save_theoretical_heteronucl_T1_relaxation_3_700R1
_Theoretical_heteronucl_T1_list.Sf_category theoretical_heteronucl_T1_relaxation
_Theoretical_heteronucl_T1_list.Sf_framecode theoretical_heteronucl_T1_relaxation_3_700R1
_Theoretical_heteronucl_T1_list.Entry_ID 50166
_Theoretical_heteronucl_T1_list.ID 2
_Theoretical_heteronucl_T1_list.Name 700R1
_Theoretical_heteronucl_T1_list.Sample_condition_list_ID 1
_Theoretical_heteronucl_T1_list.Sample_condition_list_label $sample_conditions_1_P2MIN_15N_labelled
_Theoretical_heteronucl_T1_list.Spectrometer_frequency_1H 700
_Theoretical_heteronucl_T1_list.T1_coherence_type NH
_Theoretical_heteronucl_T1_list.T1_val_units s-1
_Theoretical_heteronucl_T1_list.Details .
_Theoretical_heteronucl_T1_list.Text_data_format text
_Theoretical_heteronucl_T1_list.Text_data
;
# Parameter description: Either the R1 or R2 relaxation rate.
#
# mol_name res_num res_name spin_num spin_name value error
P2MIN 1 M 1 N None None
P2MIN 2 T 2 N None None
P2MIN 3 S 3 N 1.72379665690577 0.0678186919958034
P2MIN 4 E 4 N 1.75784518352748 0.0578055267082246
P2MIN 5 W 5 N 1.25542680598887 0.100598474620173
P2MIN 6 E 6 N 1.1797337829721 0.103820215615692
P2MIN 7 L 7 N 1.23636909430616 0.176525181338113
P2MIN 8 F 8 N 1.18078525517698 0.138261340488437
P2MIN 9 I 9 N 1.1680882158087 0.299131191358913
P2MIN 10 Y 10 N 1.15516761826175 0.166103978836533
P2MIN 11 K 11 N None None
P2MIN 12 L 12 N 1.12782467246852 0.110653933782394
P2MIN 13 K 13 N None None
P2MIN 14 A 14 N None None
P2MIN 15 D 15 N None None
P2MIN 16 K 16 N None None
P2MIN 17 W 17 N None None
P2MIN 18 C 18 N None None
P2MIN 19 I 19 N 1.14291514889226 0.132665131674771
P2MIN 20 G 20 N 1.20972984163743 0.313323006851242
P2MIN 21 E 21 N 1.24042433075712 0.0833613549698736
P2MIN 22 P 22 N None None
P2MIN 23 L 23 N 1.21675800590061 0.108763320840247
P2MIN 24 R 24 N 1.34791325061401 0.134790526701486
P2MIN 25 N 25 N 1.30035092764686 0.115265248227593
P2MIN 26 L 26 N 1.1004413213249 0.0737559022890364
P2MIN 27 F 27 N 1.04562611404412 0.131232532410849
P2MIN 28 M 28 N 1.10316755267494 0.112928607110865
P2MIN 29 P 29 N None None
P2MIN 30 E 30 N 1.19409133722951 0.0802097196126518
P2MIN 31 G 31 N 1.34956239709634 0.110446092499657
P2MIN 32 T 32 N 1.30625956121433 0.0855920278324925
P2MIN 33 R 33 N 1.21514767856843 0.10305429302381
P2MIN 34 I 34 N 1.22281852948973 0.105625049962571
P2MIN 35 A 35 N 1.2094819144032 0.198824275170229
P2MIN 36 A 36 N 1.080167957715 0.0943967599290602
P2MIN 37 V 37 N 1.16248076300361 0.220654938196654
P2MIN 38 F 38 N 1.0761283396421 0.164447929238815
P2MIN 39 R 39 N 1.11370486958634 0.143331711411953
P2MIN 40 D 40 N 1.27787959190181 0.174892619124726
P2MIN 41 N 41 N 1.07919220593459 0.213765794641998
P2MIN 42 Q 42 N 1.0380363747273 0.093658488003981
P2MIN 43 L 43 N 1.08003056818496 0.0911288408828822
P2MIN 44 L 44 N 1.23044941793552 0.248917879144203
P2MIN 45 H 45 N 1.34778406634906 0.116506125346471
P2MIN 46 P 46 N None None
P2MIN 47 S 47 N 1.44534257134564 0.155469224556886
P2MIN 48 G 48 N None None
P2MIN 49 S 49 N 1.34893755369419 0.133053959621276
P2MIN 50 T 50 N 1.43553266993591 0.0789453740879717
P2MIN 51 E 51 N 1.21707861769707 0.0938283910345766
P2MIN 52 L 52 N 1.16082503209617 0.26008746657273
P2MIN 53 C 53 N 1.10990552241022 0.123521827172222
P2MIN 54 E 54 N 1.12525897294745 0.115970146148777
P2MIN 55 G 55 N 1.21158214192857 0.123579792936634
P2MIN 56 D 56 N 1.16505224184426 0.0589232143260131
P2MIN 57 T 57 N 1.12694464500973 0.118129002028914
P2MIN 58 L 58 N 1.07365278309592 0.107147281676725
P2MIN 59 C 59 N 1.18765458902123 0.0984381129828202
P2MIN 60 V 60 N 1.16163658863446 0.125020203569216
P2MIN 61 M 61 N 1.20950800680486 0.159587710126797
P2MIN 62 A 62 N 1.19084592506596 0.141896811682065
P2MIN 63 Q 63 N 1.16952323440563 0.119634892715053
P2MIN 64 E 64 N 1.12981453911647 0.0800218664737225
P2MIN 65 R 65 N 1.17027938898689 0.0643127669397958
P2MIN 66 D 66 N 1.14345487058188 0.0640598466513143
P2MIN 67 L 67 N 1.22080810019912 0.0638914010916748
P2MIN 68 E 68 N 1.32553472051983 0.0770459639694194
P2MIN 69 S 69 N 1.21639740441734 0.0609810190125633
P2MIN 70 L 70 N 1.21372811461899 0.0799056822167699
P2MIN 71 S 71 N 1.32239757276982 0.0759632929536489
P2MIN 72 R 72 N 1.15197871765043 0.405139424958464
P2MIN 73 L 73 N 1.17739206465182 0.055839010381735
P2MIN 74 F 74 N 1.20847782690377 0.369993500803556
P2MIN 75 S 75 N None None
P2MIN 76 E 76 N None None
P2MIN 77 A 77 N 1.29624362463423 0.106475317867841
P2MIN 78 P 78 N None None
P2MIN 79 E 79 N None None
P2MIN 80 K 80 N 1.18093802455535 0.15260590836645
P2MIN 81 A 81 N 1.20593074324747 0.253791201413961
P2MIN 82 S 82 N 1.47362503105446 0.151580237123164
P2MIN 83 L 83 N None None
P2MIN 84 A 84 N 1.35675227721526 0.234538121252688
P2MIN 85 R 85 N 1.29156001381724 0.204082197393819
P2MIN 86 F 86 N 1.20132896342508 0.368292828149491
P2MIN 87 F 87 N 1.06869561862354 0.80125837704731
P2MIN 88 G 88 N None None
P2MIN 89 D 89 N 1.21192679467269 0.282447449755555
P2MIN 90 F 90 N 1.25658197970521 0.435875817375067
P2MIN 91 F 91 N 1.11014634093141 0.185567724756088
P2MIN 92 L 92 N 1.23935741207953 0.461740193320152
P2MIN 93 D 93 N 1.23763883273761 0.219662659187598
P2MIN 94 I 94 N 1.18955298095155 0.102327831457411
P2MIN 95 E 95 N 1.20746182478817 0.0538468881884052
P2MIN 96 A 96 N 1.08361656052711 0.0354565459098403
P2MIN 97 K 97 N 1.22343224686768 0.0613256994054382
P2MIN 98 L 98 N 1.21573272491633 0.079320371398718
P2MIN 99 Q 99 N 1.13834360997174 0.153177998068453
P2MIN 100 D 100 N 1.23722628137028 0.0450889840042717
P2MIN 101 V 101 N 1.14943089023054 0.0483453270973426
P2MIN 102 A 102 N 1.19853703892588 0.0855721069948399
P2MIN 103 L 103 N 1.16046235600358 0.0486831449904471
P2MIN 104 L 104 N 1.16135463492754 0.116115889080265
P2MIN 105 Y 105 N 1.14366239805555 0.0746508043974548
P2MIN 106 G 106 N 1.11157786867614 0.0685393655840966
P2MIN 107 L 107 N 1.16048977145964 0.0937239329336534
P2MIN 108 D 108 N 1.16521773853239 0.0513396644981346
P2MIN 109 L 109 N 1.04922364662923 0.0561462630327371
P2MIN 110 G 110 N 1.14917484592907 0.151081823332791
P2MIN 111 E 111 N 1.25367741639291 0.0350528607215173
P2MIN 112 L 112 N 1.01212652829014 0.0776033875939876
P2MIN 113 E 113 N 1.02066105874401 0.0681720856651831
P2MIN 114 A 114 N 1.40717856595038 0.20270800458558
P2MIN 115 D 115 N 1.21256823482418 0.0379572940911867
P2MIN 116 A 116 N 1.2252630613366 0.0282096097908948
P2MIN 117 K 117 N 1.16187353698074 0.0669290883672026
P2MIN 118 L 118 N 1.1917761249534 0.122789167406653
P2MIN 119 K 119 N 1.22774055761876 0.121856793388826
P2MIN 120 D 120 N 1.23345860252852 0.108197427866295
P2MIN 121 L 121 N 1.21881221565273 0.0540902253069944
P2MIN 122 V 122 N 1.18957713636479 0.0585661171854765
P2MIN 123 L 123 N 1.14990109704593 0.0432969643021532
P2MIN 124 E 124 N 1.23639130677021 0.0493250449018741
P2MIN 125 H 125 N 1.21378389782636 0.0646049351698835
P2MIN 126 L 126 N 1.10088354398298 0.0715399419050864
P2MIN 127 G 127 N 1.17880756149149 0.0447486843889136
P2MIN 128 E 128 N 1.20602682017685 0.0332511017372294
P2MIN 129 T 129 N 1.23171694203044 0.0320827720808247
P2MIN 130 P 130 N None None
P2MIN 131 V 131 N 1.15008009991194 0.0676368468196705
P2MIN 132 L 132 N 1.18037553861612 0.0821090332325644
P2MIN 133 G 133 N None None
P2MIN 134 D 134 N 1.26646216361148 0.100595162538697
P2MIN 135 Y 135 N 1.15449080942609 0.157849102060833
P2MIN 136 F 136 N 1.2457930482925 0.0788624845030073
P2MIN 137 E 137 N 1.1822520755802 0.0764584168233822
P2MIN 138 W 138 N 1.20642284895685 0.0835072608978827
P2MIN 139 H 139 N 1.50582750341684 0.177056017927335
P2MIN 140 G 140 N 1.29053403801839 0.0686247864669963
P2MIN 141 L 141 N 1.14563614143059 0.0690755142626868
P2MIN 142 Q 142 N 1.15845069678528 0.232593715023829
P2MIN 143 W 143 N 1.18757111956745 0.102042344286502
P2MIN 144 V 144 N 1.21440642569538 0.253938383036662
P2MIN 145 V 145 N 1.05417904086085 0.138371772019924
P2MIN 146 A 146 N 1.06952566176023 0.31606449143892
P2MIN 147 D 147 N 1.10909117316832 0.123875455377033
P2MIN 148 V 148 N 1.13812666606635 0.0560208493807698
P2MIN 149 V 149 N 1.12783699055443 0.058990925856134
P2MIN 150 D 150 N 1.35103749740099 0.0881807829914158
P2MIN 151 W 151 N 1.21147617918832 0.0982746961186928
P2MIN 152 K 152 N 1.19303706404967 0.0376770464787775
P2MIN 153 V 153 N 1.14236015434681 0.0520742498461331
P2MIN 154 T 154 N 1.24984310595531 0.095465960250492
P2MIN 155 K 155 N 1.09137089770167 0.0795624290097974
P2MIN 156 I 156 N 1.04771194543821 0.125291182839218
P2MIN 157 G 157 N None None
P2MIN 158 L 158 N None None
P2MIN 159 R 159 N 1.16599778554206 0.32231427680787
P2MIN 160 E 160 N 1.24112146778301 0.181951286169444
P2MIN 161 N 161 N 1.208077454095 0.38494896543922
P2MIN 162 L 162 N 1.27442182506769 0.164444243151462
P2MIN 163 Y 163 N 1.39299656462401 0.115532964373339
P2MIN 164 F 164 N 1.15732787265763 0.330571855169631
P2MIN 165 Q 165 N 1.3880936218666 0.0614197694310923
;
loop_
_Theoretical_heteronucl_T1_software.Software_ID
_Theoretical_heteronucl_T1_software.Software_label
_Theoretical_heteronucl_T1_software.Method_ID
_Theoretical_heteronucl_T1_software.Method_label
_Theoretical_heteronucl_T1_software.Entry_ID
_Theoretical_heteronucl_T1_software.Theoretical_heteronucl_T1_list_ID
7 $software_8_Relax . . 50166 2
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save_