 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 124.157 0.983 . . . . 12.39 109.701 -178.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -154.58 164.43 31.61 Favored Glycine 0 C--N 1.332 0.322 0 C-N-CA 120.794 -0.717 . . . . 11.21 114.742 -179.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 88.3 m95 -112.43 139.67 47.81 Favored 'General case' 0 CA--C 1.498 -1.034 0 CA-C-O 120.877 0.37 . . . . 10.89 110.03 174.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -126.06 166.21 17.4 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 106.103 -1.814 . . . . 11.12 106.103 174.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 38.3 ptt180 -145.21 149.81 35.61 Favored 'General case' 0 C--N 1.331 -0.227 0 O-C-N 123.036 0.21 . . . . 11.89 110.911 176.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 56.8 tt0 -152.33 124.41 8.08 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 113.835 1.05 . . . . 13.83 113.835 -176.136 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -95.3 152.62 39.48 Favored Pre-proline 0 CA--C 1.532 0.251 0 N-CA-C 107.231 -1.396 . . . . 11.95 107.231 172.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_exo -51.88 133.85 46.78 Favored 'Trans proline' 0 C--N 1.352 0.745 0 O-C-N 122.336 0.651 . . . . 12.68 113.58 -179.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 76.67 -7.42 33.39 Favored Glycine 0 CA--C 1.521 0.46 0 CA-C-N 115.743 -0.662 . . . . 13.29 114.579 -179.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 18.5 tttm -91.16 156.67 17.7 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.8 -0.444 . . . . 15.74 109.8 -177.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -72.86 143.43 47.81 Favored 'General case' 0 C--O 1.248 1.024 0 N-CA-C 108.546 -0.909 . . . . 18.72 108.546 172.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 25.6 ttm180 -66.58 125.4 25.65 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 119.231 -0.988 . . . . 16.36 110.082 175.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -105.21 132.22 51.69 Favored 'General case' 0 C--O 1.253 1.246 0 C-N-CA 125.46 1.504 . . . . 18.4 110.33 -172.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -67.82 143.59 55.72 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 108.659 -0.867 . . . . 13.27 108.659 169.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.8 t -120.42 -53.21 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 N-CA-C 112.099 0.407 . . . . 11.31 112.099 -179.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -159.03 151.68 21.75 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.38 -0.373 . . . . 10.71 110.701 -177.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -132.16 153.95 50.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.317 -0.401 . . . . 11.23 111.037 176.642 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 18.4 tt -146.03 146.38 19.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 115.874 -0.603 . . . . 12.06 111.127 178.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 85.1 p -151.75 155.62 38.64 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.781 -0.822 . . . . 13.11 108.781 176.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -73.15 137.37 45.1 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.967 0.728 . . . . 16.37 112.967 -176.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -107.99 -172.54 0.24 Allowed Pre-proline 0 CA--C 1.54 0.559 0 N-CA-C 107.398 -1.334 . . . . 20.81 107.398 172.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -62.57 151.99 80.21 Favored 'Trans proline' 0 C--N 1.357 1.013 0 N-CA-C 114.023 0.74 . . . . 24.47 114.023 173.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 64.95 -122.72 24.84 Favored Glycine 0 C--N 1.331 0.3 0 CA-C-N 115.75 -0.659 . . . . 24.36 112.415 179.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 43.3 p -111.57 8.88 21.11 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 120.584 0.23 . . . . 24.28 111.179 179.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -82.72 160.06 22.44 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.217 -0.447 . . . . 20.58 111.955 -179.341 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 81.1 m-85 -137.26 152.7 50.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.076 -0.511 . . . . 16.14 111.252 179.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -93.37 140.94 29.0 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 107.706 -1.22 . . . . 13.62 107.706 169.074 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -131.67 159.17 39.11 Favored 'General case' 0 C--N 1.329 -0.288 0 O-C-N 123.417 0.448 . . . . 11.73 110.821 178.514 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -151.47 135.25 16.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.926 -0.579 . . . . 11.57 109.803 176.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 -120.76 142.38 49.6 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.177 -0.465 . . . . 12.87 111.915 -175.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.87 147.98 48.27 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 108.263 -1.014 . . . . 13.39 108.263 171.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 80.7 m-20 -53.95 -30.38 46.53 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 112.743 0.646 . . . . 16.4 112.743 177.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 72.2 p -63.53 -20.05 65.29 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 113.731 1.012 . . . . 14.96 113.731 -179.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 17.6 m -125.12 2.39 4.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 N-CA-C 115.689 1.737 . . . . 16.77 115.689 -178.166 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 5.5 mtm105 -57.33 134.35 55.91 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 120.79 0.328 . . . . 23.28 111.206 178.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 88.62 -15.55 56.72 Favored Glycine 0 CA--C 1.519 0.322 0 CA-C-N 116.0 -0.545 . . . . 17.42 114.158 -179.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ARG . . . . . 0.627 ' NH2' ' OD2' ' A' ' 93' ' ' ASP . 39.6 mtp180 -116.88 -48.59 2.65 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 114.224 1.194 . . . . 16.25 114.224 -173.228 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 4.7 m-30 -97.96 148.33 23.58 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 120.807 0.337 . . . . 14.97 110.782 -177.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 60.1 p -133.47 133.33 42.14 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.764 -0.458 . . . . 15.09 109.764 174.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 17.4 tt -103.58 134.28 45.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.673 -0.694 . . . . 13.72 109.777 178.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 84.2 p -142.45 170.77 15.09 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.365 -0.605 . . . . 13.01 109.365 177.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -149.33 153.42 37.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.189 0.518 . . . . 14.28 112.105 178.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -123.58 108.94 13.16 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 107.441 -1.318 . . . . 18.07 107.441 176.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 32.1 t -60.1 -56.35 22.72 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 112.639 0.607 . . . . 17.79 112.639 -177.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -54.47 -45.96 73.27 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 122.909 0.483 . . . . 18.59 111.963 178.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -81.03 2.08 28.59 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 113.364 0.875 . . . . 20.96 113.364 -178.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 54.6 t30 52.38 37.28 22.09 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 121.64 0.733 . . . . 17.81 112.257 174.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 54.8 m -128.5 146.85 50.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.718 -0.674 . . . . 14.96 111.234 -173.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 9.0 p -121.04 142.01 39.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 N-CA-C 106.64 -1.615 . . . . 13.14 106.64 174.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 -123.59 154.29 39.47 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 112.525 0.565 . . . . 12.71 112.525 -173.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 26.2 tp -134.83 104.31 5.95 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.193 -0.912 . . . . 13.4 109.118 170.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 11.8 tp-100 -86.29 114.15 22.86 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.323 -0.621 . . . . 14.2 109.323 176.316 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 68.5 mtm -101.47 119.49 38.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.092 -0.503 . . . . 17.63 110.113 -179.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -113.35 161.53 17.15 Favored 'General case' 0 C--O 1.236 0.353 0 O-C-N 123.359 0.412 . . . . 16.18 110.952 177.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 40.7 m 45.69 48.24 11.56 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.514 0.673 . . . . 15.23 111.697 177.041 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 37.1 mt -60.77 149.15 36.61 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.189 -0.914 . . . . 16.75 110.405 -178.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 13.0 ptpt -138.57 159.05 69.16 Favored Pre-proline 0 C--N 1.325 -0.477 0 N-CA-C 108.793 -0.818 . . . . 20.54 108.793 178.08 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_exo -49.65 -31.24 24.43 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 121.269 1.313 . . . . 17.68 114.404 -176.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 8.6 pm0 -74.26 -1.76 22.05 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 114.238 1.199 . . . . 20.84 114.238 178.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ASP . . . . . 0.627 ' OD2' ' NH2' ' A' ' 70' ' ' ARG . 71.4 m-20 -90.26 -11.31 41.26 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.031 0.382 . . . . 15.03 112.031 173.679 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 84.5 m -55.22 122.95 12.21 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.209 -0.45 . . . . 12.67 110.33 177.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . 177.9 171.59 0.65 Allowed 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 115.975 -0.557 . . . . 10.85 110.189 178.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 98.5 t -86.98 128.78 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 N-CA-C 106.005 -1.85 . . . . 10.56 106.005 169.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -102.11 128.38 48.61 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 116.16 -0.473 . . . . 10.12 111.159 179.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -115.38 139.17 50.25 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 115.309 -0.859 . . . . 10.21 110.253 -177.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 12.0 p -87.18 146.44 6.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 106.989 -1.486 . . . . 11.14 106.989 170.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -137.29 154.76 50.03 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.23 0.455 . . . . 13.03 112.23 -177.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -135.39 127.83 30.48 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 115.752 -0.658 . . . . 15.0 109.5 173.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -119.4 108.98 15.23 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 108.289 -1.004 . . . . 16.83 108.289 175.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 58.3 mt -78.55 -14.31 59.4 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 115.455 1.65 . . . . 19.11 115.455 -170.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 54.8 mmtt -77.16 -36.44 55.21 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 121.138 -0.225 . . . . 23.98 111.384 176.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 95.2 mtp -64.92 145.57 56.12 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 112.169 0.433 . . . . 18.94 112.169 -179.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -105.25 -27.77 11.34 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 113.397 0.888 . . . . 21.06 113.397 -178.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 12.8 t -138.14 153.47 26.95 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 N-CA-C 109.927 -0.398 . . . . 15.81 109.927 -177.355 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -56.79 132.22 51.63 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.112 0.482 . . . . 13.24 110.762 175.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -168.94 -174.51 2.09 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 107.399 -1.334 . . . . 13.67 107.399 -179.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -58.74 132.82 55.02 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 109.025 -0.732 . . . . 18.2 109.025 173.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' MET . . . . . . . . . . . . . 90.6 mtp -113.6 125.01 53.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.046 -0.524 . . . . 18.61 111.215 179.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -78.62 125.9 30.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.055 -0.52 . . . . 22.81 110.089 172.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 2.9 pp0? -55.13 -34.22 63.55 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.758 0.651 . . . . 21.85 112.758 -179.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 32.0 ptt-85 -74.69 -16.82 60.74 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.386 0.884 . . . . 28.58 113.386 -177.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 32.0 m -91.56 -8.67 46.77 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.3 0.482 . . . . 18.12 112.3 177.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 35.5 t -63.89 130.23 28.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 111.809 0.3 . . . . 15.14 111.809 -178.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 61.8 m-20 -88.33 -31.26 19.02 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 113.495 0.924 . . . . 14.54 113.495 -178.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 99.5 m-85 -138.79 133.88 32.69 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 112.167 0.432 . . . . 13.79 112.167 -178.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -118.66 147.12 44.11 Favored 'General case' 0 CA--C 1.505 -0.784 0 C-N-CA 123.23 0.612 . . . . 12.57 109.696 176.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -81.92 -170.34 44.38 Favored Glycine 0 N--CA 1.465 0.624 0 N-CA-C 109.076 -1.609 . . . . 12.95 109.076 167.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 3.4 pm0 -91.0 -12.69 35.09 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 120.209 -0.597 . . . . 15.21 112.311 -177.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 92.08 150.26 25.53 Favored Glycine 0 C--N 1.33 0.218 0 CA-C-N 116.252 -0.431 . . . . 13.51 113.826 178.047 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 10.1 t -137.19 118.56 14.69 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.487 -0.56 . . . . 13.0 109.487 178.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' GLN . . . . . . . . . . . . . 64.4 tp60 -65.6 127.84 33.52 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.688 -0.687 . . . . 13.17 112.643 -176.157 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 44.6 t -115.4 124.83 72.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 106.692 -1.595 . . . . 13.18 106.692 171.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 39.8 m -123.46 118.7 28.03 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.212 -0.449 . . . . 15.48 110.759 -178.441 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 19.5 t -111.8 116.5 52.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.65 -0.705 . . . . 18.46 109.853 -179.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 83.1 p -90.67 145.44 24.83 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.713 -0.847 . . . . 22.96 108.713 175.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 82.6 p . . . . . 0 C--O 1.236 0.354 0 CA-C-N 116.646 -0.252 . . . . 26.04 111.18 -179.359 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 orig full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 347' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 348' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 349' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 350' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 351' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 352' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 73.9 mtp . . . . . 0 N--CA 1.493 1.722 0 CA-C-O 120.569 0.223 . . . . 39.399999999999999 110.584 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 0' ' ' ALA . . . . . . . . . . . . . . . -63.56 148.01 49.94 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.196 -0.456 . . . . 28.18 112.178 -179.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -73.0 132.52 43.51 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.02 0.438 . . . . 28.539999999999999 111.206 179.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 91.3 t -137.2 131.21 45.28 Favored 'Isoleucine or valine' 0 C--O 1.235 0.311 0 N-CA-C 107.84 -1.17 . . . . 18.66 107.84 176.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -109.9 98.56 7.84 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.247 -0.433 . . . . 20.010000000000002 111.646 -179.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 95.3 mt -87.64 136.2 33.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.339 -0.391 . . . . 14.789999999999999 109.997 177.644 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 37.6 t -129.03 118.87 47.83 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 N-CA-C 111.725 0.268 . . . . 13.57 111.725 -175.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.9 mp0 -90.28 147.4 23.53 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 120.792 0.329 . . . . 13.42 110.906 177.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 24.8 m -140.18 158.94 43.25 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 115.918 -0.583 . . . . 13.699999999999999 109.989 177.104 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 110.38 -14.99 30.28 Favored Glycine 0 N--CA 1.453 -0.175 0 N-CA-C 115.068 0.787 . . . . 15.130000000000001 115.068 171.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -50.81 152.32 4.86 Favored Glycine 0 C--N 1.333 0.365 0 C-N-CA 120.984 -0.627 . . . . 16.280000000000001 111.654 177.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 178.26 174.67 44.74 Favored Glycine 0 C--O 1.235 0.19 0 C-N-CA 121.14 -0.552 . . . . 17.300000000000001 113.987 -178.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 39.0 tp -93.18 114.72 27.29 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.017 -0.592 . . . . 19.010000000000002 110.324 178.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 6.5 m -127.27 178.02 5.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 N-CA-C 112.6 0.593 . . . . 20.199999999999999 112.6 178.891 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 57.6 mt-30 -109.07 157.53 18.62 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.745 -0.661 . . . . 26.539999999999999 110.738 179.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.57 131.84 47.22 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.026 -0.534 . . . . 21.120000000000001 109.71 172.442 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 98.74 -17.55 58.16 Favored Glycine 0 CA--C 1.52 0.375 0 CA-C-N 116.29 -0.414 . . . . 21.129999999999999 113.827 -178.325 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -75.06 170.0 16.88 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 113.681 0.993 . . . . 21.809999999999999 113.681 -179.656 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 34.6 m -116.46 149.52 39.36 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 114.733 -1.121 . . . . 18.68 109.267 171.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 32.4 tp -151.31 132.3 14.27 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 108.033 -1.099 . . . . 16.859999999999999 108.033 178.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 24.1 ttp180 -106.91 128.47 54.34 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 121.002 0.429 . . . . 21.82 111.781 179.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 38.4 mt -104.99 147.94 27.26 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.445 -0.798 . . . . 13.65 109.131 175.642 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 89.9 p -130.77 162.31 29.8 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.236 -0.653 . . . . 13.1 109.236 176.199 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -152.87 135.11 14.96 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-N 116.297 -0.41 . . . . 11.699999999999999 110.683 178.077 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 13.1 t -139.05 171.93 13.59 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 108.683 -0.858 . . . . 13.16 108.683 179.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -104.17 148.81 25.87 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.438 -0.505 . . . . 13.0 110.042 177.472 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.9 t -100.62 96.69 7.52 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.75 -0.463 . . . . 13.6 109.75 177.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 94.4 -121.28 6.67 Favored Glycine 0 C--N 1.329 0.194 0 N-CA-C 109.501 -1.44 . . . . 12.77 109.501 -175.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 46.1 ttm105 -54.71 132.77 46.42 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.908 0.385 . . . . 11.58 111.314 179.329 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.8 t -133.69 -167.53 1.96 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.092 -0.504 . . . . 12.359999999999999 110.145 -178.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -116.92 163.4 16.25 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 114.006 1.113 . . . . 13.83 114.006 179.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 30.6 t -137.65 124.87 21.69 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 106.346 -1.724 . . . . 16.18 106.346 170.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 47.5 mtp180 63.41 42.8 6.46 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 113.065 0.765 . . . . 25.079999999999998 113.065 -178.718 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -102.18 150.27 23.45 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.082 -0.508 . . . . 15.73 110.383 174.532 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 94.3 t -83.27 115.03 24.97 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 N-CA-C 107.487 -1.301 . . . . 13.359999999999999 107.487 171.663 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 90.0 mmm -104.72 149.25 25.76 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 124.157 0.983 . . . . 12.390000000000001 109.701 -178.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -154.58 164.43 31.61 Favored Glycine 0 C--N 1.332 0.322 0 C-N-CA 120.794 -0.717 . . . . 11.210000000000001 114.742 -179.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 88.3 m95 -112.43 139.67 47.81 Favored 'General case' 0 CA--C 1.498 -1.034 0 CA-C-O 120.877 0.37 . . . . 10.890000000000001 110.03 174.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -126.06 166.21 17.4 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 106.103 -1.814 . . . . 11.119999999999999 106.103 174.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 38.3 ptt180 -145.21 149.81 35.61 Favored 'General case' 0 C--N 1.331 -0.227 0 O-C-N 123.036 0.21 . . . . 11.890000000000001 110.911 176.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 56.8 tt0 -152.33 124.41 8.08 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 113.835 1.05 . . . . 13.83 113.835 -176.136 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -95.3 152.62 39.48 Favored Pre-proline 0 CA--C 1.532 0.251 0 N-CA-C 107.231 -1.396 . . . . 11.949999999999999 107.231 172.466 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_exo -51.88 133.85 46.78 Favored 'Trans proline' 0 C--N 1.352 0.745 0 O-C-N 122.336 0.651 . . . . 12.68 113.58 -179.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 76.67 -7.42 33.39 Favored Glycine 0 CA--C 1.521 0.46 0 CA-C-N 115.743 -0.662 . . . . 13.289999999999999 114.579 -179.312 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 18.5 tttm -91.16 156.67 17.7 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.8 -0.444 . . . . 15.74 109.8 -177.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -72.86 143.43 47.81 Favored 'General case' 0 C--O 1.248 1.024 0 N-CA-C 108.546 -0.909 . . . . 18.719999999999999 108.546 172.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 25.6 ttm180 -66.58 125.4 25.65 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 119.231 -0.988 . . . . 16.359999999999999 110.082 175.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -105.21 132.22 51.69 Favored 'General case' 0 C--O 1.253 1.246 0 C-N-CA 125.46 1.504 . . . . 18.399999999999999 110.33 -172.543 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -67.82 143.59 55.72 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 108.659 -0.867 . . . . 13.27 108.659 169.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.8 t -120.42 -53.21 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 N-CA-C 112.099 0.407 . . . . 11.31 112.099 -179.738 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -159.03 151.68 21.75 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.38 -0.373 . . . . 10.710000000000001 110.701 -177.289 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -132.16 153.95 50.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.317 -0.401 . . . . 11.23 111.037 176.642 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 18.4 tt -146.03 146.38 19.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 115.874 -0.603 . . . . 12.06 111.127 178.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 85.1 p -151.75 155.62 38.64 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.781 -0.822 . . . . 13.109999999999999 108.781 176.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -73.15 137.37 45.1 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.967 0.728 . . . . 16.370000000000001 112.967 -176.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -107.99 -172.54 0.24 Allowed Pre-proline 0 CA--C 1.54 0.559 0 N-CA-C 107.398 -1.334 . . . . 20.809999999999999 107.398 172.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -62.57 151.99 80.21 Favored 'Trans proline' 0 C--N 1.357 1.013 0 N-CA-C 114.023 0.74 . . . . 24.469999999999999 114.023 173.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 64.95 -122.72 24.84 Favored Glycine 0 C--N 1.331 0.3 0 CA-C-N 115.75 -0.659 . . . . 24.359999999999999 112.415 179.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 43.3 p -111.57 8.88 21.11 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 120.584 0.23 . . . . 24.280000000000001 111.179 179.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -82.72 160.06 22.44 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.217 -0.447 . . . . 20.579999999999998 111.955 -179.341 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 81.1 m-85 -137.26 152.7 50.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.076 -0.511 . . . . 16.140000000000001 111.252 179.078 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -93.37 140.94 29.0 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 107.706 -1.22 . . . . 13.619999999999999 107.706 169.074 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -131.67 159.17 39.11 Favored 'General case' 0 C--N 1.329 -0.288 0 O-C-N 123.417 0.448 . . . . 11.73 110.821 178.514 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -151.47 135.25 16.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.926 -0.579 . . . . 11.57 109.803 176.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 -120.76 142.38 49.6 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.177 -0.465 . . . . 12.869999999999999 111.915 -175.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.87 147.98 48.27 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 108.263 -1.014 . . . . 13.390000000000001 108.263 171.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 80.7 m-20 -53.95 -30.38 46.53 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 112.743 0.646 . . . . 16.399999999999999 112.743 177.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 72.2 p -63.53 -20.05 65.29 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 113.731 1.012 . . . . 14.960000000000001 113.731 -179.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 17.6 m -125.12 2.39 4.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 N-CA-C 115.689 1.737 . . . . 16.77 115.689 -178.166 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 5.5 mtm105 -57.33 134.35 55.91 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 120.79 0.328 . . . . 23.280000000000001 111.206 178.368 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 88.62 -15.55 56.72 Favored Glycine 0 CA--C 1.519 0.322 0 CA-C-N 116.0 -0.545 . . . . 17.420000000000002 114.158 -179.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ARG . . . . . 0.613 ' NH2' ' OD2' ' A' ' 93' ' ' ASP . 39.6 mtp180 -116.88 -48.59 2.65 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 114.224 1.194 . . . . 16.25 114.224 -173.228 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 4.7 m-30 -97.96 148.33 23.58 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 120.807 0.337 . . . . 14.970000000000001 110.782 -177.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 60.1 p -133.47 133.33 42.14 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.764 -0.458 . . . . 15.09 109.764 174.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 17.4 tt -103.58 134.28 45.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.673 -0.694 . . . . 13.720000000000001 109.777 178.612 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 84.2 p -142.45 170.77 15.09 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.365 -0.605 . . . . 13.01 109.365 177.011 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -149.33 153.42 37.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.189 0.518 . . . . 14.279999999999999 112.105 178.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -123.58 108.94 13.16 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 107.441 -1.318 . . . . 18.07 107.441 176.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 32.1 t -60.1 -56.35 22.72 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 112.639 0.607 . . . . 17.789999999999999 112.639 -177.109 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -54.47 -45.96 73.27 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 122.909 0.483 . . . . 18.59 111.963 178.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -81.03 2.08 28.59 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 113.364 0.875 . . . . 20.960000000000001 113.364 -178.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 54.6 t30 52.38 37.28 22.09 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 121.64 0.733 . . . . 17.809999999999999 112.257 174.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 54.8 m -128.5 146.85 50.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.718 -0.674 . . . . 14.960000000000001 111.234 -173.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 9.0 p -121.04 142.01 39.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 N-CA-C 106.64 -1.615 . . . . 13.140000000000001 106.64 174.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 -123.59 154.29 39.47 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 112.525 0.565 . . . . 12.710000000000001 112.525 -173.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 26.2 tp -134.83 104.31 5.95 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.193 -0.912 . . . . 13.4 109.118 170.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 72.4 tp60 -86.29 114.15 22.86 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.323 -0.621 . . . . 14.199999999999999 109.323 176.316 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 68.5 mtm -101.47 119.49 38.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.092 -0.503 . . . . 17.629999999999999 110.113 -179.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 30.3 m-80 -113.35 161.53 17.15 Favored 'General case' 0 C--O 1.236 0.353 0 O-C-N 123.359 0.412 . . . . 16.18 110.952 177.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 40.7 m 45.69 48.24 11.56 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.514 0.673 . . . . 15.23 111.697 177.041 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 37.1 mt -60.77 149.15 36.61 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.189 -0.914 . . . . 16.75 110.405 -178.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LYS . . . . . 0.483 ' HG3' ' HG2' ' A' ' 92' ' ' GLU . 13.0 ptpt -138.57 159.05 69.16 Favored Pre-proline 0 C--N 1.325 -0.477 0 N-CA-C 108.793 -0.818 . . . . 20.539999999999999 108.793 178.08 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_exo -49.65 -31.24 24.43 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 121.269 1.313 . . . . 17.68 114.404 -176.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLU . . . . . 0.483 ' HG2' ' HG3' ' A' ' 90' ' ' LYS . 8.6 pm0 -74.26 -1.76 22.05 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 114.238 1.199 . . . . 20.84 114.238 178.936 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ASP . . . . . 0.613 ' OD2' ' NH2' ' A' ' 70' ' ' ARG . 71.4 m-20 -90.26 -11.31 41.26 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.031 0.382 . . . . 15.029999999999999 112.031 173.679 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 84.5 m -55.22 122.95 12.21 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.209 -0.45 . . . . 12.67 110.33 177.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . 177.9 171.59 0.65 Allowed 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 115.975 -0.557 . . . . 10.85 110.189 178.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 98.5 t -86.98 128.78 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 N-CA-C 106.005 -1.85 . . . . 10.56 106.005 169.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -102.11 128.38 48.61 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 116.16 -0.473 . . . . 10.119999999999999 111.159 179.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -115.38 139.17 50.25 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 115.309 -0.859 . . . . 10.210000000000001 110.253 -177.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 12.0 p -87.18 146.44 6.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 106.989 -1.486 . . . . 11.140000000000001 106.989 170.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -137.29 154.76 50.03 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.23 0.455 . . . . 13.029999999999999 112.23 -177.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -135.39 127.83 30.48 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 115.752 -0.658 . . . . 15.0 109.5 173.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -119.4 108.98 15.23 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 108.289 -1.004 . . . . 16.829999999999998 108.289 175.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 58.3 mt -78.55 -14.31 59.4 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 115.455 1.65 . . . . 19.109999999999999 115.455 -170.537 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' LYS . . . . . 0.431 ' HG2' ' O ' ' A' ' 336' ' ' HOH . 54.8 mmtt -77.16 -36.44 55.21 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 121.138 -0.225 . . . . 23.98 111.384 176.686 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 105' ' ' MET . . . . . 0.412 ' SD ' ' HG2' ' A' ' 111' ' ' MET . 95.2 mtp -64.92 145.57 56.12 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 112.169 0.433 . . . . 18.940000000000001 112.169 -179.196 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -105.25 -27.77 11.34 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 113.397 0.888 . . . . 21.059999999999999 113.397 -178.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 12.8 t -138.14 153.47 26.95 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 N-CA-C 109.927 -0.398 . . . . 15.81 109.927 -177.355 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -56.79 132.22 51.63 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.112 0.482 . . . . 13.24 110.762 175.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -168.94 -174.51 2.09 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 107.399 -1.334 . . . . 13.67 107.399 -179.109 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -58.74 132.82 55.02 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 109.025 -0.732 . . . . 18.199999999999999 109.025 173.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' MET . . . . . 0.412 ' HG2' ' SD ' ' A' ' 105' ' ' MET . 90.6 mtp -113.6 125.01 53.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.046 -0.524 . . . . 18.609999999999999 111.215 179.937 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -78.62 125.9 30.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.055 -0.52 . . . . 22.809999999999999 110.089 172.51 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 2.9 pp0? -55.13 -34.22 63.55 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.758 0.651 . . . . 21.850000000000001 112.758 -179.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 32.0 ptt-85 -74.69 -16.82 60.74 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.386 0.884 . . . . 28.579999999999998 113.386 -177.468 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 32.0 m -91.56 -8.67 46.77 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.3 0.482 . . . . 18.120000000000001 112.3 177.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 35.5 t -63.89 130.23 28.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 111.809 0.3 . . . . 15.140000000000001 111.809 -178.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 61.8 m-20 -88.33 -31.26 19.02 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 113.495 0.924 . . . . 14.539999999999999 113.495 -178.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 99.5 m-85 -138.79 133.88 32.69 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 112.167 0.432 . . . . 13.789999999999999 112.167 -178.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -118.66 147.12 44.11 Favored 'General case' 0 CA--C 1.505 -0.784 0 C-N-CA 123.23 0.612 . . . . 12.57 109.696 176.398 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -81.92 -170.34 44.38 Favored Glycine 0 N--CA 1.465 0.624 0 N-CA-C 109.076 -1.609 . . . . 12.949999999999999 109.076 167.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 3.4 pm0 -91.0 -12.69 35.09 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 120.209 -0.597 . . . . 15.210000000000001 112.311 -177.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 92.08 150.26 25.53 Favored Glycine 0 C--N 1.33 0.218 0 CA-C-N 116.252 -0.431 . . . . 13.51 113.826 178.047 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 10.1 t -137.19 118.56 14.69 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.487 -0.56 . . . . 13.0 109.487 178.286 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' GLN . . . . . . . . . . . . . 64.4 tp60 -65.6 127.84 33.52 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.688 -0.687 . . . . 13.17 112.643 -176.157 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 44.6 t -115.4 124.83 72.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 106.692 -1.595 . . . . 13.18 106.692 171.109 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 39.8 m -123.46 118.7 28.03 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.212 -0.449 . . . . 15.48 110.759 -178.441 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 19.5 t -111.8 116.5 52.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.65 -0.705 . . . . 18.460000000000001 109.853 -179.347 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 83.1 p -90.67 145.44 24.83 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.713 -0.847 . . . . 22.960000000000001 108.713 175.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 82.6 p . . . . . 0 C--O 1.236 0.354 0 CA-C-N 116.646 -0.252 . . . . 26.039999999999999 111.18 -179.359 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 build full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 336' ' ' HOH . . . . . 0.431 ' O ' ' HG2' ' A' ' 104' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 347' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 348' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 349' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 350' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 351' ' ' HOH . . . . . 0.461 ' O ' ' HD3' ' A' ' 70' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 352' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 73.9 mtp . . . . . 0 N--CA 1.493 1.722 0 CA-C-O 120.569 0.223 . . . . 39.399999999999999 110.584 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 0' ' ' ALA . . . . . . . . . . . . . . . -63.56 148.01 49.94 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.196 -0.456 . . . . 28.18 112.178 -179.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -73.0 132.52 43.51 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.02 0.438 . . . . 28.539999999999999 111.206 179.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 91.3 t -137.2 131.21 45.28 Favored 'Isoleucine or valine' 0 C--O 1.235 0.311 0 N-CA-C 107.84 -1.17 . . . . 18.66 107.84 176.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -109.9 98.56 7.84 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.247 -0.433 . . . . 20.010000000000002 111.646 -179.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 95.3 mt -87.64 136.2 33.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.339 -0.391 . . . . 14.789999999999999 109.997 177.644 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 37.6 t -129.03 118.87 47.83 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 N-CA-C 111.725 0.268 . . . . 13.57 111.725 -175.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.9 mp0 -90.28 147.4 23.53 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 120.792 0.329 . . . . 13.42 110.906 177.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 24.8 m -140.18 158.94 43.25 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 115.918 -0.583 . . . . 13.699999999999999 109.989 177.104 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 110.38 -14.99 30.28 Favored Glycine 0 N--CA 1.453 -0.175 0 N-CA-C 115.068 0.787 . . . . 15.130000000000001 115.068 171.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -50.81 152.32 4.86 Favored Glycine 0 C--N 1.333 0.365 0 C-N-CA 120.984 -0.627 . . . . 16.280000000000001 111.654 177.968 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 178.26 174.67 44.74 Favored Glycine 0 C--O 1.235 0.19 0 C-N-CA 121.14 -0.552 . . . . 17.300000000000001 113.987 -178.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 39.0 tp -93.18 114.72 27.29 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.017 -0.592 . . . . 19.010000000000002 110.324 178.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 6.5 m -127.27 178.02 5.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 N-CA-C 112.6 0.593 . . . . 20.199999999999999 112.6 178.891 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 57.6 mt-30 -109.07 157.53 18.62 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.745 -0.661 . . . . 26.539999999999999 110.738 179.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.57 131.84 47.22 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.026 -0.534 . . . . 21.120000000000001 109.71 172.442 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 98.74 -17.55 58.16 Favored Glycine 0 CA--C 1.52 0.375 0 CA-C-N 116.29 -0.414 . . . . 21.129999999999999 113.827 -178.325 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -75.06 170.0 16.88 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 113.681 0.993 . . . . 21.809999999999999 113.681 -179.656 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 34.6 m -116.46 149.52 39.36 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 114.733 -1.121 . . . . 18.68 109.267 171.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 32.4 tp -151.31 132.3 14.27 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 108.033 -1.099 . . . . 16.859999999999999 108.033 178.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 24.1 ttp180 -106.91 128.47 54.34 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 121.002 0.429 . . . . 21.82 111.781 179.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 38.4 mt -104.99 147.94 27.26 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.445 -0.798 . . . . 13.65 109.131 175.642 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 89.9 p -130.77 162.31 29.8 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.236 -0.653 . . . . 13.1 109.236 176.199 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -152.87 135.11 14.96 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-N 116.297 -0.41 . . . . 11.699999999999999 110.683 178.077 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 13.1 t -139.05 171.93 13.59 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 108.683 -0.858 . . . . 13.16 108.683 179.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -104.17 148.81 25.87 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.438 -0.505 . . . . 13.0 110.042 177.472 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.9 t -100.62 96.69 7.52 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.75 -0.463 . . . . 13.6 109.75 177.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 94.4 -121.28 6.67 Favored Glycine 0 C--N 1.329 0.194 0 N-CA-C 109.501 -1.44 . . . . 12.77 109.501 -175.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 46.1 ttm105 -54.71 132.77 46.42 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.908 0.385 . . . . 11.58 111.314 179.329 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.8 t -133.69 -167.53 1.96 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.092 -0.504 . . . . 12.359999999999999 110.145 -178.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -116.92 163.4 16.25 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 114.006 1.113 . . . . 13.83 114.006 179.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 30.6 t -137.65 124.87 21.69 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 106.346 -1.724 . . . . 16.18 106.346 170.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 47.5 mtp180 63.41 42.8 6.46 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 113.065 0.765 . . . . 25.079999999999998 113.065 -178.718 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -102.18 150.27 23.45 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.082 -0.508 . . . . 15.73 110.383 174.532 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 94.3 t -83.27 115.03 24.97 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 N-CA-C 107.487 -1.301 . . . . 13.359999999999999 107.487 171.663 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 90.0 mmm -104.72 149.25 25.76 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 124.157 0.983 . . . . 12.390000000000001 109.701 -178.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -154.58 164.43 31.61 Favored Glycine 0 C--N 1.332 0.322 0 C-N-CA 120.794 -0.717 . . . . 11.210000000000001 114.742 -179.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 88.3 m95 -112.43 139.67 47.81 Favored 'General case' 0 CA--C 1.498 -1.034 0 CA-C-O 120.877 0.37 . . . . 10.890000000000001 110.03 174.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -126.06 166.21 17.4 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 106.103 -1.814 . . . . 11.119999999999999 106.103 174.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 38.3 ptt180 -145.21 149.81 35.61 Favored 'General case' 0 C--N 1.331 -0.227 0 O-C-N 123.036 0.21 . . . . 11.890000000000001 110.911 176.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 56.8 tt0 -152.33 124.41 8.08 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 113.835 1.05 . . . . 13.83 113.835 -176.136 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -95.3 152.62 39.48 Favored Pre-proline 0 CA--C 1.532 0.251 0 N-CA-C 107.231 -1.396 . . . . 11.949999999999999 107.231 172.466 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_exo -51.88 133.85 46.78 Favored 'Trans proline' 0 C--N 1.352 0.745 0 O-C-N 122.336 0.651 . . . . 12.68 113.58 -179.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 76.67 -7.42 33.39 Favored Glycine 0 CA--C 1.521 0.46 0 CA-C-N 115.743 -0.662 . . . . 13.289999999999999 114.579 -179.312 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 18.5 tttm -91.16 156.67 17.7 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.8 -0.444 . . . . 15.74 109.8 -177.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -72.86 143.43 47.81 Favored 'General case' 0 C--O 1.248 1.024 0 N-CA-C 108.546 -0.909 . . . . 18.719999999999999 108.546 172.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 25.6 ttm180 -66.58 125.4 25.65 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 119.231 -0.988 . . . . 16.359999999999999 110.082 175.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -105.21 132.22 51.69 Favored 'General case' 0 C--O 1.253 1.246 0 C-N-CA 125.46 1.504 . . . . 18.399999999999999 110.33 -172.543 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -67.82 143.59 55.72 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 108.659 -0.867 . . . . 13.27 108.659 169.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.8 t -120.42 -53.21 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 N-CA-C 112.099 0.407 . . . . 11.31 112.099 -179.738 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -159.03 151.68 21.75 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.38 -0.373 . . . . 10.710000000000001 110.701 -177.289 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -132.16 153.95 50.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.317 -0.401 . . . . 11.23 111.037 176.642 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 18.4 tt -146.03 146.38 19.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 115.874 -0.603 . . . . 12.06 111.127 178.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 85.1 p -151.75 155.62 38.64 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.781 -0.822 . . . . 13.109999999999999 108.781 176.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -73.15 137.37 45.1 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.967 0.728 . . . . 16.370000000000001 112.967 -176.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -107.99 -172.54 0.24 Allowed Pre-proline 0 CA--C 1.54 0.559 0 N-CA-C 107.398 -1.334 . . . . 20.809999999999999 107.398 172.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -62.57 151.99 80.21 Favored 'Trans proline' 0 C--N 1.357 1.013 0 N-CA-C 114.023 0.74 . . . . 24.469999999999999 114.023 173.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 64.95 -122.72 24.84 Favored Glycine 0 C--N 1.331 0.3 0 CA-C-N 115.75 -0.659 . . . . 24.359999999999999 112.415 179.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 43.3 p -111.57 8.88 21.11 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 120.584 0.23 . . . . 24.280000000000001 111.179 179.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -82.72 160.06 22.44 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.217 -0.447 . . . . 20.579999999999998 111.955 -179.341 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 81.1 m-85 -137.26 152.7 50.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.076 -0.511 . . . . 16.140000000000001 111.252 179.078 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -93.37 140.94 29.0 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 107.706 -1.22 . . . . 13.619999999999999 107.706 169.074 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -131.67 159.17 39.11 Favored 'General case' 0 C--N 1.329 -0.288 0 O-C-N 123.417 0.448 . . . . 11.73 110.821 178.514 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -151.47 135.25 16.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.926 -0.579 . . . . 11.57 109.803 176.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 -120.76 142.38 49.6 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.177 -0.465 . . . . 12.869999999999999 111.915 -175.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.87 147.98 48.27 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 108.263 -1.014 . . . . 13.390000000000001 108.263 171.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 80.7 m-20 -53.95 -30.38 46.53 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 112.743 0.646 . . . . 16.399999999999999 112.743 177.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 72.2 p -63.53 -20.05 65.29 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 113.731 1.012 . . . . 14.960000000000001 113.731 -179.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 17.6 m -125.12 2.39 4.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 N-CA-C 115.689 1.737 . . . . 16.77 115.689 -178.166 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 5.5 mtm105 -57.33 134.35 55.91 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 120.79 0.328 . . . . 23.280000000000001 111.206 178.368 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 88.62 -15.55 56.72 Favored Glycine 0 CA--C 1.519 0.322 0 CA-C-N 116.0 -0.545 . . . . 17.420000000000002 114.158 -179.574 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.613 ' NH2' ' OD2' ' A' ' 93' ' ' ASP . 39.6 mtp180 -116.88 -48.59 2.65 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 114.224 1.194 . . . . 16.25 114.224 -173.228 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 4.7 m-30 -97.96 148.33 23.58 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 120.807 0.337 . . . . 14.970000000000001 110.782 -177.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 60.1 p -133.47 133.33 42.14 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.764 -0.458 . . . . 15.09 109.764 174.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 17.4 tt -103.58 134.28 45.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.673 -0.694 . . . . 13.720000000000001 109.777 178.612 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 84.2 p -142.45 170.77 15.09 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.365 -0.605 . . . . 13.01 109.365 177.011 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -149.33 153.42 37.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.189 0.518 . . . . 14.279999999999999 112.105 178.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -123.58 108.94 13.16 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 107.441 -1.318 . . . . 18.07 107.441 176.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 32.1 t -60.1 -56.35 22.72 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 112.639 0.607 . . . . 17.789999999999999 112.639 -177.109 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -54.47 -45.96 73.27 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 122.909 0.483 . . . . 18.59 111.963 178.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -81.03 2.08 28.59 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 113.364 0.875 . . . . 20.960000000000001 113.364 -178.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 54.6 t30 52.38 37.28 22.09 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 121.64 0.733 . . . . 17.809999999999999 112.257 174.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 54.8 m -128.5 146.85 50.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.718 -0.674 . . . . 14.960000000000001 111.234 -173.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 9.0 p -121.04 142.01 39.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 N-CA-C 106.64 -1.615 . . . . 13.140000000000001 106.64 174.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 -123.59 154.29 39.47 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 112.525 0.565 . . . . 12.710000000000001 112.525 -173.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 26.2 tp -134.83 104.31 5.95 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.193 -0.912 . . . . 13.4 109.118 170.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 11.8 tp-100 -86.29 114.15 22.86 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.323 -0.621 . . . . 14.199999999999999 109.323 176.316 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 68.5 mtm -101.47 119.49 38.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.092 -0.503 . . . . 17.629999999999999 110.113 -179.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -113.35 161.53 17.15 Favored 'General case' 0 C--O 1.236 0.353 0 O-C-N 123.359 0.412 . . . . 16.18 110.952 177.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 40.7 m 45.69 48.24 11.56 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.514 0.673 . . . . 15.23 111.697 177.041 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 37.1 mt -60.77 149.15 36.61 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.189 -0.914 . . . . 16.75 110.405 -178.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.483 ' HG3' ' HG2' ' A' ' 92' ' ' GLU . 13.0 ptpt -138.57 159.05 69.16 Favored Pre-proline 0 C--N 1.325 -0.477 0 N-CA-C 108.793 -0.818 . . . . 20.539999999999999 108.793 178.08 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_exo -49.65 -31.24 24.43 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 121.269 1.313 . . . . 17.68 114.404 -176.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.483 ' HG2' ' HG3' ' A' ' 90' ' ' LYS . 8.6 pm0 -74.26 -1.76 22.05 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 114.238 1.199 . . . . 20.84 114.238 178.936 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.613 ' OD2' ' NH2' ' A' ' 70' ' ' ARG . 71.4 m-20 -90.26 -11.31 41.26 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.031 0.382 . . . . 15.029999999999999 112.031 173.679 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 84.5 m -55.22 122.95 12.21 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.209 -0.45 . . . . 12.67 110.33 177.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . 177.9 171.59 0.65 Allowed 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 115.975 -0.557 . . . . 10.85 110.189 178.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 98.5 t -86.98 128.78 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 N-CA-C 106.005 -1.85 . . . . 10.56 106.005 169.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -102.11 128.38 48.61 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 116.16 -0.473 . . . . 10.119999999999999 111.159 179.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -115.38 139.17 50.25 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 115.309 -0.859 . . . . 10.210000000000001 110.253 -177.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 12.0 p -87.18 146.44 6.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 106.989 -1.486 . . . . 11.140000000000001 106.989 170.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -137.29 154.76 50.03 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.23 0.455 . . . . 13.029999999999999 112.23 -177.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -135.39 127.83 30.48 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 115.752 -0.658 . . . . 15.0 109.5 173.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -119.4 108.98 15.23 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 108.289 -1.004 . . . . 16.829999999999998 108.289 175.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 58.3 mt -78.55 -14.31 59.4 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 115.455 1.65 . . . . 19.109999999999999 115.455 -170.537 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.431 ' HG2' ' O ' ' A' ' 336' ' ' HOH . 54.8 mmtt -77.16 -36.44 55.21 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 121.138 -0.225 . . . . 23.98 111.384 176.686 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' MET . . . . . 0.412 ' SD ' ' HG2' ' A' ' 111' ' ' MET . 95.2 mtp -64.92 145.57 56.12 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 112.169 0.433 . . . . 18.940000000000001 112.169 -179.196 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -105.25 -27.77 11.34 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 113.397 0.888 . . . . 21.059999999999999 113.397 -178.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 12.8 t -138.14 153.47 26.95 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 N-CA-C 109.927 -0.398 . . . . 15.81 109.927 -177.355 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -56.79 132.22 51.63 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.112 0.482 . . . . 13.24 110.762 175.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -168.94 -174.51 2.09 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 107.399 -1.334 . . . . 13.67 107.399 -179.109 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -58.74 132.82 55.02 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 109.025 -0.732 . . . . 18.199999999999999 109.025 173.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' MET . . . . . 0.412 ' HG2' ' SD ' ' A' ' 105' ' ' MET . 90.6 mtp -113.6 125.01 53.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.046 -0.524 . . . . 18.609999999999999 111.215 179.937 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -78.62 125.9 30.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.055 -0.52 . . . . 22.809999999999999 110.089 172.51 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 2.9 pp0? -55.13 -34.22 63.55 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.758 0.651 . . . . 21.850000000000001 112.758 -179.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 32.0 ptt-85 -74.69 -16.82 60.74 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.386 0.884 . . . . 28.579999999999998 113.386 -177.468 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 32.0 m -91.56 -8.67 46.77 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.3 0.482 . . . . 18.120000000000001 112.3 177.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 35.5 t -63.89 130.23 28.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 111.809 0.3 . . . . 15.140000000000001 111.809 -178.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 61.8 m-20 -88.33 -31.26 19.02 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 113.495 0.924 . . . . 14.539999999999999 113.495 -178.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 99.5 m-85 -138.79 133.88 32.69 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 112.167 0.432 . . . . 13.789999999999999 112.167 -178.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -118.66 147.12 44.11 Favored 'General case' 0 CA--C 1.505 -0.784 0 C-N-CA 123.23 0.612 . . . . 12.57 109.696 176.398 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -81.92 -170.34 44.38 Favored Glycine 0 N--CA 1.465 0.624 0 N-CA-C 109.076 -1.609 . . . . 12.949999999999999 109.076 167.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 3.4 pm0 -91.0 -12.69 35.09 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 120.209 -0.597 . . . . 15.210000000000001 112.311 -177.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 92.08 150.26 25.53 Favored Glycine 0 C--N 1.33 0.218 0 CA-C-N 116.252 -0.431 . . . . 13.51 113.826 178.047 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 10.1 t -137.19 118.56 14.69 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.487 -0.56 . . . . 13.0 109.487 178.286 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' GLN . . . . . . . . . . . . . 64.4 tp60 -65.6 127.84 33.52 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.688 -0.687 . . . . 13.17 112.643 -176.157 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 44.6 t -115.4 124.83 72.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 106.692 -1.595 . . . . 13.18 106.692 171.109 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 39.8 m -123.46 118.7 28.03 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.212 -0.449 . . . . 15.48 110.759 -178.441 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 19.5 t -111.8 116.5 52.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.65 -0.705 . . . . 18.460000000000001 109.853 -179.347 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 83.1 p -90.67 145.44 24.83 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.713 -0.847 . . . . 22.960000000000001 108.713 175.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 82.6 p . . . . . 0 C--O 1.236 0.354 0 CA-C-N 116.646 -0.252 . . . . 26.039999999999999 111.18 -179.359 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 . 001 ecloud nobuild full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 336' ' ' HOH . . . . . 0.431 ' O ' ' HG2' ' A' ' 104' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 347' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 348' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 349' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 350' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 351' ' ' HOH . . . . . 0.461 ' O ' ' HD3' ' A' ' 70' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 352' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_