###################### # Order parameters # ###################### save_order_parameter_list_1 _Order_parameter_list.Sf_category order_parameters _Order_parameter_list.Sf_framecode order_parameter_list_1 _Order_parameter_list.Entry_ID 26714 _Order_parameter_list.ID 1 _Order_parameter_list.Sample_condition_list_ID 1 _Order_parameter_list.Sample_condition_list_label $sample_conditions_1 _Order_parameter_list.Tau_e_val_units s _Order_parameter_list.Tau_f_val_units s _Order_parameter_list.Tau_s_val_units s _Order_parameter_list.Rex_field_strength . _Order_parameter_list.Rex_val_units . _Order_parameter_list.Details 'Bond_length_val: 1.02e-10.' _Order_parameter_list.Text_data_format . _Order_parameter_list.Text_data . loop_ _Order_parameter_experiment.Experiment_ID _Order_parameter_experiment.Experiment_name _Order_parameter_experiment.Sample_ID _Order_parameter_experiment.Sample_label _Order_parameter_experiment.Sample_state _Order_parameter_experiment.Entry_ID _Order_parameter_experiment.Order_parameter_list_ID 1 '600.133 MHz R1' 1 $sample_1 . 26714 1 2 '600.133 MHz R2' 1 $sample_1 . 26714 1 3 '600.133 MHz steady-state NOE' 1 $sample_1 . 26714 1 4 '750.46 MHz R1' 1 $sample_1 . 26714 1 5 '750.46 MHz R2' 1 $sample_1 . 26714 1 6 '750.46 MHz steady-state NOE' 1 $sample_1 . 26714 1 stop_ loop_ _Order_parameter_software.Software_ID _Order_parameter_software.Software_label _Order_parameter_software.Method_ID _Order_parameter_software.Method_label _Order_parameter_software.Entry_ID _Order_parameter_software.Order_parameter_list_ID 1 $relax . . 26714 1 stop_ loop_ _Order_param.ID _Order_param.Assembly_atom_ID _Order_param.Entity_assembly_ID _Order_param.Entity_ID _Order_param.Comp_index_ID _Order_param.Seq_ID _Order_param.Comp_ID _Order_param.Atom_ID _Order_param.Atom_type _Order_param.Atom_isotope_number _Order_param.Order_param_val _Order_param.Order_param_val_fit_err _Order_param.Tau_e_val _Order_param.Tau_e_val_fit_err _Order_param.Tau_f_val _Order_param.Tau_f_val_fit_err _Order_param.Tau_s_val _Order_param.Tau_s_val_fit_err _Order_param.Rex_val _Order_param.Rex_val_fit_err _Order_param.Model_free_sum_squared_errs _Order_param.Model_fit _Order_param.Sf2_val _Order_param.Sf2_val_fit_err _Order_param.Ss2_val _Order_param.Ss2_val_fit_err _Order_param.SH2_val _Order_param.SH2_val_fit_err _Order_param.SN2_val _Order_param.SN2_val_fit_err _Order_param.Resonance_ID _Order_param.Auth_entity_assembly_ID _Order_param.Auth_seq_ID _Order_param.Auth_comp_ID _Order_param.Auth_atom_ID _Order_param.Entry_ID _Order_param.Order_parameter_list_ID 1 . 1 1 3 3 GLN N N 15 0.495117054839 0.116464491592 . . . . 9.53078172235e-10 3.23185808388e-10 1.44325942283e-37 2.35360731578e-38 . 'S2f, S2, ts, Rex' 0.76185562099 0.0503036076019 0.64752734509 0.120170123688 . . . . . . . . . 26714 1 2 . 1 1 4 4 ARG N N 15 0.935526804967 0.0190265990494 . . . . . . . . . S2 . . . . . . . . . . . . . 26714 1 3 . 1 1 7 7 LYS N N 15 0.908140904102 0.0148231532269 . . . . . . 1.48750065405e-38 7.42843224429e-39 . 'S2, Rex' . . . . . . . . . . . . . 26714 1 4 . 1 1 10 10 VAL N N 15 0.846849564381 0.0277527486418 . . . . 2.49200991678e-09 1.52763673145e-09 . . . 'S2f, S2, ts' 0.919405092491 0.0129191449231 0.936715474223 0.0221387114604 . . . . . . . . . 26714 1 5 . 1 1 11 11 TYR N N 15 0.81997882273 0.0236615568483 . . . . 2.59285983367e-09 8.32886963573e-10 . . . 'S2f, S2, ts' 0.970375854909 0.0116061907388 0.876069815996 0.0176259494498 . . . . . . . . . 26714 1 6 . 1 1 12 12 SER N N 15 0.704583651227 0.0479860045356 6.65831825953e-09 1.86061283587e-09 . . . . 9.1056947919e-39 6.94240877251e-39 . 'S2, te, Rex' . . . . . . . . . . . . . 26714 1 7 . 1 1 14 14 HIS N N 15 . . . . . . . . 4.52354424042e-38 7.03053412537e-39 . Rex . . . . . . . . . . . . . 26714 1 8 . 1 1 17 17 GLU N N 15 0.704664155083 0.0250631879002 . . . . 2.19420173205e-09 5.87423311409e-10 . . . 'S2f, S2, ts' 0.885470785398 0.0164512719966 0.816448700908 0.0191177856743 . . . . . . . . . 26714 1 9 . 1 1 18 18 ASN N N 15 0.870486775785 0.033573981766 . . . . . . 5.22840579128e-38 1.99328976885e-38 . 'S2, Rex' . . . . . . . . . . . . . 26714 1 10 . 1 1 19 19 GLY N N 15 0.929157449705 0.0171765093009 . . . . . . . . . S2 . . . . . . . . . . . . . 26714 1 11 . 1 1 20 20 LYS N N 15 0.934437610144 0.00973457837193 . . . . . . 1.1768998103e-38 4.39823391343e-39 . 'S2, Rex' . . . . . . . . . . . . . 26714 1 12 . 1 1 21 21 SER N N 15 0.808456640358 0.00998601401938 . . . . . . 9.88788548609e-38 5.7132321543e-39 . 'S2, Rex' . . . . . . . . . . . . . 26714 1 13 . 1 1 22 22 ASN N N 15 0.939107278187 0.0145906491871 . . . . . . 2.91876645852e-38 7.30787679114e-39 . 'S2, Rex' . . . . . . . . . . . . . 26714 1 14 . 1 1 23 23 PHE N N 15 0.918031455511 0.0150296952405 . . . . . . . . . S2 . . . . . . . . . . . . . 26714 1 15 . 1 1 25 25 ASN N N 15 0.479242461488 0.0118037920588 . . . . 1.82895457821e-09 1.07720440864e-10 . . . 'S2f, S2, ts' 0.764562314215 0.00896591561188 0.656198203872 0.0116827536652 . . . . . . . . . 26714 1 16 . 1 1 26 26 CYS N N 15 0.794610364945 0.035007249979 . . . . 8.14285392884e-09 2.05704990609e-09 . . . 'S2f, S2, ts' 0.917752930356 0.0117145591705 0.908961450046 0.0310365899496 . . . . . . . . . 26714 1 17 . 1 1 27 27 TYR N N 15 0.734590778048 0.0442313815225 . . . . 5.76649353762e-09 1.72610945691e-09 . . . 'S2f, S2, ts' 0.965466411655 0.0153496116216 0.819964671558 0.0406174608595 . . . . . . . . . 26714 1 18 . 1 1 28 28 VAL N N 15 0.97254276722 0.0156107654815 . . . . . . 5.6834433192e-38 1.03604712528e-38 . 'S2, Rex' . . . . . . . . . . . . . 26714 1 19 . 1 1 29 29 SER N N 15 . . . . . . . . 1.09001091465e-38 6.45736380846e-39 . Rex . . . . . . . . . . . . . 26714 1 20 . 1 1 30 30 GLY N N 15 0.903324164173 0.0255559950663 . . . . . . . . . S2 . . . . . . . . . . . . . 26714 1 21 . 1 1 35 35 ASP N N 15 0.940879056432 0.0085135277781 . . . . . . . . . S2 . . . . . . . . . . . . . 26714 1 22 . 1 1 36 36 ILE N N 15 0.876853929436 0.0078295373463 . . . . . . 1.76802617839e-38 4.11373576519e-39 . 'S2, Rex' . . . . . . . . . . . . . 26714 1 23 . 1 1 40 40 LEU N N 15 0.884151744203 0.0130916346019 1.37417531479e-11 9.38007210675e-12 . . . . 1.06763928744e-38 5.97336359172e-39 . 'S2, te, Rex' . . . . . . . . . . . . . 26714 1 24 . 1 1 41 41 LEU N N 15 0.965316690334 0.011988591081 . . . . . . . . . S2 . . . . . . . . . . . . . 26714 1 25 . 1 1 43 43 ASN N N 15 0.582012048511 0.0666283395093 . . . . 1.66160528043e-09 2.6972919564e-10 3.25419610824e-38 1.42956176639e-38 . 'S2f, S2, ts, Rex' 0.796500439423 0.0311698469583 0.730112633738 0.0573951609173 . . . . . . . . . 26714 1 26 . 1 1 44 44 GLY N N 15 0.952108536768 0.0203788998077 . . . . . . . . . S2 . . . . . . . . . . . . . 26714 1 27 . 1 1 45 45 GLU N N 15 0.702449689839 0.0257587851914 . . . . 4.1785170202e-09 1.09198923271e-09 . . . 'S2f, S2, ts' 0.927427183357 0.0087475166671 0.785946186971 0.0250298380419 . . . . . . . . . 26714 1 28 . 1 1 46 46 ARG N N 15 0.787883180291 0.0373689743653 . . . . 2.02580294462e-09 1.37742564502e-09 . . . 'S2f, S2, ts' 0.881891306245 0.0190654660122 0.894273839303 0.0319170576728 . . . . . . . . . 26714 1 29 . 1 1 47 47 ILE N N 15 0.880617645445 0.0133343243034 . . . . . . 5.18985323341e-38 7.111242616e-39 . 'S2, Rex' . . . . . . . . . . . . . 26714 1 30 . 1 1 48 48 GLU N N 15 0.819400358556 0.0131929304328 . . . . . . 6.20591101139e-38 7.92237588479e-39 . 'S2, Rex' . . . . . . . . . . . . . 26714 1 31 . 1 1 49 49 LYS N N 15 0.664261666877 0.0168506708422 . . . . 1.23366146171e-09 1.59126198622e-10 . . . 'S2f, S2, ts' 0.804962120229 0.0125794535117 0.848036700767 0.0151782841202 . . . . . . . . . 26714 1 32 . 1 1 50 50 VAL N N 15 0.25343445156 0.00805060182845 . . 6.67230819145e-12 2.42689128017e-12 2.6155662468e-09 4.08005939072e-10 . . . 'S2f, tf, S2, ts' 0.495233410262 0.00915471079088 0.546641956633 0.0102954874727 . . . . . . . . . 26714 1 33 . 1 1 51 51 GLU N N 15 0.468832288648 0.0102146082193 . . . . 2.04150295461e-09 1.12953941474e-10 . . . 'S2f, S2, ts' 0.792191758991 0.0078375019258 0.622684078213 0.00964263596892 . . . . . . . . . 26714 1 34 . 1 1 52 52 HIS N N 15 . . . . . . . . 9.20965072799e-38 7.1854387902e-39 . Rex . . . . . . . . . . . . . 26714 1 35 . 1 1 53 53 SER N N 15 . . . . . . . . . . . . . . . . . . . . . . . . . 26714 1 36 . 1 1 61 61 TRP NE1 N 15 0.627126623812 0.0591811302658 . . . . 1.87913181668e-09 1.31890381441e-09 . . . 'S2f, S2, ts' 0.838129935679 0.0444069601741 0.779988321828 0.0566915004284 . . . . . . . . . 26714 1 37 . 1 1 65 65 LEU N N 15 . . . . . . . . 7.68074774466e-38 8.37776660897e-39 . Rex . . . . . . . . . . . . . 26714 1 38 . 1 1 66 66 LEU N N 15 0.592968838453 0.0799612455611 . . . . 1.501628567e-09 4.7641842391e-10 1.35625815888e-38 1.4904136269e-38 . 'S2f, S2, ts, Rex' 0.734676776007 0.0350191813095 0.799721432169 0.0784848179172 . . . . . . . . . 26714 1 39 . 1 1 67 67 TYR N N 15 0.981116842528 0.0123815744628 . . . . . . . . . S2 . . . . . . . . . . . . . 26714 1 40 . 1 1 68 68 TYR N N 15 0.940679719036 0.0153313278037 1.33132312483e-09 5.18867641075e-10 . . . . . . . 'S2, te' . . . . . . . . . . . . . 26714 1 41 . 1 1 69 69 THR N N 15 0.647553951098 0.0431998139401 . . . . 8.27509128231e-09 1.73503874484e-09 . . . 'S2f, S2, ts' 0.941476263281 0.0107783440547 0.750670516762 0.0446035214791 . . . . . . . . . 26714 1 42 . 1 1 70 70 GLU N N 15 0.859044429731 0.0242183297473 . . . . 2.54411363517e-09 1.63526866096e-09 . . . 'S2f, S2, ts' 0.940300141701 0.0112783716645 0.930848545416 0.019434040645 . . . . . . . . . 26714 1 43 . 1 1 72 72 THR N N 15 0.932341846708 0.0139006526033 . . . . . . . . . S2 . . . . . . . . . . . . . 26714 1 44 . 1 1 74 74 THR N N 15 0.809621966487 0.0244714208811 . . . . 2.03726015155e-09 1.11578665642e-09 . . . 'S2f, S2, ts' 0.896611270775 0.0127721701347 0.903257879281 0.0189286446027 . . . . . . . . . 26714 1 45 . 1 1 75 75 GLU N N 15 0.873278237327 0.0502747130374 . . . . . . . . . S2 . . . . . . . . . . . . . 26714 1 46 . 1 1 76 76 LYS N N 15 0.779884145405 0.0147779518117 1.35101685437e-11 6.55987981522e-12 . . . . . . . 'S2, te' . . . . . . . . . . . . . 26714 1 47 . 1 1 77 77 ASP N N 15 0.770148455066 0.0945595746347 . . . . 1.71636970336e-09 1.60248309747e-09 2.56891048764e-38 1.62935502318e-38 . 'S2f, S2, ts, Rex' 0.836216945772 0.056644220305 0.912607005847 0.078460661809 . . . . . . . . . 26714 1 48 . 1 1 78 78 GLU N N 15 0.834542757917 0.028410027437 . . . . 2.64451601641e-09 1.50768166798e-09 . . . 'S2f, S2, ts' 0.916238636413 0.0131714535981 0.916327575808 0.0236156927916 . . . . . . . . . 26714 1 49 . 1 1 79 79 TYR N N 15 0.728246182273 0.0337614331469 . . . . 3.59926111476e-09 1.54580921057e-09 . . . 'S2f, S2, ts' 0.893708199442 0.0126025395191 0.840624813318 0.0319722321032 . . . . . . . . . 26714 1 50 . 1 1 81 81 CYS N N 15 0.91310620044 0.0111984097267 . . . . . . 1.46331122855e-38 5.62063198776e-39 . 'S2, Rex' . . . . . . . . . . . . . 26714 1 51 . 1 1 82 82 ARG N N 15 0.947770087353 0.0103344667691 . . . . . . . . . S2 . . . . . . . . . . . . . 26714 1 52 . 1 1 83 83 VAL N N 15 0.930141007361 0.0102900085318 3.18257343339e-11 1.57833892348e-11 . . . . . . . 'S2, te' . . . . . . . . . . . . . 26714 1 53 . 1 1 84 84 ASN N N 15 0.944254440314 0.00963395794316 . . . . . . . . . S2 . . . . . . . . . . . . . 26714 1 54 . 1 1 85 85 HIS N N 15 0.598055585039 0.00982322616776 . . . . 1.32404646669e-09 1.18390845035e-10 . . . 'S2f, S2, ts' 0.722960263215 0.00628379501497 0.821232404422 0.010765431845 . . . . . . . . . 26714 1 55 . 1 1 87 87 THR N N 15 . . . . . . . . . . . . . . . . . . . . . . . . . 26714 1 56 . 1 1 88 88 LEU N N 15 0.984668348136 0.00803802711741 . . . . . . . . . S2 . . . . . . . . . . . . . 26714 1 57 . 1 1 93 93 ILE N N 15 0.86877806393 0.00713310317436 2.87497611183e-11 7.01720554359e-12 . . . . . . . 'S2, te' . . . . . . . . . . . . . 26714 1 58 . 1 1 94 94 VAL N N 15 0.851657644896 0.0301218024034 . . . . 2.5503416834e-09 1.57467511719e-09 . . . 'S2f, S2, ts' 0.921211577853 0.0145243982585 0.934476492755 0.0233786340933 . . . . . . . . . 26714 1 59 . 1 1 95 95 LYS N N 15 0.81271011017 0.108983222251 . . . . 2.62205061087e-09 2.35481288611e-09 3.02134180226e-38 1.70495819266e-38 . 'S2f, S2, ts, Rex' 0.881041526334 0.0478092307792 0.915000171447 0.0889074056236 . . . . . . . . . 26714 1 60 . 1 1 96 96 TRP N N 15 0.887287991974 0.0111333682049 1.47230389205e-11 9.07539594436e-12 . . . . 2.68444172966e-38 5.80370588734e-39 . 'S2, te, Rex' . . . . . . . . . . . . . 26714 1 61 . 1 1 96 96 TRP NE1 N 15 0.777895914302 0.0120236773349 . . . . . . 2.06895929497e-38 6.25418857942e-39 . 'S2, Rex' . . . . . . . . . . . . . 26714 1 62 . 1 1 97 97 ASP N N 15 0.854948583079 0.0145487253236 2.17498536004e-11 8.3904253649e-12 . . . . 2.48150454403e-38 7.55798947974e-39 . 'S2, te, Rex' . . . . . . . . . . . . . 26714 1 stop_ save_