data_3pk2_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 3pk2 _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 ' 13' ' ' ASP . . . . . 0.595 ' OD2' ' OG1' ' A' ' 71' ' ' THR . 87.5 m-20 . . . . . 0 N--CA 1.492 1.633 0 N-CA-C 111.576 0.213 . . . . 40.07 111.576 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 70.6 tt0 -50.88 -45.57 60.06 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.187 -0.672 . . . . 38.829999999999998 109.187 174.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.64 -40.87 84.59 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 115.204 -0.907 . . . . 33.5 111.559 -178.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -69.64 -38.0 77.64 Favored Glycine 0 C--N 1.332 0.359 0 N-CA-C 114.481 0.552 . . . . 27.829999999999998 114.481 -178.013 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 96.6 mt -76.39 -42.11 36.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 N-CA-C 113.195 0.813 . . . . 20.710000000000001 113.195 -177.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 52.5 m -58.98 127.25 31.27 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.187 0.518 . . . . 18.600000000000001 111.625 -177.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 141.56 -161.25 27.0 Favored Glycine 0 C--N 1.329 0.171 0 CA-C-N 116.058 -0.519 . . . . 16.879999999999999 112.768 176.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 90.5 m -105.83 131.95 52.54 Favored 'General case' 0 C--O 1.242 0.661 0 N-CA-C 108.538 -0.912 . . . . 18.0 108.538 -174.676 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 78.7 m95 -125.57 152.82 44.58 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 114.977 -1.01 . . . . 14.550000000000001 111.191 179.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 40.6 m-85 -130.54 136.43 48.92 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.41 -0.589 . . . . 18.289999999999999 109.41 -177.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 39.4 p30 -100.06 -178.85 3.97 Favored 'General case' 0 C--O 1.24 0.591 0 C-N-CA 119.213 -0.995 . . . . 16.41 113.268 176.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 8.3 pm0 -68.37 -19.35 64.62 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 115.341 -0.845 . . . . 18.870000000000001 111.947 -174.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 98.3 mt -85.54 -9.88 56.76 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 122.905 0.482 . . . . 20.370000000000001 112.058 178.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 92.4 8.14 62.91 Favored Glycine 0 CA--C 1.519 0.322 0 CA-C-O 120.153 -0.248 . . . . 18.870000000000001 113.171 -177.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 69.6 m -73.44 155.19 39.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.917 0.359 . . . . 15.85 111.297 177.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.3 m -119.92 124.82 46.94 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.432 0.693 . . . . 19.280000000000001 110.313 -176.413 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -117.36 112.1 20.25 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 105.55 -2.018 . . . . 16.960000000000001 105.55 -176.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 76.5 mt -109.89 121.26 62.5 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 N-CA-C 109.405 -0.591 . . . . 20.66 109.405 178.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.8 p -139.78 146.32 25.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 N-CA-C 113.811 1.041 . . . . 17.800000000000001 113.811 -170.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 98.6 m -117.43 126.22 52.28 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 108.321 -0.992 . . . . 20.25 108.321 169.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -97.54 119.82 36.8 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 109.03 -0.73 . . . . 20.75 109.03 177.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -80.39 157.99 41.14 Favored Glycine 0 CA--C 1.519 0.307 0 N-CA-C 112.047 -0.421 . . . . 22.420000000000002 112.047 178.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -60.12 -21.88 62.11 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 121.428 0.632 . . . . 27.289999999999999 110.743 -176.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 35.1 p30 -93.58 -15.45 25.4 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.414 1.486 . . . . 30.940000000000001 113.377 -168.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 116.32 -1.37 20.67 Favored Glycine 0 C--O 1.221 -0.659 0 O-C-N 121.929 -0.482 . . . . 20.670000000000002 112.465 -176.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -71.09 141.43 50.83 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 112.595 0.591 . . . . 16.210000000000001 112.595 177.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 94.0 mt -121.47 131.38 54.13 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 109.125 -0.695 . . . . 13.869999999999999 109.125 166.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' THR . . . . . 0.443 ' CG2' ' O ' ' A' ' 554' ' ' HOH . 70.7 p -142.37 146.22 34.71 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.259 -1.015 . . . . 18.359999999999999 108.259 179.466 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 165.16 -152.44 21.95 Favored Glycine 0 CA--C 1.51 -0.267 0 C-N-CA 120.271 -0.966 . . . . 14.6 112.971 176.013 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 81.1 p -134.56 152.99 52.16 Favored 'General case' 0 C--O 1.248 0.999 0 CA-C-O 121.413 0.625 . . . . 15.970000000000001 110.307 -177.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -127.61 135.86 50.86 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 114.833 -1.076 . . . . 12.84 108.758 178.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 82.1 tt0 -124.9 112.36 16.54 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 107.381 -1.341 . . . . 24.699999999999999 107.381 175.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 47.6 t -85.94 133.41 33.94 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.316 0.487 . . . . 15.23 112.316 -179.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -76.12 -13.12 60.21 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.207 -0.452 . . . . 16.829999999999998 112.208 175.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 31.7 m -133.69 161.69 40.71 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 CA-C-O 121.096 0.474 . . . . 15.93 111.774 -175.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 85.7 -170.02 43.52 Favored Glycine 0 C--O 1.237 0.301 0 CA-C-N 115.539 -0.755 . . . . 16.609999999999999 113.48 172.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 47.7 t-20 -83.59 71.55 10.35 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 107.981 -1.118 . . . . 21.34 107.981 -175.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.14 141.08 27.16 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 114.76 -1.109 . . . . 16.43 111.202 -172.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 55.6 tt0 -144.77 131.73 20.31 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.24 -0.891 . . . . 29.25 109.468 175.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 7.5 t 67.8 -156.91 0.21 Allowed 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.424 -0.807 . . . . 21.109999999999999 111.353 177.092 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 21.9 mtt180 -92.98 145.18 24.56 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 112.751 0.648 . . . . 26.120000000000001 112.751 -173.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -124.9 143.58 50.78 Favored 'General case' 0 N--CA 1.461 0.115 0 C-N-CA 125.224 1.41 . . . . 13.619999999999999 109.014 176.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 74.0 t -66.39 139.2 21.57 Favored 'Isoleucine or valine' 0 C--O 1.238 0.47 0 N-CA-C 109.008 -0.738 . . . . 15.66 109.008 177.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.6 pp -128.63 148.93 50.83 Favored 'General case' 0 C--O 1.243 0.727 0 CA-C-O 121.894 0.854 . . . . 15.199999999999999 110.404 169.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 15.2 t -142.29 149.35 39.41 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 114.741 -1.118 . . . . 16.5 108.815 171.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -165.38 -164.02 19.92 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.732 -0.747 . . . . 10.82 111.968 179.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 29.8 mmm180 -142.59 152.14 42.24 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.93 -0.635 . . . . 17.010000000000002 109.435 -177.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 16.6 p90 -138.98 157.52 45.86 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 116.018 -0.537 . . . . 17.859999999999999 109.768 172.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -73.84 107.07 5.86 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 108.77 -0.826 . . . . 18.57 108.77 174.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 66.8 p -86.86 6.83 29.84 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 114.075 1.139 . . . . 25.879999999999999 114.075 -174.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -145.86 69.31 13.28 Favored Pre-proline 0 C--O 1.235 0.323 0 N-CA-C 108.631 -0.878 . . . . 30.690000000000001 108.631 173.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_endo -78.21 166.97 23.92 Favored 'Trans proline' 0 C--O 1.238 0.525 0 C-N-CA 122.602 2.201 . . . . 34.469999999999999 113.7 -174.074 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.93 140.07 58.34 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.003 -0.544 . . . . 35.68 111.514 -178.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 39.3 p -103.41 44.03 1.04 Allowed 'General case' 1 C--N 1.243 -4.028 0 O-C-N 124.682 1.239 . . . . 48.719999999999999 109.694 179.762 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 55.1 p-10 -123.48 25.59 8.19 Favored 'General case' 1 C--N 1.219 -5.088 0 CA-C-N 111.387 -2.642 . . . . 45.969999999999999 112.031 176.152 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 84.84 1.83 88.78 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 114.571 0.588 . . . . 42.020000000000003 114.571 -179.532 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 70.1 m -72.37 155.72 39.84 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 117.194 0.497 . . . . 34.670000000000002 111.062 179.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -70.58 169.56 47.42 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 121.345 -0.455 . . . . 24.899999999999999 111.964 173.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' THR . . . . . 0.595 ' OG1' ' OD2' ' A' ' 13' ' ' ASP . 86.1 m -103.97 112.04 24.85 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 123.433 0.693 . . . . 18.460000000000001 110.944 176.93 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.73 140.72 58.75 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 120.805 0.336 . . . . 14.93 111.506 -178.5 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -160.23 164.79 32.47 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 121.645 0.736 . . . . 16.940000000000001 110.984 178.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -159.4 158.77 29.88 Favored Glycine 0 C--O 1.221 -0.703 0 CA-C-N 115.112 -0.949 . . . . 10.6 111.459 175.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' TRP . . . . . . . . . . . . . 30.8 p90 -155.26 162.87 40.79 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 110.293 -0.262 . . . . 11.67 110.293 176.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 80.5 m -128.09 139.91 52.24 Favored 'General case' 0 C--O 1.236 0.383 0 O-C-N 124.335 1.022 . . . . 9.6699999999999999 110.466 -178.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 41.1 t -121.95 128.88 75.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 108.377 -0.971 . . . . 10.0 108.377 165.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -95.43 128.93 42.69 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 106.832 -1.544 . . . . 11.699999999999999 106.832 166.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 97.5 m95 -85.04 47.46 1.41 Allowed 'General case' 0 C--O 1.244 0.807 0 CA-C-O 122.126 0.965 . . . . 13.51 112.672 -167.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 59.8 tttm -121.56 126.86 50.15 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 114.307 -1.315 . . . . 26.109999999999999 108.161 172.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 53.8 p30 -142.36 -167.11 2.41 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.608 -0.886 . . . . 17.98 108.608 168.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -67.57 -15.12 63.49 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 114.083 1.142 . . . . 29.530000000000001 114.083 -178.166 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -97.06 -40.98 8.58 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 112.943 0.72 . . . . 29.370000000000001 112.943 -176.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 69.4 mtt180 -149.1 155.53 40.86 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.064 -0.516 . . . . 29.66 112.322 -170.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 54.0 t-20 -133.25 107.95 8.46 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.377 -0.828 . . . . 18.34 109.499 169.24 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -91.8 9.55 32.25 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.755 0.65 . . . . 14.85 112.755 -178.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 51.2 m-70 46.73 51.42 12.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.548 0.689 . . . . 15.25 112.346 175.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 15.6 p -157.65 164.1 37.55 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-N 114.84 -1.073 . . . . 12.99 110.755 -176.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -142.67 137.78 30.17 Favored 'General case' 0 C--O 1.241 0.638 0 CA-C-N 114.899 -1.046 . . . . 10.199999999999999 109.12 177.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 89.2 m -115.39 135.19 54.38 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 109.653 -0.499 . . . . 9.7799999999999994 109.653 175.492 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 69.2 p -117.17 130.87 56.89 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.56 -0.533 . . . . 10.279999999999999 109.56 169.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 16.1 m-90 -105.22 130.99 53.25 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 107.442 -1.318 . . . . 8.5800000000000001 107.442 174.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 45.2 t -123.69 130.33 52.48 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 107.517 -1.29 . . . . 12.15 107.517 175.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -176.11 -156.46 15.17 Favored Glycine 0 CA--C 1.51 -0.243 0 C-N-CA 119.816 -1.183 . . . . 12.75 114.462 -178.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -138.96 144.66 39.09 Favored 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 113.034 0.753 . . . . 20.0 113.034 176.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 9.5 t80 -89.93 128.38 36.21 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 114.257 -1.338 . . . . 20.309999999999999 108.167 174.412 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 36.4 t -117.42 122.47 69.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 N-CA-C 106.355 -1.72 . . . . 24.219999999999999 106.355 175.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -83.67 -170.11 45.99 Favored Glycine 0 N--CA 1.465 0.627 0 C-N-CA 121.436 -0.411 . . . . 28.800000000000001 112.606 -177.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 105.34 -175.94 22.2 Favored Glycine 0 N--CA 1.464 0.567 0 O-C-N 122.986 -0.126 . . . . 32.109999999999999 113.063 178.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -60.82 -31.29 70.71 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 123.205 0.602 . . . . 36.859999999999999 112.231 -174.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -114.84 59.92 0.69 Allowed 'General case' 0 C--O 1.234 0.273 0 N-CA-C 108.917 -0.772 . . . . 37.350000000000001 108.917 174.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -57.11 142.41 42.53 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 115.456 -0.793 . . . . 26.300000000000001 110.807 -179.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ARG . . . . . 0.768 ' CG ' ' NH2' ' A' ' 103' ' ' ARG . 0.0 OUTLIER -146.25 148.0 32.01 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.619 -0.719 . . . . 27.309999999999999 110.887 -178.24 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 60.1 mt -115.3 110.55 32.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 N-CA-C 106.479 -1.675 . . . . 15.699999999999999 106.479 164.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -99.19 121.85 41.59 Favored 'General case' 0 CA--C 1.51 -0.586 0 N-CA-C 108.625 -0.88 . . . . 20.920000000000002 108.625 -177.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 15.0 p -130.75 156.78 44.38 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 114.439 1.274 . . . . 11.93 114.439 -174.233 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -117.15 147.44 42.44 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 105.676 -1.972 . . . . 11.16 105.676 161.013 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 38.8 p-90 -132.88 156.16 47.7 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 113.066 0.765 . . . . 11.140000000000001 113.066 -176.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 83.3 mt -124.46 122.54 37.91 Favored 'General case' 0 C--O 1.241 0.629 0 N-CA-C 108.22 -1.03 . . . . 10.449999999999999 108.22 174.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.6 tt -110.19 114.21 27.5 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 107.677 -1.231 . . . . 12.1 107.677 176.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 42.6 m -105.78 128.26 53.61 Favored 'General case' 0 C--O 1.241 0.627 0 N-CA-C 109.563 -0.532 . . . . 10.74 109.563 176.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.27 147.77 23.44 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 115.587 -0.733 . . . . 14.109999999999999 109.412 173.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -67.52 127.89 26.6 Favored Glycine 0 N--CA 1.462 0.429 0 N-CA-C 108.778 -1.729 . . . . 18.640000000000001 108.778 170.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 29.0 p -136.61 167.25 21.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 117.34 0.57 . . . . 19.309999999999999 111.641 -179.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 81.8 p -67.52 162.27 23.68 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.164 -1.05 . . . . 24.91 108.164 166.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 59.1 mt-10 -63.4 -36.03 82.36 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.669 -0.493 . . . . 30.199999999999999 109.669 -179.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -62.37 -30.02 70.89 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.461 0.541 . . . . 26.260000000000002 112.461 179.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 -102.09 8.0 40.92 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 113.971 1.1 . . . . 23.899999999999999 113.971 -177.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -60.46 -30.88 69.94 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 113.124 0.787 . . . . 16.98 113.124 -175.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 58.8 p-90 -61.99 -26.77 68.42 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.672 -0.24 . . . . 17.120000000000001 111.474 -179.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 49.9 pttt -110.76 32.51 5.18 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 113.011 0.745 . . . . 21.920000000000002 113.011 178.608 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 92.7 p -87.46 -18.12 30.61 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 114.325 1.232 . . . . 13.91 114.325 -174.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 33.4 m -127.07 119.16 25.89 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 113.492 0.923 . . . . 12.859999999999999 113.492 -163.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 82.4 mt -91.53 149.7 21.55 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.184 -0.916 . . . . 14.84 109.838 172.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 14.9 p -127.6 142.83 42.57 Favored 'Isoleucine or valine' 0 C--O 1.239 0.524 0 CA-C-N 115.511 -0.768 . . . . 10.529999999999999 108.991 173.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -161.69 -168.38 23.49 Favored Glycine 0 N--CA 1.451 -0.319 0 CA-C-N 115.652 -0.703 . . . . 10.18 111.425 175.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 16.4 p-80 -141.52 142.18 33.57 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.872 -0.331 . . . . 22.25 110.127 178.193 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 89.6 m-20 -126.75 139.31 53.22 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 124.137 0.975 . . . . 13.31 109.356 176.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 86.7 m -115.13 125.17 53.14 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 107.238 -1.393 . . . . 16.809999999999999 107.238 171.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -107.38 137.08 46.08 Favored 'General case' 0 C--O 1.24 0.593 0 O-C-N 123.7 0.625 . . . . 15.199999999999999 109.976 -179.166 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 67.6 p -129.12 165.96 20.23 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.646 -0.707 . . . . 20.68 109.548 174.28 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 32.6 mmmt -77.98 -18.93 55.4 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.479 0.548 . . . . 29.489999999999998 112.479 -179.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' VAL . . . . . 0.6 ' O ' ' CB ' ' A' ' 134' ' ' LYS . 4.0 m -110.43 142.98 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 N-CA-C 109.553 -0.536 . . . . 30.920000000000002 109.553 177.853 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' LYS . . . . . 0.6 ' CB ' ' O ' ' A' ' 133' ' ' VAL 0.93 17.9 tttm . . . . . 1 CA--C 1.37 -5.975 1 CA-C-O 129.057 4.265 . . . . 35.920000000000002 121.095 -177.483 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' A' A ' 400' ' ' 4IR . . . . . 0.83 ' O3 ' ' C25' ' A' ' 400' ' ' 4IR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 500' ' ' IR3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 601' ' ' IR3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 535' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 536' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 537' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 538' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 539' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 540' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 541' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 542' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 543' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 544' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 545' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 546' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 547' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 548' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 549' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 550' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 551' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 552' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 553' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 554' ' ' HOH . . . . . 0.443 ' O ' ' CG2' ' A' ' 40' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 555' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 556' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 557' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 558' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 559' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 560' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 561' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 562' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 563' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 564' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 565' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 566' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 567' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 568' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ASP . . . . . 0.593 ' HB2' ' O ' ' A' ' 521' ' ' HOH . 87.5 m-20 . . . . . 0 N--CA 1.492 1.633 0 N-CA-C 111.576 0.213 . . . . 40.07 111.576 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 70.6 tt0 -50.88 -45.57 60.06 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.187 -0.672 . . . . 38.829999999999998 109.187 174.078 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.64 -40.87 84.59 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 115.204 -0.907 . . . . 33.5 111.559 -178.372 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -69.64 -38.0 77.64 Favored Glycine 0 C--N 1.332 0.359 0 N-CA-C 114.481 0.552 . . . . 27.829999999999998 114.481 -178.013 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 96.6 mt -76.39 -42.11 36.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 N-CA-C 113.195 0.813 . . . . 20.710000000000001 113.195 -177.85 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 52.5 m -58.98 127.25 31.27 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.187 0.518 . . . . 18.600000000000001 111.625 -177.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 141.56 -161.25 27.0 Favored Glycine 0 C--N 1.329 0.171 0 CA-C-N 116.058 -0.519 . . . . 16.879999999999999 112.768 176.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 90.5 m -105.83 131.95 52.54 Favored 'General case' 0 C--O 1.242 0.661 0 N-CA-C 108.538 -0.912 . . . . 18.0 108.538 -174.676 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 78.7 m95 -125.57 152.82 44.58 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 114.977 -1.01 . . . . 14.550000000000001 111.191 179.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 40.6 m-85 -130.54 136.43 48.92 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.41 -0.589 . . . . 18.289999999999999 109.41 -177.779 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 39.4 p30 -100.06 -178.85 3.97 Favored 'General case' 0 C--O 1.24 0.591 0 C-N-CA 119.213 -0.995 . . . . 16.41 113.268 176.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 8.3 pm0 -68.37 -19.35 64.62 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 115.341 -0.845 . . . . 18.870000000000001 111.947 -174.764 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 98.3 mt -85.54 -9.88 56.76 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 122.905 0.482 . . . . 20.370000000000001 112.058 178.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 92.4 8.14 62.91 Favored Glycine 0 CA--C 1.519 0.322 0 CA-C-O 120.153 -0.248 . . . . 18.870000000000001 113.171 -177.056 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 69.6 m -73.44 155.19 39.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.917 0.359 . . . . 15.85 111.297 177.063 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.3 m -119.92 124.82 46.94 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.432 0.693 . . . . 19.280000000000001 110.313 -176.413 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -117.36 112.1 20.25 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 105.55 -2.018 . . . . 16.960000000000001 105.55 -176.104 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ILE . . . . . 0.588 HG23 ' O ' ' A' ' 536' ' ' HOH . 76.5 mt -109.89 121.26 62.5 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 N-CA-C 109.405 -0.591 . . . . 20.66 109.405 178.194 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.8 p -139.78 146.32 25.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 N-CA-C 113.811 1.041 . . . . 17.800000000000001 113.811 -170.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 98.6 m -117.43 126.22 52.28 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 108.321 -0.992 . . . . 20.25 108.321 169.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -97.54 119.82 36.8 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 109.03 -0.73 . . . . 20.75 109.03 177.127 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -80.39 157.99 41.14 Favored Glycine 0 CA--C 1.519 0.307 0 N-CA-C 112.047 -0.421 . . . . 22.420000000000002 112.047 178.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -60.12 -21.88 62.11 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 121.428 0.632 . . . . 27.289999999999999 110.743 -176.85 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ASP . . . . . 0.501 ' HA ' ' O ' ' A' ' 552' ' ' HOH . 35.1 p30 -93.58 -15.45 25.4 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.414 1.486 . . . . 30.940000000000001 113.377 -168.895 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 116.32 -1.37 20.67 Favored Glycine 0 C--O 1.221 -0.659 0 O-C-N 121.929 -0.482 . . . . 20.670000000000002 112.465 -176.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -71.09 141.43 50.83 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 112.595 0.591 . . . . 16.210000000000001 112.595 177.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 94.0 mt -121.47 131.38 54.13 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 109.125 -0.695 . . . . 13.869999999999999 109.125 166.056 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' THR . . . . . 0.67 HG22 ' O ' ' A' ' 554' ' ' HOH . 70.7 p -142.37 146.22 34.71 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.259 -1.015 . . . . 18.359999999999999 108.259 179.466 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 165.16 -152.44 21.95 Favored Glycine 0 CA--C 1.51 -0.267 0 C-N-CA 120.271 -0.966 . . . . 14.6 112.971 176.013 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 81.1 p -134.56 152.99 52.16 Favored 'General case' 0 C--O 1.248 0.999 0 CA-C-O 121.413 0.625 . . . . 15.970000000000001 110.307 -177.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -127.61 135.86 50.86 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 114.833 -1.076 . . . . 12.84 108.758 178.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 82.1 tt0 -124.9 112.36 16.54 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 107.381 -1.341 . . . . 24.699999999999999 107.381 175.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 47.6 t -85.94 133.41 33.94 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.316 0.487 . . . . 15.23 112.316 -179.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -76.12 -13.12 60.21 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.207 -0.452 . . . . 16.829999999999998 112.208 175.019 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 31.7 m -133.69 161.69 40.71 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 CA-C-O 121.096 0.474 . . . . 15.93 111.774 -175.499 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 85.7 -170.02 43.52 Favored Glycine 0 C--O 1.237 0.301 0 CA-C-N 115.539 -0.755 . . . . 16.609999999999999 113.48 172.981 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 47.7 t-20 -83.59 71.55 10.35 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 107.981 -1.118 . . . . 21.34 107.981 -175.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.14 141.08 27.16 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 114.76 -1.109 . . . . 16.43 111.202 -172.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 55.6 tt0 -144.77 131.73 20.31 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.24 -0.891 . . . . 29.25 109.468 175.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 7.5 t 67.8 -156.91 0.21 Allowed 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.424 -0.807 . . . . 21.109999999999999 111.353 177.092 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 21.9 mtt180 -92.98 145.18 24.56 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 112.751 0.648 . . . . 27.73 112.751 -173.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -124.9 143.58 50.78 Favored 'General case' 0 N--CA 1.461 0.115 0 C-N-CA 125.224 1.41 . . . . 13.619999999999999 109.014 176.519 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 74.0 t -66.39 139.2 21.57 Favored 'Isoleucine or valine' 0 C--O 1.238 0.47 0 N-CA-C 109.008 -0.738 . . . . 15.66 109.008 177.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.6 pp -128.63 148.93 50.83 Favored 'General case' 0 C--O 1.243 0.727 0 CA-C-O 121.894 0.854 . . . . 15.199999999999999 110.404 169.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 15.2 t -142.29 149.35 39.41 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 114.741 -1.118 . . . . 16.5 108.815 171.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -165.38 -164.02 19.92 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.732 -0.747 . . . . 10.82 111.968 179.145 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 29.8 mmm180 -142.59 152.14 42.24 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.93 -0.635 . . . . 17.010000000000002 109.435 -177.662 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 16.6 p90 -138.98 157.52 45.86 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 116.018 -0.537 . . . . 17.859999999999999 109.768 172.949 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -73.84 107.07 5.86 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 108.77 -0.826 . . . . 18.57 108.77 174.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 66.8 p -86.86 6.83 29.84 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 114.075 1.139 . . . . 25.879999999999999 114.075 -174.584 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -145.86 69.31 13.28 Favored Pre-proline 0 C--O 1.235 0.323 0 N-CA-C 108.631 -0.878 . . . . 30.690000000000001 108.631 173.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_endo -78.21 166.97 23.92 Favored 'Trans proline' 0 C--O 1.238 0.525 0 C-N-CA 122.602 2.201 . . . . 34.469999999999999 113.7 -174.074 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.93 140.07 58.34 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.003 -0.544 . . . . 35.68 111.514 -178.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 39.3 p -103.41 44.03 1.04 Allowed 'General case' 1 C--N 1.243 -4.028 0 O-C-N 124.682 1.239 . . . . 48.719999999999999 109.694 179.762 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 55.1 p-10 -123.48 25.59 8.19 Favored 'General case' 1 C--N 1.219 -5.088 0 CA-C-N 111.387 -2.642 . . . . 45.969999999999999 112.031 176.152 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 84.84 1.83 88.78 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 114.571 0.588 . . . . 42.020000000000003 114.571 -179.532 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 70.1 m -72.37 155.72 39.84 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 117.194 0.497 . . . . 34.670000000000002 111.062 179.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -70.58 169.56 47.42 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 121.345 -0.455 . . . . 24.899999999999999 111.964 173.282 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' THR . . . . . 0.536 ' OG1' ' OD2' ' A' ' 13' ' ' ASP . 86.1 m -103.97 112.04 24.85 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 123.433 0.693 . . . . 18.460000000000001 110.944 176.93 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.73 140.72 58.75 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 120.805 0.336 . . . . 14.93 111.506 -178.5 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -160.23 164.79 32.47 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 121.645 0.736 . . . . 16.940000000000001 110.984 178.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -159.4 158.77 29.88 Favored Glycine 0 C--O 1.221 -0.703 0 CA-C-N 115.112 -0.949 . . . . 10.6 111.459 175.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' TRP . . . . . . . . . . . . . 30.8 p90 -155.26 162.87 40.79 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 110.293 -0.262 . . . . 11.67 110.293 176.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 80.5 m -128.09 139.91 52.24 Favored 'General case' 0 C--O 1.236 0.383 0 O-C-N 124.335 1.022 . . . . 9.6699999999999999 110.466 -178.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 41.1 t -121.95 128.88 75.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 108.377 -0.971 . . . . 10.0 108.377 165.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -95.43 128.93 42.69 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 106.832 -1.544 . . . . 11.699999999999999 106.832 166.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 97.5 m95 -85.04 47.46 1.41 Allowed 'General case' 0 C--O 1.244 0.807 0 CA-C-O 122.126 0.965 . . . . 13.51 112.672 -167.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 59.8 tttm -121.56 126.86 50.15 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 114.307 -1.315 . . . . 26.109999999999999 108.161 172.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 53.8 p30 -142.36 -167.11 2.41 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.608 -0.886 . . . . 17.98 108.608 168.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -67.57 -15.12 63.49 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 114.083 1.142 . . . . 29.530000000000001 114.083 -178.166 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -97.06 -40.98 8.58 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 112.943 0.72 . . . . 29.370000000000001 112.943 -176.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 69.4 mtt180 -149.1 155.53 40.86 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.064 -0.516 . . . . 29.66 112.322 -170.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 54.0 t-20 -133.25 107.95 8.46 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.377 -0.828 . . . . 18.34 109.499 169.24 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -91.8 9.55 32.25 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.755 0.65 . . . . 14.85 112.755 -178.415 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 51.2 m-70 46.73 51.42 12.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.548 0.689 . . . . 15.25 112.346 175.709 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 15.6 p -157.65 164.1 37.55 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-N 114.84 -1.073 . . . . 12.99 110.755 -176.145 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -142.67 137.78 30.17 Favored 'General case' 0 C--O 1.241 0.638 0 CA-C-N 114.899 -1.046 . . . . 10.199999999999999 109.12 177.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 89.2 m -115.39 135.19 54.38 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 109.653 -0.499 . . . . 9.7799999999999994 109.653 175.492 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 69.2 p -117.17 130.87 56.89 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.56 -0.533 . . . . 10.279999999999999 109.56 169.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 16.1 m-90 -105.22 130.99 53.25 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 107.442 -1.318 . . . . 8.5800000000000001 107.442 174.245 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 45.2 t -123.69 130.33 52.48 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 107.517 -1.29 . . . . 12.15 107.517 175.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -176.11 -156.46 15.17 Favored Glycine 0 CA--C 1.51 -0.243 0 C-N-CA 119.816 -1.183 . . . . 12.75 114.462 -178.706 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -138.96 144.66 39.09 Favored 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 113.034 0.753 . . . . 20.0 113.034 176.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 9.5 t80 -89.93 128.38 36.21 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 114.257 -1.338 . . . . 20.309999999999999 108.167 174.412 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 36.4 t -117.42 122.47 69.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 N-CA-C 106.355 -1.72 . . . . 24.219999999999999 106.355 175.315 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -83.67 -170.11 45.99 Favored Glycine 0 N--CA 1.465 0.627 0 C-N-CA 121.436 -0.411 . . . . 28.800000000000001 112.606 -177.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 105.34 -175.94 22.2 Favored Glycine 0 N--CA 1.464 0.567 0 O-C-N 122.986 -0.126 . . . . 32.109999999999999 113.063 178.063 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -60.82 -31.29 70.71 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 123.205 0.602 . . . . 36.859999999999999 112.231 -174.791 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -114.84 59.92 0.69 Allowed 'General case' 0 C--O 1.234 0.273 0 N-CA-C 108.917 -0.772 . . . . 37.350000000000001 108.917 174.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -57.11 142.41 42.53 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 115.456 -0.793 . . . . 26.300000000000001 110.807 -179.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ARG . . . . . 0.961 HH21 ' HG3' ' A' ' 103' ' ' ARG . 0.0 OUTLIER -146.25 148.0 32.01 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.619 -0.719 . . . . 27.309999999999999 110.887 -178.24 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 60.1 mt -115.3 110.55 32.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 N-CA-C 106.479 -1.675 . . . . 15.699999999999999 106.479 164.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -99.19 121.85 41.59 Favored 'General case' 0 CA--C 1.51 -0.586 0 N-CA-C 108.625 -0.88 . . . . 20.920000000000002 108.625 -177.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 15.0 p -130.75 156.78 44.38 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 114.439 1.274 . . . . 11.93 114.439 -174.233 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -117.15 147.44 42.44 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 105.676 -1.972 . . . . 16.34 105.676 161.013 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 38.8 p-90 -132.88 156.16 47.7 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 113.066 0.765 . . . . 11.140000000000001 113.066 -176.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 83.3 mt -124.46 122.54 37.91 Favored 'General case' 0 C--O 1.241 0.629 0 N-CA-C 108.22 -1.03 . . . . 10.449999999999999 108.22 174.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.6 tt -110.19 114.21 27.5 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 107.677 -1.231 . . . . 12.1 107.677 176.461 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 42.6 m -105.78 128.26 53.61 Favored 'General case' 0 C--O 1.241 0.627 0 N-CA-C 109.563 -0.532 . . . . 10.74 109.563 176.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.27 147.77 23.44 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 115.587 -0.733 . . . . 14.109999999999999 109.412 173.016 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -67.52 127.89 26.6 Favored Glycine 0 N--CA 1.462 0.429 0 N-CA-C 108.778 -1.729 . . . . 18.640000000000001 108.778 170.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 29.0 p -136.61 167.25 21.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 117.34 0.57 . . . . 19.309999999999999 111.641 -179.798 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 81.8 p -67.52 162.27 23.68 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.164 -1.05 . . . . 24.91 108.164 166.243 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 59.1 mt-10 -63.4 -36.03 82.36 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.669 -0.493 . . . . 30.199999999999999 109.669 -179.017 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -62.37 -30.02 70.89 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.461 0.541 . . . . 26.260000000000002 112.461 179.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 -102.09 8.0 40.92 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 113.971 1.1 . . . . 23.899999999999999 113.971 -177.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -60.46 -30.88 69.94 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 113.124 0.787 . . . . 16.98 113.124 -175.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 58.8 p-90 -61.99 -26.77 68.42 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.672 -0.24 . . . . 17.120000000000001 111.474 -179.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 49.9 pttt -110.76 32.51 5.18 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 113.011 0.745 . . . . 21.920000000000002 113.011 178.608 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 92.7 p -87.46 -18.12 30.61 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 114.325 1.232 . . . . 13.91 114.325 -174.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 33.4 m -127.07 119.16 25.89 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 113.492 0.923 . . . . 12.859999999999999 113.492 -163.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 82.4 mt -91.53 149.7 21.55 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.184 -0.916 . . . . 14.84 109.838 172.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 14.9 p -127.6 142.83 42.57 Favored 'Isoleucine or valine' 0 C--O 1.239 0.524 0 CA-C-N 115.511 -0.768 . . . . 10.529999999999999 108.991 173.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -161.69 -168.38 23.49 Favored Glycine 0 N--CA 1.451 -0.319 0 CA-C-N 115.652 -0.703 . . . . 10.18 111.425 175.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 16.4 p-80 -141.52 142.18 33.57 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.872 -0.331 . . . . 22.25 110.127 178.193 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 89.6 m-20 -126.75 139.31 53.22 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 124.137 0.975 . . . . 13.31 109.356 176.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 86.7 m -115.13 125.17 53.14 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 107.238 -1.393 . . . . 16.809999999999999 107.238 171.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -107.38 137.08 46.08 Favored 'General case' 0 C--O 1.24 0.593 0 O-C-N 123.7 0.625 . . . . 15.199999999999999 109.976 -179.166 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' THR . . . . . 0.442 HG22 ' HG2' ' A' ' 103' ' ' ARG . 67.6 p -129.12 165.96 20.23 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.646 -0.707 . . . . 20.68 109.548 174.28 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 32.6 mmmt -77.98 -18.93 55.4 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.479 0.548 . . . . 29.489999999999998 112.479 -179.613 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' VAL . . . . . 0.6 ' O ' ' CB ' ' A' ' 134' ' ' LYS . 4.0 m -110.43 142.98 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 N-CA-C 109.553 -0.536 . . . . 30.920000000000002 109.553 177.853 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 134' ' ' LYS . . . . . 0.6 ' CB ' ' O ' ' A' ' 133' ' ' VAL 0.93 17.9 tttm . . . . . 1 CA--C 1.37 -5.975 1 CA-C-O 129.057 4.265 . . . . 35.920000000000002 121.095 -177.483 . . . . . . . . 4 2 . 1 . 001 ecloud build full ' A' A ' 400' ' ' 4IR . . . . . 0.83 ' O3 ' ' C25' ' A' ' 400' ' ' 4IR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 500' ' ' IR3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 601' ' ' IR3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 521' ' ' HOH . . . . . 0.593 ' O ' ' HB2' ' A' ' 13' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 535' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 536' ' ' HOH . . . . . 0.588 ' O ' HG23 ' A' ' 30' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 537' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 538' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 539' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 540' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 541' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 542' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 543' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 544' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 545' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 546' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 547' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 548' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 549' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 550' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 551' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 552' ' ' HOH . . . . . 0.501 ' O ' ' HA ' ' A' ' 36' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 553' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 554' ' ' HOH . . . . . 0.67 ' O ' HG22 ' A' ' 40' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 555' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 556' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 557' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 558' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 559' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 560' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 561' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 562' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 563' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 564' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 565' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 566' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 567' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 568' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.593 ' HB2' ' O ' ' A' ' 521' ' ' HOH . 87.5 m-20 . . . . . 0 N--CA 1.492 1.633 0 N-CA-C 111.576 0.213 . . . . 40.07 111.576 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 70.6 tt0 -50.88 -45.57 60.06 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.187 -0.672 . . . . 38.829999999999998 109.187 174.078 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.64 -40.87 84.59 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 115.204 -0.907 . . . . 33.5 111.559 -178.372 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -69.64 -38.0 77.64 Favored Glycine 0 C--N 1.332 0.359 0 N-CA-C 114.481 0.552 . . . . 27.829999999999998 114.481 -178.013 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 96.6 mt -76.39 -42.11 36.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 N-CA-C 113.195 0.813 . . . . 20.710000000000001 113.195 -177.85 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 52.5 m -58.98 127.25 31.27 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.187 0.518 . . . . 18.600000000000001 111.625 -177.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 141.56 -161.25 27.0 Favored Glycine 0 C--N 1.329 0.171 0 CA-C-N 116.058 -0.519 . . . . 16.879999999999999 112.768 176.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 90.5 m -105.83 131.95 52.54 Favored 'General case' 0 C--O 1.242 0.661 0 N-CA-C 108.538 -0.912 . . . . 18.0 108.538 -174.676 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 78.7 m95 -125.57 152.82 44.58 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 114.977 -1.01 . . . . 14.550000000000001 111.191 179.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 40.6 m-85 -130.54 136.43 48.92 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.41 -0.589 . . . . 18.289999999999999 109.41 -177.779 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 39.4 p30 -100.06 -178.85 3.97 Favored 'General case' 0 C--O 1.24 0.591 0 C-N-CA 119.213 -0.995 . . . . 16.41 113.268 176.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 8.3 pm0 -68.37 -19.35 64.62 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 115.341 -0.845 . . . . 18.870000000000001 111.947 -174.764 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 98.3 mt -85.54 -9.88 56.76 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 122.905 0.482 . . . . 20.370000000000001 112.058 178.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 92.4 8.14 62.91 Favored Glycine 0 CA--C 1.519 0.322 0 CA-C-O 120.153 -0.248 . . . . 18.870000000000001 113.171 -177.056 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 69.6 m -73.44 155.19 39.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.917 0.359 . . . . 15.85 111.297 177.063 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.3 m -119.92 124.82 46.94 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.432 0.693 . . . . 19.280000000000001 110.313 -176.413 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -117.36 112.1 20.25 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 105.55 -2.018 . . . . 16.960000000000001 105.55 -176.104 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.588 HG23 ' O ' ' A' ' 536' ' ' HOH . 76.5 mt -109.89 121.26 62.5 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 N-CA-C 109.405 -0.591 . . . . 20.66 109.405 178.194 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.8 p -139.78 146.32 25.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 N-CA-C 113.811 1.041 . . . . 17.800000000000001 113.811 -170.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 98.6 m -117.43 126.22 52.28 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 108.321 -0.992 . . . . 20.25 108.321 169.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -97.54 119.82 36.8 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 109.03 -0.73 . . . . 20.75 109.03 177.127 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -80.39 157.99 41.14 Favored Glycine 0 CA--C 1.519 0.307 0 N-CA-C 112.047 -0.421 . . . . 22.420000000000002 112.047 178.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -60.12 -21.88 62.11 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 121.428 0.632 . . . . 27.289999999999999 110.743 -176.85 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.501 ' HA ' ' O ' ' A' ' 552' ' ' HOH . 35.1 p30 -93.58 -15.45 25.4 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.414 1.486 . . . . 30.940000000000001 113.377 -168.895 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 116.32 -1.37 20.67 Favored Glycine 0 C--O 1.221 -0.659 0 O-C-N 121.929 -0.482 . . . . 20.670000000000002 112.465 -176.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -71.09 141.43 50.83 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 112.595 0.591 . . . . 16.210000000000001 112.595 177.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 94.0 mt -121.47 131.38 54.13 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 109.125 -0.695 . . . . 13.869999999999999 109.125 166.056 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' THR . . . . . 0.67 HG22 ' O ' ' A' ' 554' ' ' HOH . 70.7 p -142.37 146.22 34.71 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.259 -1.015 . . . . 18.359999999999999 108.259 179.466 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 165.16 -152.44 21.95 Favored Glycine 0 CA--C 1.51 -0.267 0 C-N-CA 120.271 -0.966 . . . . 14.6 112.971 176.013 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 81.1 p -134.56 152.99 52.16 Favored 'General case' 0 C--O 1.248 0.999 0 CA-C-O 121.413 0.625 . . . . 15.970000000000001 110.307 -177.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -127.61 135.86 50.86 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 114.833 -1.076 . . . . 12.84 108.758 178.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 82.1 tt0 -124.9 112.36 16.54 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 107.381 -1.341 . . . . 24.699999999999999 107.381 175.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 47.6 t -85.94 133.41 33.94 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.316 0.487 . . . . 15.23 112.316 -179.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -76.12 -13.12 60.21 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.207 -0.452 . . . . 16.829999999999998 112.208 175.019 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 31.7 m -133.69 161.69 40.71 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 CA-C-O 121.096 0.474 . . . . 15.93 111.774 -175.499 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 85.7 -170.02 43.52 Favored Glycine 0 C--O 1.237 0.301 0 CA-C-N 115.539 -0.755 . . . . 16.609999999999999 113.48 172.981 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 47.7 t-20 -83.59 71.55 10.35 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 107.981 -1.118 . . . . 21.34 107.981 -175.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.14 141.08 27.16 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 114.76 -1.109 . . . . 16.43 111.202 -172.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 55.6 tt0 -144.77 131.73 20.31 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.24 -0.891 . . . . 29.25 109.468 175.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 7.5 t 67.8 -156.91 0.21 Allowed 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.424 -0.807 . . . . 21.109999999999999 111.353 177.092 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 21.9 mtt180 -92.98 145.18 24.56 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 112.751 0.648 . . . . 27.73 112.751 -173.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -124.9 143.58 50.78 Favored 'General case' 0 N--CA 1.461 0.115 0 C-N-CA 125.224 1.41 . . . . 13.619999999999999 109.014 176.519 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 74.0 t -66.39 139.2 21.57 Favored 'Isoleucine or valine' 0 C--O 1.238 0.47 0 N-CA-C 109.008 -0.738 . . . . 15.66 109.008 177.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.6 pp -128.63 148.93 50.83 Favored 'General case' 0 C--O 1.243 0.727 0 CA-C-O 121.894 0.854 . . . . 15.199999999999999 110.404 169.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 15.2 t -142.29 149.35 39.41 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 114.741 -1.118 . . . . 16.5 108.815 171.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -165.38 -164.02 19.92 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.732 -0.747 . . . . 10.82 111.968 179.145 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 29.8 mmm180 -142.59 152.14 42.24 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.93 -0.635 . . . . 17.010000000000002 109.435 -177.662 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 16.6 p90 -138.98 157.52 45.86 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 116.018 -0.537 . . . . 17.859999999999999 109.768 172.949 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -73.84 107.07 5.86 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 108.77 -0.826 . . . . 18.57 108.77 174.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 66.8 p -86.86 6.83 29.84 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 114.075 1.139 . . . . 25.879999999999999 114.075 -174.584 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -145.86 69.31 13.28 Favored Pre-proline 0 C--O 1.235 0.323 0 N-CA-C 108.631 -0.878 . . . . 30.690000000000001 108.631 173.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_endo -78.21 166.97 23.92 Favored 'Trans proline' 0 C--O 1.238 0.525 0 C-N-CA 122.602 2.201 . . . . 34.469999999999999 113.7 -174.074 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.93 140.07 58.34 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.003 -0.544 . . . . 35.68 111.514 -178.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 39.3 p -103.41 44.03 1.04 Allowed 'General case' 1 C--N 1.243 -4.028 0 O-C-N 124.682 1.239 . . . . 48.719999999999999 109.694 179.762 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 55.1 p-10 -123.48 25.59 8.19 Favored 'General case' 1 C--N 1.219 -5.088 0 CA-C-N 111.387 -2.642 . . . . 45.969999999999999 112.031 176.152 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 84.84 1.83 88.78 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 114.571 0.588 . . . . 42.020000000000003 114.571 -179.532 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 70.1 m -72.37 155.72 39.84 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 117.194 0.497 . . . . 34.670000000000002 111.062 179.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -70.58 169.56 47.42 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 121.345 -0.455 . . . . 24.899999999999999 111.964 173.282 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' THR . . . . . 0.536 ' OG1' ' OD2' ' A' ' 13' ' ' ASP . 86.1 m -103.97 112.04 24.85 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 123.433 0.693 . . . . 18.460000000000001 110.944 176.93 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.73 140.72 58.75 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 120.805 0.336 . . . . 14.93 111.506 -178.5 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -160.23 164.79 32.47 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 121.645 0.736 . . . . 16.940000000000001 110.984 178.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -159.4 158.77 29.88 Favored Glycine 0 C--O 1.221 -0.703 0 CA-C-N 115.112 -0.949 . . . . 10.6 111.459 175.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' TRP . . . . . . . . . . . . . 30.8 p90 -155.26 162.87 40.79 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 110.293 -0.262 . . . . 11.67 110.293 176.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 80.5 m -128.09 139.91 52.24 Favored 'General case' 0 C--O 1.236 0.383 0 O-C-N 124.335 1.022 . . . . 9.6699999999999999 110.466 -178.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 41.1 t -121.95 128.88 75.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 108.377 -0.971 . . . . 10.0 108.377 165.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -95.43 128.93 42.69 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 106.832 -1.544 . . . . 11.699999999999999 106.832 166.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 97.5 m95 -85.04 47.46 1.41 Allowed 'General case' 0 C--O 1.244 0.807 0 CA-C-O 122.126 0.965 . . . . 13.51 112.672 -167.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 59.8 tttm -121.56 126.86 50.15 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 114.307 -1.315 . . . . 26.109999999999999 108.161 172.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 53.8 p30 -142.36 -167.11 2.41 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.608 -0.886 . . . . 17.98 108.608 168.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -67.57 -15.12 63.49 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 114.083 1.142 . . . . 29.530000000000001 114.083 -178.166 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -97.06 -40.98 8.58 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 112.943 0.72 . . . . 29.370000000000001 112.943 -176.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 69.4 mtt180 -149.1 155.53 40.86 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.064 -0.516 . . . . 29.66 112.322 -170.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 54.0 t-20 -133.25 107.95 8.46 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.377 -0.828 . . . . 18.34 109.499 169.24 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -91.8 9.55 32.25 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.755 0.65 . . . . 14.85 112.755 -178.415 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 51.2 m-70 46.73 51.42 12.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.548 0.689 . . . . 15.25 112.346 175.709 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 15.6 p -157.65 164.1 37.55 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-N 114.84 -1.073 . . . . 12.99 110.755 -176.145 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -142.67 137.78 30.17 Favored 'General case' 0 C--O 1.241 0.638 0 CA-C-N 114.899 -1.046 . . . . 10.199999999999999 109.12 177.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 89.2 m -115.39 135.19 54.38 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 109.653 -0.499 . . . . 9.7799999999999994 109.653 175.492 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 69.2 p -117.17 130.87 56.89 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.56 -0.533 . . . . 10.279999999999999 109.56 169.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 16.1 m-90 -105.22 130.99 53.25 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 107.442 -1.318 . . . . 8.5800000000000001 107.442 174.245 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 45.2 t -123.69 130.33 52.48 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 107.517 -1.29 . . . . 12.15 107.517 175.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -176.11 -156.46 15.17 Favored Glycine 0 CA--C 1.51 -0.243 0 C-N-CA 119.816 -1.183 . . . . 12.75 114.462 -178.706 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -138.96 144.66 39.09 Favored 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 113.034 0.753 . . . . 20.0 113.034 176.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 9.5 t80 -89.93 128.38 36.21 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 114.257 -1.338 . . . . 20.309999999999999 108.167 174.412 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 36.4 t -117.42 122.47 69.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 N-CA-C 106.355 -1.72 . . . . 24.219999999999999 106.355 175.315 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -83.67 -170.11 45.99 Favored Glycine 0 N--CA 1.465 0.627 0 C-N-CA 121.436 -0.411 . . . . 28.800000000000001 112.606 -177.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 105.34 -175.94 22.2 Favored Glycine 0 N--CA 1.464 0.567 0 O-C-N 122.986 -0.126 . . . . 32.109999999999999 113.063 178.063 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -60.82 -31.29 70.71 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 123.205 0.602 . . . . 36.859999999999999 112.231 -174.791 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -114.84 59.92 0.69 Allowed 'General case' 0 C--O 1.234 0.273 0 N-CA-C 108.917 -0.772 . . . . 37.350000000000001 108.917 174.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -57.11 142.41 42.53 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 115.456 -0.793 . . . . 26.300000000000001 110.807 -179.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ARG . . . . . 0.961 HH21 ' HG3' ' A' ' 103' ' ' ARG . 0.0 OUTLIER -146.25 148.0 32.01 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.619 -0.719 . . . . 27.309999999999999 110.887 -178.24 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 60.1 mt -115.3 110.55 32.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 N-CA-C 106.479 -1.675 . . . . 15.699999999999999 106.479 164.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -99.19 121.85 41.59 Favored 'General case' 0 CA--C 1.51 -0.586 0 N-CA-C 108.625 -0.88 . . . . 20.920000000000002 108.625 -177.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 15.0 p -130.75 156.78 44.38 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 114.439 1.274 . . . . 11.93 114.439 -174.233 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -117.15 147.44 42.44 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 105.676 -1.972 . . . . 16.34 105.676 161.013 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 38.8 p-90 -132.88 156.16 47.7 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 113.066 0.765 . . . . 11.140000000000001 113.066 -176.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 83.3 mt -124.46 122.54 37.91 Favored 'General case' 0 C--O 1.241 0.629 0 N-CA-C 108.22 -1.03 . . . . 10.449999999999999 108.22 174.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.6 tt -110.19 114.21 27.5 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 107.677 -1.231 . . . . 12.1 107.677 176.461 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 42.6 m -105.78 128.26 53.61 Favored 'General case' 0 C--O 1.241 0.627 0 N-CA-C 109.563 -0.532 . . . . 10.74 109.563 176.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.27 147.77 23.44 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 115.587 -0.733 . . . . 14.109999999999999 109.412 173.016 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -67.52 127.89 26.6 Favored Glycine 0 N--CA 1.462 0.429 0 N-CA-C 108.778 -1.729 . . . . 18.640000000000001 108.778 170.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 29.0 p -136.61 167.25 21.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 117.34 0.57 . . . . 19.309999999999999 111.641 -179.798 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 81.8 p -67.52 162.27 23.68 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.164 -1.05 . . . . 24.91 108.164 166.243 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 59.1 mt-10 -63.4 -36.03 82.36 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.669 -0.493 . . . . 30.199999999999999 109.669 -179.017 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -62.37 -30.02 70.89 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.461 0.541 . . . . 26.260000000000002 112.461 179.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 -102.09 8.0 40.92 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 113.971 1.1 . . . . 23.899999999999999 113.971 -177.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -60.46 -30.88 69.94 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 113.124 0.787 . . . . 16.98 113.124 -175.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 58.8 p-90 -61.99 -26.77 68.42 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.672 -0.24 . . . . 17.120000000000001 111.474 -179.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 49.9 pttt -110.76 32.51 5.18 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 113.011 0.745 . . . . 21.920000000000002 113.011 178.608 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 92.7 p -87.46 -18.12 30.61 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 114.325 1.232 . . . . 13.91 114.325 -174.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 33.4 m -127.07 119.16 25.89 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 113.492 0.923 . . . . 12.859999999999999 113.492 -163.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 82.4 mt -91.53 149.7 21.55 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.184 -0.916 . . . . 14.84 109.838 172.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 14.9 p -127.6 142.83 42.57 Favored 'Isoleucine or valine' 0 C--O 1.239 0.524 0 CA-C-N 115.511 -0.768 . . . . 10.529999999999999 108.991 173.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -161.69 -168.38 23.49 Favored Glycine 0 N--CA 1.451 -0.319 0 CA-C-N 115.652 -0.703 . . . . 10.18 111.425 175.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 16.4 p-80 -141.52 142.18 33.57 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.872 -0.331 . . . . 22.25 110.127 178.193 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 89.6 m-20 -126.75 139.31 53.22 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 124.137 0.975 . . . . 13.31 109.356 176.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 86.7 m -115.13 125.17 53.14 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 107.238 -1.393 . . . . 16.809999999999999 107.238 171.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -107.38 137.08 46.08 Favored 'General case' 0 C--O 1.24 0.593 0 O-C-N 123.7 0.625 . . . . 15.199999999999999 109.976 -179.166 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' THR . . . . . 0.442 HG22 ' HG2' ' A' ' 103' ' ' ARG . 67.6 p -129.12 165.96 20.23 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.646 -0.707 . . . . 20.68 109.548 174.28 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 32.6 mmmt -77.98 -18.93 55.4 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.479 0.548 . . . . 29.489999999999998 112.479 -179.613 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' VAL . . . . . 0.6 ' O ' ' CB ' ' A' ' 134' ' ' LYS . 4.0 m -110.43 142.98 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 N-CA-C 109.553 -0.536 . . . . 30.920000000000002 109.553 177.853 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.6 ' CB ' ' O ' ' A' ' 133' ' ' VAL 0.93 17.9 tttm . . . . . 1 CA--C 1.37 -5.975 1 CA-C-O 129.057 4.265 . . . . 35.920000000000002 121.095 -177.483 . . . . . . . . 4 2 . 1 . 001 ecloud nobuild full ' A' A ' 400' ' ' 4IR . . . . . 0.83 ' O3 ' ' C25' ' A' ' 400' ' ' 4IR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 500' ' ' IR3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 601' ' ' IR3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 521' ' ' HOH . . . . . 0.593 ' O ' ' HB2' ' A' ' 13' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 535' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 536' ' ' HOH . . . . . 0.588 ' O ' HG23 ' A' ' 30' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 537' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 538' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 539' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 540' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 541' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 542' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 543' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 544' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 545' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 546' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 547' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 548' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 549' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 550' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 551' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 552' ' ' HOH . . . . . 0.501 ' O ' ' HA ' ' A' ' 36' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 553' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 554' ' ' HOH . . . . . 0.67 ' O ' HG22 ' A' ' 40' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 555' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 556' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 557' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 558' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 559' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 560' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 561' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 562' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 563' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 564' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 565' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 566' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 567' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 568' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_