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(~ ~  ee ,($        Pp\f~7_dna3___i686.get_pc_thunk.bx___i686.get_pc_thunk.axdyld_stub_binding_helper_connectres_mergestr_setframe_copymolecule_transformmol_alignframe_addresidue_addstrand_newmolecule_getresidue_NAB_matcpy_newtransform#1/28 1199171710 0 0 100644 5876 ` dna3_to_allatom.o|   __text__TEXTP |__data__DATAP__cstring__TEXT`__picsymbolstub2__TEXTn l__la_sym_ptr2__DATA0 H `__nl_symbol_ptr__DATAx  $__textcoal_nt__TEXT  @, P&USdEEEEEEEEEEED$Eȉ$TD$E$uUD$Eȉ$ED$Eĉ$mTD$E$=ueD$Eĉ$=ED$E؉$)TD$E$u(EĉD$EȉD$E $D$E؉$EiD$E$eoD$E$PtD$E$ EE $9Et,D$p $$EE;E~vD$ED$E $ID$E$UEȉD$$ED$ED$E؉$ D$E$UEȉD$$EED$E$ED$E$D$E$ D$E܉$tE܉D$ED$ED$ED$ ED$ED$$ED$ D$D$'l $='t*4D$ D$:wD$$~l D$E$D$Eԉ$ED$ D$D$'l $H='t*D$ D$;wD$$l D$E$=D$EЉ$.ED$ D$D$'l $='t*D$ D$<wD$$nl D$E$D$Ẻ$ẺD$EԉD$EЉD$EԉD$ EԉD$ED$$BED$E$WD$iD$ED$ ]D$iD$E$WD$oD$ED$ ]D$oD$E$VE$2E}Ed[]dna.amber94.rlbdnasenseantinresiduesdna3_to_allatom: the number of dna3 residues must be the same as the all atom residues 1:1:C1'|2:1:C1'1:1:C5|2:1:C52:1:C1'1:%d:CE( snprintf( NAB_rsbuf, 10000, "1:%d:CE", residuenumber ) ) < 10000dna3_to_allatom.c%s:%u: failed assertion `%s' 1:%d:MA( snprintf( NAB_rsbuf, 10000, "1:%d:MA", residuenumber ) ) < 100001:%d:SI( snprintf( NAB_rsbuf, 10000, "1:%d:SI", residuenumber ) ) < 10000firstlast⍀Pyt⍀P`[⍀PGB~⍀~P.)i⍀iPT⍀TP?⍀?P*⍀*P⍀P⍀P⍀Pz⍀Pfa⍀PMH⍀P4/⍀P⍀Pm⍀mPX⍀XP{*C\u $ $Ë$8-{ i { c u i u c m^Mx G? 5 #  x  x    |x j ]N=x 7/ % @ x   { uf ]H6' |  ve _P{ J;u 2-` q ` a yh` b  t  t    p  p    l ~l x s mh eh _ Z Td Ld F A ;` 3` - ( "\ \   X mX m  T TT T  P ;P ;  L "L "  H H   D D ~ y s@ k@ e ` Z< R< L G A8 98 3 . (4  4   0 s0 s D@<840,($          *  [flzB_dna3_to_allatom___i686.get_pc_thunk.bx___i686.get_pc_thunk.axdyld_stub_binding_helper_NAB_rsbuf___sF_freemolecule_mergestr_alignframe___eprintf_snprintf_setframe_wc_basepair_getres_substr_exit_fprintf_strlen_NAB_mri_addstrand_newmolecule_wc_complement_NAB_strcmp_NAB_strcpy #1/12 1199171710 0 0 100644 5948 ` dump.o| } s __text__TEXT/  __data__DATA/ __cstring__TEXT@ \ __bss__DATAs __picsymbolstub2__TEXT 4*__la_sym_ptr2__DATAK L__textcoal_nt__TEXTg  @d P US4E D$4 D$E$ C D$E$ E @D$E @D$E D$K D$E$ E @(D$E @ D$E @D$g D$E$x E @@D$E @8D$E @0D$ D$E$9 E @XD$E @PD$E @HD$ D$E$ E @`D$ D$E$ E @dE}u2ED$ED$ ED$ED$E$ E@Eƍ D$E$ 4[]ÐUS$E @D$0D$E$E xu =EaE xu CEME xu GE9E xu KE%E @D$ND$Eȉ$LEȉEED$UD$E$E x u =EME x u bE9E x u iE%E @ D$mD$Eȉ$EȉEED$tD$E$E @$D$D$E$E D$D$E$E @$D$D$E$E @%d:%d No external bonds ATM[%3d,%3d,%p,%p] %-4s %s %8.3f%8.3f%8.3f [ %2d] %8.3f_⍀PKF⍀P2-⍀Pk⍀kPV⍀VPA⍀AP,⍀,P & ? $Ë $Ë$) s s  }bS      wh`  E \}- \m^ \2# \ \ \r \bS \D5 \+ \ \ \ \ \ \~o \Z \F \2 \ \ \ \r \e \X \teI \X D5E '8 *  ~o _P @1 '      SD 4%  s whW 9*O $@  c 7 c 7  _  _  ~ y s[  k[  e ` ZW RW L G AS 9S 3 . 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Guttman transform majorization of coordinates -- this option not implemented in this version! Unable to successfully embed random metrization for %d pairs distance : %5d %5d %9.2f %9.2f %9.2f %9.2f chirality: %5d %9.2f %5d %5d %5d %5d %9.2f %9.2f tot bounds chi e4d gsq wmax db:%7d %-10.4g %-10.4g %-10.4g %-10.4g %-10.4g %-10.4g distance : %5d %5d %9.2f chirality: %5d %9.2f tot bounds chi gsq db:%7d %-10.4g %-10.4g %-10.4g %-10.4g bmatccompleted %5d calls to trifix average bounds gap = %8.3f rd_mmat: syntax: %s rrd_mmat: can't open metric mat file %s %d %s %s %d %s %s %lf%d %s %smk_mmat: %d neg COM dist: %8.3f com2[i] * com2[j] >= 0.wmk_mmat: can't write metric matrix file %s ptqtpcqcpminpmaxqminqmax%-12s %-12s %9.3f boundListqueueinQueuelowerBoundPathLengthupperBoundPathLengthBOUNDS VIOLATION ( inverting lb, ub ): %s - %s ( %f - %f ) ready to triangle smooth atom %5d T1err: %4d %4d %4d %7.2f %7.2f %7.2f %7.2f %7.2f %7.2f %7.2f %7.2f T2err: %4d %4d %4d (%7.2f %7.2f)(%7.2f %7.2f)(%7.2f %7.2f)(%7.2f %7.2f) dg_options: %s unknown option: %s fatal flex scanner internal error--no action foundfatal flex scanner internal error--end of buffer missedfatal error - scanner input buffer overflowflex scanner push-back overflowout of dynamic memory in dgo_create_buffer()out of dynamic memory in dgo_scan_buffer()out of dynamic memory in dgo_scan_bytes()bad buffer in dgo_scan_bytes()%s Mb`?MbP?ffffff??h㈵>Hz>:0yU>?@? ?@? {Gz?:0yU>???ffffff?ffffff-C6??@& .>?@& .>@        !"#"0.I ,.<>JLMNOSZX^adklipstz{xelG[NQC@.+;;< <? ?01 IxK IK"U#Yo $gU!Y%]aefhT]aefhkkkpqrrrpvvvwwwkkk{|~~~{|rrrrrrvvvwww~~~}PzPQyQ^u^`t`snmljidcb_\[ZXWVSRONMLJHGFEDCBA@>=:98765432/.-,+*)('&& &' '**  4646@D@DHLRSVHLRSVYYY_aaaa}_eeefffkkklmppp{ylmqqqrrrtuvvvzstuwwwz~~~njidcb\[ZXWONMJGFECBA>=:98753210/.-,+)(%$#"!  d⍀Pdd⍀Pdd⍀Pdd⍀Pd}dj⍀jPidddU⍀UPPdKd@⍀@P7d2d+⍀+Pdd⍀Pdd⍀Pcc⍀Pcc⍀Pcc⍀Pcc⍀Pcc⍀Pocjc⍀PVcQcn⍀nP=c8cY⍀YP$ccD⍀DP cc/⍀/Pbb⍀Pbb⍀Pbb⍀Pbb⍀Pbb⍀Pubpb⍀P\bWb⍀PCb>b⍀P*b%br⍀rPb b]⍀]PaaH⍀HPaa3⍀3Paa⍀Paa ⍀ Paa⍀P{ava⍀Pba]a⍀PIaDa⍀P0a+a⍀Paa⍀P``v⍀vP``a⍀aP``L⍀LP``7⍀7P``"⍀"P`|` ⍀ Ph`c`⍀PO`J`⍀P6`1`⍀P``⍀P`_⍀P__⍀P__z⍀zP__e⍀eP__P⍀PP__;⍀;Pn_i_&⍀&PU_P_⍀P<_7_⍀P#_'@Yr֛!:SlМ4Mfʝ.G`yĞݞ(AZsן ";TmѠ$Ë$lڃlԃ Ãlll lltln lhL I 4    ̡؂؂ԂL  G ? 0 L ȁ[ S` D L  L y q A '    L    Y x p Ya UL 8~2p~& ~ \~ ~ ~~~ ~~t~~L ~xl~~ ~ l~~tl~~ l~~l~~ l~~pl~~l~}~ l~n~ l~h~L U~ P~ F~ ~7~ ~/~ %~\~~ ~ ~L }|}p|}|}|}|}|}} }\|}x||} w} m}\|H}@}|1}|+}|}| }t|} ||||||p||||L |{|p{|{| |{s| {c| {]|t{U| {| { | {{ {{ {{t{{ {{p{{{{L _{`zY{zF{z-{z{`z{zzzz|zzzzzzL z`yzy}zydzyEz`y?zy3zy(z|yzyyyyyyyyyyL y vyvytvy vxytvpy vaytv[ytvCy v4y *y\vytvytvx vxtvx x vx vxvx xvpx xvw vw vwtvw vw vqwvkwvBwvmpj8mtj4mtj0mtj,mOtj(mGkj$mtj msjmysjm1sjmrjmrj mSrjm rjmqjmqjl9qjlpjlpjlcpjlpjlojlMojlnjlYnjlmjlemjlh;>P;i> Y>̡;O>;8>h;>h;>P;=h;=P;=h;=;=P;~=P;l=P;K=P;9=P;<P;<P;<P;<P;<;;;;P;;;;h;;$;;L ; k; : : :8: :8;: 989 9 9̡8989 ~9p8x9 l9 \9̡8R9[879 +9 9̡89[88 8L 8 8?e2<8e28e27$e2i7$e2L7e2A7 %7$e27$e26e26e25$e25$e25e25 5̡e25 e2[5 C5$e24e294 14He2"4$e24 4He23$e23 3e2a3$e2K3$e2>3 23 "3e23e2 3 2$e22$e22e22e22e22e2v2$e2p2$e2a2L &2 2&1 1&1 1$&X1$&B1p&1&0&N/ F/s&/P&/p&.P&.`&i.&[.`&B.&<. -`&-\&-p&+ +X&+P&+p&+P&_+ &4+&*+ &+&*&q* &G*@&/* *&)&)&,)@&) (&(@&(@&W(@&0(@&H'&.'@&'x&&@&&$&&p&&$&x&p&V&$&@&p&1&p&& &&L % % e}% u%e(%Pe$Pe$$e$He$ $$e4$$e$He#e#eJ" B"e!Pe!He!Pe!Pe!`e Pe e f `eT \em e@e@e@ePeHePey eNheD e*`e`e e^@eF +e`e`e:@e" e@e@e_@e8@eBXe(@ePe@e$eHe$eFPe<e&e$eHe$eHeHe}Heg eaL 6  @  H H L u kHT$> 4D $$ L$$ P$ Ty$s iXR$L @ 8Ӆ    ` H$| tR7H$ T B(T\TB(08"@TThTT(Tr j MTHHoTHLL$$0HmX9HH$  (Tm@RTX H H HC X$ L H H $ ( Hm $R (+ X  H $ 0 $ X X3 H L X X $ ( X $e (] T" H $  D L  D  @q Lf ` X ߄< / #  ؄X $  фT $ w g]̄PPH 3$- ! 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(3 3  // XTPLHD@<840,($      , " 8, ]wkcD_put_tmp___i686.get_pc_thunk.bx_fd_helix___i686.get_pc_thunk.axdyld_stub_binding_helper___sF_unlink_getpdb_prm_fclose_sin_cos_NAB_hnext_NAB_hfirst_sscanf_NAB_readstring_NAB_getline_fopen_printf_substr_strlen_wc_complement_NAB_strcat_exit_getenv_NAB_href_fprintf_NAB_strcpy_NAB_strcmp_NAB_rematch #1/20 1199171711 0 0 100644 17748 ` frameutil.oH (-d+ __text__TEXT/%d.Y__data__DATA@%`(__bss__DATA+__cstring__TEXT%)__literal8__TEXT'P +__const__DATA(0d+__picsymbolstub2__TEXT0(+9__la_sym_ptr2__DATA+ti.$?__nl_symbol_ptr__DATA|+.:__textcoal_nt__TEXT+. @@2PC P! @;US$E,D$ED$E $*E}t,D$ED$E $*E}t,D$ED$E $i*E}t`,D$ED$E $B*E}t9-D$E D$E $*E}tE D$E$)E$[]ÐUSD$ED$+$)D$ED$+$|)D$ED$+$_)D$ED$+$B)D$E D$ ,$%)E D$E$,)[]ÐUVSP?EE@dE}uDEUE;B|%MUЍAP$P[^]ÐUSTE D$E$#E$#EE$#EED$E$#E$#EE;EED$ ED$D$d%$#E}~DE}~-&UԉЉUЍ!эEЃˍEԃ봍&EqEEEUЉ$#EEu,D$d%$A#$#U$:#E܋E܅u,D$d%$"$"U$"E؋E؅u,( D$d%$"$"EE;E|UЍEE؋EEE;E|UЍEE؋E܉D$E$!UE܉D$E$L!E؉D$E$S!EEE;E|jUЍ U؍! 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(-f -f  )M)M         `" T  XSYipya:_getdist___i686.get_pc_thunk.bx___i686.get_pc_thunk.axdyld_stub_binding_helper___sF_fclose_sscanf_fgets_fprintf_sprintf_getenv_fopen_strcpy_strcmp_savename_n_drecs_filename_nhp_nabhome_drecs #1/20 1199171711 0 0 100644 6564 ` hashutil.o X  __text__TEXTs __data__DATAs O__cstring__TEXT \__literal8__TEXT __picsymbolstub2__TEXT *__la_sym_ptr2__DATA l__nl_symbol_ptr__DATA __textcoal_nt__TEXT  @ P UVS u$ u,s D$ $Y $4 $Z EEu, D$ $ $ E}~UЍEE׋EE E@E@E@ EEB [^]ÐUVSPE8uED$E$E $5 EE EE  UЍEEĉЋMęy UEEEEUЍAE}uDE D$E@$ E}~$}uEEEE܍EEE봃}4$$ E؋E؅u3E D$ D$ $i $D E$h EEu3E D$/ D$ $ $ E D$E$ EEE;B~ EEBE@U؋E}uE0UЍ VE؉ U܋E؉U؋EBU؋EBEEԋEԃ8  MԋЍ+[jyE@ E@ U؍ B E@ ~U؍ B U؍ BU؍ BFE@ :E@ .E@ "E@ E@ E@ E؃P[^]UE E @U}u EE xucEUE;B |CMUЍAEtU EU EBE@EEEE @EtU EBE@E_E EUE;B |@MUЍAEtU EU EBE@EEEEÐUH}u EE $EE EE  UЍEEԉЋMԙy UMUЍAE}u@E D$E@$\E}~ E }u EEEEEÐUVD}u`} uEUE;B |\MUЍAE}uEEE$EE݋MUЍAE뗋E@E $EE EE  UЍEEԉЋMԙy UEMUЍAE}uoE D$E@$ E}~O}u9}uuUЍ VE EUE$EEEE뉃D^]USDL} t$E 8tE D$D$E$}uD$E$oED$D$E$E@D$D$E$bE@D$D$E$CE@ D$D$E$$EUE;B |EMUЍAE}uEEE} }uED$ ED$D$E$EMUЍAE}u=E@D$ED$ ED$D$E$IEEEx EPЍ$Hl2I`E@ D$"D$E$hE@ D$(D$E$DE@ D$.D$E$ E@ D$5D$E$ZE@ EEx u ;EED$BD$E$JD$E$MD$E$PD$E$qSD$E$ZVD$E$CYD$E$,\D$E$t_D$E$]bD$E$HEEED[]NAB_hinit: can't alloc new hashed array NAB_hinit: can't alloc new he tab NAB_hinit: can't add %s to hash NAB_hinit: can't save %s in hash HD: %s htab == NULL HD: type %d HD: llen %d HD: #ent %d HD: size %d HD: htab[%3d] %3d entries HD: %p %p '%s' U %d I %d S %ld F %g(NULL) s '%s' P M f a r m b ? ⍀P⍀P⍀Pk⍀kP|wV⍀VPc^A⍀APJE,⍀,P1- F _ x $Ë$Q B  < -  %                  { l \ ? 0                H     x P A  uf VG 7(  x j b  D    h!d` \XTPLHD{@l<+0<{k a@ J<0   2'  r h XL@0 &      ~ y s k e ` Z p R p L G A W 9 W 3 . 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(       ,($  A6FM W GS$1^` n0 %<   z 5,#_MAT_fprint___i686.get_pc_thunk.bx_MAT_sprint_MAT_fscan_MAT_sscan_MAT_concat_MAT_count_MAT_getsyminfo_MAT_istrue___i686.get_pc_thunk.cx___i686.get_pc_thunk.axdyld_stub_binding_helper___sF__DefaultRuneLocale_malloc_strncpy_strchr_sscanf_strlen_strcpy_fgets_ungetc_getc_sprintf_fprintf___maskrune_gsb_gsbuf___istype_m.0 #1/20 1199171712 0 0 100644 3780 ` memutil.o| __text__TEXT 4__data__DATA__cstring__TEXT A__picsymbolstub2__TEXTaT $__la_sym_ptr2__DATA t __nl_symbol_ptr__DATA  __textcoal_nt__TEXT @  P  USED$D$$$US$UE )$JE}u6E D$$@X$4$_EE)Ѓ$[]ÐUS$0__data__DATA/2__cstring__TEXT/o2__literal8__TEXT7P0:__bss__DATA;(R__picsymbolstub2__TEXT`7:`X__la_sym_ptr2__DATA;6>_&&__nl_symbol_ptr__DATA;>L__textcoal_nt__TEXT;> @a6pd4 P`NUS$}tE8u;E/D$E$:u ;EwE:uL/D$E$V:E}u.ED$/D$;$ :EE$9(:tEE D$E$9E;9Et9u E$j9E$[]ÐUS$}tE8u :Ew.D$E$9u :EQ.D$E$a9E}u3ED$.D$:$9$8E D$E$}8E:9Et E$8E$[]US$} u58u -D$9$8EE8-D$E$8u9@XEB .D$E$V8E}u$ED$ .D$$7E}x4ED$E D$E$B79@X9Et E$7E$7EE$[]ÐUS$}u,-D$8$7E,D$E$7u8@XEG,D$E$W7E}u)ED$,D$$6$6ED$E D$E$+68@X9Et E$6EE$[]ÐUSTEE} u,),D$7$6E!+D$E$~6E}u)ED$+D$$5$5EE @dE}uEPEE@EUЉЉ$5EȋEȅu,@,D$h,D$$25EAEEE @dE}uUЉЍ UȋE Ex~nE@PEx 5Ex ,uUB EDB uUB EDB EE@[^]ÐU8EU @x\BxEEU \EEU \EEf(YMEYEXEYEX$&ÐUSi} u% D$$}u%%D$$}u ƅ!D$ED$$EE x`~ ƅAƅ EEEE @dE܃}uhEU܋E;B|M܋UЍAE؋E؋@E؃xu AD$E$BD$$tE؉D$Eȉ$E؋@D$Eȉ$aEU؋E;B<|dEU؋EiBDEԍBD$$ tEȉD$EԋD$E$EԋD$E$AD$E$`t!ID$$uID$$tE EE}䟆MD$$Mu E㉅ Dž ED$,ED$$E@xD$ED$D$EȉD$ED$ ED$iD$E$MD$$u E㉅ Dž ED$,ED$$E@xD$ED$D$EȉD$ED$ M三 )‰i)ȉD$D$E$H}䟆cED$(ED$ E@xD$ED$EȉD$ED$ ED$D$E$~ED$(ED$ E@xD$ED$EȉD$ED$ M三 )‰i)ȉD$)D$E$YD$$t3E@<D$E@4D$TD$E$ MdD$$u1E@DD$E@LD$lD$E$BD$$ftVD$$Ju:dD$$.uEԋD$D$E$KD$E$6EEED$E$E x`~EE܋@EĴ[]ÐUS E @D$E$xP D$E$uGD$E$JD D$E$uKD$E$V D$E$uOD$E$J D$E$iuSD$E$\ D$E$;uWD$E$[D$E$ uGD$E$d^D$E$uKD$E$6aD$E$uOD$E$dD$E$uSD$E$gD$E$UuGD$E$jD$E$'uKD$E$~mD$E$uWD$E$PpD$E$uSD$E$"sD$E$uGD$E$wD$E$ouKD$E${D$E$AuOD$E$D$E$uSD$E$jD$E$uGD$E$<D$E$uKD$E$D$E$uWD$E$D$E$[uSD$E$D$E$-uGD$E$D$E$uKD$E$VD$E$uOD$E$(D$E$uSD$E$D$E$uuGD$E$D$E$GuKD$E$D$E$uWD$E$pD$E$uSD$E$BD$E$uD$E$D$E$uD$E$D$E$auD$E$D$E$3uD$E$D$E$uD$E$\D$E$uD$E$.[]ÐUSE E $ vE 8 tEU UE UE UE E8'u E*ED$c D$E$ E81tE82t E83t|D$f D$E$ tDj 9EtPn 9EtEr 9Et:D$v D$E$` uUEE []ÐUStX}u*%D$ D$)D$1$ }u*OD$ D$)D$1$X Ex`~EAE.EӈEE D$RD$E$t xD$E$_ E D$D$E$C D$E$. D$E$ 8 D$E$ x D$E$ D$E$ D$E$ EEEE@dE܃}uEEU܋E;B|M܋UЍAEEU؋E;B<|EU؋EiBDEԋED$8ED$4ED$,ED$$E@xD$ED$ED$E؋@D$EԋD$ ED$8 D$E$ EKEE Ex`~EE܋@Et[]ÐUSE}x(}l MU D4!ЅtEE[]-rgetpdb: can't open file %s getcif: can't open file %s putpdb: NULL molecule wCan't open file %s. putcif: NULL molecule putbnd: NULL molecule aoff array in putbndUnable to allocate space for %s. %d %d putdist: NULL molecule can't allocate res can't open dist file %s %3d %-4s %-4s %3d %-4s %4s %8.3f ATOMHETATMC5MC7O2'H2'1H2'AADECCYTGGUATTHYUURA%d-pqr%lf%lfHNOSPTERENDgetcif routine not implemnted in this version! ...compile cifparse.a, and NAB with -DMMCIF initres: can't allocate res->r_resname. initres: can't allocate res->r_resid. init_atab: can't alloc a_atomname. fputpdb: NULL molecule fputpdb: NULL file pointer -brook-tr-nocidATOM %5d %-4s %-3s %c%4d %8.3f%8.3f%8.3fATOM %05d %-4s %-3s %c%4d %8.3f%8.3f%8.3fATOM %5d %-4s %3s %-6s %8.3f%8.3f%8.3fATOM %05d %-4s %3s %-6s %8.3f%8.3f%8.3f%10.5f%10.5f -nobocc%6.2f%6.2f %.1s TER G A T C UDGDADTDCRGRARURCDG3DA3DT3DC3RG3RA3RU3RC3DG5DA5DT5DC5RG5RA5RU5RC5HIDHISHIPCYXCYSASHASPGLHGLU H HBPHETYRTRPHImolmolio.c%s:%u: failed assertion `%s' fpdata_%s ########### ## ENTRY ## ########### _entry.id %s ############### ## ATOM_SITE ## ############### loop_ _atom_site.id _atom_site.label_atom_id _atom_site.label_comp_id _atom_site.label_asym_id _atom_site.auth_seq_id _atom_site.cartn_x _atom_site.cartn_y _atom_site.cartn_z _atom_site.label_entity_id _atom_site.label_seq_id %5d %-4s %3s %c %4d %8.3f %8.3f %8.3f %3d %4d ?333333?333333?????333333??⍀P⍀Pni⍀PUPr⍀rP<7]⍀]P#H⍀HP 3⍀3P⍀P ⍀ P⍀P⍀P⍀Pto⍀P[V⍀PB=⍀P)$v⍀vP a⍀aPL⍀LP7⍀7P"⍀"P ⍀ P⍀Pzu⍀Pa\⍀PHC⍀P/*⍀P⍀Pz⍀zPe⍀ePP⍀PP;⍀;P&⍀&P{⍀Pgb⍀PNI⍀P50⍀P⍀P⍀Pm7777778858N8g88888889/9H9a9z999999:):B:[:t:::::: ;$Ë$`/;H/D/ ..6,--6,--`6,-- 6,--5,--5,-q-`5,k-\-F5,O-@- 5,:-+-4,-,4,,4,,4,,,4,,4,,4,, s,d,4T+Q,4T+F,4T+;,4T+1,",4T+++4T+a+P+ ;+,+4$"++4$ +*4$**4$**4$**4$**4$**4$*t*4$j*[*4$U*F*4$<*-*4$'**34$*)4$))74$))4$))+4$))4$))'4$)u)4$o)`)34$V)G)4$A)2)/4$()){4$))+4$((w4$(('4$((s4$((34$((o4$(z(74$p(a(k4$[(L(+4$B(3(g4$-(('4$((c4$''34$''_4$''/4$''[4$''+4$'{'W4$u'f''4$\'M'S4$G'8'34$.''P4$' '74$'&M4$&&+4$&&J4$&&'4$&&G4$&&34$v&g&D4$a&R&/4$H&9&A4$3&$&+4$& &>4$&%'4$%%;4$%%74$%%<1$%%34$%%*1${%l%/4$b%S%61$M%>%+4$4%%%$1$%%'4$%$01$$$ $$"4x$i$ 4c$T$4A$/$3%$$C1 $#2##4##3##3m#[#C1U#F#3""3f"W"@3!!2!!3"!!2  2  2  2 n O = 2 22;2;2 X72P7 i/) ;2;/ ;yi;_@2SJ>2, ;2 thX;,N1,H8;,.1,(        q c[]1          tlY1 L ; 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|UЍ u ỦEċEĉEDEEEEEĉEEEĉEDEEĉ\UЍ u ỦTTUЍE 9E}^UЍ u ỦXUЍ u ỦXP\<DňEȉ8UЍuE<EMEȃ>\8hEȃAEE(D$ED$h$}B]MЍ0f.wMЍ 1XEЋEuU)ЍE Df(\ EuU)ЍE D\f(YЋEuU)ЍE Df(\LEuU)ЍE D\DYXЋEuU)ЍE D f(\LEuU)ЍE D \DYX$L3ݝ@@^E`Ef(Y`EXE؍Ẽ5E0݅0[^_]ÐUWVEEDEEEDE} E}~jE쉅DEETЍu E<EMEȃ>\DhED$h$pEȉD$hD$EE($E}~iE쉅@EEЍu E<EMEȃ>\@hED$h$EȉD$EE(D$h$}E}~iE쉅\<HED$H$ED$EE(D$H$"E}~jE쉅8EETЍu E<EMEȃ>\8HED$H$BED$HD$EE($iD$Eȉ$ D$E$ED$ED$Eȉ$*D$E$ED$EȉD$E$2=^_]UVS胺33$1u83D$!D$3$1$p133)$1u,!D$3$A1$143)$.1u,"D$3$0$0 43ip$0u,C"D$3$0$x043i $0u,"D$3$M0$(0343)$:0u,"D$3$/$/743)$/u,#D$3$/$/43i0$/u,C#D$3$U/$0/43$B/u,#D$3$/$.43$.u,#D$3$.$.43i0$.u,$D$3$].$8.43)$J.u,C$D$3$ .$-#43i$-u,$D$3$-$-;43)$-u,$D$3$e-$@-'43$N-u,%D$3$ -$,+43$,u,C%D$3$,$,/43$,u,%D$3$e,$@,?43i$V,u,%D$3$,$+C43i0$,u,&D$3$+$+G43 $+u,C&D$3$q+$L+[^]US\-$$d-$$h-$$p-$$l-$$-$$-$$t-$y$|-$i$x-$Y$-$I$-$9$-$)$-$$-$ $-$#-$#-$#-$#-$#`-$#[]Unable to allocate space for res FACE CHECK: face %d has %d cycles add_edge(): edge vertex not on circle MAX_EDGE exceeded MAXPROBE exceeded: %d %d %d convex_edges() MAX_FACE exceeded vertex atom mismatch atom: %d vertex atom: %d MAX_NEIGHBOR exceeded: %d %d %d MAX_NEIGHBOR exceeded MAX_NSORT exceeded: %d %d sarg1 >= 0.0molsurf.c%s:%u: failed assertion `%s' sarg2 >= 0.0MAX_TORUS exceeded MAX_CIRCLE exceeded concave_circles() MAX_CIRCLE exceeded MAXTOR_EDGE exceeded MAX_FACE exceeded odd number of probe positions on torus! concave edge on torus has mismatched atoms torus %d atoms %d %d edge %d vert1.atom %d vert2.atom %d MAX_VERTS exceeded convex_edges() convex and concave edges not paired convex_edges(): number of convex edges from toruslist %d not equal to total number of convex edges %d convex vertex atom mismatch 2 iatom: %d number of convex edges %d ie: %d edge vertices: v1 %d v2 %d edge v1.atom %d edge v2.atom %d convex vertex atom mismatch 3 convex vertex atom mismatch convex_edges(): number of convex edges from atomlist %d convex_edges() MAXTOR_EDGE exceeded convex_edges() MAXAT_EDGE exceeded sort_edges() MAXTOR_EDGE exceeded sort_edges(): iatom not found MAX_CYCLES exceeded next_edge(): No edge found looking for 1st vertex of : %d amoung edges for atom %d edge: %d v1: %d v2: %d ATOM 1 N VRT %4d %8.3f%8.3f%8.3f 0.5 %d %d is_cycle_inside(): MAXAT_EDGE exceeded is_cycle_inside(): sdist < 0 cycle_area(): vert = -1 but n_edges > 1 saddle_area() circle mismatch negative saddle face area! area1 %f area 2 %f theta1 %f theta2 %f sin(theta1) %f sin(theta2) %f wrap angle %f torus rad %f probe rad %f id_torus(): Could not find torus for atoms %d and %d MAX_LOW_TORUS exceeded %d make_cones() MAXTOR_PROBE exceeded MAX_VERTS exceeded %d get_low_torus_index() low torus not found! MAX_CONE_FACE exceeded trim_probes(): MAXTOR_PROBE exceeded trim_probes(): n broken faces on low torus is odd trim_probes() low torus has no faces, but is not free add_concave_cycle() MAX_CYCLES exceeded theta negative for cone face axial_trim(): MAXTOR_PROBE exceeded axial_trim(): n_cycles != 1 axial_trim(): n_edges != 3 axial_trim(): bad edge direction on cycle odd number of faces on torus concave edge should already be dead axial_trim(): MAX_CUSPS exceeded get_cycle_edge(): could not find edge face edges: %d bad vertex concave edge %d ( vert %d atom %d ) (vert %d atom %d ) torus atoms %d %d here are all the %d edges vertices and atoms: edge: %10d ( v1 %10d a1 %10d ) (v2 %10d a2 %d ) axial_trim(): MAX_CIRCLE exceeded cone_edge(): could not fine cone edges low torus: %d = torus %d looking for edge with verts %d %d and found: ic %d cone %d edge %d verts %d %d iv1: %8.3f%8.3f%8.3f atom %d iv2: %8.3f%8.3f%8.3f atom %d add_edges_2_cycle(): could not find edge to replace add_edges_2_cycle(): MAX_FACE_EDGE exceeded concentric_axial_cusps(): cycle mismatch reroute(): cusp edge mismatch Unable to allocate space for edge_used split_cycle(): could not find a starting edge for 2nd cycle edge %d not used concentric_axial_cusps(): n_cycles != 1 next_cycle_edge(): could not find next edge with vertex %d Unable to allocate space for group WARNING: 3 cusps intersection: not trimmed yet WARNING: 4 cusps intersection: not trimmed yet two many interesecting cusps %d flag icusp %d jcusp %d alpha %8.1f alpha < 0 should not happen circles don't intersect alpha %8.1f > %8.1f alpha > pi/2 h1:%8.3f h2:%8.3f sin(alpha) %8.3f cos(alpha) %8.3f tan(alpha) %8.3f h1*cos(alpha) < h2 ------------------ cusps %d %d icycle %d circles %d %d probe %d probe center %8.3f%8.3f%8.3f offset %8.3f icusp %d jcusp %d c1 radius %8.3f c2 radius %8.3f c1 height %8.3f c2 height %8.3f uv1: %8.3f%8.3f%8.3f uv2: %8.3f%8.3f%8.3f drawing circles wcircle.pdbcircle.bndcircle.propaxis: %8.3f%8.3f%8.3f angle range %8.1f circle rad %8.3f offset/rad: %8.3f xaxis %8.3f%8.3f%8.3f midpoint %8.3f%8.3f%8.3f reversing vertices v1: %8.3f%8.3f%8.3f v2: %8.3f%8.3f%8.3f cusp straddles vertex, no bueno angle1: %8.1f angle2: %8.1f add new cusp 1 v1 < 0, changing to positive angle: before %8.1f + %8.1f after %8.3f v2 < 0, changing to positive angle: add new cusp 2 v2_angle > v1_angle v1 angle %8.1f v2 angle %8.1f no cusp v1_angle %8.1f v2_angle %8.1f cusps have identical cycles icusp %d cycles %d %d jcusp %d cycles %d %d no cycles found get_probeid(): no cycles match sin angle %8.3f radius %8.3f zaxis: %8.3f%8.3f%8.3f add_new_cusp(): MAX_CUSP_PAIRS exceeded center_cycle():no cusp match number_of_cusps(): too many unique cusps MAXTMP exceeded broken concave face num of cycles != 1 no unique cycle found split_old_cusps: not cutting with 2 verts ncut %d new_cusp(): old cusp not dead MAX_CUSPS exceeded broken concave face has more than one cycle face %d number of cycles %d face cycle mismatch face %d face.cycle = %d cycle = %d split_face(): MAXTMP exceeded split_face(): face has more than 2 cycles too many starting edges split_face(): num starting edges > 2 (%d) cusp_match(): could not find match for vertex %d concave_cycle(): vert = -1 but n_edges > 1 Unable to allocate space for atom: %d Unable to allocate space for upper_neighbors Unable to allocate space for neighbors Unable to allocate space for probelist Unable to allocate space for toruslist Unable to allocate space for convex_circle_list Unable to allocate space for concave_circle_list Unable to allocate space for concave_face Unable to allocate space for convex_face Unable to allocate space for saddle_face Unable to allocate space for cone_face Unable to allocate space for broken_concave_face Unable to allocate space for concave_cycle Unable to allocate space for cyclelist Unable to allocate space for vertexlist Unable to allocate space for concave_edge_list Unable to allocate space for convex_edge_list Unable to allocate space for low_torus Unable to allocate space for cusp_edge Unable to allocate space for cusp_pair ??|=?|=????-DT!@-DT!@-DT! 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E Cv S cm**-1 kcal/mol cal/mol-K cal/mol-K Total: %11.3f %11.3f %11.3f translational: %11.3f %11.3f %11.3f rotational: %11.3f %11.3f %11.3f vibrational: %11.3f %11.3f %11.3f ff energy: %11.3f %5d %10.3f %5d %10.3f %11.3f %11.3f %11.3f RMS gradient = %12.5e wvecs modes from NAB %5d %11.5f **** %5d%12.5f k⍀PWRv⍀vP>9a⍀aP% L⍀LP 7⍀7P"⍀"P ⍀ P⍀P⍀P⍀Pvq⍀P]X⍀PD?⍀P+&z⍀zP e⍀ePP⍀PP****++3+L+e+~++++++,$Ë $Ë$"$####(#%-#%- #""f*-""f*-Q"?"_*-"!h*-!!f*-c!Q!f*-! !_*-  Z*-  I*-  D*- B*-5 %-)  *-%-%-`,-`,-L=+%-h,-+*-z%-d,-d,-v) |h,r*h,)}h,s)bUh,K)h,`)h, )h,v(F9h,/()h,@(h,'p%Bx%$$|$v$_$S...h,']$0p%p%.;.h,$'h%V$$x h,@'  h, & $E 8 h,. 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EEuQED$D$T$ TD$tD$$ EUE艂E$ $ EEuNED$D$T$ TD$tD$$< EZUE䉂UExxUE||UEUEEEE4[]V%6d%6d%6d%6d%6d%6d%6d%6d%6d%6d%6d%6d unexpected end in parm file programming error: name w/ length %d .Z%s, %s: does not exist %s: sys err zcat %srpclosefclosemalloc %lu malloc err:Error: unexpected EOF in %s Error: line too long in %s: %.81sReading parm file (%s) Cannot read parm file %s %VERSIONTITLEtitle: %s POINTERS%d%d%d%d%d%d%d%d%d%d%d%d%d%d%d%d%d%d%d%d%d%d%d%d%d%d%d%d%d%d%dATOM_NAMECHARGE %lfMASS %leATOM_TYPE_INDEX %dNUMBER_EXCLUDED_ATOMSNONBONDED_PARM_INDEX Parameter topology includes 10-12 terms: These are assumed to be zero here (e.g. from TIP3P water) RESIDUE_LABELRESIDUE_POINTERBOND_FORCE_CONSTANTBOND_EQUIL_VALUEANGLE_FORCE_CONSTANTANGLE_EQUIL_VALUEDIHEDRAL_FORCE_CONSTANTDIHEDRAL_PERIODICITYDIHEDRAL_PHASESOLTYLENNARD_JONES_ACOEFLENNARD_JONES_BCOEFBONDS_INC_HYDROGEN %d %d %dBONDS_WITHOUT_HYDROGENANGLES_INC_HYDROGEN %d %d %d %dANGLES_WITHOUT_HYDROGENDIHEDRALS_INC_HYDROGEN %d %d %d %d %dDIHEDRALS_WITHOUT_HYDROGENEXCLUDED_ATOMS_LISTHBOND_ACOEFHBOND_BCOEFHBCUTAMBER_ATOM_TYPETREE_CHAIN_CLASSIFICATIONJOIN_ARRAYIROTATperiodic prmtop found, not supported by NAB CAP_INFO %d CAP_INFO2 %lf %lf %lf %lfRADIISCREENold prmtop format => using old algorithm for GB parms bad atom symbol: %d, %c writeparm() sees a NULL parmstruct w%-80s%FLAG TITLE%FORMAT(20a4)%FLAG POINTERS%FORMAT(10I8)%8d%FLAG ATOM_NAME%-4s%FLAG CHARGE%FORMAT(5E16.8)%16.8lE%FLAG MASS%FLAG ATOM_TYPE_INDEX%FLAG NUMBER_EXCLUDED_ATOMS%FLAG NONBONDED_PARM_INDEX%FLAG RESIDUE_LABEL%FLAG RESIDUE_POINTER%FLAG BOND_FORCE_CONSTANT%FLAG BOND_EQUIL_VALUE%FLAG ANGLE_FORCE_CONSTANT%FLAG ANGLE_EQUIL_VALUE%FLAG DIHEDRAL_FORCE_CONSTANT%FLAG DIHEDRAL_PERIODICITY%FLAG DIHEDRAL_PHASE%FLAG SOLTY%FLAG LENNARD_JONES_ACOEF%FLAG LENNARD_JONES_BCOEF%FLAG BONDS_INC_HYDROGEN%FLAG BONDS_WITHOUT_HYDROGEN%FLAG ANGLES_INC_HYDROGEN%FLAG ANGLES_WITHOUT_HYDROGEN%FLAG DIHEDRALS_INC_HYDROGEN%FLAG DIHEDRALS_WITHOUT_HYDROGEN%FLAG EXCLUDED_ATOMS_LIST%FLAG HBOND_ACOEF%FLAG HBOND_BCOEF%FLAG HBCUT%FLAG AMBER_ATOM_TYPE%FLAG TREE_CHAIN_CLASSIFICATION%FLAG JOIN_ARRAY%FLAG IROTAT%FLAG CAP_INFO%FLAG CAP_INFO2%FLAG RADII%FLAG SCREENnew PARMSTRUCT_T %sUnable to allocate space for %s. copyparm AtomNames %scopyparm ResNames %scopyparm AtomSym %scopyparm AtomTree %s ףp= ?333333??333333?? ףp= ?333333?HzG???)\(?Q?Q??Q???ffffff?%%VERSION VERSION_STAMP = V0001.000 DATE = %m/%d/%y %H:%M:%S:⍀P&!⍀P ⍀P⍀P۞֞|⍀|Pž轞g⍀gP驞褞R⍀RP鐞苞=⍀=Pwr(⍀(P^Y⍀PE@⍀P,'⍀P⍀P⍀Pܝ⍀PȝÝ⍀P鯝誝⍀P閝葝k⍀kP}xV⍀VPd_A⍀APKF,⍀,P2-⍀P⍀P⍀P⍀PΜɜ⍀P鵜谜⍀P霜藜⍀P郜~⍀Pj``aa2aKada}aaaaaab,bEb^bwbbbbbb c&c?cXcqcc$Ë$ÁUqU`_MgU@dMaUYU@dMOU_M2U'UTT`_MT@dMTT@dMT_MTT#QQ`_M Q@dMQP@dMP_MPPFP6P`_M,P@dM&PP@dMP_MOO[N=N-N`_M#N@dMNN@dM N6_MMM MMMe2MMjMZM\2TMLM \2FM>M)_28M(M[2"MMLL\2LL \2LL_2LL[2LLtL\LDL,LL\2LL \2LL _2KK[2KKKK[2KK[2KK^2KK[2sKfKCK3K[2-K%K[2KK^2KK[2JJJJ[2JJ[2JJ^2JrJ[2lJ_J>\2>> \2>>@]2>>[2y>l>->>\2>> \2 >>%]2==[2====\2={= \2u=m=]2g=W=[2Q=D==<\2<< \2<<\2<<[2<<q<a<\2[<S< \2M<E<\2?</<[2)<<;;\2;; \2;;\2;;[2;;I;9;\23;+; \2%;;\2;;[2;:::[2::[2::\2:u:[2o:b:F:99[299[299y\299[299i9Y9[2S9K9[2E9=9^\279'9[2!9988[288[288B\288[288K8;8[258-8[2'88,\28 8[28777\277 \277!\27x7[2r7e7)77\27 7 \276[266[2666w6g6[2a6Y6[2S6K6[2E656[2/6*666555555555{5g5S5?5+555444444}4l4[4J494(444[243[233[2333[233[2333`233s3c3[2L3:3e223#3[23 322 d22[222 2ed22ed222ed2~2p[d2q2ed2f2ed2`2 H2e1B282e1.2p[1"2e12e12e12e121e11@e11 1eT111eT11p[T11eT11eT11eT11eT11u1eT1k1@eT1P1 81e021(1e01p[01e0 1e01e00e000e00@e00 0e00e000@e00e00 ]0,, d ,_ +++ d +W[ ++h` s+P` C+h` !+P` *`` *P` *X` }*P` M*H` +*@` )8` )0` )(` )_ W) ` 5)` )` (` (_ (` \(_ ,(_ '_ B'_ 9'1' [ ''&_ `&_ W&D&5&W &%%Z %%%W %%u%Z e%V%Z %%%Z $$Z $$$Z $$$Z $l$###W #x#b#Z \#I#:#W #""Z ""W ,""eZ "!W Y!C!UZ =!2!! !W     OZ    W e I 3 CZ -   W 7Z W rV@#Z :$Y pZZ T>/Y wY q[LY Y Y Y Y lP:Y 4!Y tY xiW L0`Y W LY {W ^B,FY &W 7Y W pT>"Y 8%W  Y W fPX J7(W  X W xbX \I:W X W z^HX 7(W oX iIA`X ;3 X  W  X {W Y@*W $W W W lS=W 7$W W W  W {\=~\:wX9    s T 5      r U 8       m P +      r    W    W ~ycnW ]UcW D? 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;[]ÐUVS k$(2E}u$/3UE B uE@ $2FExu$2E@ED$E$2E [^]ÐUS}u;:E;u :ExtE@$2E$2[]ÐU(E$1UE E@ EEE} tE $1$f1~EEUBÐUS$}uQE@E@E@UE@BE@E@$X9E;u[]ÐUS$} vE E8uE E8u E$(0E}u$L1UE B MUEBAE@EUE@ BE@E@E@ E@$E$EEE$[]ÐU(EEE8uEED$E$/ÐUS$E EE$0E}uD$`0EE;E |EU‹EEEۋE U‹E EED$E$`E}u$/E@E$[]ÐUSED$zD$ 6$C4$4UE$]3ÐUE D$E$y.ÐUE$2ÐUÐUS$X@766+9E ~!@766+ЉEE E}~1ED$6D$E$-66EE$[]4@ ''@333333?.@{Gzt?S@?MbP?~.Ar@4pGP?$@$@ Hbhb-rgetx: can't open file %s %dwCan't open file %s. %6d %20.15f%20.15f%20.15f %20.15f%20.15f%20.15f%20.15f getxv: can't open file %s %d %lfno velocities were found %s %6d%15.5f %12.7f%12.7f%12.7f%12.7f%12.7f%12.7f %12.7f%12.7f%12.7f bad value for Pn: %d %d %d %d %8.3f Error allocate kdnode array in nbtree! NULL pair list entry in nbond, taskid = %d Error in egb: rgbmax = %f is greater than cutoff = %f Effective Born radii: NULL pair list entry in egb loop 1, taskid = %d %d %15.7f %15.7f NULL pair list entry in egb loop 2, taskid = %d count <= 30*prm->Natomeff.c%s:%u: failed assertion `%s' NULL pair list entry in egb loop 3, taskid = %d NULL pair list entry in egb loop 4, taskid = %d iter Total bad vdW elect. cons. genBorn frms enb14%20s(%4i) %s --> %9.3f eel14enbeele_gbesurfff:%4d %9.2f %9.2f %9.2f %9.2f %9.2f %9.2f %9.2e bond: %15.9f angle: %15.9f dihedral: %15.9f enb14: %15.9f eel14: %15.9f enb: %15.9f eel: %15.9f egb: %15.9f econs: %15.9f esurf: %15.9f Total: %15.9f First derivative timing summary: constraints %10.2f bonds %10.2f angles %10.2f torsions %10.2f pairlist %10.2f nonbonds %10.2f gen. Born %10.2f mme %10.2f Total %10.2f conj. grad. %10.2f molec. dyn. %10.2f e_bondsff2.ce_thetabi > 0.01bk > 0.01iper != (fabs(Pn[atyp]) - 0.0001)iper >= 1 && iper <= 6bad periodicity: %d fabs(3.14159 - Phase[atyp]) < 0.01e_torsNULL pair list entry in nbond2, taskid = %d enter egb2, n = %d freevectors Error in egb2: rgbmax = %f is greater than cutoff = %f NULL pair list entry in egb2 loop 1, mytaskid = %d reff calculated, mytaskid = %d NULL pair list entry in egb2 loop 2, taskid %d reff calculated NULL pair list entry in egb2 loop 3, taskid = %d end loop 1 NULL pair list entry in egb2 loop 5, taskid = %d end loop 3 matrix preparation time = %10.2f n = %d m3 = %d dgemm1 time = %10.2f dgemm2 time = %10.2f dgemm3 time = %10.2f exit egb2 Inside mme2: Second derivative timing summary: mme2 %10.2f Total deriv %10.2f Born dgemm timing summary: dgemm1 %10.2f dgemm2 %10.2f dgemm3 %10.2f total dgemm %10.2f Born-dgemm %10.2f Overall timing summary: derivatives %10.2f level %10.2f dsyev %10.2f dposv %10.2f newton %10.2f CTbad number of bonds to CT: %d %d; using default carbon parameters Cbad number of bonds to C: %d %d; O O2Obad number of bonds to O*: %d %d; using default oxygen parameters N3bad number of bonds to N3: %d %d; using default nitrogen parameters Nbad number of bonds to N: %d %d; SHSPbad number of bonds to P: %d %d; using default phosphorus parameters HUsing carbon SA parms for atom type %s bad p0: %d %12.6f %s prm != NULLsff.cscaling charges by %8.3f constrained all %d atoms constrained %d atoms using expression %s Error allocating pairlist array in mme_init! freezing %d atoms using expression %s for moving atoms Error allocating N14pearlist array in mme_init! 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(UQ UQ ' UQUQ |xtplhd`\XTPLHD@<840,($   "  $#%! &  "  $#%! &  #U UWThn3_~?(ycI q;_dg_helix___i686.get_pc_thunk.bx___i686.get_pc_thunk.axdyld_stub_binding_helper_NAB_rsbuf_db_viol___sF_addstrand_newmolecule_superimpose___eprintf_snprintf_freemolecule_copymolecule_setmol_from_xyzw_conjgrad_setxyzw_from_mol_dg_options_setbounds_usemodeldist_malloc_NAB_mri_newbounds_connectres_mergestr_transformmol_NAB_matcpy_newtransform_wc_basepair_exit_getres_NAB_strcat_NAB_rematch_setreslibkind_substr_strlen_wc_complement_fprintf_NAB_strcpy_NAB_strcmp#1/20 1199171719 0 0 100644 1916 ` getchivol.o8 T__text__TEXTT,__data__DATA__literal8__TEXT__picsymbolstub2__TEXTl__la_sym_ptr2__DATA__textcoal_nt__TEXT! @t PUEU f(Y EYEU YEY\ȋEU YEY\ȋEU YEYXȋEU YEYXȋEU YEY\ȋEU YEY\ȋEU YEYXȋEUYEYXȋE UYEY\ȋEUYEY\ȋE UYEYXȋEU YEYXȋEU YEY\ȋEUYEY\ȋE UYEYXȋEUYEYXȋE UYEY\ȋEU YEY\ȋEU YEYXȋEUYEYXȋE UYEY\ȋEUYEY\ȋE UYEYXȍ^MEÐUE؉D$E D$E$ED$ED$E$iED$ED$E$PxD$ED$E$4xD$ ED$ED$E؉$a@K⍀P7$Ë $x\C*    0 % aH_getchivolp___i686.get_pc_thunk.cx_getchivol___i686.get_pc_thunk.axdyld_stub_binding_helper_setxyz_from_mol#1/12 1199171720 0 0 100644 2820 ` getres.o| __text__TEXT(F__data__DATA,__cstring__TEXT@,__picsymbolstub2__TEXTlX$__la_sym_ptr2__DATAjx __nl_symbol_ptr__DATA __textcoal_nt__TEXT  @ ` P US$ED$D$E$!PD$$D$D$E$PD$$D$D$E$PD$$D$D$E$PD$$]D$D$E$YPD$$+D$D$E$'PD$$D$D$E$PD$$D$D$E$PD$$D$D$E$PD$$cD$D$E$_PD$$1ED$E$t7D$ED$E$‹E D$B$E5ED$D$x$n$IE$[]AADECCYTGGUATTHYUURAacgtuundefined residue "%s" '⍀P|⍀|Pg⍀gPR⍀RP=⍀=P(⍀(P,E^$Ë$Ç{k a M7     { ma XI ;/ &       sg ^O A5 ,  ~V~V~ y sz=kz=e ` Zv$Rv$L G Ar 9r 3 . (n n  jj    ! s|RX^g9_getres___i686.get_pc_thunk.bx___i686.get_pc_thunk.axdyld_stub_binding_helper___sF_exit_fprintf_getresidue_NAB_hin_NAB_strcpy_NAB_href #1/28 1199171721 0 0 100644 12340 ` getseq_from_pdb.o| ,,__text__TEXT'__data__DATA'__cstring__TEXT@E__picsymbolstub2__TEXT^*T__la_sym_ptr2__DATA8{D-__nl_symbol_ptr__DATA__textcoal_nt__TEXT$ @,./ P-UVSDžDžD$0D$$P4D$$XD$6D$$QP:D$$#D$<D$$P@D$$D$BD$$PFD$$D$HD$$PLD$$D$ND$$}PRD$$OD$TD$$HPXD$$D$ZD$$PXD$$D$^D$$PbD$$D$dD$$PhD$${D$jD$$tPnD$$FD$pD$$?PtD$$D$vD$$ PzD$$D$|D$$PD$$D$D$$PD$$rD$D$$kPD$$=D$D$$6PD$$D$D$$PD$$D$D$$PD$$D$D$$PD$$iD$D$$bPD$$4D$D$$-PD$$D$D$$PD$$D$D$$PD$$D$D$$PD$$`D$D$$YPD$$+D$D$$$P4D$$D$D$$PRD$$D$D$$P:D$$D$D$$PD$$WD$D$$PPD$$"D$4D$$P4D$$D$RD$$PRD$$D$:D$$P:D$$D$D$$|PD$$ND$D$$GPD$$D$D$$P4D$$D$D$$PRD$$D$D$$P:D$$zD$D$$sPD$$ED$D$$>P4D$$D$D$$ PRD$$D$D$$P:D$$D$D$$PD$$qD$D$$jP4D$$<D$D$$5PRD$$D$D$$P:D$$ D$D$$ PD$$ D$ D$$ P4D$$h D$D$$a PRD$$3 D$D$$, P:D$$ D$D$$ PD$$ D$D$$ PD$$ D$D$$ P4D$$_ D$D$$X PRD$$* D$!D$$# P:D$$ D$$D$$ PD$$ D$'D$$ PD$$ D$*D$$ P.D$$V D$0D$$O P.D$$! D$4D$$ P8D$$ D$:D$$ P>D$$ ED$E$ E}u $T E EEED$E$ E}uJ@D$E$ ;Eu#GD$E$ U ;uGD$E$ U ;u GD$E$r E 82~UpD$$- E D$D$$ $C E DŽD$E E$@ D$E E$ D$D$E@0@$dD$E E$D$E E$E D$ D$D$' $='t*D$ D$+D$=$g D$$.D$E E$E@0@D$$tkD$E@0@D$$@D$E E$D$E E$@D$E$ 8uOE@0@D$E E$C[D$E E$FbD$E E$D$E E$ED$E@0@$D$E@0@$dD$E@0@$D$E@0@$D$E@0@$zt|RD$E@0@$[t]4D$E@0@$<t>D$E@0@$t:D$E@0@$uPhD$E E$Vu%lD$E E$YD$E@0@$t]D$E@0@$pt>D$E@0@$QtD$E@0@$2u%hD$E E$pD$E@0@$qt%hD$E E$tsD$E@0@$-u!D$E@0@$uE DŽ@D$E$EEU E;~[E샼tFD$E E$D$E E$E뙋E[^]ALAACYSCASPDGLUEPHEFGLYGHISHHIDHIEhILEILYSKLEULMETMASNNPROPGLNQARGRSERSTHRTVALVTRPWCYXXTYRYACEnNMEcHIP3ADEGUACYTTHYURAURARGRCRURA5RG5RC5RU5RA3RG3RC3RU3A5G5C5T5U5A3G3C3T3U3WATwHOHNH2aMTHmresnumstrandnumgetseq_from_pdb.nab:113 assert 'numstrand <= 50' failed. getseq_from_pdb.nab:113 'numstrand' = %d protein %d( snprintf( NAB_rsbuf, 10000, "%d", *numstrand ) ) < 10000getseq_from_pdb.c%s:%u: failed assertion `%s' hetatm?APUrnadna^U5vY⍀YPb]D⍀DPID/⍀/P0+⍀P⍀P⍀P⍀P⍀P⍀P⍀P|⍀Phcr⍀rPOJ]⍀]P61H⍀HP(AZs$Ë$Ps^T?9xxyoZT5|+ xJDboaL>)trpkj=.P#ke]MS;A,"smN8,     W  W  Ws d PP '    N  J  H  D  >w e @W K >B 0 :"    7    4  J  1 w bn \ .N B D9 ' +    (    %  J  "z n be S E 9 D0        J    b  q e D\ J < 0 '   JbDvh\SA3'J bDm_SJ8*JJbbDDvdVJA/!J bDvm[MA8& ymdRD8/~pd[I;/&ug[~R@z2&x trnhjh~ld^RbI7^)\XVRPL~JucFUID@.@  Z TLF A ;3- ( "      kk  RR  99      ~ y ske ` ZRL G A93 . (    40,($           *$(l[yfB_getseq_from_pdb___i686.get_pc_thunk.bx___i686.get_pc_thunk.axdyld_stub_binding_helper_NAB_rsbuf___sF_NAB_rematch_NAB_strcat_NAB_hin___eprintf_snprintf_NAB_strcmp_substr_fprintf_NAB_ari_NAB_mnext_exit_getpdb_NAB_strcpy_NAB_href #1/28 1199171721 0 0 100644 8756 ` getxyz_from_pdb.o X__text__TEXT0 __data__DATA0 __cstring__TEXT@ __literal8__TEXT __picsymbolstub2__TEXT __la_sym_ptr2__DATArhN__nl_symbol_ptr__DATA4__textcoal_nt__TEXT @8 h Pd5UVS9EEEEDž,Dž|D$<D$H$D$<D$c$D$E D$0 $D$0 $vE썃0 $LD$E$PE}u $ EED$E$ E}uE; D$E$ D$D$Eԉ$l PExD$$> EEED D$E$ EED$E $B E}u; D$E$ D$D$EЉ$ PExD$$ ; D$E$ D$Eԉ$N m; D$E$ D$D$Eԉ$c D$Ex$5 EEED$E$ E}ucE D$E$ Ѝ0PE@D$$ HE D$E$G Ѝ0PE@$D$$n _EEED$E $ E}u@E؃E؋cD$E$ E؋DD$E@$$ EED$E $E E}u; D$E$ D$Ẻ$ ẺD$Eԉ$ t렋E8D$D$E$ M D$$ tO D$E$ DžDD$E$ @@tG; D$E$= D$S D$$ $= ; D$$ D$Eԉ$~ }; D$$ D$,$c ,D$Eȉ$N DD$$<Dž4D4;<~D$D$4$rM D$$E; D$4$D$Eԉ$qu`; D$4$D$n $D$,$wD$,$-D4DDž44;<~D$D$4$aM D$$4; D$4$D$Eԉ$`uPD$4$8Dž00;8~D$D$0$M D$$v,D$0$; D$0$D$Eԉ${u`; D$0$D$n $D$,$D$,$7D04D,D$ E D$,D$E$D$,D$ E D$,D$E$; D$E$D$|$|D$T$E$9D$EȉD$E$D$xD$X$D$D$8$D$$ f.w7; D$E$D$ D$p $.D$Ex$E}uẺD$E$j D$E$;Eu9ED$ $jD$E$YD$E$5ẺD$n $3D$E$"D$E$E D$E$0E}uẺD$E$ D$E$;Eu9ED$ $D$E$D$E$F5ẺD$n $gD$E$VD$E$E D$E$dEEED$E$5E}uq; D$E$D$Ẻ$ẺD$EЉ$uuẺD$ ED$ D$$rE9[^]temp___pdbfullnametresnumHOXTwrong number of bonds: %s |Large rms of %8.3f in building %-10s resnum,unmatched atom in file %s: %s ?⍀Pp⍀pP[⍀[PF⍀FP1⍀1P⍀P}⍀Pid⍀PPK⍀P72⍀P⍀P⍀P⍀Pt⍀tP_⍀_PJ⍀JP5⍀5Poj ⍀ PVQ ⍀ P=8⍀P$⍀P ⍀P⍀P⍀P⍀Px⍀xP  ' @ Y r !:Sl4Mf$Ë$       K   q e V E = ~ .           y q ~ b S B : $        K  ~ l P +  K =+~ K K u] m#K ] G5#~ K K ] G&K K c sK ^7&_ ] K vZ-U U |XC*K  K K {lT O:!K @ @ @ xZ   ^x^r m gE_EY T N,F,@ ; 5-' "           }}  d~dx s mKeK_ Z T2L2F A ;3- ( "                 j j ~ y sQ kQ e ` Z~8 R~8 L G Az 9z 3 . (v v   r r  d`\XTPLHD@<840,($        *.a$7r} [BP`jXHB_getxyz_from_pdb___i686.get_pc_thunk.bx___i686.get_pc_thunk.axdyld_stub_binding_helper___sF_NAB_ari_printf_NAB_ptadd_NAB_ptsub_setxyz_from_mol_rmsd_superimpose_NAB_aematch_NAB_strcat_fprintf_bonded_atoms_NAB_strcmp_substr_NAB_rri_NAB_rnext_NAB_hin_NAB_strcpy_NAB_ptcpy_NAB_href_NAB_arc_NAB_mnext_exit_unlink_getpdb_putpdb_memset #1/20 1199171721 0 0 100644 4380 ` getpdb_prm.o| __text__TEXTD M__data__DATA`__cstring__TEXT$x__picsymbolstub2__TEXT^ T__la_sym_ptr2__DATAb8L__nl_symbol_ptr__DATA4 __textcoal_nt__TEXT< @4$ PUSdEEEE$D$E$u,D$$$D$E$D$E$FEE D$D$E$WED$D$E$9E8tED$D$E$ED$D$E$4D$E$UD$E$E$sED$ ED$ED$ED$ED$ED$ tD$D$'$='t*D$ D$4D$$D$Eԉ$;D$E$,ED$$hE$DE$ D$E$D$$ED$E$E8uID$E$$$$$Ed[]NABHOMENABHOME not defined. leap.inwsource %s X = loadPdb %s %s savePdb X %s.lpdb saveAmberParm X tprmtop tprmcrd quit %s/bin/teLeap -s -f %s -I%s/leap/cmd -I%s/leap/parm -I%s/leap/prep -I%s/leap/lib > tleap.out( snprintf( NAB_rsbuf, 10000, "%s/bin/teLeap -s -f %s -I%s/leap/cmd -I%s/leap/parm -I%s/leap/prep -I%s/leap/lib > tleap.out", nabhome, lcfile, nabhome, nabhome, nabhome, nabhome ) ) < 10000getpdb_prm.c%s:%u: failed assertion `%s' Running: %s .lpdbtprmtop./tprmtop./tprmcrd./leap.logY⍀YPD⍀DP/⍀/P⍀P⍀Pz⍀Pfa⍀PMH⍀P4/⍀P⍀P⍀Pr⍀rP]⍀]PH⍀HP*C\u $=V$Ë$û   x j[ RB1 +         UJ;a 5&@ ' #    w qeU K A2*  Z TNLNF A ;535- ( "        ~~  zz  vv~ y srmkrme ` ZnTRnTL G Aj;9j;3 . (f" f"  b b  40,($          % Vyaqg=_getpdb_prm___i686.get_pc_thunk.bx___i686.get_pc_thunk.axdyld_stub_binding_helper_NAB_rsbuf___sF_readparm_getpdb_NAB_strcat_unlink_system_printf___eprintf_snprintf_fclose_fopen_exit_fprintf_NAB_strcpy_getenv#1/20 1199171721 0 0 100644 5924 ` getpdb_rlb.o|   __text__TEXTe w__data__DATAe __cstring__TEXT __picsymbolstub2__TEXT? w PZ__la_sym_ptr2__DATA <N __nl_symbol_ptr__DATA  __textcoal_nt__TEXT  @ PUVS`EEEEEEsD$E؉$Q D$Eԉ$< D$EЉ$' D$E $ tE D$E؉$ D$E $ tE D$Eԉ$ D$E $ tE D$EЉ$ ED$$? ED$ED$ ED$ED$E$EEE;E~D$UE$tgE$UED$ UED$UED$$mEX}tS$N$EEE;E~UED$ UED$UED$$UED$E$4rD$UE$u=E D$UED$UE$EXzD$UE$?uwEUED$E${EЉD$UE$'D$UED$E$D$UE$uuD$Eĉ$učD$Eȉ$Eȉt$D$ E؉D$UED$UE$4ED$UE$uuD$Eĉ$učD$Eȉ$Eȉt$D$ E؉D$UED$UE$E|D$UE$cuuD$Eĉ$cučD$Eȉ$KEȉt$D$ EԉD$UED$UE$ED$UE$urD$Eĉ$učD$Eȉ$Eȉt$D$ EԉD$UED$UE$ZECUED$D$ $$D$UED$ED$ D$UED$E$EaED$$}EẺD$ E܉D$ED$E$*EED$$>D$E܉$BtE܉D$ $E`[^]dna.amber94.rlbrna.amber94.rlbhetatm.amber94.rlb Getting sequence from %s ?Problem interpreting a pdb sequence: strand %s is %8s with sequence: %s Exiting due to above problems proteinhetatmdna35DNAdnacrnaRNArnacunknown type: %s firstlast Getting coordinates from %s Got %d coordinates using getxyz_from_pdb Atoms not found:%s r⍀rP]⍀]PH⍀HPvq3⍀3P]X⍀PD? ⍀ P+&⍀P ⍀P⍀P⍀P⍀P⍀Pv⍀vP|wa⍀aPc^L⍀LPJL e ~  - F _ x $Ë$WO* >/ )!   z thX N ,   N? 6'    ` R   oJA"    *%`    p O(    x rc ]N H9  s m e _ Z T L F A ; p 3 p - ( " W  W    >  >  % %     ~ y s k e ` Z R L G A v 9 v 3 . ( ] ]    D  D  840,($            %  Vw\m=_getpdb_rlb___i686.get_pc_thunk.bx___i686.get_pc_thunk.axdyld_stub_binding_helper___sF_getxyz_from_pdb_mergestr_fprintf_link_na_addresidue_getresidue_linkprot_addstrand_newmolecule_exit_NAB_rematch_getseq_from_pdb_printf_NAB_strcmp_NAB_strcpy #1/20 1199171722 0 0 100644 15332 ` linkprot.o X__text__TEXTd __data__DATA__cstring__TEXTk__literal8__TEXT0 __picsymbolstub2__TEXTP,4r__la_sym_ptr2__DATA+L $8__nl_symbol_ptr__DATAxT &__textcoal_nt__TEXT\ @\9:8 P8(US$ED$D$E$PD$$D$D$E$PD$$D$D$E$~PD$$PD$D$E$LPD$$D$D$E$PD$$D$D$E$PD$$D$D$E$PD$$D$D$E$PD$$VD$D$E$RPD$$$D$D$E$ PD$$D$D$E$PD$$D$D$E$PD$$D$D$E$PD$$\D$D$E$XPD$$*D$D$E$&P D$$D$D$E$PD$$D$D$E$PD$$D$D$E$PD$$bD$ D$E$^P"D$$0D$&D$E$,P(D$$D$,D$E$P.D$$D$2D$E$P4D$$D$8D$E$P:D$$hD$>D$E$dP@D$$6D$DD$E$2PFD$$D$JD$E$PLD$$D$PD$E$PRD$$D$VD$E$PXD$$nD$\D$E$jP^D$$<ED$E$t7D$ED$E$!‹E D$B$E5ED$bD$p$y$TE$[]ÐUSTEEEEEEEE $EED$E$D$D$E $fD$E$.D$E$'t/D$E$ u,5D$Eȉ$EȉD$E$EwKD$E$tQD$E$u,VD$Eȉ$rEȉD$E$gEED$E$PEED$ED$E$1jD$D$' $='t*D$ D$bD$$ D$Eȉ$D$E܉$D$D$' $u='t*D$ D$cD$$# D$Eȉ$8D$E؉$)D$D$' $='t*(D$ D$dD$$ D$Eȉ$D$Eԉ$ZD$D$' $s='t*hD$ D$eD$$! D$Eȉ$6D$EЉ$'E܉D$EԉD$E܉D$E؉D$ E܉D$ED$$D$E$EE9E~ED$ D$D$' $='t*D$ D$nD$$6 D$Eȉ$KD$E܉$<ED$ D$D$' $='t*D$ D$oD$$ D$Eȉ$D$E؉$ED$ !D$D$' $r='t*(D$ D$pD$$  D$Eȉ$5D$Eԉ$&ED$ bD$D$' $='t*hD$ D$qD$$ D$Eȉ$D$EЉ$E܉D$EԉD$E܉D$E؉D$ E܉D$ED$$#D$E$D$ED$E $qD$E$*.D$E$2tQKD$E$t6/D$E$tQD$E$u,VD$Eȉ$EȉD$E$EED$E$EED$E$ED$D$E$JD$E$NuJD$ZD$D$ZD$ ZD$ED$$ D$E$ uGD$ZD$D$ZD$ ZD$ED$$> ED$ZD$D$ZD$ ZD$ED$$ D$E$ EẺD$E$ Ẽ}uDŰEHxXBxŰEX럍D$D$ED$ D$ED$E$ D$ED$nD$ ED$ED$E$ EmEE}ED$ D$D$' $ ='t*D$ D$D$$ D$Eȉ$ D$E܉$ ED$ D$D$' $j ='t*D$ D$D$$ D$Eȉ$- D$E؉$ ED$ !D$D$' $ ='t*(D$ D$D$$ D$Eȉ$ D$Eԉ$ ED$ bD$D$' $W ='t*hD$ D$D$$ D$Eȉ$ D$EЉ$ E܉D$EԉD$E܉D$E؉D$ E܉D$ED$$ D$E$d D$ED$E $ D$E$ .D$E$ tKD$E$ u,D$Eȉ$L EȉD$E$AEw/D$E$= tQD$E$" u,VD$Eȉ$ EȉD$E$EED$E$E< ED$E$ED$D$E$D$E$uJD$ZD$D$ZD$ ZD$ED$$D$E$,uGD$ZD$D$ZD$ ZD$ED$$ED$ZD$D$ZD$ ZD$ED$$8D$E$ EẺD$E$Ẽ}uDŰEHxXBxŰEX럍D$D$ED$ D$ED$E$9D$ED$nD$ ED$ED$E$jD$D$' $[='t*D$ D$D$$  D$Eȉ$D$E܉$D$D$' $='t*D$ D$D$$ D$Eȉ$D$E؉$D$D$' $Y='t*(D$ D$D$$ D$Eȉ$D$Eԉ$ ZD$D$' $='t*hD$ D$D$$ D$Eȉ$D$EЉ$E܉D$EԉD$E܉D$E؉D$ E܉D$ED$$D$E$ET[]AALACCYSDASPEGLUFPHEGGLYHHIDhHIEIILEKLYSLLEUMMETNASNPPROQGLNRARGSSERTTHRVVALWTRPXCYXYTYRnACEcNME3HIP4RIEaNH27ASH8GLHundefined residue "%s" cneutprotein.amber94.N.rlbnneutneutprotein.amber94.rlb:1:C( snprintf( NAB_rsbuf, 10000, ":1:C" ) ) < 10000linkprot.c%s:%u: failed assertion `%s' :1:O( snprintf( NAB_rsbuf, 10000, ":1:O" ) ) < 10000:1:CA( snprintf( NAB_rsbuf, 10000, ":1:CA" ) ) < 10000:1:N( snprintf( NAB_rsbuf, 10000, ":1:N" ) ) < 10000:%d:C( snprintf( NAB_rsbuf, 10000, ":%d:C", i - 1 ) ) < 10000:%d:O( snprintf( NAB_rsbuf, 10000, ":%d:O", i - 1 ) ) < 10000:%d:CA( snprintf( NAB_rsbuf, 10000, ":%d:CA", i - 1 ) ) < 10000:%d:N( snprintf( NAB_rsbuf, 10000, ":%d:N", i ) ) < 10000new:1:CD:1:H1:1:Hfirstlastprotein.amber94.C.rlblxz,C?L F%u?V-?333333?⍀P⍀P~y⍀Pe`⍀PLG⍀P3.m⍀mPX⍀XPC⍀CP.⍀.P⍀P⍀P⍀P⍀Pkf⍀PRM⍀P94⍀P ⍀Pq⍀qP\⍀\P]v %>Wp$Ë$òiZIxXC;X1XX xXXxXXXXxXmqXgXGxXA9X/X@XxX:XxXXXX}xXkXeCX2X,XX XHX@XxaXWXMXCX9qX1XXXXX\XXXXXqXvXpaXTEX<4 XXXXXudX^O3 xXXXXxXoXbSBxX<4X*XXxXyXxXXX@XxnxX\9XL=,xX&XXXxXXXsXmUXDX: X"8X0XXXXXzqXr[XQXGX=X3X)\X X X X X qX  X  X  X} u ^ L = X3 " X  X  X  X    W H 7 xX1 ) X X X  xX X   xX  X X Xp f xXT yXD 5 $ xX  X X @X  xX 9X   xX  X Xo XZ P xX> X     xX  X X Xo e xXS XM > - xX'  X X XxXqXxXXX@XmcxXQ:XK<+xX%XXXxXXtXjYXO>X3!XXXT =1!| n j h {d rcb UI^ @1\ #X V R P L J F xiD [O@ F7> ): 8 4 2 . , ( ~o& aU" L=  /#         u g[ RC 5)       { ma XI ;/ &       sg ^O A5 ,   ss  oo  kk  g~gx s mcec_ Z T_L_F A ;[3[- ( "WhWh  SOSO  O6O6  KK  GG  CC  ??~ y s;k;e ` Z7R7L G A3933 . (/n /n  +U+U HD@<840,($           . $L,_ jp |F_getres_aa___i686.get_pc_thunk.bx_linkprot___i686.get_pc_thunk.axdyld_stub_binding_helper_NAB_rsbuf___sF_connectres_mergestr_NAB_mnext_alignframe_setframe___eprintf_snprintf_addresidue_NAB_strcmp_substr_addstrand_strlen_newmolecule_exit_fprintf_getresidue_NAB_hin_NAB_strcpy_NAB_href #1/20 1199171722 0 0 100644 26236 ` link_na.o X55__text__TEXT}/p8__data__DATA}/Y2__cstring__TEXT/?\2__literal8__TEXT2(5__picsymbolstub2__TEXT2?5]__la_sym_ptr2__DATA'5\8b__nl_symbol_ptr__DATA5`8.__textcoal_nt__TEXT5h8 @cdl Pb0U(EE D$E$4EE$4D$E$44EED$E$R4ED$ED$E$4EUSyDždDž`Dž\DžDžDž DžDžD$E $3u/.D$5$O3DžO./D$E$B3u/D$`$3ED$`$q3ED$`$2E $2D$D$E $b2D$d$3`D$\$3 /D$E$2tQ`$(2D$D$`$1"/D$$1D$\$2ED$\D$d$EDž9~&D$D$E $k1D$d$!2ED$`D$d$&E(/D$//D$4/D$;/D$ //D$ED$$0D$ B/D$D$'4$_0='t*Y/D$ D$L/D$/$ 04D$$81D$ /D$D$'4$/='t*/D$ D$L/D$/$/4D$$0D$ 0D$D$'4$O/='t*90D$ D$L/D$/$.4D$ $(0D$ t0D$D$'4$.='t*0D$ D$L/D$/$u.4D$$/D$ /D$D$'4$?.='t*/D$ D$L/D$/$-4D$$/T$T$T$T$ D$ED$$-D$E$h-D$E$U-92D$(92D$ 92D$A2D$92D$92$,D$h$,D$ED$h$w,92D$(92D$ I2D$92D$92D$92$E,D$h$,D$ED$h$+0D$ED$ED$ 0D$ED$E$+0D$D$0D$ D$ED$E$;+D$ 0D$D$'4$+='t*0D$ D$]/D$/$l+4D$$,D$ 01D$D$'4$9+='t*91D$ D$]/D$/$*4D$$,D$ /D$D$'4$*='t*/D$ D$]/D$/$_*4D$ $+D$ 01D$D$'4$,*='t*91D$ D$]/D$/$)4D$$+D$ 01D$D$'4$)='t*91D$ D$]/D$/$U)4D$$*T$T$T$T$ D$ED$$.)D$E$(Q2D$(92D$ 92D$92D$92D$92$S(D$h$((D$ n1D$D$'4$`(='t*y1D$ D$`/D$/$(4D$$9)D$ED$h$w'D$ 0D$D$'4$'='t*0D$ D$f/D$/$v'4D$$(D$ 01D$D$'4$C'='t*91D$ D$f/D$/$&4D$$(D$ /D$D$'4$&='t*/D$ D$f/D$/$i&4D$ $'D$ 01D$D$'4$6&='t*91D$ D$f/D$/$%4D$$'D$ 01D$D$'4$%='t*91D$ D$f/D$/$_%4D$$&T$T$T$T$ D$ED$$8%D$E$$D$ /D$D$'4$$='t*/D$ D$h/D$/$$4D$$%D$ 1D$D$'4$X$='t*1D$ D$h/D$/$$4D$$1%T$D$E$$#ݝHD$ /D$D$'4$#='t*/D$ D$i/D$/$e#4D$$$D$ 1D$D$'4$2#='t*1D$ D$i/D$/$"4D$$ $T$D$E$!ݝ@92D$(Y2D$ 92D$92D$92D$92$"D$h$!D$ n1D$D$'4$"='t*y1D$ D$k/D$/$!4D$$"D$ED$h$5!D$ 0D$D$'4$!='t*0D$ D$p/D$/$4!4D$$_"D$ 01D$D$'4$!='t*91D$ D$p/D$/$ 4D$$!D$ /D$D$'4$y ='t*/D$ D$p/D$/$' 4D$ $R!D$ 01D$D$'4$='t*91D$ D$p/D$/$4D$$ D$ 01D$D$'4$o='t*91D$ D$p/D$/$4D$$H T$T$T$T$ D$ED$$D$E$D$ /D$D$'4$='t*/D$ D$r/D$/$I4D$$tD$ 1D$D$'4$='t*1D$ D$r/D$/$4D$$T$D$E$ݝ8D$ /D$D$'4$u='t*/D$ D$s/D$/$#4D$$ND$ 1D$D$'4$='t*1D$ D$s/D$/$4D$$T$D$E$ݝ08\H(0\@ 0f(\8(\ ^f(P92D$(PD$ 92D$92D$92D$92$mD$h$BD$ n1D$D$'4$z='t*y1D$ D$x/D$/$(4D$$SD$ED$h$D$D$E $,D$d$`D$\$02D$E$tQ`$D$D$`$22D$$vD$\$^ED$\D$d$cE(/D$//D$4/D$;/D$ //D$ED$$D$ B/D$D$'4$='t*Y/D$ D$/D$/$J4D$$uD$ /D$D$'4$='t*/D$ D$/D$/$4D$$D$ 0D$D$'4$='t*90D$ D$/D$/$:4D$ $eD$ t0D$D$'4$='t*0D$ D$/D$/$4D$$D$ /D$D$'4$|='t*/D$ D$/D$/$*4D$$UT$T$T$T$ D$ED$$D$E$D$E$92D$(92D$ 92D$A2D$92D$92$D$h$D$ED$h$92D$(92D$ I2D$92D$92D$92$D$h$WD$ED$h$!0D$ED$ED$ 0D$ED$E$0D$D$0D$ D$ED$E$xD$ 0D$D$'4$='t*0D$ D$/D$/$4D$$D$ 01D$D$'4$v='t*91D$ D$/D$/$$4D$$OD$ /D$D$'4$='t*/D$ D$/D$/$4D$ $D$ 01D$D$'4$i='t*91D$ D$/D$/$4D$$BD$ 01D$D$'4$='t*91D$ D$/D$/$4D$$T$T$T$T$ D$ED$$kD$E$ Q2D$(92D$ 92D$92D$92D$92$D$h$eD$ n1D$D$'4$='t*y1D$ D$/D$/$K4D$$vD$ED$h$D$ 0D$D$'4$='t*0D$ D$/D$/$4D$$D$ 01D$D$'4$='t*91D$ D$/D$/$.4D$$YD$ /D$D$'4$='t*/D$ D$/D$/$4D$ $D$ 01D$D$'4$s='t*91D$ D$/D$/$!4D$$LD$ 01D$D$'4$='t*91D$ D$/D$/$4D$$T$T$T$T$ D$ED$$uD$E$D$ /D$D$'4$='t*/D$ D$/D$/$ 4D$$|D$ 1D$D$'4$ ='t*1D$ D$/D$/$C 4D$$n|T$D$E$a ݝHD$ /D$D$'4$ ='t*/D$ D$/D$/$ 4D$$ xD$ 1D$D$'4$o ='t*1D$ D$/D$/$ 4D$$H xT$D$E$; ݝ@92D$(Y2D$ 92D$92D$92D$92$N D$h$# D$ n1D$D$'4$[ ='t*y1D$ D$/D$/$ 4D$$4 D$ED$h$r D$ 0D$D$'4$ ='t*0D$ D$/D$/$q 4D$$ tD$ 01D$D$'4$> ='t*91D$ D$/D$/$ 4D$$ pD$ /D$D$'4$ ='t*/D$ D$/D$/$d 4D$ $ lD$ 01D$D$'4$1 ='t*91D$ D$/D$/$4D$$ hD$ 01D$D$'4$='t*91D$ D$/D$/$Z4D$$ tT$pT$lT$hT$ D$ED$$3D$E$D$ /D$D$'4$='t*/D$ D$/D$/$4D$$dD$ 1D$D$'4$S='t*1D$ D$/D$/$4D$$,dT$D$E$ݝ8D$ /D$D$'4$='t*/D$ D$/D$/$`4D$$`D$ 1D$D$'4$-='t*1D$ D$/D$/$4D$$`T$D$E$ݝ08\H(0\@ 0f(\8(\ ^f(P92D$(PD$ 92D$92D$92D$92$D$h$D$ n1D$D$'4$='t*y1D$ D$/D$/$e4D$$D$ED$h$E[]link_na: no sequence dna.amberua.rlb55.rlb:1:O5':1:P:1:O1P:1:O2P:%d:C3'( snprintf( NAB_rsbuf, 10000, ":%d:C3'", i - 1 ) ) < 10000link_na.c%s:%u: failed assertion `%s' :%d:O3'( snprintf( NAB_rsbuf, 10000, ":%d:O3'", i - 1 ) ) < 10000:%d:C4'( snprintf( NAB_rsbuf, 10000, ":%d:C4'", i - 1 ) ) < 10000:%d:C2'( snprintf( NAB_rsbuf, 10000, ":%d:C2'", i - 1 ) ) < 10000firstlastPO3':%d:O5'( snprintf( NAB_rsbuf, 10000, ":%d:O5'", i ) ) < 10000:%d:P( snprintf( NAB_rsbuf, 10000, ":%d:P", i ) ) < 10000:%d:( snprintf( NAB_rsbuf, 10000, ":%d:", i ) ) < 10000:%d:O2P( snprintf( NAB_rsbuf, 10000, ":%d:O2P", i ) ) < 10000:%d:O1P( snprintf( NAB_rsbuf, 10000, ":%d:O1P", i ) ) < 1000033.rlbQ?b@*@?:⍀:P%⍀%P⍀P⍀P⍀P⍀P}⍀Pid⍀PPK⍀P72}⍀}Ph⍀hPS⍀SP>⍀>P)⍀)P⍀P⍀P⍀Poj⍀PVQ⍀P=8⍀P$⍀P ⍀Pl⍀lP23'3@3Y3r3333334!4:4S4l44444455$Ë$a/H/4/5./&/%0/0 /2..5.1...2.2.2y.2[.2---5--%0-0-2-u-5c-w2M-9-53-+-%0!-0-`0,,5,C0,,,5,,%0,0n,@2Y,O,5=,42',,5 ,,%0+0+`0++5+C0++S+?+59+1+%0'+0+1+*5*1**5**%0*0*1{*q*5_*1I*5*5/*'*%0*0 *`0))5)C0))5))%0)0)1n)d)5R)1<)()5"))%0)0(1((5(l1(((5((%0x(0f(2Q(G(55(1%(((2'2'2'2'2'2''|'5v'n'%0d'0R'2='3'5!'w2 '&5&&%0&0&`0&&5&C0&j&V&5P&H&%0>&0,&@2& &5%42%%5%%%0%0%`0%%5v%C0c%P%%$5$$%0$0$1$$5$1$x$5r$j$%0`$0N$19$/$5$1$#5##%0#0#`0##5#C0#k#5e#]#%0S#0A#1,#"#5#1""5""%0"0"1""5"l1{"b"N"5H"@"%06"0$"2""5!1!!!2!2!2!2!2s!2m!Z!!!5! %0 0 1  5 1  5| t %0j 0X 1C 9 5' 1 5%00`05C0u5og%0]0K16,515%0015l1`h1Lf1F.a1[1222222{^L>2.22222o5ia%0W0E`00&5C05%00 150s_5YQ%0G050 505%00`05|C0cO5IA%070%/5//////zh\2T7%2q5kc%0Y0G22(5122222(5%0025w2v5ph%0^0L`07-5C05%00@25z42dP5JB%080&`05C0|5vn%0d0R1=35!1 5%00151r5ld%0Z0H`03)5C05%00151ye5_W%0M0;1&5 l15%0025r1bPB222"22225%002zp5^w2H45.&%00 `05C05%0{0i@2TJ5842"5%00`05C0N:54,%0"01  5 1  5  %0 0 1v l 5Z 1D 0 5* " %0 0 `0  5 C0  5  %0 0~ 1i _ 5M 17 # 5  %0 0 1  5 l1   5 } %0s 0a 2L B 50 1   2 2 2 2 2 2  X D 5> 6 %0, 0 1  5 1  5  %0 0 1 v 5d 1N : 54 , %0" 0 `05C05%001si5W1A-5'%0015l1h1f1ka1Q[1K.222222{2k2[2K2;2+2%5%00`0mc5QC08$5%0 0 1505%00r0]S5A0(5%00`05C05~%0t0b/MC51//////cD2&//~gN</2!/ 5/ oT=8); 555-55' " {54{54  w54w54  s54s54  o54o54  k54k54  g5}4g5}4  c5d4~c5d4x s m_5K4e_5K4_ Z T[524L[524F A ;W543W54- ( "S54S54  O53O53  K53K53  G53G53  C53C53  ?53?53  ;5j3;5j3~ y s75Q3k75Q3e ` Z3583R3583L G A/539/533 . (+53 +53  '52'52 XTPLHD@<840,($         )55xZKe'3qkcW}>A_build_link_na___i686.get_pc_thunk.bx___i686.get_pc_thunk.axdyld_stub_binding_helper_NAB_rsbuf___sF_dist_connectres_mergestr_transformmol_NAB_matcpy_newtransform_alignframe___eprintf_snprintf_setframe_NAB_strcat_NAB_rematch_substr_strlen_setreslibkind_fprintf_NAB_strcmp_addresidue_addstrand_newmolecule_NAB_strcpy_getresname_getres #1/20 1199171724 0 0 100644 135364 ` na_anal.oH cdc __text__TEXT[?d@g__data__DATA[?B__literal8__TEXT`?XB__cstring__TEXT@$D__const__DATA]Da__const__TEXTp^a__picsymbolstub2__TEXTr^a__la_sym_ptr2__DATA cmf//__nl_symbol_ptr__DATAc,g^__textcoal_nt__TEXTc 4g @Z  P((2``UVSM U EX@xMUEXMUEXUEV?XMuEEBxf(YHxXM u EEf(YXM$u$EEBxf(YXM(u(EEBxf(YXM,u,EEf(YX[^]ÐUWVS|=E؍=EЍ=Eȍ=E=E=E=E=E=E=EDžEED$E$`E}upE D$E$`tɍED$$ED$ ED$ED$ED$ED$EȉD$ EЉD$E؉D$E$cqE(E@EXEpE0EHE`ExE8EPEhEE=DžDž;~Dž9~w;~k\f(f(fTЋk\f(fTf.w@3=f.zt,K?D$Wb$]$];~ Љ^9~ЉЉf(Y\bs=f.zt,K?D$Wb$9\$\Љ ^=;~Tf(YX뜋 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;kD$$u‹EE9@D$$u$#{D$Dk$s$%DkD$$u${D$$ztD$$ps|D$Tk$fs$$TkD$$t$ t0|D$$sD$$rC$h t.6|D$$sD$$r$t3P|D$$gsD$$]r$t0k|D$$sD$$rC$t.|D$$rD$$qD${D$$rwrD$$lrU;RkD$$Gr‹EE9*@D$$r$ {D$Dk$&q$P"DkD$$Fr${D$$qD$$p|D$Tk$p$!TkD$$q$>t0|D$$ qD$$pC$t.6|D$$pD$$o$t3P|D$$pD$$o$t0k|D$$PpD$$FoC$t.|D$$ pD$$oD${D$$pEE;E~UE;EudD$U$zoD$$hoD$$VoD$$Ln}UEPEE9ubD$U$nD$$nD$$nD$$mEED$E D$ |D$D$'$Rn='t*|D$ D$TlD$^l$nD$D$nD$ ED$ }D$$l }D$ D$ }D$$lUE;EED$E D$ |D$D$'$km='t*4}D$ D$TlD$^l$mD$D$mD$ ED$ }D$$l }D$ D$ }D$$kED$ED$ |D$D$'$l='t*D$ D$TlD$^l$ClD$D$#mD$ ED$ }D$$D$$:>hD$ D$D$$D$ (D$HD$H$D$$D$D$$RD$hD$H$0HD$D$$D$HD$$)=D$D$$X=D$$=D$D$$hD$D$$<D$D$$<D$($<E(E0E8EPEf(YEPEYXȋEPEYX$l>Ef(YYXȍif.wif.s EE*Ef(YYX$=ݝPP^YE^$[:ݝPPiYY*Ef(PPTf(YYX$<ݝPP^f(YE^$a9ݝPPiYYEEEP*EȋEYiEiY$l;f(ݝPPTEi\ȍiY$;ݝPPX^f( i8 f(fWi(i@ii0iHiXXD$ D$D$X$ED$ iPPD$iXXD$$[D$D$X$D$hD$X$D$D$X$D$D$$6D$$6hD$D$$t6D$h${6D$hD$$D$D$$6D$D$$M6D$$ 6(D$D$$E(E0E|8@f(YYXȍif.ztNf(Yif.w%EPiEPiEiEiY$7f(ݝPPTEi\ȍiY$6ݝPPX^f( i8 f(fWi(i@ii0iH(D$D$$E(E0E|8if.s EEEPiEPiE|p*E$4ݝPPY*Mf(YYX$4ݝPP^YxE|^$f1ݝPPiYYx*Epf(PPThlf(YYX$3ݝPPh^f(pY`E|^$l0ݝPPiYY`EEEPiD$XHD$PD$HPD$@XD$8`D$0hD$(pD$ D$ED$ED$D$ED$ E D$ԁD$$2U؍EEpEhE`EXEPEEHEEU܍EEddD$$4ݝEddD$$ ݝpEddD$$ݝ`EddD$$ݝPEddD$$ݝ@EddD$$bݝ0EddD$$8ݝ EddD$$ݝTzD$$.D$@ D$80D$0@D$(PD$ `D$pD$D$D$$/EddD$D$$ݝxEddD$pD$$xݝhEddD$`D$$DݝXEddD$PD$$ݝHEddD$@D$$ݝ8EddD$0D$$ݝ(EddD$ D$$tݝEddD$D$$@ݝTzD$0$,D$@D$8(D$08D$(HD$ XD$hD$xD$D$$-ME)ЅME)ЅUM E)ЅME )Ѕ0D$@D$r_strand->s_strandname, *( NAB_rri( r, "resnum" ) ), new_a->a_atomname ) ) < 10000na_anal.c%s:%u: failed assertion `%s' Alphasugarpuckeranal%s: can't allocate space for dynamic array "%s" BetaGammaDeltaEpsilonZetaChiPseudorotation *** Sugar Pucker Analysis : Strand number %d. *** Res Type Alpha Beta Gamma Delta Epsilon Zeta Chi Pseudorotation %d:%d:C5'( snprintf( NAB_rsbuf, 10000, "%d:%d:C5'", *str, res ) ) < 10000%d:%d:O5'( snprintf( NAB_rsbuf, 10000, "%d:%d:O5'", *str, res ) ) < 10000%d:%d:P( snprintf( NAB_rsbuf, 10000, "%d:%d:P", *str, res ) ) < 10000%d:%d:O3'( snprintf( NAB_rsbuf, 10000, "%d:%d:O3'", *str, res - 1 ) ) < 10000%d:%d:C4'( snprintf( NAB_rsbuf, 10000, "%d:%d:C4'", *str, res ) ) < 10000%d:%d:P,H5T( snprintf( NAB_rsbuf, 10000, "%d:%d:P,H5T", *str, res ) ) < 10000%d:%d:C3'( snprintf( NAB_rsbuf, 10000, "%d:%d:C3'", *str, res ) ) < 10000( snprintf( NAB_rsbuf, 10000, "%d:%d:O3'", *str, res ) ) < 10000( snprintf( NAB_rsbuf, 10000, "%d:%d:P", *str, res + 1 ) ) < 10000( snprintf( NAB_rsbuf, 10000, "%d:%d:O5'", *str, res + 1 ) ) < 10000%d:%d:C2'( snprintf( NAB_rsbuf, 10000, "%d:%d:C2'", *str, res ) ) < 10000%d:%d:C1'( snprintf( NAB_rsbuf, 10000, "%d:%d:C1'", *str, res ) ) < 10000%d:%d:O4'( snprintf( NAB_rsbuf, 10000, "%d:%d:O4'", *str, res ) ) < 10000strandnum%d:%d:C4( snprintf( NAB_rsbuf, 10000, "%d:%d:C4", *str, res ) ) < 10000%d:%d:N9( snprintf( NAB_rsbuf, 10000, "%d:%d:N9", *str, res ) ) < 10000%d:%d:C2( snprintf( NAB_rsbuf, 10000, "%d:%d:C2", *str, res ) ) < 10000%d:%d:N1( snprintf( NAB_rsbuf, 10000, "%d:%d:N1", *str, res ) ) < 10000%d:%d:N1,N9( snprintf( NAB_rsbuf, 10000, "%d:%d:N1,N9", *str, res ) ) < 10000%2d:%2d%4s - %8.2f%8.2f%8.2f - - %8.2f%8.2f %2d:%2d%4s - %8.2f%8.2f%8.2f%8.2f%8.2f%8.2f%8.2f %2d:%2d%4s%8.2f%8.2f%8.2f%8.2f - - %8.2f%8.2f %2d:%2d%4s%8.2f%8.2f%8.2f%8.2f%8.2f%8.2f%8.2f%8.2f Mean %8.2f%8.2f%8.2f%8.2f%8.2f%8.2f%8.2f%8.2f Mean - %8.2f%8.2f%8.2f - - %8.2f%8.2f Std Dev %8.2f%8.2f%8.2f%8.2f%8.2f%8.2f%8.2f%8.2f Std Dev - %8.2f%8.2f%8.2f - - %8.2f%8.2f *** Local Helical Analysis : Strand %d. *** DX DY DZ Top Base / Bottom Base Inclination Tip HTwist *** Local Helical Analysis : Strands %d and %d. *** Top Basepair / Bottom Basepair Inclination Tip HTwist %8.2f%8.2f%8.2f%8.2f%8.2f %2d:%2d / %2d:%2d %8.2f%2d:%2d - %2d:%2d / %2d:%2d - %2d:%2d %8.2f Mean %8.2f%8.2f%8.2f%8.2f%8.2f%8.2f Standard Deviation %8.2f%8.2f%8.2f%8.2f%8.2f%8.2f *** Adjacent Base Analysis : Strand %d. *** Angle Shift Slide Rise Dist Top Base / Bottom Base Tilt Roll Twist *** Local Basepair Analysis : Strands %d and %d. *** Top Basepair / Bottom Basepair Tilt Roll Twist %8.2f%8.2f%8.2f%8.2f%8.2f%8.2f%8.2f %2d:%2d / %2d:%2d %8.2f%2d:%2d - %2d:%2d / %2d:%2d - %2d:%2d%8.2f Mean %8.2f Standard Deviation %8.2fNABHOMENABHOME not defined. Dist1baseanalDist2TiltRollTwistShiftSlideRiseOmegahAngleInclinationTipHTwistdxdydz1dna/dgdb/basepairs/at.XX.pdbrna/dgdb/basepairs/au.XX.pdb/dgdb/basepairs/ua.XX.pdb/dgdb/basepairs/cg.XIX.pdb/dgdb/basepairs/gc.XIX.pdb/dgdb/basepairs/ta.XX.pdb%d:%d:[^H]?,C1'( snprintf( NAB_rsbuf, 10000, "%d:%d:[^H]?,C1'", *PrimaryStrand, PrimaryBase ) ) < 100001:1:[^H]?,C1'( snprintf( NAB_rsbuf, 10000, "%d:%d:[^H]?,C1'", *PrimaryStrand, PrimaryBase + PrimaryBaseIncrement ) ) < 10000firstlast1:1:C1'2:1:C1'1:2:C1'1:1:C61:2:C6NonWCPrimaryResiduebasepairanalnonReferenceDoes this helix have any non-Watson-Crick base pairs? (y/n) %syYWhich residue of the primary strand ( %d ) forms a non-Watson-Crick base pair (%d-%d) Which base pairing scheme should be used ( e.g., gu.XXVII - See $NABHOME/dgdb/basepairs ) Does this helix have any other non-Watson-Crick base pairs? (y/n) nN"%s" is not a valid answer. *** Basepair Analysis : Strands %d and %d. *** Stretch Stagger Dist Basepair Buckle Prop Opening Angle Shear BucklePropellerTwistOpeningAngle2ShearStretchStagger2.pdb/dgdb/basepairs/( snprintf( NAB_rsbuf, 10000, "%d:%d:[^H]?,C1'", *ComplementaryStrand, ComplementaryBase ) ) < 10000( snprintf( NAB_rsbuf, 10000, "%d:%d:[^H]?,C1'", *ComplementaryStrand, ComplementaryBase + ComplementaryBaseIncrement ) ) < 100002:2:C1'2:1:C62:2:C6%2d:%2d%4s - %2d:%2d%4s%8.2f%8.2f%8.2f%8.2f%8.2f%8.2f%8.2f%8.2f Mean %8.2f Standard Deviation %8.2fIs this helix (A)nti-parallel, (P)arallel, or (S)ingle stranded? Anti-parallel double helix PpParallel double helix SsSingle stranded nstrandsWhich strand should be considered the primary strand (1-%d)? Which strand should be considered the complementary strand (1-%d)? Strand numbers must be between 1 and %d. What is the primary strand starting residue number (1-%d)? What is the primary strand ending residue number (1-%d)? Primary strand residue numbers must be between 1 and %d. What is the complementary strand starting residue number { paired with %d:%d } (1-%d)? What is the complementary strand ending residue number { paired with %d:%d } (1-%d)? Complementary strand residue numbers must be between 1 and %d. Primary strand and complementary strand must have the same number of residues. Do you wish to use the default Pivot Point [ 0, 1.808, 0 ]? 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Rx?D2p?$p?p?x?p?hVp?4x?&p?p?x?p?ex?WEp?7%p?p?x?p?qp?Ox?A/p?p?x?p?x?r`p?R@p? MA1c'AA A@A A@ fUAK:A) AwfAU4   te4#A A A A A A yA kZA L;A -A  A  A   A ~ A t c A Y H A > - A   A    A  A  |A } zA s b vA T C rA 5 $ nA   jA  fA  dA  YA  WA { j LA \ K IA = , FA   DA  @A   @<8 h?uqcug@uSh?ucu@uh?u2]u]uFh?uK,h?uh?uh?uh?uh?uh?uh?uh?uh?uwh?uq d`?  Y cbcb zY tcblcbf aY [cbScbM HY Bcb:cb4 /Y )cb!cb Y cxbcxb Y c_bc_b Y cFbcFb Y c-bc-b Y cbcb Y caca Y zcarcal gY acaYcaS NY Hca@ca: 5Y /ca'ca! Y c~ac~a Y ceacea Y }cLa}cLa Y yc3ayc3a Y ucauca Y qcaqca Y mc`xmc`r mY gic`_ic`Y TY Nec`Fec`@ ;Y 5ac`-ac`' "Y ]c`]c` Y Yck`Yck` Y UcR`UcR` Y Qc9`Qc9` Y Mc `Mc ` Y Ic`Ic` Y Ec_~Ec_x sY mAc_eAc__ ZY T=c_L=c_F AY ;9c_39c_- (Y "5c_5c_ Y 1cq_1cq_ Y -cX_-cX_ Y )c?_)c?_ Y %c&_%c&_ Y !c _!c _ Y c^c^~ yY sc^kc^e `Y Zc^Rc^L GY Ac^9c^3 .Y ( c^ c^ Y  cw^ cw^ |xtplhd`\XTPLHD@<840,($  AE,BO3NC=0/2.1-RLWIQH@XKP;T68V*>J?5:MSDU)49FG(+AE,BO3NC=0/2.1-RLWIQH@XKP;T68V*>J?5:MSDU)49FG(+7<j c c c2jQ< c_6& 30;x uC }K S j[X0^@'2e#J"H%&<&\,\,d,-x 4{H:$/S` =lrmV+uE8B`_get_atom_position___i686.get_pc_thunk.bx_plane_is_ADE_is_CYT_is_GUA_is_THY_is_URA_is_pyrimidine_is_purine_is_DNA_is_RNA_standard_resname_norm_fill_rotation_matrix_make_rotation_matrix_make_3x2_matrix_fill_diagonal___i686.get_pc_thunk.cx_transpose_transpose3x2_inverse2x2_inverse3x3_matrix_multiply_matrix_matrix_multiply_matrix3x2_matrix_multiply_matrix2x3_matrix_multiply_vector_matrix_multiply_vector2x3_matrix_multiply_vector2x1_make_nab_NA_mean_standard_deviation_sugarpuckeranal_local_helical_parameters_helix_properties_baseanal_get_base_parameters_basepairanal_helixanal___i686.get_pc_thunk.axdyld_stub_binding_helper_NAB_rsbuf___sF_atof_countstrandresidues_NAB_mri_atoi_scanf_NAB_readstring_printf_calloc_acos_NAB_ptdot_NAB_ptcrs_NAB_ptsub_NAB_ptcpy_NAB_ptscl_NAB_ptadd_setxyz_from_mol_mergestr_superimpose_getpdb_setreslibkind_getenv_atan_torsion_malloc_setmol_from_xyz___eprintf_snprintf_NAB_rri_NAB_strcat_substr_NAB_index_addresidue_getresidue_addstrand_NAB_rnext_NAB_strcpy_newmolecule_sin_cos_sqrt_NAB_anext_NAB_rematch_NAB_strcmp_exit_fprintf_NAB_aematch_NAB_mnext #1/28 1199171724 0 0 100644 7860 ` setboundsfromdb.o| __text__TEXT __data__DATA __cstring__TEXT  __picsymbolstub2__TEXT|`__la_sym_ptr2__DATA@;|__nl_symbol_ptr__DATA| __textcoal_nt__TEXT @  P"USEEEEEEEEEEEEDžtD$D$Eȉ$ D$EȉD$E$EȉD$E$ẺD$E$E$jE D$EȉD$E${EȉD$E$PẺD$E$>E$EEED$E $ E}u D$E$ ;Eu_ED$E@$$p uDE@D$E$ D$D$E$# D$E$ c D$E$, ;ECED$E@$$ $E@D$E$8 D$D$E$ D$E$ }u/ D$$M Džpe}u/Q D$$ Džp0ED$ ED$| D$$ EED$E $ E}uED$E$l uč D$E$6 t맋ED$ED$ED$ D$D$'$ ='t* D$ D$O D$! $ D$t$ D$E$v EED$E $ E}uED$E$q uč D$E$; t맍? D$E$ u ? D$E$ uED$ED$ED$ D$D$'$ ='t*Q D$ D$V D$! $V D$t$O D$E$@ ED$ED$ED$ED$ D$D$'$ ='t* D$ D$X D$! $D$t$ D$Eĉ$ ED$ED$ED$ED$ D$D$'$`='t*Q D$ D$Z D$! $D$t$ D$E$xD$ED$ED$ED$ ED$ED$Eĉ$uBxD$ED$ED$ ED$E D$E$: xD$ED$ED$ED$ ED$ED$E$uBxD$ED$ED$ ED$E D$E$ED$ EĉD$ D$$6XED$ED$ED$ D$D$'$='t*Q D$ D$e D$! $BD$t$;D$E$,ED$ED$ED$ED$ D$D$'$='t* D$ D$g D$! $D$t$D$Eĉ$ED$ED$ED$ED$ D$D$'$L='t*Q D$ D$i D$! $D$t$D$E$xD$ED$ED$ED$ ED$ED$Eĉ$u_EYEXED$Ef(YME\D$ED$ ED$E D$E$ xD$ED$ED$ED$ ED$ED$E$u_EYEXED$Ef(YME\D$ED$ ED$E D$E$n?ED$ EĉD$ D$$ DžppĴ[]:resnumsetboundsfromdb: 1st residue type unknown setboundsfromdb: 2nd residue type unknown setboundsfromdb: %s -> %s [H]%s:%d:%s( snprintf( NAB_rsbuf, 10000, "%s:%d:%s", i_strandname, ri_resnum, ai->a_atomname ) ) < 10000setboundsfromdb.c%s:%u: failed assertion `%s' [P\*']( snprintf( NAB_rsbuf, 10000, "%s:%d:%s", j_strandname, rj_resnum, aj->a_atomname ) ) < 10000%s:%s-%s:%s( snprintf( NAB_rsbuf, 10000, "%s:%s-%s:%s", rit, ai->a_atomname, rjt, aj->a_atomname ) ) < 10000( snprintf( NAB_rsbuf, 10000, "%s:%s-%s:%s", rjt, aj->a_atomname, rit, ai->a_atomname ) ) < 10000setboundsfromdb: Couldn't find entry for %s in %s ⍀Pv⍀vPa⍀aPL⍀LP7⍀7Ppk"⍀"PWR ⍀ P>9⍀P% ⍀P ⍀P⍀P⍀P⍀Pz⍀zPe⍀ePvqP⍀PP] 9Rk3Le~$Ë$    C   p a M G ? 0 5  # `    0   j`N (0  `  xn S\M93+0 ! `  0 } k VL: 0  `  p_N UDN 8' 0   |r` =,   ` qaW F7 bS ?!     ~x s mvev_ Z T]L]F A ;D3D- ( "++            ~ y s|k|e ` ZcRcL G AJ9J3 . (1 1   <840,($           *[flwB_setboundsfromdb___i686.get_pc_thunk.bx___i686.get_pc_thunk.axdyld_stub_binding_helper_NAB_rsbuf___sF_andbounds_getdist___eprintf_snprintf_NAB_rematch_NAB_aematch_NAB_mnext_fprintf_substr_NAB_strcmp_NAB_rri_NAB_rnext_atoi_NAB_strcpy_split_memset#1/20 1199171724 0 0 100644 3172 ` setchiplane.o|   __text__TEXT\N__data__DATA\__cstring__TEXT\ __literal8__TEXTh__picsymbolstub2__TEXTp} __la_sym_ptr2__DATA __textcoal_nt__TEXT @T P, UWVS\EEEEEEED$E $E}uED$E$MtEED$E $GE}u}u,ND$E$D$E$uEED$E$tND$E$ƍND$E$‹D$$_GEE܉D$E $E܃}u}u,ND$E$,D$E܉$4uEED$E܉$tND$E$ƍND$E܉$‹D$$GND$E$ƍND$E܉$‹D$$YEE؉D$E $E؃}u}u,ND$E܉$&D$E؉$.uEED$E؉$ tND$E$ƍND$E؉$‹D$$GND$E$ƍND$E؉$~‹D$$SND$E܉$OƍND$E؉$8‹D$$ ND$E؉$ END$E܉$ƍND$E$ǍND$E$ZD$MD$D$D$ D$E D$E$NEăEE4EEă\[^_]fullnamex⍀xPwrc⍀cP^YN⍀NPE@9⍀9P,'$⍀$P}$Ë$h\\\\xfW\O@\2 \ \\\xi\O, \\\\rc\I&\\\jH  y ske ` ZRL G A93 . (   uu  &xobW>_setchiplane___i686.get_pc_thunk.bx___i686.get_pc_thunk.axdyld_stub_binding_helper_setchivol_NAB_rematch_NAB_arc_NAB_aematch_NAB_mnext#1/20 1199171725 0 0 100644 8724 ` wc_basepair.o XLL__text__TEXT8 (X__data__DATA8 __cstring__TEXT@ __literal8__TEXTP ,__picsymbolstub2__TEXTp L`__la_sym_ptr2__DATA@__nl_symbol_ptr__DATA@ __textcoal_nt__TEXTD  @  Ph!USEEEEEE E E E썃1 D$E$h 7 D$E$S 1 D$E$> 7 D$E$) E$ D$E؉$ E $ D$E܉$ < D$Ẻ$ G D$Eȉ$ Q D$E؉$g tPU D$E؉$N t7X D$E؉$5 t[ D$E؉$ uA Ee D$Eԉ$ o D$EЉ$ ED$1 D$E$ y D$~ D$ D$ D$ ~ D$ED$$,  D$E؉$] t D$E؉$+ uI E D$Eԉ$0 D$EЉ$ ED$1 D$E$ D$ D$y D$ D$ D$ED$$T  D$E؉$ t D$E؉$S uI Ee D$Eԉ$X o D$EЉ$C ED$1 D$E$ y D$~ D$ D$ D$ ~ D$ED$$|  D$E؉$ t D$E؉${ uA E D$Eԉ$ D$EЉ$k ED$1 D$E$ D$ D$y D$ D$ D$ED$$ D$E؉$t D$E؉$uA E D$Eԉ$ D$EЉ$ED$1 D$E$* D$ D$y D$ D$ D$ED$$3E؉D$ D$1$$eQ D$E܉$tMU D$E܉$t4X D$E܉$t[ D$E܉$iuhE D$7 D$E$,y D$~ D$ D$ D$ ~ D$ED$$ D$E܉$t D$E܉$uhE D$7 D$E$ D$ D$y D$ D$ D$ED$$2 D$E܉$ct D$E܉$1uhE D$7 D$E$y D$~ D$ D$ D$ ~ D$ED$$h D$E܉$t D$E܉$uhE D$7 D$E$X D$ D$y D$ D$ D$ED$$ D$E܉$+t D$E܉$ueE D$7 D$E$ D$ D$y D$ D$ D$ED$$^3E܉D$ D$1$$D$E$D$E$Q D$(Q D$ Y D$Q D$Q D$Q $;D$H$D$ED$H$Q D$(Q D$ Q D$Q D$ED$Q $D$H$D$ED$H$L0 D$1 D$ED$ 6 D$1 D$E$0 D$7 D$ED$ 6 D$7 D$E$E$E$EȉD$ẺD$EЉD$EԉD$ ; D$ED$$D$E$E[]senseantisense::C1'anti::C1'ADEDARA[DR]A[35]sense::C5sense::N3::N1::C4::N3::C5CYT[DR]C[35]*sense::C6sense::N1::C6GUA[DR]G[35]*THYDT[35]*URARU[35]*wc_basepair : unknown sres %s wc_basepair : unknown ares %s firstlast::C1'Gz @ ףp= @f@⍀Pwrv⍀vP^Ya⍀aPE@L⍀LP,'7⍀7P"⍀"P ⍀ P⍀P⍀P⍀P⍀P}x⍀Pd_⍀PKFz⍀zP2-e⍀ePP⍀PP}  , E ^ w $Ë$(   J     F  E  F  ?  } @ s E b @ X ? 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(    u u  <840,($        &DHW]k u>_wc_basepair___i686.get_pc_thunk.bx___i686.get_pc_thunk.axdyld_stub_binding_helper___sF_freemolecule_mergestr_transformmol_NAB_matcpy_newtransform_alignframe_exit_fprintf_setframe_addresidue_NAB_rematch_NAB_strcmp_NAB_strcpy_getresname_addstrand_newmolecule#1/20 1199171725 0 0 100644 3172 ` wc_complement.o| xx__text__TEXTI__data__DATA__cstring__TEXT__picsymbolstub2__TEXT8X *__la_sym_ptr2__DATAO __nl_symbol_ptr__DATAl__textcoal_nt__TEXTp @ P US4EEEED$E$uD$E$gD$E$uD$E$5ED$D$`$O$*E$EEEE;E~D$ED$E$D$E$SD$E$ tUD$E$uED$E$]WD$E$tYD$E$u[D$E$v[D$E$ut]D$E$\uWD$E$*D$E$)t_D$E$uSD$E$|D$E$taD$E$uSD$E$3ED$tD$`$S$.ED$E$D$E$?EE4[]dnatrnauwc_complement: rlt (%s) is not dna/rna, has no W/C complement aAcCgGTUwc_complement: unknown base %s [⍀PGB⍀P.)⍀Pk⍀kPV⍀VPA⍀AP,⍀,P*C$Ë$l  u_ k\m RC  ;,_ "k  c i g g {e qbc WA2a (_ l  w  m\ TE ;*  g;g; c"c"~ y s_ k_ e ` Z[R[L G AW9W3 . 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#nbn- yammp.nab:156 assert 'NTYPES <= 40' failed. yammp.nab:156 'NTYPES' = %d %lf%dyammp.nab:199 assert 'NEXT < 100000' failed. yammp.nab:199 'NEXT' = %d typeivmsbondyammp.nab:225 assert 'MBONA < 6000' failed. yammp.nab:225 'MBONA' = %d ,yammp.nab:237 assert 'icbt < 1000' failed. yammp.nab:237 'icbt' = %d anglyammp.nab:251 assert 'MTHETA < 6000' failed. yammp.nab:251 'MTHETA' = %d yammp.nab:263 assert 'ictt < 1000' failed. yammp.nab:263 'ictt' = %d angn# angn: %s &rst iat=%d,%d,%d,0, r1=0.0, r2=%.2f, r3=170.0, r4=180., rk2=%.2f, rk3=0.0, &end itoryammp.nab:297 assert 'MPHIA < 6000' failed. yammp.nab:297 'MPHIA' = %d yammp.nab:310 assert 'icpt < 1000' failed. yammp.nab:310 'icpt' = %d noen# noen: %s &rst iat=%d,%d,0,0, r1=0.0, r2=%.2f, r3=%.2f, r4=999., rk2=%.4f, rk3=%.4f, &end Unable to open prmtop file %s converted from descriptor by dt_to_prmtop nresidues%6d%6d%6d%6d%6d%6d%6d%6d%6d%6d%6d%6d %6d%6d%6d%6d%6d%6d %-4s .00000000E+00 .00000000E+00 .00000000E+00 .00000000E+00 .00000000E+00%s %16.8E%6d 1.00000000E+00 0.00000000E+00 %6d%6d%6d%6d%6d%6d%6d DUM DUM DUM DUM DUM DUM DUM DUM DUM DUM DUM DUM DUM DUM DUM DUM DUM DUM DUM DUM 1 1 1 1 1 1 1 1 1 1 1 1yammp.nab:669 assert 'm . natoms < 3000' failed. yammp.nab:668 'm . natoms' = %d fulllinktrna.dtyammp.nab:689 assert 'numty < 40' failed. yammp.nab:689 'numty' = %d tatomnum:%d:( snprintf( NAB_rsbuf, 10000, ":%d:", i ) ) < 10000yammp.c%s:%u: failed assertion `%s' ( snprintf( NAB_rsbuf, 10000, ":%d:", j ) ) < 10000( snprintf( NAB_rsbuf, 10000, ":%d:", k ) ) < 10000( snprintf( NAB_rsbuf, 10000, ":%d:", l ) ) < 10000Unable to open prmcrd file %s created by dt_to_prmtop %5d %12.7f%12.7f%12.7fUnable to open archive file %s ARC3 0%8d 0 10 0 3 0 %12.5f %12.5f %12.5f g~Θc??f@n! 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