Author: bugman Date: Thu Jun 28 12:15:51 2012 New Revision: 17089 URL: http://svn.gna.org/viewcvs/relax?rev=17089&view=rev Log: Reverted the CaM synthetic randomised data change of r17071, as the data randomisation shouldn't change. The commands used were: svn merge -r17071:r17070 synth_rdc_rand svn merge -r17071:r17070 synth_pcs_rand Modified: branches/interatomic/test_suite/shared_data/align_data/CaM/synth_pcs_rand branches/interatomic/test_suite/shared_data/align_data/CaM/synth_rdc_rand Modified: branches/interatomic/test_suite/shared_data/align_data/CaM/synth_pcs_rand URL: http://svn.gna.org/viewcvs/relax/branches/interatomic/test_suite/shared_data/align_data/CaM/synth_pcs_rand?rev=17089&r1=17088&r2=17089&view=diff ============================================================================== --- branches/interatomic/test_suite/shared_data/align_data/CaM/synth_pcs_rand (original) +++ branches/interatomic/test_suite/shared_data/align_data/CaM/synth_pcs_rand Thu Jun 28 12:15:51 2012 @@ -1,59 +1,59 @@ -bax_C_1J7P_N_H_Ca_mol1 82 GLU 1 N 1.00236867240 -bax_C_1J7P_N_H_Ca_mol1 83 GLU 15 N 0.80281315989 -bax_C_1J7P_N_H_Ca_mol1 83 GLU 24 H 0.75880140074 -bax_C_1J7P_N_H_Ca_mol1 84 GLU 30 N 0.73233784643 -bax_C_1J7P_N_H_Ca_mol1 84 GLU 39 H 0.74343689467 -bax_C_1J7P_N_H_Ca_mol1 85 ILE 45 N 1.69239981929 -bax_C_1J7P_N_H_Ca_mol1 85 ILE 53 H 1.79465945999 -bax_C_1J7P_N_H_Ca_mol1 86 ARG 75 H 1.77928776709 -bax_C_1J7P_N_H_Ca_mol1 111 ASN 458 N -1.22364746324 -bax_C_1J7P_N_H_Ca_mol1 112 LEU 472 N -0.66551448188 -bax_C_1J7P_N_H_Ca_mol1 112 LEU 480 H -0.78900502958 -bax_C_1J7P_N_H_Ca_mol1 113 GLY 491 N -0.30378707960 -bax_C_1J7P_N_H_Ca_mol1 113 GLY 495 H -0.51120186070 -bax_C_1J7P_N_H_Ca_mol1 114 GLU 498 N -0.18276729590 -bax_C_1J7P_N_H_Ca_mol1 114 GLU 507 H -0.39947401452 -bax_C_1J7P_N_H_Ca_mol1 115 LYS 513 N -0.73577002066 -bax_C_1J7P_N_H_Ca_mol1 115 LYS 522 H -0.57597301133 -bax_C_1J7P_N_H_Ca_mol1 116 LEU 535 N -1.13998676753 -bax_C_1J7P_N_H_Ca_mol1 116 LEU 543 H -1.28114382341 -bax_C_1J7P_N_H_Ca_mol1 117 THR 554 N -1.49872816869 -bax_C_1J7P_N_H_Ca_mol1 117 THR 561 H -1.27222513878 -bax_C_1J7P_N_H_Ca_mol1 118 ASP 568 N -2.03320763053 -bax_C_1J7P_N_H_Ca_mol1 118 ASP 576 H -1.84064553331 -bax_C_1J7P_N_H_Ca_mol1 119 GLU 580 N -1.81792858933 -bax_C_1J7P_N_H_Ca_mol1 119 GLU 589 H -1.67463704543 -bax_C_1J7P_N_H_Ca_mol1 120 GLU 595 N -1.24483918897 -bax_C_1J7P_N_H_Ca_mol1 120 GLU 604 H -1.22305353375 -bax_C_1J7P_N_H_Ca_mol1 121 VAL 610 N -1.65072635255 -bax_C_1J7P_N_H_Ca_mol1 121 VAL 617 H -1.91221393099 -bax_C_1J7P_N_H_Ca_mol1 122 ASP 626 N -1.85899702037 -bax_C_1J7P_N_H_Ca_mol1 122 ASP 634 H -2.00584847521 -bax_C_1J7P_N_H_Ca_mol1 123 GLU 638 N -0.87072488316 -bax_C_1J7P_N_H_Ca_mol1 123 GLU 647 H -0.85180398701 -bax_C_1J7P_N_H_Ca_mol1 124 MET 653 N -0.06712531061 -bax_C_1J7P_N_H_Ca_mol1 124 MET 661 H -0.41495291790 -bax_C_1J7P_N_H_Ca_mol1 126 ARG 689 N 0.08248267324 -bax_C_1J7P_N_H_Ca_mol1 126 ARG 700 H -0.37950139730 -bax_C_1J7P_N_H_Ca_mol1 127 GLU 713 N 0.71268342496 -bax_C_1J7P_N_H_Ca_mol1 127 GLU 722 H 0.47615496772 -bax_C_1J7P_N_H_Ca_mol1 128 ALA 728 N 1.83952049677 -bax_C_1J7P_N_H_Ca_mol1 128 ALA 733 H 1.48100430526 -bax_C_1J7P_N_H_Ca_mol1 130 ILE 750 N 2.01920849129 -bax_C_1J7P_N_H_Ca_mol1 130 ILE 758 H 2.64074252997 -bax_C_1J7P_N_H_Ca_mol1 131 ASP 769 N 1.42068355848 -bax_C_1J7P_N_H_Ca_mol1 131 ASP 777 H 1.84713969103 -bax_C_1J7P_N_H_Ca_mol1 132 GLY 781 N 0.81659804750 -bax_C_1J7P_N_H_Ca_mol1 132 GLY 785 H 0.81402488591 -bax_C_1J7P_N_H_Ca_mol1 143 GLN 939 N 3.19973161162 -bax_C_1J7P_N_H_Ca_mol1 143 GLN 948 H 3.64600659584 -bax_C_1J7P_N_H_Ca_mol1 144 MET 956 N 2.90550220837 -bax_C_1J7P_N_H_Ca_mol1 144 MET 964 H 3.49273743861 -bax_C_1J7P_N_H_Ca_mol1 145 MET 973 N 2.73274251436 -bax_C_1J7P_N_H_Ca_mol1 145 MET 981 H 3.47364254700 -bax_C_1J7P_N_H_Ca_mol1 146 THR 990 N 2.20650400269 -bax_C_1J7P_N_H_Ca_mol1 146 THR 997 H 2.62707995645 -bax_C_1J7P_N_H_Ca_mol1 147 ALA 1004 N 1.71689301649 -bax_C_1J7P_N_H_Ca_mol1 147 ALA 1009 H 1.71319878606 -bax_C_1J7P_N_H_Ca_mol1 148 LYS 1014 N 0.92527247998 -bax_C_1J7P_N_H_Ca_mol1 148 LYS 1022 H 1.10401564205 +bax_C_1J7P_N_H_Ca_mol1 82 GLU 1 N 0.90794432765 +bax_C_1J7P_N_H_Ca_mol1 83 GLU 15 N 0.67161503888 +bax_C_1J7P_N_H_Ca_mol1 83 GLU 24 H 0.54395613661 +bax_C_1J7P_N_H_Ca_mol1 84 GLU 30 N 0.82708948667 +bax_C_1J7P_N_H_Ca_mol1 84 GLU 39 H 0.89090369605 +bax_C_1J7P_N_H_Ca_mol1 85 ILE 45 N 1.92676349238 +bax_C_1J7P_N_H_Ca_mol1 85 ILE 53 H 1.74504547690 +bax_C_1J7P_N_H_Ca_mol1 86 ARG 75 H 1.84633848361 +bax_C_1J7P_N_H_Ca_mol1 111 ASN 458 N -0.91802699489 +bax_C_1J7P_N_H_Ca_mol1 112 LEU 472 N -0.69773318411 +bax_C_1J7P_N_H_Ca_mol1 112 LEU 480 H -0.67036508790 +bax_C_1J7P_N_H_Ca_mol1 113 GLY 491 N -0.23899020416 +bax_C_1J7P_N_H_Ca_mol1 113 GLY 495 H -0.68013203527 +bax_C_1J7P_N_H_Ca_mol1 114 GLU 498 N -0.41430390311 +bax_C_1J7P_N_H_Ca_mol1 114 GLU 507 H -0.38005141277 +bax_C_1J7P_N_H_Ca_mol1 115 LYS 513 N -0.53301931949 +bax_C_1J7P_N_H_Ca_mol1 115 LYS 522 H -0.72174462597 +bax_C_1J7P_N_H_Ca_mol1 116 LEU 535 N -1.30335472561 +bax_C_1J7P_N_H_Ca_mol1 116 LEU 543 H -1.24462648741 +bax_C_1J7P_N_H_Ca_mol1 117 THR 554 N -1.61067656020 +bax_C_1J7P_N_H_Ca_mol1 117 THR 561 H -1.05863664972 +bax_C_1J7P_N_H_Ca_mol1 118 ASP 568 N -2.05217060454 +bax_C_1J7P_N_H_Ca_mol1 118 ASP 576 H -2.12102627869 +bax_C_1J7P_N_H_Ca_mol1 119 GLU 580 N -1.64790336741 +bax_C_1J7P_N_H_Ca_mol1 119 GLU 589 H -1.59533685164 +bax_C_1J7P_N_H_Ca_mol1 120 GLU 595 N -1.22500563481 +bax_C_1J7P_N_H_Ca_mol1 120 GLU 604 H -1.30030635808 +bax_C_1J7P_N_H_Ca_mol1 121 VAL 610 N -1.49502693620 +bax_C_1J7P_N_H_Ca_mol1 121 VAL 617 H -1.92017378314 +bax_C_1J7P_N_H_Ca_mol1 122 ASP 626 N -1.98985085174 +bax_C_1J7P_N_H_Ca_mol1 122 ASP 634 H -2.18289023453 +bax_C_1J7P_N_H_Ca_mol1 123 GLU 638 N -1.02093189728 +bax_C_1J7P_N_H_Ca_mol1 123 GLU 647 H -1.11173540502 +bax_C_1J7P_N_H_Ca_mol1 124 MET 653 N -0.04407898699 +bax_C_1J7P_N_H_Ca_mol1 124 MET 661 H -0.49105648538 +bax_C_1J7P_N_H_Ca_mol1 126 ARG 689 N -0.12348982105 +bax_C_1J7P_N_H_Ca_mol1 126 ARG 700 H -0.26211153106 +bax_C_1J7P_N_H_Ca_mol1 127 GLU 713 N 0.73766649831 +bax_C_1J7P_N_H_Ca_mol1 127 GLU 722 H 0.47728539073 +bax_C_1J7P_N_H_Ca_mol1 128 ALA 728 N 1.61199300746 +bax_C_1J7P_N_H_Ca_mol1 128 ALA 733 H 1.49579775155 +bax_C_1J7P_N_H_Ca_mol1 130 ILE 750 N 1.86290472058 +bax_C_1J7P_N_H_Ca_mol1 130 ILE 758 H 2.54586444900 +bax_C_1J7P_N_H_Ca_mol1 131 ASP 769 N 1.40491557426 +bax_C_1J7P_N_H_Ca_mol1 131 ASP 777 H 1.98872629157 +bax_C_1J7P_N_H_Ca_mol1 132 GLY 781 N 0.59122371846 +bax_C_1J7P_N_H_Ca_mol1 132 GLY 785 H 1.13867016669 +bax_C_1J7P_N_H_Ca_mol1 143 GLN 939 N 3.37272671868 +bax_C_1J7P_N_H_Ca_mol1 143 GLN 948 H 3.67030800834 +bax_C_1J7P_N_H_Ca_mol1 144 MET 956 N 3.17053756434 +bax_C_1J7P_N_H_Ca_mol1 144 MET 964 H 3.67840711443 +bax_C_1J7P_N_H_Ca_mol1 145 MET 973 N 2.92400000331 +bax_C_1J7P_N_H_Ca_mol1 145 MET 981 H 3.43230222919 +bax_C_1J7P_N_H_Ca_mol1 146 THR 990 N 2.37935038198 +bax_C_1J7P_N_H_Ca_mol1 146 THR 997 H 2.43496988605 +bax_C_1J7P_N_H_Ca_mol1 147 ALA 1004 N 1.60514345360 +bax_C_1J7P_N_H_Ca_mol1 147 ALA 1009 H 1.62422398559 +bax_C_1J7P_N_H_Ca_mol1 148 LYS 1014 N 1.15301371414 +bax_C_1J7P_N_H_Ca_mol1 148 LYS 1022 H 1.26621894748 Modified: branches/interatomic/test_suite/shared_data/align_data/CaM/synth_rdc_rand URL: http://svn.gna.org/viewcvs/relax/branches/interatomic/test_suite/shared_data/align_data/CaM/synth_rdc_rand?rev=17089&r1=17088&r2=17089&view=diff ============================================================================== --- branches/interatomic/test_suite/shared_data/align_data/CaM/synth_rdc_rand (original) +++ branches/interatomic/test_suite/shared_data/align_data/CaM/synth_rdc_rand Thu Jun 28 12:15:51 2012 @@ -1,29 +1,29 @@ -':83@N' ':83@H' 5.55815492694 -':84@N' ':84@H' 12.88010914886 -':85@N' ':85@H' 7.31588462464 -':111@N' ':111@H' -2.80308752920 -':112@N' ':112@H' -1.51329284694 -':113@N' ':113@H' 11.94706207408 -':114@N' ':114@H' -8.35190976445 -':115@N' ':115@H' 2.62206767506 -':116@N' ':116@H' -5.53687124978 -':117@N' ':117@H' 11.81746424564 -':118@N' ':118@H' 3.61348019473 -':119@N' ':119@H' -4.46122849233 -':120@N' ':120@H' 2.19650075336 -':121@N' ':121@H' 6.89495799808 -':122@N' ':122@H' -5.76753339016 -':123@N' ':123@H' -2.72831776845 -':124@N' ':124@H' 3.71091818495 -':126@N' ':126@H' -5.84660139502 -':127@N' ':127@H' 0.62566636075 -':128@N' ':128@H' 5.33615736349 -':130@N' ':130@H' -9.08693366822 -':131@N' ':131@H' -3.58865951927 -':132@N' ':132@H' 2.61356139923 -':143@N' ':143@H' 4.47017999659 -':144@N' ':144@H' 7.52428822224 -':145@N' ':145@H' -1.76021766342 -':146@N' ':146@H' 3.42391681205 -':147@N' ':147@H' 5.53772288353 -':148@N' ':148@H' -3.57265486780 +:83@N :83@H 3.50041894608 +:84@N :84@H 15.05885228596 +:85@N :85@H 6.60052138912 +:111@N :111@H -3.42652425216 +:112@N :112@H -3.10233875314 +:113@N :113@H 9.94189222624 +:114@N :114@H -8.91932696050 +:115@N :115@H 2.37098524736 +:116@N :116@H -6.37585104623 +:117@N :117@H 13.95994434173 +:118@N :118@H 3.68281325404 +:119@N :119@H -5.26983616680 +:120@N :120@H 4.65264001333 +:121@N :121@H 7.50520868831 +:122@N :122@H -4.65128051324 +:123@N :123@H -1.72468012783 +:124@N :124@H 5.52289680809 +:126@N :126@H -2.52580362597 +:127@N :127@H 1.60602730741 +:128@N :128@H 2.98160534379 +:130@N :130@H -11.10811280331 +:131@N :131@H -1.13840203230 +:132@N :132@H 4.52587502438 +:143@N :143@H 4.39042119515 +:144@N :144@H 5.61796380031 +:145@N :145@H -2.93824952863 +:146@N :146@H 1.77384593911 +:147@N :147@H 7.98066753298 +:148@N :148@H -2.77632582621