Réimplémentation du programme DSSP en Python

1est_H.pdb 316KB

12345678910111213141516171819202122232425262728293031323334353637383940414243444546474849505152535455565758596061626364656667686970717273747576777879808182838485868788899091929394959697989910010110210310410510610710810911011111211311411511611711811912012112212312412512612712812913013113213313413513613713813914014114214314414514614714814915015115215315415515615715815916016116216316416516616716816917017117217317417517617717817918018118218318418518618718818919019119219319419519619719819920020120220320420520620720820921021121221321421521621721821922022122222322422522622722822923023123223323423523623723823924024124224324424524624724824925025125225325425525625725825926026126226326426526626726826927027127227327427527627727827928028128228328428528628728828929029129229329429529629729829930030130230330430530630730830931031131231331431531631731831932032132232332432532632732832933033133233333433533633733833934034134234334434534634734834935035135235335435535635735835936036136236336436536636736836937037137237337437537637737837938038138238338438538638738838939039139239339439539639739839940040140240340440540640740840941041141241341441541641741841942042142242342442542642742842943043143243343443543643743843944044144244344444544644744844945045145245345445545645745845946046146246346446546646746846947047147247347447547647747847948048148248348448548648748848949049149249349449549649749849950050150250350450550650750850951051151251351451551651751851952052152252352452552652752852953053153253353453553653753853954054154254354454554654754854955055155255355455555655755855956056156256356456556656756856957057157257357457557657757857958058158258358458558658758858959059159259359459559659759859960060160260360460560660760860961061161261361461561661761861962062162262362462562662762862963063163263363463563663763863964064164264364464564664764864965065165265365465565665765865966066166266366466566666766866967067167267367467567667767867968068168268368468568668768868969069169269369469569669769869970070170270370470570670770870971071171271371471571671771871972072172272372472572672772872973073173273373473573673773873974074174274374474574674774874975075175275375475575675775875976076176276376476576676776876977077177277377477577677777877978078178278378478578678778878979079179279379479579679779879980080180280380480580680780880981081181281381481581681781881982082182282382482582682782882983083183283383483583683783883984084184284384484584684784884985085185285385485585685785885986086186286386486586686786886987087187287387487587687787887988088188288388488588688788888989089189289389489589689789889990090190290390490590690790890991091191291391491591691791891992092192292392492592692792892993093193293393493593693793893994094194294394494594694794894995095195295395495595695795895996096196296396496596696796896997097197297397497597697797897998098198298398498598698798898999099199299399499599699799899910001001100210031004100510061007100810091010101110121013101410151016101710181019102010211022102310241025102610271028102910301031103210331034103510361037103810391040104110421043104410451046104710481049105010511052105310541055105610571058105910601061106210631064106510661067106810691070107110721073107410751076107710781079108010811082108310841085108610871088108910901091109210931094109510961097109810991100110111021103110411051106110711081109111011111112111311141115111611171118111911201121112211231124112511261127112811291130113111321133113411351136113711381139114011411142114311441145114611471148114911501151115211531154115511561157115811591160116111621163116411651166116711681169117011711172117311741175117611771178117911801181118211831184118511861187118811891190119111921193119411951196119711981199120012011202120312041205120612071208120912101211121212131214121512161217121812191220122112221223122412251226122712281229123012311232123312341235123612371238123912401241124212431244124512461247124812491250125112521253125412551256125712581259126012611262126312641265126612671268126912701271127212731274127512761277127812791280128112821283128412851286128712881289129012911292129312941295129612971298129913001301130213031304130513061307130813091310131113121313131413151316131713181319132013211322132313241325132613271328132913301331133213331334133513361337133813391340134113421343134413451346134713481349135013511352135313541355135613571358135913601361136213631364136513661367136813691370137113721373137413751376137713781379138013811382138313841385138613871388138913901391139213931394139513961397139813991400140114021403140414051406140714081409141014111412141314141415141614171418141914201421142214231424142514261427142814291430143114321433143414351436143714381439144014411442144314441445144614471448144914501451145214531454145514561457145814591460146114621463146414651466146714681469147014711472147314741475147614771478147914801481148214831484148514861487148814891490149114921493149414951496149714981499150015011502150315041505150615071508150915101511151215131514151515161517151815191520152115221523152415251526152715281529153015311532153315341535153615371538153915401541154215431544154515461547154815491550155115521553155415551556155715581559156015611562156315641565156615671568156915701571157215731574157515761577157815791580158115821583158415851586158715881589159015911592159315941595159615971598159916001601160216031604160516061607160816091610161116121613161416151616161716181619162016211622162316241625162616271628162916301631163216331634163516361637163816391640164116421643164416451646164716481649165016511652165316541655165616571658165916601661166216631664166516661667166816691670167116721673167416751676167716781679168016811682168316841685168616871688168916901691169216931694169516961697169816991700170117021703170417051706170717081709171017111712171317141715171617171718171917201721172217231724172517261727172817291730173117321733173417351736173717381739174017411742174317441745174617471748174917501751175217531754175517561757175817591760176117621763176417651766176717681769177017711772177317741775177617771778177917801781178217831784178517861787178817891790179117921793179417951796179717981799180018011802180318041805180618071808180918101811181218131814181518161817181818191820182118221823182418251826182718281829183018311832183318341835183618371838183918401841184218431844184518461847184818491850185118521853185418551856185718581859186018611862186318641865186618671868186918701871187218731874187518761877187818791880188118821883188418851886188718881889189018911892189318941895189618971898189919001901190219031904190519061907190819091910191119121913191419151916191719181919192019211922192319241925192619271928192919301931193219331934193519361937193819391940194119421943194419451946194719481949195019511952195319541955195619571958195919601961196219631964196519661967196819691970197119721973197419751976197719781979198019811982198319841985198619871988198919901991199219931994199519961997199819992000200120022003200420052006200720082009201020112012201320142015201620172018201920202021202220232024202520262027202820292030203120322033203420352036203720382039204020412042204320442045204620472048204920502051205220532054205520562057205820592060206120622063206420652066206720682069207020712072207320742075207620772078207920802081208220832084208520862087208820892090209120922093209420952096209720982099210021012102210321042105210621072108210921102111211221132114211521162117211821192120212121222123212421252126212721282129213021312132213321342135213621372138213921402141214221432144214521462147214821492150215121522153215421552156215721582159216021612162216321642165216621672168216921702171217221732174217521762177217821792180218121822183218421852186218721882189219021912192219321942195219621972198219922002201220222032204220522062207220822092210221122122213221422152216221722182219222022212222222322242225222622272228222922302231223222332234223522362237223822392240224122422243224422452246224722482249225022512252225322542255225622572258225922602261226222632264226522662267226822692270227122722273227422752276227722782279228022812282228322842285228622872288228922902291229222932294229522962297229822992300230123022303230423052306230723082309231023112312231323142315231623172318231923202321232223232324232523262327232823292330233123322333233423352336233723382339234023412342234323442345234623472348234923502351235223532354235523562357235823592360236123622363236423652366236723682369237023712372237323742375237623772378237923802381238223832384238523862387238823892390239123922393239423952396239723982399240024012402240324042405240624072408240924102411241224132414241524162417241824192420242124222423242424252426242724282429243024312432243324342435243624372438243924402441244224432444244524462447244824492450245124522453245424552456245724582459246024612462246324642465246624672468246924702471247224732474247524762477247824792480248124822483248424852486248724882489249024912492249324942495249624972498249925002501250225032504250525062507250825092510251125122513251425152516251725182519252025212522252325242525252625272528252925302531253225332534253525362537253825392540254125422543254425452546254725482549255025512552255325542555255625572558255925602561256225632564256525662567256825692570257125722573257425752576257725782579258025812582258325842585258625872588258925902591259225932594259525962597259825992600260126022603260426052606260726082609261026112612261326142615261626172618261926202621262226232624262526262627262826292630263126322633263426352636263726382639264026412642264326442645264626472648264926502651265226532654265526562657265826592660266126622663266426652666266726682669267026712672267326742675267626772678267926802681268226832684268526862687268826892690269126922693269426952696269726982699270027012702270327042705270627072708270927102711271227132714271527162717271827192720272127222723272427252726272727282729273027312732273327342735273627372738273927402741274227432744274527462747274827492750275127522753275427552756275727582759276027612762276327642765276627672768276927702771277227732774277527762777277827792780278127822783278427852786278727882789279027912792279327942795279627972798279928002801280228032804280528062807280828092810281128122813281428152816281728182819282028212822282328242825282628272828282928302831283228332834283528362837283828392840284128422843284428452846284728482849285028512852285328542855285628572858285928602861286228632864286528662867286828692870287128722873287428752876287728782879288028812882288328842885288628872888288928902891289228932894289528962897289828992900290129022903290429052906290729082909291029112912291329142915291629172918291929202921292229232924292529262927292829292930293129322933293429352936293729382939294029412942294329442945294629472948294929502951295229532954295529562957295829592960296129622963296429652966296729682969297029712972297329742975297629772978297929802981298229832984298529862987298829892990299129922993299429952996299729982999300030013002300330043005300630073008300930103011301230133014301530163017301830193020302130223023302430253026302730283029303030313032303330343035303630373038303930403041304230433044304530463047304830493050305130523053305430553056305730583059306030613062306330643065306630673068306930703071307230733074307530763077307830793080308130823083308430853086308730883089309030913092309330943095309630973098309931003101310231033104310531063107310831093110311131123113311431153116311731183119312031213122312331243125312631273128312931303131313231333134313531363137313831393140314131423143314431453146314731483149315031513152315331543155315631573158315931603161316231633164316531663167316831693170317131723173317431753176317731783179318031813182318331843185318631873188318931903191319231933194319531963197319831993200320132023203320432053206320732083209321032113212321332143215321632173218321932203221322232233224322532263227322832293230323132323233323432353236323732383239324032413242324332443245324632473248324932503251325232533254325532563257325832593260326132623263326432653266326732683269327032713272327332743275327632773278327932803281328232833284328532863287328832893290329132923293329432953296329732983299330033013302330333043305330633073308330933103311331233133314331533163317331833193320332133223323332433253326332733283329333033313332333333343335333633373338333933403341334233433344334533463347334833493350335133523353335433553356335733583359336033613362336333643365336633673368336933703371337233733374337533763377337833793380338133823383338433853386338733883389339033913392339333943395339633973398339934003401340234033404340534063407340834093410341134123413341434153416341734183419342034213422342334243425342634273428342934303431343234333434343534363437343834393440344134423443344434453446344734483449345034513452345334543455345634573458345934603461346234633464346534663467346834693470347134723473347434753476347734783479348034813482348334843485348634873488348934903491349234933494349534963497349834993500350135023503350435053506350735083509351035113512351335143515351635173518351935203521352235233524352535263527352835293530353135323533353435353536353735383539354035413542354335443545354635473548354935503551355235533554355535563557355835593560356135623563356435653566356735683569357035713572357335743575357635773578357935803581358235833584358535863587358835893590359135923593359435953596359735983599360036013602360336043605360636073608360936103611361236133614361536163617361836193620362136223623362436253626362736283629363036313632363336343635363636373638363936403641364236433644364536463647364836493650365136523653365436553656365736583659366036613662366336643665366636673668366936703671367236733674367536763677367836793680368136823683368436853686368736883689369036913692369336943695369636973698369937003701370237033704370537063707370837093710371137123713371437153716371737183719372037213722372337243725372637273728372937303731373237333734373537363737373837393740374137423743374437453746374737483749375037513752375337543755375637573758375937603761376237633764376537663767376837693770377137723773377437753776377737783779378037813782378337843785378637873788378937903791379237933794379537963797379837993800380138023803380438053806380738083809381038113812381338143815381638173818381938203821382238233824382538263827382838293830383138323833383438353836383738383839384038413842384338443845384638473848384938503851385238533854385538563857385838593860386138623863386438653866386738683869387038713872387338743875387638773878387938803881388238833884388538863887388838893890389138923893389438953896389738983899390039013902390339043905390639073908390939103911391239133914391539163917391839193920392139223923392439253926392739283929393039313932393339343935393639373938393939403941394239433944394539463947394839493950395139523953395439553956395739583959396039613962396339643965396639673968396939703971397239733974397539763977397839793980398139823983398439853986398739883989399039913992399339943995399639973998399940004001400240034004400540064007400840094010401140124013401440154016401740184019402040214022402340244025402640274028402940304031403240334034403540364037403840394040404140424043404440454046404740484049405040514052405340544055405640574058405940604061406240634064406540664067406840694070407140724073407440754076407740784079408040814082408340844085408640874088408940904091409240934094409540964097409840994100410141024103410441054106410741084109411041114112411341144115411641174118411941204121412241234124412541264127412841294130413141324133413441354136413741384139414041414142414341444145414641474148414941504151415241534154415541564157415841594160416141624163416441654166416741684169417041714172417341744175417641774178417941804181418241834184418541864187418841894190419141924193419441954196419741984199420042014202420342044205420642074208420942104211421242134214421542164217421842194220422142224223422442254226422742284229
  1. USER MOD reduce.3.23.130521 H: found=0, std=0, add=1752, rem=0, adj=56
  2. HEADER HYDROLASE 17-MAY-76 1EST
  3. TITLE THE ATOMIC STRUCTURE OF CRYSTALLINE PORCINE PANCREATIC ELASTASE AT 2.5
  4. TITLE 2 ANGSTROMS RESOLUTION. COMPARISONS WITH THE STRUCTURE OF ALPHA-
  5. TITLE 3 CHYMOTRYPSIN
  6. COMPND MOL_ID: 1;
  7. COMPND 2 MOLECULE: PORCINE PANCREATIC ELASTASE;
  8. COMPND 3 CHAIN: A;
  9. COMPND 4 EC: 3.4.21.36;
  10. COMPND 5 ENGINEERED: YES
  11. SOURCE MOL_ID: 1;
  12. SOURCE 2 ORGANISM_SCIENTIFIC: SUS SCROFA;
  13. SOURCE 3 ORGANISM_COMMON: PIG;
  14. SOURCE 4 ORGANISM_TAXID: 9823
  15. KEYWDS HYDROLASE (SERINE PROTEINASE), HYDROLASE
  16. EXPDTA X-RAY DIFFRACTION
  17. AUTHOR L.SAWYER,D.M.SHOTTON,H.C.WATSON
  18. REVDAT 13 24-AUG-11 1EST 1 HEADER HET HETATM HETNAM
  19. REVDAT 13 2 1 LINK REMARK VERSN
  20. REVDAT 12 24-FEB-09 1EST 1 VERSN
  21. REVDAT 11 01-APR-03 1EST 1 JRNL
  22. REVDAT 10 16-OCT-87 1EST 1 SOURCE JRNL
  23. REVDAT 9 30-SEP-83 1EST 1 REVDAT
  24. REVDAT 8 15-JAN-82 1EST 1 REMARK
  25. REVDAT 7 20-APR-81 1EST 1 HELIX
  26. REVDAT 6 31-DEC-80 1EST 1 REMARK
  27. REVDAT 5 25-MAY-78 1EST 1 JRNL
  28. REVDAT 4 01-NOV-77 1EST 1 COMPND SOURCE AUTHOR REMARK
  29. REVDAT 4 2 1 FORMUL SSBOND
  30. REVDAT 3 13-JUN-77 1EST 1 HET
  31. REVDAT 2 03-JAN-77 1EST 2 CONECT
  32. REVDAT 1 27-MAY-76 1EST 0
  33. JRNL AUTH L.SAWYER,D.M.SHOTTON,J.W.CAMPBELL,P.L.WENDELL,H.MUIRHEAD,
  34. JRNL AUTH 2 H.C.WATSON,R.DIAMOND,R.C.LADNER
  35. JRNL TITL THE ATOMIC STRUCTURE OF CRYSTALLINE PORCINE PANCREATIC
  36. JRNL TITL 2 ELASTASE AT 2.5 A RESOLUTION: COMPARISONS WITH THE STRUCTURE
  37. JRNL TITL 3 OF ALPHA-CHYMOTRYPSIN.
  38. JRNL REF J.MOL.BIOL. V. 118 137 1978
  39. JRNL REFN ISSN 0022-2836
  40. JRNL PMID 628010
  41. JRNL DOI 10.1016/0022-2836(78)90412-6
  42. REMARK 1
  43. REMARK 1 REFERENCE 1
  44. REMARK 1 AUTH L.SAWYER,D.M.SHOTTON,H.C.WATSON
  45. REMARK 1 TITL ATOMIC COORDINATES FOR TOSYL-ELASTASE
  46. REMARK 1 REF BIOCHEM.BIOPHYS.RES.COMMUN. V. 53 944 1973
  47. REMARK 1 REFN ISSN 0006-291X
  48. REMARK 1 REFERENCE 2
  49. REMARK 1 AUTH D.M.SHOTTON,B.S.HARTLEY
  50. REMARK 1 TITL AMINO-ACID SEQUENCE OF PORCINE PANCREATIC ELASTASE AND ITS
  51. REMARK 1 TITL 2 HOMOLOGIES WITH OTHER SERINE PROTEINASES
  52. REMARK 1 REF NATURE V. 225 802 1970
  53. REMARK 1 REFN ISSN 0028-0836
  54. REMARK 1 REFERENCE 3
  55. REMARK 1 AUTH H.C.WATSON,D.M.SHOTTON,J.M.COX,H.MUIRHEAD
  56. REMARK 1 TITL THREE-DIMENSIONAL FOURIER SYNTHESIS OF TOSYL-ELASTASE AT 3.5
  57. REMARK 1 TITL 2 ANGSTROMS RESOLUTION
  58. REMARK 1 REF NATURE V. 225 806 1970
  59. REMARK 1 REFN ISSN 0028-0836
  60. REMARK 1 REFERENCE 4
  61. REMARK 1 AUTH D.M.SHOTTON,H.C.WATSON
  62. REMARK 1 TITL THREE DIMENSIONAL STRUCTURE OF TOSYL-ELASTASE
  63. REMARK 1 REF NATURE V. 225 811 1970
  64. REMARK 1 REFN ISSN 0028-0836
  65. REMARK 1 REFERENCE 5
  66. REMARK 1 EDIT R.J.FELDMANN
  67. REMARK 1 REF ATLAS OF MACROMOLECULAR 233 1976
  68. REMARK 1 REF 2 STRUCTURE ON MICROFICHE
  69. REMARK 1 PUBL TRACOR JITCO,INC.,ROCKVILLE,MD.
  70. REMARK 1 REFN
  71. REMARK 1 REFERENCE 6
  72. REMARK 1 EDIT M.O.DAYHOFF
  73. REMARK 1 REF ATLAS OF PROTEIN SEQUENCE V. 5 96 1976
  74. REMARK 1 REF 2 AND STRUCTURE,SUPPLEMENT 2
  75. REMARK 1 PUBL NATIONAL BIOMEDICAL RESEARCH FOUNDATION, SILVER SPRING,MD.
  76. REMARK 1 REFN ISSN 0-912466-05-7
  77. REMARK 2
  78. REMARK 2 RESOLUTION. 2.50 ANGSTROMS.
  79. REMARK 3
  80. REMARK 3 REFINEMENT.
  81. REMARK 3 PROGRAM : NULL
  82. REMARK 3 AUTHORS : NULL
  83. REMARK 3
  84. REMARK 3 DATA USED IN REFINEMENT.
  85. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.50
  86. REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : NULL
  87. REMARK 3 DATA CUTOFF (SIGMA(F)) : NULL
  88. REMARK 3 DATA CUTOFF HIGH (ABS(F)) : NULL
  89. REMARK 3 DATA CUTOFF LOW (ABS(F)) : NULL
  90. REMARK 3 COMPLETENESS (WORKING+TEST) (%) : NULL
  91. REMARK 3 NUMBER OF REFLECTIONS : NULL
  92. REMARK 3
  93. REMARK 3 FIT TO DATA USED IN REFINEMENT.
  94. REMARK 3 CROSS-VALIDATION METHOD : NULL
  95. REMARK 3 FREE R VALUE TEST SET SELECTION : NULL
  96. REMARK 3 R VALUE (WORKING SET) : NULL
  97. REMARK 3 FREE R VALUE : NULL
  98. REMARK 3 FREE R VALUE TEST SET SIZE (%) : NULL
  99. REMARK 3 FREE R VALUE TEST SET COUNT : NULL
  100. REMARK 3 ESTIMATED ERROR OF FREE R VALUE : NULL
  101. REMARK 3
  102. REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN.
  103. REMARK 3 TOTAL NUMBER OF BINS USED : NULL
  104. REMARK 3 BIN RESOLUTION RANGE HIGH (A) : NULL
  105. REMARK 3 BIN RESOLUTION RANGE LOW (A) : NULL
  106. REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : NULL
  107. REMARK 3 REFLECTIONS IN BIN (WORKING SET) : NULL
  108. REMARK 3 BIN R VALUE (WORKING SET) : NULL
  109. REMARK 3 BIN FREE R VALUE : NULL
  110. REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : NULL
  111. REMARK 3 BIN FREE R VALUE TEST SET COUNT : NULL
  112. REMARK 3 ESTIMATED ERROR OF BIN FREE R VALUE : NULL
  113. REMARK 3
  114. REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT.
  115. REMARK 3 PROTEIN ATOMS : 1822
  116. REMARK 3 NUCLEIC ACID ATOMS : 0
  117. REMARK 3 HETEROGEN ATOMS : 11
  118. REMARK 3 SOLVENT ATOMS : 25
  119. REMARK 3
  120. REMARK 3 B VALUES.
  121. REMARK 3 FROM WILSON PLOT (A**2) : NULL
  122. REMARK 3 MEAN B VALUE (OVERALL, A**2) : NULL
  123. REMARK 3 OVERALL ANISOTROPIC B VALUE.
  124. REMARK 3 B11 (A**2) : NULL
  125. REMARK 3 B22 (A**2) : NULL
  126. REMARK 3 B33 (A**2) : NULL
  127. REMARK 3 B12 (A**2) : NULL
  128. REMARK 3 B13 (A**2) : NULL
  129. REMARK 3 B23 (A**2) : NULL
  130. REMARK 3
  131. REMARK 3 ESTIMATED COORDINATE ERROR.
  132. REMARK 3 ESD FROM LUZZATI PLOT (A) : NULL
  133. REMARK 3 ESD FROM SIGMAA (A) : NULL
  134. REMARK 3 LOW RESOLUTION CUTOFF (A) : NULL
  135. REMARK 3
  136. REMARK 3 CROSS-VALIDATED ESTIMATED COORDINATE ERROR.
  137. REMARK 3 ESD FROM C-V LUZZATI PLOT (A) : NULL
  138. REMARK 3 ESD FROM C-V SIGMAA (A) : NULL
  139. REMARK 3
  140. REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES.
  141. REMARK 3 BOND LENGTHS (A) : NULL
  142. REMARK 3 BOND ANGLES (DEGREES) : NULL
  143. REMARK 3 DIHEDRAL ANGLES (DEGREES) : NULL
  144. REMARK 3 IMPROPER ANGLES (DEGREES) : NULL
  145. REMARK 3
  146. REMARK 3 ISOTROPIC THERMAL MODEL : NULL
  147. REMARK 3
  148. REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. RMS SIGMA
  149. REMARK 3 MAIN-CHAIN BOND (A**2) : NULL ; NULL
  150. REMARK 3 MAIN-CHAIN ANGLE (A**2) : NULL ; NULL
  151. REMARK 3 SIDE-CHAIN BOND (A**2) : NULL ; NULL
  152. REMARK 3 SIDE-CHAIN ANGLE (A**2) : NULL ; NULL
  153. REMARK 3
  154. REMARK 3 NCS MODEL : NULL
  155. REMARK 3
  156. REMARK 3 NCS RESTRAINTS. RMS SIGMA/WEIGHT
  157. REMARK 3 GROUP 1 POSITIONAL (A) : NULL ; NULL
  158. REMARK 3 GROUP 1 B-FACTOR (A**2) : NULL ; NULL
  159. REMARK 3
  160. REMARK 3 PARAMETER FILE 1 : NULL
  161. REMARK 3 TOPOLOGY FILE 1 : NULL
  162. REMARK 3
  163. REMARK 3 OTHER REFINEMENT REMARKS:
  164. REMARK 3 COORDINATES FOR THE 27 WATER MOLECULES AND 1 SULPHATE ION
  165. REMARK 3 WERE TAKEN FROM THE ARTICLE CITED AS REFERENCE 1.
  166. REMARK 4
  167. REMARK 4 1EST COMPLIES WITH FORMAT V. 3.15, 01-DEC-08
  168. REMARK 100
  169. REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY BNL.
  170. REMARK 200
  171. REMARK 200 EXPERIMENTAL DETAILS
  172. REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION
  173. REMARK 200 DATE OF DATA COLLECTION : NULL
  174. REMARK 200 TEMPERATURE (KELVIN) : NULL
  175. REMARK 200 PH : NULL
  176. REMARK 200 NUMBER OF CRYSTALS USED : NULL
  177. REMARK 200
  178. REMARK 200 SYNCHROTRON (Y/N) : NULL
  179. REMARK 200 RADIATION SOURCE : NULL
  180. REMARK 200 BEAMLINE : NULL
  181. REMARK 200 X-RAY GENERATOR MODEL : NULL
  182. REMARK 200 MONOCHROMATIC OR LAUE (M/L) : NULL
  183. REMARK 200 WAVELENGTH OR RANGE (A) : NULL
  184. REMARK 200 MONOCHROMATOR : NULL
  185. REMARK 200 OPTICS : NULL
  186. REMARK 200
  187. REMARK 200 DETECTOR TYPE : NULL
  188. REMARK 200 DETECTOR MANUFACTURER : NULL
  189. REMARK 200 INTENSITY-INTEGRATION SOFTWARE : NULL
  190. REMARK 200 DATA SCALING SOFTWARE : NULL
  191. REMARK 200
  192. REMARK 200 NUMBER OF UNIQUE REFLECTIONS : NULL
  193. REMARK 200 RESOLUTION RANGE HIGH (A) : NULL
  194. REMARK 200 RESOLUTION RANGE LOW (A) : NULL
  195. REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL
  196. REMARK 200
  197. REMARK 200 OVERALL.
  198. REMARK 200 COMPLETENESS FOR RANGE (%) : NULL
  199. REMARK 200 DATA REDUNDANCY : NULL
  200. REMARK 200 R MERGE (I) : NULL
  201. REMARK 200 R SYM (I) : NULL
  202. REMARK 200 <I/SIGMA(I)> FOR THE DATA SET : NULL
  203. REMARK 200
  204. REMARK 200 IN THE HIGHEST RESOLUTION SHELL.
  205. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : NULL
  206. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : NULL
  207. REMARK 200 COMPLETENESS FOR SHELL (%) : NULL
  208. REMARK 200 DATA REDUNDANCY IN SHELL : NULL
  209. REMARK 200 R MERGE FOR SHELL (I) : NULL
  210. REMARK 200 R SYM FOR SHELL (I) : NULL
  211. REMARK 200 <I/SIGMA(I)> FOR SHELL : NULL
  212. REMARK 200
  213. REMARK 200 DIFFRACTION PROTOCOL: NULL
  214. REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: NULL
  215. REMARK 200 SOFTWARE USED: NULL
  216. REMARK 200 STARTING MODEL: NULL
  217. REMARK 200
  218. REMARK 200 REMARK: NULL
  219. REMARK 280
  220. REMARK 280 CRYSTAL
  221. REMARK 280 SOLVENT CONTENT, VS (%): 43.42
  222. REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.17
  223. REMARK 280
  224. REMARK 280 CRYSTALLIZATION CONDITIONS: NULL
  225. REMARK 290
  226. REMARK 290 CRYSTALLOGRAPHIC SYMMETRY
  227. REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 21 21 21
  228. REMARK 290
  229. REMARK 290 SYMOP SYMMETRY
  230. REMARK 290 NNNMMM OPERATOR
  231. REMARK 290 1555 X,Y,Z
  232. REMARK 290 2555 -X+1/2,-Y,Z+1/2
  233. REMARK 290 3555 -X,Y+1/2,-Z+1/2
  234. REMARK 290 4555 X+1/2,-Y+1/2,-Z
  235. REMARK 290
  236. REMARK 290 WHERE NNN -> OPERATOR NUMBER
  237. REMARK 290 MMM -> TRANSLATION VECTOR
  238. REMARK 290
  239. REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS
  240. REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM
  241. REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY
  242. REMARK 290 RELATED MOLECULES.
  243. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000
  244. REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000
  245. REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000
  246. REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 25.75000
  247. REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000
  248. REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 37.75000
  249. REMARK 290 SMTRY1 3 -1.000000 0.000000 0.000000 0.00000
  250. REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 29.00000
  251. REMARK 290 SMTRY3 3 0.000000 0.000000 -1.000000 37.75000
  252. REMARK 290 SMTRY1 4 1.000000 0.000000 0.000000 25.75000
  253. REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 29.00000
  254. REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000
  255. REMARK 290
  256. REMARK 290 REMARK: NULL
  257. REMARK 300
  258. REMARK 300 BIOMOLECULE: 1
  259. REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM
  260. REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN
  261. REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON
  262. REMARK 300 BURIED SURFACE AREA.
  263. REMARK 350
  264. REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN
  265. REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE
  266. REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS
  267. REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND
  268. REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN.
  269. REMARK 350
  270. REMARK 350 BIOMOLECULE: 1
  271. REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC
  272. REMARK 350 APPLY THE FOLLOWING TO CHAINS: A
  273. REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000
  274. REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000
  275. REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000
  276. REMARK 500
  277. REMARK 500 GEOMETRY AND STEREOCHEMISTRY
  278. REMARK 500 SUBTOPIC: CLOSE CONTACTS IN SAME ASYMMETRIC UNIT
  279. REMARK 500
  280. REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT.
  281. REMARK 500
  282. REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE
  283. REMARK 500 OG SER A 195 S TSU A 247 1.45
  284. REMARK 500 O GLN A 75 O HOH A 272 1.92
  285. REMARK 500 OD1 ASN A 77 O HOH A 272 2.07
  286. REMARK 500 O ASN A 72 O HOH A 272 2.10
  287. REMARK 500 O HOH A 266 O HOH A 267 2.18
  288. REMARK 500
  289. REMARK 500 REMARK: NULL
  290. REMARK 500
  291. REMARK 500 GEOMETRY AND STEREOCHEMISTRY
  292. REMARK 500 SUBTOPIC: COVALENT BOND LENGTHS
  293. REMARK 500
  294. REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES
  295. REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE
  296. REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN
  297. REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).
  298. REMARK 500
  299. REMARK 500 STANDARD TABLE:
  300. REMARK 500 FORMAT: (10X,I3,1X,2(A3,1X,A1,I4,A1,1X,A4,3X),1X,F6.3)
  301. REMARK 500
  302. REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999
  303. REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996
  304. REMARK 500
  305. REMARK 500 M RES CSSEQI ATM1 RES CSSEQI ATM2 DEVIATION
  306. REMARK 500 TRP A 27 NE1 TRP A 27 CE2 -0.096
  307. REMARK 500 TRP A 38 NE1 TRP A 38 CE2 -0.096
  308. REMARK 500 TRP A 51 NE1 TRP A 51 CE2 -0.096
  309. REMARK 500 TRP A 94 NE1 TRP A 94 CE2 -0.096
  310. REMARK 500 TRP A 141 NE1 TRP A 141 CE2 -0.095
  311. REMARK 500 TRP A 172 NE1 TRP A 172 CE2 -0.097
  312. REMARK 500 TRP A 237 NE1 TRP A 237 CE2 -0.096
  313. REMARK 500
  314. REMARK 500 REMARK: NULL
  315. REMARK 500
  316. REMARK 500 GEOMETRY AND STEREOCHEMISTRY
  317. REMARK 500 SUBTOPIC: TORSION ANGLES
  318. REMARK 500
  319. REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS:
  320. REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER;
  321. REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).
  322. REMARK 500
  323. REMARK 500 STANDARD TABLE:
  324. REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2)
  325. REMARK 500
  326. REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI-
  327. REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400
  328. REMARK 500
  329. REMARK 500 M RES CSSEQI PSI PHI
  330. REMARK 500 ARG A 24 -47.16 -25.92
  331. REMARK 500 GLU A 62 79.88 -59.54
  332. REMARK 500 HIS A 71 -53.19 -139.06
  333. REMARK 500 ASN A 76 105.70 -59.25
  334. REMARK 500 PRO A 92 -18.69 -43.13
  335. REMARK 500 THR A 96 -39.57 -36.52
  336. REMARK 500 TYR A 101 24.49 48.03
  337. REMARK 500 ASN A 115 -159.95 -139.22
  338. REMARK 500 ASN A 133 8.79 85.71
  339. REMARK 500 ASP A 164 171.31 -58.49
  340. REMARK 500 TYR A 171 -112.76 -109.43
  341. REMARK 500 GLN A 192 107.73 -42.07
  342. REMARK 500 SER A 195 139.16 -38.08
  343. REMARK 500 THR A 213 107.51 -38.46
  344. REMARK 500 SER A 214 -70.91 -98.61
  345. REMARK 500 LYS A 224 72.81 -118.26
  346. REMARK 500 ARG A 230 86.08 -59.39
  347. REMARK 500
  348. REMARK 500 REMARK: NULL
  349. REMARK 500
  350. REMARK 500 GEOMETRY AND STEREOCHEMISTRY
  351. REMARK 500 SUBTOPIC: NON-CIS, NON-TRANS
  352. REMARK 500
  353. REMARK 500 THE FOLLOWING PEPTIDE BONDS DEVIATE SIGNIFICANTLY FROM BOTH
  354. REMARK 500 CIS AND TRANS CONFORMATION. CIS BONDS, IF ANY, ARE LISTED
  355. REMARK 500 ON CISPEP RECORDS. TRANS IS DEFINED AS 180 +/- 30 AND
  356. REMARK 500 CIS IS DEFINED AS 0 +/- 30 DEGREES.
  357. REMARK 500 MODEL OMEGA
  358. REMARK 500 GLY A 197 PRO A 198 -147.45
  359. REMARK 500
  360. REMARK 500 REMARK: NULL
  361. REMARK 500
  362. REMARK 500 GEOMETRY AND STEREOCHEMISTRY
  363. REMARK 500 SUBTOPIC: PLANAR GROUPS
  364. REMARK 500
  365. REMARK 500 PLANAR GROUPS IN THE FOLLOWING RESIDUES HAVE A TOTAL
  366. REMARK 500 RMS DISTANCE OF ALL ATOMS FROM THE BEST-FIT PLANE
  367. REMARK 500 BY MORE THAN AN EXPECTED VALUE OF 6*RMSD, WITH AN
  368. REMARK 500 RMSD 0.02 ANGSTROMS, OR AT LEAST ONE ATOM HAS
  369. REMARK 500 AN RMSD GREATER THAN THIS VALUE
  370. REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER;
  371. REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).
  372. REMARK 500
  373. REMARK 500 M RES CSSEQI RMS TYPE
  374. REMARK 500 TYR A 35 0.12 SIDE CHAIN
  375. REMARK 500 ASN A 77 0.08 SIDE CHAIN
  376. REMARK 500 TYR A 82 0.07 SIDE CHAIN
  377. REMARK 500 TYR A 93 0.12 SIDE CHAIN
  378. REMARK 500 ASN A 115 0.07 SIDE CHAIN
  379. REMARK 500 TYR A 117 0.07 SIDE CHAIN
  380. REMARK 500 TYR A 171 0.07 SIDE CHAIN
  381. REMARK 500 ASN A 245 0.08 SIDE CHAIN
  382. REMARK 500
  383. REMARK 500 REMARK: NULL
  384. REMARK 500
  385. REMARK 500 GEOMETRY AND STEREOCHEMISTRY
  386. REMARK 500 SUBTOPIC: MAIN CHAIN PLANARITY
  387. REMARK 500
  388. REMARK 500 THE FOLLOWING RESIDUES HAVE A PSEUDO PLANARITY
  389. REMARK 500 TORSION ANGLE, C(I) - CA(I) - N(I+1) - O(I), GREATER
  390. REMARK 500 10.0 DEGREES. (M=MODEL NUMBER; RES=RESIDUE NAME;
  391. REMARK 500 C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER;
  392. REMARK 500 I=INSERTION CODE).
  393. REMARK 500
  394. REMARK 500 M RES CSSEQI ANGLE
  395. REMARK 500 GLU A 21 11.54
  396. REMARK 500 GLN A 23 14.85
  397. REMARK 500 LEU A 33 12.94
  398. REMARK 500 ARG A 36 12.22
  399. REMARK 500 SER A 36A 12.84
  400. REMARK 500 HIS A 40 11.42
  401. REMARK 500 CYS A 42 -11.23
  402. REMARK 500 LEU A 46 10.16
  403. REMARK 500 GLN A 49 -10.69
  404. REMARK 500 THR A 54 10.93
  405. REMARK 500 HIS A 57 -14.21
  406. REMARK 500 ARG A 61 12.34
  407. REMARK 500 THR A 64 10.42
  408. REMARK 500 ARG A 65A 10.76
  409. REMARK 500 VAL A 66 12.74
  410. REMARK 500 VAL A 68 10.15
  411. REMARK 500 GLY A 69 11.41
  412. REMARK 500 ASN A 72 12.10
  413. REMARK 500 GLU A 80 11.93
  414. REMARK 500 VAL A 90 12.92
  415. REMARK 500 HIS A 91 10.46
  416. REMARK 500 TRP A 94 15.11
  417. REMARK 500 ASN A 95 12.12
  418. REMARK 500 VAL A 99 -12.42
  419. REMARK 500 ALA A 99A -10.44
  420. REMARK 500 GLY A 100 -10.13
  421. REMARK 500 ILE A 103 11.90
  422. REMARK 500 ARG A 107 13.15
  423. REMARK 500 THR A 113 10.88
  424. REMARK 500 LEU A 114 12.06
  425. REMARK 500 SER A 116 -10.09
  426. REMARK 500 VAL A 118 11.28
  427. REMARK 500 GLY A 121 11.63
  428. REMARK 500 VAL A 122 11.85
  429. REMARK 500 ARG A 125 12.80
  430. REMARK 500 ALA A 126 11.24
  431. REMARK 500 ASN A 132 12.19
  432. REMARK 500 ILE A 138 13.39
  433. REMARK 500 TRP A 141 -10.08
  434. REMARK 500 THR A 147 11.77
  435. REMARK 500 ALA A 152 12.17
  436. REMARK 500 LEU A 155 13.06
  437. REMARK 500 TYR A 159 12.42
  438. REMARK 500 VAL A 163 10.50
  439. REMARK 500 ASP A 164 -11.62
  440. REMARK 500 TYR A 165 -13.20
  441. REMARK 500 ALA A 166 -15.64
  442. REMARK 500 ILE A 167 -11.58
  443. REMARK 500 CYS A 168 -11.77
  444. REMARK 500 SER A 170 11.55
  445. REMARK 500
  446. REMARK 500 THIS ENTRY HAS 78 MAIN CHAIN PLANARITY DEVIATIONS.
  447. REMARK 500
  448. REMARK 500 REMARK: NULL
  449. REMARK 610
  450. REMARK 610 MISSING HETEROATOM
  451. REMARK 610 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (M=MODEL NUMBER;
  452. REMARK 610 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER;
  453. REMARK 610 I=INSERTION CODE):
  454. REMARK 610 M RES C SSEQI
  455. REMARK 610 SO4 A 246
  456. REMARK 610 TSU A 247
  457. REMARK 700
  458. REMARK 700 SHEET
  459. REMARK 700 THE TWO SEVEN STRANDED SHEETS IN THIS STRUCTURE ARE REALLY
  460. REMARK 700 SIX STRANDED BETA BARRELS - THIS IS DENOTED BY THE FIRST
  461. REMARK 700 STRAND RECURRING AS THE LAST STRAND.
  462. REMARK 800
  463. REMARK 800 SITE
  464. REMARK 800 SITE_IDENTIFIER: CAT
  465. REMARK 800 EVIDENCE_CODE: UNKNOWN
  466. REMARK 800 SITE_DESCRIPTION: NULL
  467. REMARK 800
  468. REMARK 800 SITE_IDENTIFIER: AC1
  469. REMARK 800 EVIDENCE_CODE: SOFTWARE
  470. REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE SO4 A 246
  471. REMARK 800
  472. REMARK 800 SITE_IDENTIFIER: AC2
  473. REMARK 800 EVIDENCE_CODE: SOFTWARE
  474. REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE TOS A 247
  475. DBREF 1EST A 16 245 UNP P00772 ELA1_PIG 27 266
  476. SEQADV 1EST ASN A 77 UNP P00772 ASP 92 CONFLICT
  477. SEQRES 1 A 240 VAL VAL GLY GLY THR GLU ALA GLN ARG ASN SER TRP PRO
  478. SEQRES 2 A 240 SER GLN ILE SER LEU GLN TYR ARG SER GLY SER SER TRP
  479. SEQRES 3 A 240 ALA HIS THR CYS GLY GLY THR LEU ILE ARG GLN ASN TRP
  480. SEQRES 4 A 240 VAL MET THR ALA ALA HIS CYS VAL ASP ARG GLU LEU THR
  481. SEQRES 5 A 240 PHE ARG VAL VAL VAL GLY GLU HIS ASN LEU ASN GLN ASN
  482. SEQRES 6 A 240 ASN GLY THR GLU GLN TYR VAL GLY VAL GLN LYS ILE VAL
  483. SEQRES 7 A 240 VAL HIS PRO TYR TRP ASN THR ASP ASP VAL ALA ALA GLY
  484. SEQRES 8 A 240 TYR ASP ILE ALA LEU LEU ARG LEU ALA GLN SER VAL THR
  485. SEQRES 9 A 240 LEU ASN SER TYR VAL GLN LEU GLY VAL LEU PRO ARG ALA
  486. SEQRES 10 A 240 GLY THR ILE LEU ALA ASN ASN SER PRO CYS TYR ILE THR
  487. SEQRES 11 A 240 GLY TRP GLY LEU THR ARG THR ASN GLY GLN LEU ALA GLN
  488. SEQRES 12 A 240 THR LEU GLN GLN ALA TYR LEU PRO THR VAL ASP TYR ALA
  489. SEQRES 13 A 240 ILE CYS SER SER SER SER TYR TRP GLY SER THR VAL LYS
  490. SEQRES 14 A 240 ASN SER MET VAL CYS ALA GLY GLY ASP GLY VAL ARG SER
  491. SEQRES 15 A 240 GLY CYS GLN GLY ASP SER GLY GLY PRO LEU HIS CYS LEU
  492. SEQRES 16 A 240 VAL ASN GLY GLN TYR ALA VAL HIS GLY VAL THR SER PHE
  493. SEQRES 17 A 240 VAL SER ARG LEU GLY CYS ASN VAL THR ARG LYS PRO THR
  494. SEQRES 18 A 240 VAL PHE THR ARG VAL SER ALA TYR ILE SER TRP ILE ASN
  495. SEQRES 19 A 240 ASN VAL ILE ALA SER ASN
  496. HET SO4 A 246 1
  497. HET TSU A 247 10
  498. HETNAM SO4 SULFATE ION
  499. HETNAM TSU PARA-TOLUENE SULFONATE
  500. FORMUL 2 SO4 O4 S 2-
  501. FORMUL 3 TSU C7 H8 O3 S
  502. FORMUL 4 HOH *25(H2 O)
  503. HELIX 1 HA ASP A 164 SER A 170 1 7
  504. HELIX 2 HB TYR A 234 ASN A 245 1HELICAL TAIL AT CARBOXY END 12
  505. SHEET 1 A 7 SER A 29 SER A 36A 0
  506. SHEET 2 A 7 SER A 37 ILE A 47 -1
  507. SHEET 3 A 7 ASN A 50 ALA A 56 -1
  508. SHEET 4 A 7 ASP A 102 GLN A 110 -1
  509. SHEET 5 A 7 GLU A 80 HIS A 91 -1
  510. SHEET 6 A 7 PHE A 65 GLY A 69 -1
  511. SHEET 7 A 7 SER A 29 SER A 36A-1
  512. SHEET 1 B 7 ASN A 133 THR A 144 0
  513. SHEET 2 B 7 GLY A 149 VAL A 163 -1
  514. SHEET 3 B 7 SER A 179 VAL A 188 -1
  515. SHEET 4 B 7 ASN A 221 VAL A 231 -1
  516. SHEET 5 B 7 HIS A 210 VAL A 216 -1
  517. SHEET 6 B 7 SER A 195 CYS A 201 -1
  518. SHEET 7 B 7 ASN A 133 THR A 144 -1
  519. SHEET 1 C 3 GLY A 149 ALA A 152 0
  520. SHEET 2 C 3 TRP A 141 LEU A 143 -1
  521. SHEET 3 C 3 GLN A 192 ASP A 194 -1
  522. SSBOND *** CYS A 42 CYS A 58 1555 1555 2.03
  523. SSBOND *** CYS A 136 CYS A 201 1555 1555 2.04
  524. SSBOND *** CYS A 168 CYS A 182 1555 1555 2.03
  525. SSBOND *** CYS A 191 CYS A 220 1555 1555 2.03
  526. SITE *** CAT 3 HIS A 57 ASP A 102 SER A 195
  527. SITE *** AC1 1 ARG A 230
  528. SITE *** AC2 5 CYS A 191 GLN A 192 GLY A 193 SER A 195
  529. SITE *** AC2 5 SER A 214
  530. CRYST1 51.500 58.000 75.500 90.00 90.00 90.00 P 21 21 21 4
  531. ORIGX1 1.000000 0.000000 0.000000 0.00000
  532. ORIGX2 0.000000 1.000000 0.000000 0.00000
  533. ORIGX3 0.000000 0.000000 1.000000 0.00000
  534. SCALE1 0.019417 0.000000 0.000000 0.00000
  535. SCALE2 0.000000 0.017241 0.000000 0.00000
  536. SCALE3 0.000000 0.000000 0.013245 0.00000
  537. USER MOD -----------------------------------------------------------------
  538. USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q
  539. USER MOD "o" means original, "f" means flipped, "180deg" is methyl default
  540. USER MOD "!" flags a clash with an overlap of 0.40A or greater
  541. USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip
  542. USER MOD Single : A 20 THR OG1 : rot 180:sc= 0
  543. USER MOD Single : A 26 SER OG : rot -4:sc= -1.68!
  544. USER MOD Single : A 29 SER OG : rot 180:sc= 0
  545. USER MOD Single : A 32 SER OG : rot 68:sc= 0.554
  546. USER MOD Single : A 35 TYR OH : rot 180:sc= 0
  547. USER MOD Single : A 36ASER OG : rot 180:sc= 0
  548. USER MOD Single : A 36CSER OG : rot 180:sc= 0
  549. USER MOD Single : A 37 SER OG : rot 180:sc= 0
  550. USER MOD Single : A 41 THR OG1 : rot 180:sc= 0
  551. USER MOD Single : A 45 THR OG1 : rot 99:sc= 0.745
  552. USER MOD Single : A 53 MET CE :methyl 159:sc= -0.142 (180deg=-0.875)
  553. USER MOD Single : A 54 THR OG1 : rot 91:sc= 0.295
  554. USER MOD Single : A 64 THR OG1 : rot 180:sc= 0
  555. USER MOD Single : A 79 THR OG1 : rot 79:sc= 1.83
  556. USER MOD Single : A 82 TYR OH : rot 180:sc= 0
  557. USER MOD Single : A 87 LYS NZ :NH3+ 143:sc= -0.0763 (180deg=-0.498)
  558. USER MOD Single : A 93 TYR OH : rot 180:sc= 0
  559. USER MOD Single : A 96 THR OG1 : rot -93:sc= 0.152
  560. USER MOD Single : A 101 TYR OH : rot 180:sc= 0
  561. USER MOD Single : A 111 SER OG : rot 180:sc= -0.256
  562. USER MOD Single : A 113 THR OG1 : rot 180:sc= 0
  563. USER MOD Single : A 116 SER OG : rot 180:sc= 0.00357
  564. USER MOD Single : A 117 TYR OH : rot 180:sc= 0
  565. USER MOD Single : A 128 THR OG1 : rot 86:sc= 0.373
  566. USER MOD Single : A 134 SER OG : rot 88:sc= 0.895
  567. USER MOD Single : A 137 TYR OH : rot 180:sc= 0
  568. USER MOD Single : A 139 THR OG1 : rot 87:sc= 0.811
  569. USER MOD Single : A 144 THR OG1 : rot 180:sc= 0
  570. USER MOD Single : A 147 THR OG1 : rot 91:sc= 0.109
  571. USER MOD Single : A 154 THR OG1 : rot -170:sc= 0
  572. USER MOD Single : A 159 TYR OH : rot 180:sc= 0
  573. USER MOD Single : A 162 THR OG1 : rot 148:sc= 0.436
  574. USER MOD Single : A 165 TYR OH : rot 180:sc= 0
  575. USER MOD Single : A 169 SER OG : rot -76:sc= 0.525
  576. USER MOD Single : A 170 SER OG : rot 82:sc= 0.252
  577. USER MOD Single : A 171 TYR OH : rot 180:sc= 0
  578. USER MOD Single : A 171ASER OG : rot 180:sc= 0
  579. USER MOD Single : A 171BSER OG : rot 180:sc= 0
  580. USER MOD Single : A 174 SER OG : rot 180:sc= 0
  581. USER MOD Single : A 175 THR OG1 : rot 180:sc= 0
  582. USER MOD Single : A 177 LYS NZ :NH3+ -131:sc= 0.427 (180deg=-0.121)
  583. USER MOD Single : A 179 SER OG : rot 121:sc= 0.293
  584. USER MOD Single : A 180 MET CE :methyl -126:sc= -0.0492 (180deg=-0.226)
  585. USER MOD Single : A 189 SER OG : rot 93:sc= 0.218
  586. USER MOD Single : A 207 TYR OH : rot 180:sc= 0
  587. USER MOD Single : A 213 THR OG1 : rot -37:sc= 1.05
  588. USER MOD Single : A 214 SER OG : rot 57:sc= 1.17
  589. USER MOD Single : A 217 SER OG : rot 180:sc= 0.144
  590. USER MOD Single : A 222 THR OG1 : rot 180:sc= 0.0374
  591. USER MOD Single : A 224 LYS NZ :NH3+ -119:sc= 0.8 (180deg=-0.552)
  592. USER MOD Single : A 226 THR OG1 : rot 116:sc= 0.129
  593. USER MOD Single : A 229 THR OG1 : rot 179:sc= 0.794
  594. USER MOD Single : A 232 SER OG : rot -173:sc= 0.928
  595. USER MOD Single : A 234 TYR OH : rot -5:sc= 1.75
  596. USER MOD Single : A 236 SER OG : rot 180:sc= 0
  597. USER MOD Single : A 244 SER OG : rot -17:sc= 0.315
  598. USER MOD -----------------------------------------------------------------
  599. ATOM 1 N VAL A 16 -10.259 32.951 35.052 1.00 0.00 N
  600. ATOM 2 CA VAL A 16 -11.137 33.755 35.924 1.00 0.00 C
  601. ATOM 3 C VAL A 16 -12.287 34.427 35.174 1.00 0.00 C
  602. ATOM 4 O VAL A 16 -12.049 35.172 34.215 1.00 0.00 O
  603. ATOM 5 CB VAL A 16 -10.330 34.815 36.679 1.00 0.00 C
  604. ATOM 6 CG1 VAL A 16 -11.217 35.815 37.418 1.00 0.00 C
  605. ATOM 7 CG2 VAL A 16 -9.287 34.204 37.610 1.00 0.00 C
  606. ATOM 0 HA VAL A 16 -11.531 33.129 36.552 1.00 0.00 H new
  607. ATOM 0 HB VAL A 16 -9.849 35.311 35.998 1.00 0.00 H new
  608. ATOM 0 HG11 VAL A 16 -10.661 36.463 37.878 1.00 0.00 H new
  609. ATOM 0 HG12 VAL A 16 -11.788 36.274 36.782 1.00 0.00 H new
  610. ATOM 0 HG13 VAL A 16 -11.767 35.345 38.064 1.00 0.00 H new
  611. ATOM 0 HG21 VAL A 16 -8.804 34.912 38.064 1.00 0.00 H new
  612. ATOM 0 HG22 VAL A 16 -9.728 33.642 38.266 1.00 0.00 H new
  613. ATOM 0 HG23 VAL A 16 -8.665 33.669 37.093 1.00 0.00 H new
  614. ATOM 8 N VAL A 17 -13.481 33.908 35.414 1.00 0.00 N
  615. ATOM 9 CA VAL A 17 -14.699 34.440 34.794 1.00 0.00 C
  616. ATOM 10 C VAL A 17 -15.260 35.626 35.578 1.00 0.00 C
  617. ATOM 11 O VAL A 17 -15.222 35.610 36.815 1.00 0.00 O
  618. ATOM 12 CB VAL A 17 -15.762 33.344 34.723 1.00 0.00 C
  619. ATOM 13 CG1 VAL A 17 -17.005 33.814 33.973 1.00 0.00 C
  620. ATOM 14 CG2 VAL A 17 -15.212 32.055 34.119 1.00 0.00 C
  621. ATOM 0 H VAL A 17 -13.615 33.239 35.938 1.00 0.00 H new
  622. ATOM 0 HA VAL A 17 -14.466 34.744 33.903 1.00 0.00 H new
  623. ATOM 0 HB VAL A 17 -16.024 33.148 35.636 1.00 0.00 H new
  624. ATOM 0 HG11 VAL A 17 -17.658 33.097 33.946 1.00 0.00 H new
  625. ATOM 0 HG12 VAL A 17 -17.387 34.581 34.428 1.00 0.00 H new
  626. ATOM 0 HG13 VAL A 17 -16.762 34.063 33.068 1.00 0.00 H new
  627. ATOM 0 HG21 VAL A 17 -15.913 31.386 34.091 1.00 0.00 H new
  628. ATOM 0 HG22 VAL A 17 -14.895 32.229 33.219 1.00 0.00 H new
  629. ATOM 0 HG23 VAL A 17 -14.477 31.730 34.663 1.00 0.00 H new
  630. ATOM 15 N GLY A 18 -15.443 36.724 34.861 1.00 0.00 N
  631. ATOM 16 CA GLY A 18 -16.037 37.948 35.413 1.00 0.00 C
  632. ATOM 17 C GLY A 18 -15.026 38.773 36.201 1.00 0.00 C
  633. ATOM 18 O GLY A 18 -15.376 39.402 37.208 1.00 0.00 O
  634. ATOM 0 H GLY A 18 -15.226 36.787 34.031 1.00 0.00 H new
  635. ATOM 0 HA2 GLY A 18 -16.397 38.485 34.690 1.00 0.00 H new
  636. ATOM 0 HA3 GLY A 18 -16.781 37.713 35.990 1.00 0.00 H new
  637. ATOM 19 N GLY A 19 -13.769 38.571 35.852 1.00 0.00 N
  638. ATOM 20 CA GLY A 19 -12.655 39.253 36.520 1.00 0.00 C
  639. ATOM 21 C GLY A 19 -12.114 40.455 35.749 1.00 0.00 C
  640. ATOM 22 O GLY A 19 -12.694 40.856 34.732 1.00 0.00 O
  641. ATOM 0 H GLY A 19 -13.528 38.037 35.223 1.00 0.00 H new
  642. ATOM 0 HA2 GLY A 19 -12.947 39.547 37.397 1.00 0.00 H new
  643. ATOM 0 HA3 GLY A 19 -11.935 38.618 36.659 1.00 0.00 H new
  644. ATOM 23 N THR A 20 -11.258 41.186 36.443 1.00 0.00 N
  645. ATOM 24 CA THR A 20 -10.574 42.377 35.920 1.00 0.00 C
  646. ATOM 25 C THR A 20 -9.071 42.141 35.834 1.00 0.00 C
  647. ATOM 26 O THR A 20 -8.543 41.280 36.544 1.00 0.00 O
  648. ATOM 27 CB THR A 20 -10.786 43.548 36.874 1.00 0.00 C
  649. ATOM 28 OG1 THR A 20 -10.138 43.250 38.107 1.00 0.00 O
  650. ATOM 29 CG2 THR A 20 -12.263 43.850 37.119 1.00 0.00 C
  651. ATOM 0 H THR A 20 -11.047 41.005 37.257 1.00 0.00 H new
  652. ATOM 0 HA THR A 20 -10.937 42.565 35.040 1.00 0.00 H new
  653. ATOM 0 HB THR A 20 -10.406 44.342 36.466 1.00 0.00 H new
  654. ATOM 0 HG1 THR A 20 -10.246 43.889 38.642 1.00 0.00 H new
  655. ATOM 0 HG21 THR A 20 -12.343 44.599 37.730 1.00 0.00 H new
  656. ATOM 0 HG22 THR A 20 -12.692 44.071 36.278 1.00 0.00 H new
  657. ATOM 0 HG23 THR A 20 -12.693 43.071 37.506 1.00 0.00 H new
  658. ATOM 30 N GLU A 21 -8.392 43.011 35.118 1.00 0.00 N
  659. ATOM 31 CA GLU A 21 -6.935 42.915 35.001 1.00 0.00 C
  660. ATOM 32 C GLU A 21 -6.232 43.483 36.230 1.00 0.00 C
  661. ATOM 33 O GLU A 21 -6.739 44.437 36.834 1.00 0.00 O
  662. ATOM 34 CB GLU A 21 -6.452 43.624 33.735 1.00 0.00 C
  663. ATOM 35 CG GLU A 21 -4.946 43.473 33.523 1.00 0.00 C
  664. ATOM 36 CD GLU A 21 -4.544 44.110 32.197 1.00 0.00 C
  665. ATOM 37 OE1 GLU A 21 -3.364 44.438 32.021 1.00 0.00 O
  666. ATOM 38 OE2 GLU A 21 -5.359 44.116 31.265 1.00 0.00 O
  667. ATOM 0 H GLU A 21 -8.745 43.667 34.689 1.00 0.00 H new
  668. ATOM 0 HA GLU A 21 -6.707 41.974 34.941 1.00 0.00 H new
  669. ATOM 0 HB2 GLU A 21 -6.922 43.265 32.966 1.00 0.00 H new
  670. ATOM 0 HB3 GLU A 21 -6.676 44.566 33.789 1.00 0.00 H new
  671. ATOM 0 HG2 GLU A 21 -4.465 43.894 34.252 1.00 0.00 H new
  672. ATOM 0 HG3 GLU A 21 -4.703 42.534 33.527 1.00 0.00 H new
  673. ATOM 39 N ALA A 22 -5.390 42.636 36.799 1.00 0.00 N
  674. ATOM 40 CA ALA A 22 -4.582 42.981 37.976 1.00 0.00 C
  675. ATOM 41 C ALA A 22 -3.391 43.878 37.645 1.00 0.00 C
  676. ATOM 42 O ALA A 22 -3.167 44.215 36.476 1.00 0.00 O
  677. ATOM 43 CB ALA A 22 -4.068 41.701 38.631 1.00 0.00 C
  678. ATOM 0 H ALA A 22 -5.264 41.834 36.515 1.00 0.00 H new
  679. ATOM 0 HA ALA A 22 -5.160 43.477 38.577 1.00 0.00 H new
  680. ATOM 0 HB1 ALA A 22 -3.534 41.927 39.409 1.00 0.00 H new
  681. ATOM 0 HB2 ALA A 22 -4.820 41.152 38.904 1.00 0.00 H new
  682. ATOM 0 HB3 ALA A 22 -3.523 41.209 37.997 1.00 0.00 H new
  683. ATOM 44 N GLN A 23 -2.879 44.510 38.687 1.00 0.00 N
  684. ATOM 45 CA GLN A 23 -1.679 45.347 38.576 1.00 0.00 C
  685. ATOM 46 C GLN A 23 -0.441 44.522 38.914 1.00 0.00 C
  686. ATOM 47 O GLN A 23 -0.596 43.516 39.619 1.00 0.00 O
  687. ATOM 48 CB GLN A 23 -1.783 46.525 39.539 1.00 0.00 C
  688. ATOM 49 CG GLN A 23 -3.090 47.296 39.372 1.00 0.00 C
  689. ATOM 50 CD GLN A 23 -3.235 48.278 40.530 1.00 0.00 C
  690. ATOM 51 OE1 GLN A 23 -2.506 48.158 41.523 1.00 0.00 O
  691. ATOM 52 NE2 GLN A 23 -4.377 48.949 40.540 1.00 0.00 N
  692. ATOM 0 H GLN A 23 -3.210 44.471 39.480 1.00 0.00 H new
  693. ATOM 0 HA GLN A 23 -1.606 45.679 37.667 1.00 0.00 H new
  694. ATOM 0 HB2 GLN A 23 -1.715 46.202 40.451 1.00 0.00 H new
  695. ATOM 0 HB3 GLN A 23 -1.035 47.125 39.394 1.00 0.00 H new
  696. ATOM 0 HG2 GLN A 23 -3.093 47.771 38.526 1.00 0.00 H new
  697. ATOM 0 HG3 GLN A 23 -3.842 46.683 39.356 1.00 0.00 H new
  698. ATOM 0 HE21 GLN A 23 -4.850 49.004 39.824 1.00 0.00 H new
  699. ATOM 0 HE22 GLN A 23 -4.646 49.329 41.263 1.00 0.00 H new
  700. ATOM 53 N ARG A 24 0.505 44.620 37.993 1.00 0.00 N
  701. ATOM 54 CA ARG A 24 1.801 43.917 38.007 1.00 0.00 C
  702. ATOM 55 C ARG A 24 2.325 43.520 39.384 1.00 0.00 C
  703. ATOM 56 O ARG A 24 2.640 42.348 39.625 1.00 0.00 O
  704. ATOM 57 CB ARG A 24 2.871 44.754 37.315 1.00 0.00 C
  705. ATOM 58 CG ARG A 24 2.542 45.005 35.849 1.00 0.00 C
  706. ATOM 59 CD ARG A 24 3.725 45.613 35.101 1.00 0.00 C
  707. ATOM 60 NE ARG A 24 3.387 45.759 33.679 1.00 0.00 N
  708. ATOM 61 CZ ARG A 24 3.728 44.873 32.754 1.00 0.00 C
  709. ATOM 62 NH1 ARG A 24 3.381 45.074 31.493 1.00 0.00 N
  710. ATOM 63 NH2 ARG A 24 4.480 43.829 33.071 1.00 0.00 N
  711. ATOM 0 H ARG A 24 0.413 45.123 37.302 1.00 0.00 H new
  712. ATOM 0 HA ARG A 24 1.621 43.090 37.533 1.00 0.00 H new
  713. ATOM 0 HB2 ARG A 24 2.963 45.603 37.775 1.00 0.00 H new
  714. ATOM 0 HB3 ARG A 24 3.727 44.302 37.380 1.00 0.00 H new
  715. ATOM 0 HG2 ARG A 24 2.287 44.170 35.427 1.00 0.00 H new
  716. ATOM 0 HG3 ARG A 24 1.778 45.600 35.786 1.00 0.00 H new
  717. ATOM 0 HD2 ARG A 24 3.949 46.477 35.480 1.00 0.00 H new
  718. ATOM 0 HD3 ARG A 24 4.507 45.048 35.201 1.00 0.00 H new
  719. ATOM 0 HE ARG A 24 2.945 46.455 33.434 1.00 0.00 H new
  720. ATOM 0 HH11 ARG A 24 2.936 45.777 31.276 1.00 0.00 H new
  721. ATOM 0 HH12 ARG A 24 3.601 44.501 30.890 1.00 0.00 H new
  722. ATOM 0 HH21 ARG A 24 4.750 43.723 33.881 1.00 0.00 H new
  723. ATOM 0 HH22 ARG A 24 4.698 43.257 32.467 1.00 0.00 H new
  724. ATOM 64 N ASN A 25 2.272 44.472 40.288 1.00 0.00 N
  725. ATOM 65 CA ASN A 25 2.844 44.312 41.628 1.00 0.00 C
  726. ATOM 66 C ASN A 25 1.838 43.861 42.681 1.00 0.00 C
  727. ATOM 67 O ASN A 25 2.178 43.817 43.870 1.00 0.00 O
  728. ATOM 68 CB ASN A 25 3.524 45.606 42.077 1.00 0.00 C
  729. ATOM 69 CG ASN A 25 2.528 46.763 42.179 1.00 0.00 C
  730. ATOM 70 OD1 ASN A 25 1.429 46.720 41.609 1.00 0.00 O
  731. ATOM 71 ND2 ASN A 25 3.067 47.887 42.623 1.00 0.00 N
  732. ATOM 0 H ASN A 25 1.904 45.237 40.152 1.00 0.00 H new
  733. ATOM 0 HA ASN A 25 3.498 43.600 41.552 1.00 0.00 H new
  734. ATOM 0 HB2 ASN A 25 3.948 45.467 42.938 1.00 0.00 H new
  735. ATOM 0 HB3 ASN A 25 4.226 45.838 41.449 1.00 0.00 H new
  736. ATOM 0 HD21 ASN A 25 2.651 48.633 42.521 1.00 0.00 H new
  737. ATOM 0 HD22 ASN A 25 3.833 47.872 43.014 1.00 0.00 H new
  738. ATOM 72 N SER A 26 0.582 43.847 42.266 1.00 0.00 N
  739. ATOM 73 CA SER A 26 -0.518 43.480 43.173 1.00 0.00 C
  740. ATOM 74 C SER A 26 -0.368 42.129 43.863 1.00 0.00 C
  741. ATOM 75 O SER A 26 -0.370 42.071 45.099 1.00 0.00 O
  742. ATOM 76 CB SER A 26 -1.882 43.549 42.494 1.00 0.00 C
  743. ATOM 77 OG SER A 26 -2.162 44.895 42.138 1.00 0.00 O
  744. ATOM 0 H SER A 26 0.336 44.045 41.466 1.00 0.00 H new
  745. ATOM 0 HA SER A 26 -0.462 44.155 43.867 1.00 0.00 H new
  746. ATOM 0 HB2 SER A 26 -1.890 42.986 41.704 1.00 0.00 H new
  747. ATOM 0 HB3 SER A 26 -2.569 43.212 43.090 1.00 0.00 H new
  748. ATOM 0 HG SER A 26 -1.547 45.393 42.420 1.00 0.00 H new
  749. ATOM 78 N TRP A 27 -0.248 41.075 43.071 1.00 0.00 N
  750. ATOM 79 CA TRP A 27 -0.233 39.708 43.628 1.00 0.00 C
  751. ATOM 80 C TRP A 27 1.037 38.911 43.317 1.00 0.00 C
  752. ATOM 81 O TRP A 27 0.990 37.980 42.504 1.00 0.00 O
  753. ATOM 82 CB TRP A 27 -1.440 38.922 43.101 1.00 0.00 C
  754. ATOM 83 CG TRP A 27 -2.766 39.699 43.206 1.00 0.00 C
  755. ATOM 84 CD1 TRP A 27 -3.503 40.259 42.222 1.00 0.00 C
  756. ATOM 85 CD2 TRP A 27 -3.466 39.982 44.381 1.00 0.00 C
  757. ATOM 86 NE1 TRP A 27 -4.637 40.852 42.742 1.00 0.00 N
  758. ATOM 87 CE2 TRP A 27 -4.636 40.690 44.007 1.00 0.00 C
  759. ATOM 88 CE3 TRP A 27 -3.197 39.675 45.706 1.00 0.00 C
  760. ATOM 89 CZ2 TRP A 27 -5.610 41.078 44.912 1.00 0.00 C
  761. ATOM 90 CZ3 TRP A 27 -4.164 40.093 46.631 1.00 0.00 C
  762. ATOM 91 CH2 TRP A 27 -5.333 40.764 46.248 1.00 0.00 C
  763. ATOM 0 H TRP A 27 -0.174 41.117 42.215 1.00 0.00 H new
  764. ATOM 0 HA TRP A 27 -0.267 39.819 44.591 1.00 0.00 H new
  765. ATOM 0 HB2 TRP A 27 -1.284 38.685 42.173 1.00 0.00 H new
  766. ATOM 0 HB3 TRP A 27 -1.519 38.092 43.596 1.00 0.00 H new
  767. ATOM 0 HD1 TRP A 27 -3.278 40.247 41.320 1.00 0.00 H new
  768. ATOM 0 HE1 TRP A 27 -5.242 41.262 42.289 1.00 0.00 H new
  769. ATOM 0 HE3 TRP A 27 -2.427 39.222 45.964 1.00 0.00 H new
  770. ATOM 0 HZ2 TRP A 27 -6.389 41.514 44.652 1.00 0.00 H new
  771. ATOM 0 HZ3 TRP A 27 -4.024 39.918 47.534 1.00 0.00 H new
  772. ATOM 0 HH2 TRP A 27 -5.946 41.009 46.903 1.00 0.00 H new
  773. ATOM 92 N PRO A 28 2.105 39.137 44.072 1.00 0.00 N
  774. ATOM 93 CA PRO A 28 3.462 38.827 43.585 1.00 0.00 C
  775. ATOM 94 C PRO A 28 3.951 37.452 44.037 1.00 0.00 C
  776. ATOM 95 O PRO A 28 5.091 37.072 43.744 1.00 0.00 O
  777. ATOM 96 CB PRO A 28 4.352 39.918 44.167 1.00 0.00 C
  778. ATOM 97 CG PRO A 28 3.678 40.282 45.474 1.00 0.00 C
  779. ATOM 98 CD PRO A 28 2.191 40.100 45.194 1.00 0.00 C
  780. ATOM 0 HA PRO A 28 3.477 38.802 42.615 1.00 0.00 H new
  781. ATOM 0 HB2 PRO A 28 5.257 39.599 44.311 1.00 0.00 H new
  782. ATOM 0 HB3 PRO A 28 4.411 40.683 43.573 1.00 0.00 H new
  783. ATOM 0 HG2 PRO A 28 3.975 39.708 46.197 1.00 0.00 H new
  784. ATOM 0 HG3 PRO A 28 3.880 41.194 45.735 1.00 0.00 H new
  785. ATOM 0 HD2 PRO A 28 1.728 39.763 45.977 1.00 0.00 H new
  786. ATOM 0 HD3 PRO A 28 1.775 40.945 44.960 1.00 0.00 H new
  787. ATOM 99 N SER A 29 3.007 36.647 44.490 1.00 0.00 N
  788. ATOM 100 CA SER A 29 3.290 35.270 44.914 1.00 0.00 C
  789. ATOM 101 C SER A 29 2.720 34.280 43.905 1.00 0.00 C
  790. ATOM 102 O SER A 29 2.803 33.062 44.106 1.00 0.00 O
  791. ATOM 103 CB SER A 29 2.677 35.000 46.283 1.00 0.00 C
  792. ATOM 104 OG SER A 29 1.261 35.078 46.174 1.00 0.00 O
  793. ATOM 0 H SER A 29 2.181 36.875 44.564 1.00 0.00 H new
  794. ATOM 0 HA SER A 29 4.252 35.160 44.966 1.00 0.00 H new
  795. ATOM 0 HB2 SER A 29 2.942 34.123 46.603 1.00 0.00 H new
  796. ATOM 0 HB3 SER A 29 3.000 35.647 46.929 1.00 0.00 H new
  797. ATOM 0 HG SER A 29 0.913 34.929 46.924 1.00 0.00 H new
  798. ATOM 105 N GLN A 30 1.878 34.847 43.056 1.00 0.00 N
  799. ATOM 106 CA GLN A 30 1.218 34.136 41.952 1.00 0.00 C
  800. ATOM 107 C GLN A 30 2.220 33.621 40.921 1.00 0.00 C
  801. ATOM 108 O GLN A 30 3.148 34.352 40.554 1.00 0.00 O
  802. ATOM 109 CB GLN A 30 0.244 35.098 41.267 1.00 0.00 C
  803. ATOM 110 CG GLN A 30 -0.429 34.532 40.014 1.00 0.00 C
  804. ATOM 111 CD GLN A 30 -1.427 33.438 40.381 1.00 0.00 C
  805. ATOM 112 OE1 GLN A 30 -2.577 33.754 40.712 1.00 0.00 O
  806. ATOM 113 NE2 GLN A 30 -1.104 32.238 39.921 1.00 0.00 N
  807. ATOM 0 H GLN A 30 1.663 35.679 43.100 1.00 0.00 H new
  808. ATOM 0 HA GLN A 30 0.753 33.368 42.320 1.00 0.00 H new
  809. ATOM 0 HB2 GLN A 30 -0.443 35.352 41.903 1.00 0.00 H new
  810. ATOM 0 HB3 GLN A 30 0.721 35.907 41.027 1.00 0.00 H new
  811. ATOM 0 HG2 GLN A 30 -0.884 35.244 39.537 1.00 0.00 H new
  812. ATOM 0 HG3 GLN A 30 0.244 34.174 39.414 1.00 0.00 H new
  813. ATOM 0 HE21 GLN A 30 -0.290 32.066 39.704 1.00 0.00 H new
  814. ATOM 0 HE22 GLN A 30 -1.708 31.632 39.840 1.00 0.00 H new
  815. ATOM 114 N ILE A 31 2.221 32.305 40.748 1.00 0.00 N
  816. ATOM 115 CA ILE A 31 3.075 31.681 39.725 1.00 0.00 C
  817. ATOM 116 C ILE A 31 2.292 30.995 38.608 1.00 0.00 C
  818. ATOM 117 O ILE A 31 1.109 30.671 38.776 1.00 0.00 O
  819. ATOM 118 CB ILE A 31 4.122 30.740 40.341 1.00 0.00 C
  820. ATOM 119 CG1 ILE A 31 3.571 29.438 40.928 1.00 0.00 C
  821. ATOM 120 CG2 ILE A 31 4.985 31.461 41.370 1.00 0.00 C
  822. ATOM 121 CD1 ILE A 31 3.559 28.258 39.953 1.00 0.00 C
  823. ATOM 0 H ILE A 31 1.742 31.755 41.204 1.00 0.00 H new
  824. ATOM 0 HA ILE A 31 3.549 32.416 39.305 1.00 0.00 H new
  825. ATOM 0 HB ILE A 31 4.668 30.470 39.586 1.00 0.00 H new
  826. ATOM 0 HG12 ILE A 31 4.101 29.197 41.704 1.00 0.00 H new
  827. ATOM 0 HG13 ILE A 31 2.666 29.595 41.240 1.00 0.00 H new
  828. ATOM 0 HG21 ILE A 31 5.634 30.842 41.739 1.00 0.00 H new
  829. ATOM 0 HG22 ILE A 31 5.449 32.199 40.944 1.00 0.00 H new
  830. ATOM 0 HG23 ILE A 31 4.422 31.802 42.083 1.00 0.00 H new
  831. ATOM 0 HD11 ILE A 31 3.198 27.475 40.397 1.00 0.00 H new
  832. ATOM 0 HD12 ILE A 31 3.007 28.477 39.186 1.00 0.00 H new
  833. ATOM 0 HD13 ILE A 31 4.464 28.073 39.657 1.00 0.00 H new
  834. ATOM 122 N SER A 32 2.969 30.831 37.482 1.00 0.00 N
  835. ATOM 123 CA SER A 32 2.433 30.097 36.330 1.00 0.00 C
  836. ATOM 124 C SER A 32 3.102 28.739 36.138 1.00 0.00 C
  837. ATOM 125 O SER A 32 4.335 28.663 36.069 1.00 0.00 O
  838. ATOM 126 CB SER A 32 2.597 30.905 35.049 1.00 0.00 C
  839. ATOM 127 OG SER A 32 2.185 30.090 33.955 1.00 0.00 O
  840. ATOM 0 H SER A 32 3.761 31.143 37.357 1.00 0.00 H new
  841. ATOM 0 HA SER A 32 1.492 29.952 36.517 1.00 0.00 H new
  842. ATOM 0 HB2 SER A 32 2.063 31.714 35.088 1.00 0.00 H new
  843. ATOM 0 HB3 SER A 32 3.521 31.180 34.938 1.00 0.00 H new
  844. ATOM 0 HG SER A 32 1.356 29.964 33.996 1.00 0.00 H new
  845. ATOM 128 N LEU A 33 2.315 27.710 36.387 1.00 0.00 N
  846. ATOM 129 CA LEU A 33 2.749 26.318 36.213 1.00 0.00 C
  847. ATOM 130 C LEU A 33 2.512 25.861 34.778 1.00 0.00 C
  848. ATOM 131 O LEU A 33 1.385 25.991 34.280 1.00 0.00 O
  849. ATOM 132 CB LEU A 33 1.993 25.403 37.177 1.00 0.00 C
  850. ATOM 133 CG LEU A 33 2.471 23.953 37.115 1.00 0.00 C
  851. ATOM 134 CD1 LEU A 33 3.951 23.827 37.474 1.00 0.00 C
  852. ATOM 135 CD2 LEU A 33 1.605 23.034 37.974 1.00 0.00 C
  853. ATOM 0 H LEU A 33 1.505 27.790 36.665 1.00 0.00 H new
  854. ATOM 0 HA LEU A 33 3.698 26.268 36.406 1.00 0.00 H new
  855. ATOM 0 HB2 LEU A 33 2.099 25.736 38.082 1.00 0.00 H new
  856. ATOM 0 HB3 LEU A 33 1.046 25.436 36.972 1.00 0.00 H new
  857. ATOM 0 HG LEU A 33 2.374 23.662 36.195 1.00 0.00 H new
  858. ATOM 0 HD11 LEU A 33 4.218 22.896 37.424 1.00 0.00 H new
  859. ATOM 0 HD12 LEU A 33 4.481 24.349 36.851 1.00 0.00 H new
  860. ATOM 0 HD13 LEU A 33 4.095 24.156 38.375 1.00 0.00 H new
  861. ATOM 0 HD21 LEU A 33 1.936 22.125 37.911 1.00 0.00 H new
  862. ATOM 0 HD22 LEU A 33 1.640 23.327 38.898 1.00 0.00 H new
  863. ATOM 0 HD23 LEU A 33 0.688 23.066 37.659 1.00 0.00 H new
  864. ATOM 136 N GLN A 34 3.622 25.845 34.056 1.00 0.00 N
  865. ATOM 137 CA GLN A 34 3.644 25.487 32.634 1.00 0.00 C
  866. ATOM 138 C GLN A 34 4.269 24.125 32.346 1.00 0.00 C
  867. ATOM 139 O GLN A 34 5.120 23.668 33.115 1.00 0.00 O
  868. ATOM 140 CB GLN A 34 4.409 26.561 31.866 1.00 0.00 C
  869. ATOM 141 CG GLN A 34 3.772 27.932 32.068 1.00 0.00 C
  870. ATOM 142 CD GLN A 34 4.553 28.999 31.308 1.00 0.00 C
  871. ATOM 143 OE1 GLN A 34 5.676 28.747 30.855 1.00 0.00 O
  872. ATOM 144 NE2 GLN A 34 4.030 30.214 31.373 1.00 0.00 N
  873. ATOM 0 H GLN A 34 4.395 26.043 34.376 1.00 0.00 H new
  874. ATOM 0 HA GLN A 34 2.719 25.430 32.347 1.00 0.00 H new
  875. ATOM 0 HB2 GLN A 34 5.332 26.582 32.164 1.00 0.00 H new
  876. ATOM 0 HB3 GLN A 34 4.421 26.342 30.921 1.00 0.00 H new
  877. ATOM 0 HG2 GLN A 34 2.852 27.916 31.761 1.00 0.00 H new
  878. ATOM 0 HG3 GLN A 34 3.752 28.150 33.013 1.00 0.00 H new
  879. ATOM 0 HE21 GLN A 34 3.242 30.326 31.699 1.00 0.00 H new
  880. ATOM 0 HE22 GLN A 34 4.478 30.891 31.089 1.00 0.00 H new
  881. ATOM 145 N TYR A 35 3.686 23.426 31.378 1.00 0.00 N
  882. ATOM 146 CA TYR A 35 4.229 22.144 30.897 1.00 0.00 C
  883. ATOM 147 C TYR A 35 4.737 22.223 29.458 1.00 0.00 C
  884. ATOM 148 O TYR A 35 4.328 23.120 28.709 1.00 0.00 O
  885. ATOM 149 CB TYR A 35 3.283 20.951 31.104 1.00 0.00 C
  886. ATOM 150 CG TYR A 35 2.055 20.947 30.176 1.00 0.00 C
  887. ATOM 151 CD1 TYR A 35 0.923 21.666 30.518 1.00 0.00 C
  888. ATOM 152 CD2 TYR A 35 2.058 20.178 29.022 1.00 0.00 C
  889. ATOM 153 CE1 TYR A 35 -0.198 21.663 29.679 1.00 0.00 C
  890. ATOM 154 CE2 TYR A 35 0.942 20.168 28.177 1.00 0.00 C
  891. ATOM 155 CZ TYR A 35 -0.187 20.917 28.503 1.00 0.00 C
  892. ATOM 156 OH TYR A 35 -1.064 21.265 27.496 1.00 0.00 O
  893. ATOM 0 H TYR A 35 2.966 23.675 30.978 1.00 0.00 H new
  894. ATOM 0 HA TYR A 35 4.998 21.972 31.463 1.00 0.00 H new
  895. ATOM 0 HB2 TYR A 35 3.781 20.130 30.968 1.00 0.00 H new
  896. ATOM 0 HB3 TYR A 35 2.979 20.949 32.025 1.00 0.00 H new
  897. ATOM 0 HD1 TYR A 35 0.907 22.154 31.310 1.00 0.00 H new
  898. ATOM 0 HD2 TYR A 35 2.805 19.667 28.808 1.00 0.00 H new
  899. ATOM 0 HE1 TYR A 35 -0.950 22.160 29.907 1.00 0.00 H new
  900. ATOM 0 HE2 TYR A 35 0.954 19.661 27.397 1.00 0.00 H new
  901. ATOM 0 HH TYR A 35 -0.962 20.746 26.844 1.00 0.00 H new
  902. ATOM 157 N ARG A 36 5.835 21.527 29.216 1.00 0.00 N
  903. ATOM 158 CA ARG A 36 6.459 21.579 27.889 1.00 0.00 C
  904. ATOM 159 C ARG A 36 5.694 20.809 26.819 1.00 0.00 C
  905. ATOM 160 O ARG A 36 5.580 19.580 26.904 1.00 0.00 O
  906. ATOM 161 CB ARG A 36 7.934 21.187 27.899 1.00 0.00 C
  907. ATOM 162 CG ARG A 36 8.508 21.235 26.483 1.00 0.00 C
  908. ATOM 163 CD ARG A 36 10.011 20.975 26.431 1.00 0.00 C
  909. ATOM 164 NE ARG A 36 10.720 22.210 26.064 1.00 0.00 N
  910. ATOM 165 CZ ARG A 36 11.865 22.583 26.617 1.00 0.00 C
  911. ATOM 166 NH1 ARG A 36 12.449 23.705 26.225 1.00 0.00 N
  912. ATOM 167 NH2 ARG A 36 12.546 21.719 27.355 1.00 0.00 N
  913. ATOM 0 H ARG A 36 6.234 21.025 29.789 1.00 0.00 H new
  914. ATOM 0 HA ARG A 36 6.413 22.516 27.643 1.00 0.00 H new
  915. ATOM 0 HB2 ARG A 36 8.431 21.788 28.476 1.00 0.00 H new
  916. ATOM 0 HB3 ARG A 36 8.035 20.294 28.265 1.00 0.00 H new
  917. ATOM 0 HG2 ARG A 36 8.053 20.577 25.934 1.00 0.00 H new
  918. ATOM 0 HG3 ARG A 36 8.323 22.105 26.095 1.00 0.00 H new
  919. ATOM 0 HD2 ARG A 36 10.322 20.658 27.293 1.00 0.00 H new
  920. ATOM 0 HD3 ARG A 36 10.204 20.277 25.785 1.00 0.00 H new
  921. ATOM 0 HE ARG A 36 10.374 22.715 25.460 1.00 0.00 H new
  922. ATOM 0 HH11 ARG A 36 12.085 24.188 25.614 1.00 0.00 H new
  923. ATOM 0 HH12 ARG A 36 13.192 23.950 26.582 1.00 0.00 H new
  924. ATOM 0 HH21 ARG A 36 12.244 20.922 27.472 1.00 0.00 H new
  925. ATOM 0 HH22 ARG A 36 13.290 21.955 27.717 1.00 0.00 H new
  926. ATOM 168 N SER A 36A 4.832 21.573 26.178 1.00 0.00 N
  927. ATOM 169 CA SER A 36A 4.005 21.065 25.083 1.00 0.00 C
  928. ATOM 170 C SER A 36A 4.752 21.029 23.753 1.00 0.00 C
  929. ATOM 171 O SER A 36A 4.766 22.045 23.043 1.00 0.00 O
  930. ATOM 172 CB SER A 36A 2.740 21.901 24.940 1.00 0.00 C
  931. ATOM 173 OG SER A 36A 1.970 21.372 23.866 1.00 0.00 O
  932. ATOM 0 H SER A 36A 4.704 22.404 26.360 1.00 0.00 H new
  933. ATOM 0 HA SER A 36A 3.770 20.152 25.310 1.00 0.00 H new
  934. ATOM 0 HB2 SER A 36A 2.228 21.882 25.764 1.00 0.00 H new
  935. ATOM 0 HB3 SER A 36A 2.966 22.828 24.768 1.00 0.00 H new
  936. ATOM 0 HG SER A 36A 1.267 21.823 23.776 1.00 0.00 H new
  937. ATOM 174 N GLY A 36B 5.703 20.110 23.741 1.00 0.00 N
  938. ATOM 175 CA GLY A 36B 6.506 19.772 22.558 1.00 0.00 C
  939. ATOM 176 C GLY A 36B 7.607 20.781 22.246 1.00 0.00 C
  940. ATOM 177 O GLY A 36B 8.660 20.765 22.895 1.00 0.00 O
  941. ATOM 0 H GLY A 36B 5.911 19.648 24.436 1.00 0.00 H new
  942. ATOM 0 HA2 GLY A 36B 6.908 18.899 22.690 1.00 0.00 H new
  943. ATOM 0 HA3 GLY A 36B 5.919 19.700 21.789 1.00 0.00 H new
  944. ATOM 178 N SER A 36C 7.186 21.827 21.563 1.00 0.00 N
  945. ATOM 179 CA SER A 36C 8.085 22.881 21.083 1.00 0.00 C
  946. ATOM 180 C SER A 36C 8.212 24.020 22.084 1.00 0.00 C
  947. ATOM 181 O SER A 36C 9.202 24.761 22.064 1.00 0.00 O
  948. ATOM 182 CB SER A 36C 7.527 23.454 19.785 1.00 0.00 C
  949. ATOM 183 OG SER A 36C 7.338 22.397 18.852 1.00 0.00 O
  950. ATOM 0 H SER A 36C 6.361 21.955 21.358 1.00 0.00 H new
  951. ATOM 0 HA SER A 36C 8.961 22.485 20.952 1.00 0.00 H new
  952. ATOM 0 HB2 SER A 36C 6.685 23.906 19.953 1.00 0.00 H new
  953. ATOM 0 HB3 SER A 36C 8.137 24.116 19.422 1.00 0.00 H new
  954. ATOM 0 HG SER A 36C 7.029 22.708 18.135 1.00 0.00 H new
  955. ATOM 184 N SER A 37 7.072 24.332 22.661 1.00 0.00 N
  956. ATOM 185 CA SER A 37 6.960 25.450 23.600 1.00 0.00 C
  957. ATOM 186 C SER A 37 6.357 25.036 24.935 1.00 0.00 C
  958. ATOM 187 O SER A 37 6.181 23.842 25.200 1.00 0.00 O
  959. ATOM 188 CB SER A 37 6.098 26.544 22.983 1.00 0.00 C
  960. ATOM 189 OG SER A 37 4.817 25.996 22.698 1.00 0.00 O
  961. ATOM 0 H SER A 37 6.336 23.908 22.526 1.00 0.00 H new
  962. ATOM 0 HA SER A 37 7.859 25.772 23.772 1.00 0.00 H new
  963. ATOM 0 HB2 SER A 37 6.017 27.294 23.593 1.00 0.00 H new
  964. ATOM 0 HB3 SER A 37 6.509 26.881 22.172 1.00 0.00 H new
  965. ATOM 0 HG SER A 37 4.328 26.588 22.358 1.00 0.00 H new
  966. ATOM 190 N TRP A 38 6.144 26.035 25.768 1.00 0.00 N
  967. ATOM 191 CA TRP A 38 5.584 25.859 27.110 1.00 0.00 C
  968. ATOM 192 C TRP A 38 4.155 26.389 27.202 1.00 0.00 C
  969. ATOM 193 O TRP A 38 3.827 27.413 26.590 1.00 0.00 O
  970. ATOM 194 CB TRP A 38 6.456 26.570 28.143 1.00 0.00 C
  971. ATOM 195 CG TRP A 38 7.869 25.968 28.240 1.00 0.00 C
  972. ATOM 196 CD1 TRP A 38 8.980 26.241 27.521 1.00 0.00 C
  973. ATOM 197 CD2 TRP A 38 8.267 24.995 29.156 1.00 0.00 C
  974. ATOM 198 NE1 TRP A 38 10.041 25.479 27.966 1.00 0.00 N
  975. ATOM 199 CE2 TRP A 38 9.643 24.750 28.933 1.00 0.00 C
  976. ATOM 200 CE3 TRP A 38 7.565 24.341 30.153 1.00 0.00 C
  977. ATOM 201 CZ2 TRP A 38 10.389 23.870 29.699 1.00 0.00 C
  978. ATOM 202 CZ3 TRP A 38 8.310 23.433 30.917 1.00 0.00 C
  979. ATOM 203 CH2 TRP A 38 9.675 23.206 30.701 1.00 0.00 C
  980. ATOM 0 H TRP A 38 6.321 26.854 25.574 1.00 0.00 H new
  981. ATOM 0 HA TRP A 38 5.566 24.907 27.293 1.00 0.00 H new
  982. ATOM 0 HB2 TRP A 38 6.524 27.510 27.912 1.00 0.00 H new
  983. ATOM 0 HB3 TRP A 38 6.027 26.521 29.012 1.00 0.00 H new
  984. ATOM 0 HD1 TRP A 38 9.024 26.856 26.824 1.00 0.00 H new
  985. ATOM 0 HE1 TRP A 38 10.838 25.494 27.644 1.00 0.00 H new
  986. ATOM 0 HE3 TRP A 38 6.660 24.494 30.306 1.00 0.00 H new
  987. ATOM 0 HZ2 TRP A 38 11.298 23.731 29.557 1.00 0.00 H new
  988. ATOM 0 HZ3 TRP A 38 7.881 22.962 31.595 1.00 0.00 H new
  989. ATOM 0 HH2 TRP A 38 10.121 22.594 31.241 1.00 0.00 H new
  990. ATOM 204 N ALA A 39 3.310 25.601 27.842 1.00 0.00 N
  991. ATOM 205 CA ALA A 39 1.883 25.915 27.986 1.00 0.00 C
  992. ATOM 206 C ALA A 39 1.431 26.037 29.439 1.00 0.00 C
  993. ATOM 207 O ALA A 39 1.617 25.101 30.225 1.00 0.00 O
  994. ATOM 208 CB ALA A 39 1.052 24.836 27.296 1.00 0.00 C
  995. ATOM 0 H ALA A 39 3.542 24.860 28.212 1.00 0.00 H new
  996. ATOM 0 HA ALA A 39 1.747 26.782 27.572 1.00 0.00 H new
  997. ATOM 0 HB1 ALA A 39 0.109 25.043 27.391 1.00 0.00 H new
  998. ATOM 0 HB2 ALA A 39 1.282 24.803 26.354 1.00 0.00 H new
  999. ATOM 0 HB3 ALA A 39 1.236 23.975 27.704 1.00 0.00 H new
  1000. ATOM 209 N HIS A 40 0.663 27.083 29.695 1.00 0.00 N
  1001. ATOM 210 CA HIS A 40 0.070 27.343 31.014 1.00 0.00 C
  1002. ATOM 211 C HIS A 40 -1.026 26.338 31.351 1.00 0.00 C
  1003. ATOM 212 O HIS A 40 -1.852 26.031 30.481 1.00 0.00 O
  1004. ATOM 213 CB HIS A 40 -0.523 28.753 31.040 1.00 0.00 C
  1005. ATOM 214 CG HIS A 40 -1.312 29.021 32.333 1.00 0.00 C
  1006. ATOM 215 ND1 HIS A 40 -0.690 29.269 33.523 1.00 0.00 N
  1007. ATOM 216 CD2 HIS A 40 -2.644 29.042 32.541 1.00 0.00 C
  1008. ATOM 217 CE1 HIS A 40 -1.659 29.468 34.465 1.00 0.00 C
  1009. ATOM 218 NE2 HIS A 40 -2.872 29.316 33.860 1.00 0.00 N
  1010. ATOM 0 H HIS A 40 0.464 27.675 29.104 1.00 0.00 H new
  1011. ATOM 0 HA HIS A 40 0.775 27.257 31.675 1.00 0.00 H new
  1012. ATOM 0 HB2 HIS A 40 0.190 29.405 30.956 1.00 0.00 H new
  1013. ATOM 0 HB3 HIS A 40 -1.107 28.872 30.275 1.00 0.00 H new
  1014. ATOM 0 HD2 HIS A 40 -3.297 28.895 31.896 1.00 0.00 H new
  1015. ATOM 0 HE1 HIS A 40 -1.517 29.671 35.361 1.00 0.00 H new
  1016. ATOM 219 N THR A 41 -0.765 25.554 32.380 1.00 0.00 N
  1017. ATOM 220 CA THR A 41 -1.780 24.597 32.828 1.00 0.00 C
  1018. ATOM 221 C THR A 41 -2.477 24.979 34.129 1.00 0.00 C
  1019. ATOM 222 O THR A 41 -3.704 24.861 34.230 1.00 0.00 O
  1020. ATOM 223 CB THR A 41 -1.264 23.160 32.891 1.00 0.00 C
  1021. ATOM 224 OG1 THR A 41 -2.327 22.319 33.323 1.00 0.00 O
  1022. ATOM 225 CG2 THR A 41 -0.062 22.970 33.817 1.00 0.00 C
  1023. ATOM 0 H THR A 41 -0.031 25.552 32.827 1.00 0.00 H new
  1024. ATOM 0 HA THR A 41 -2.456 24.640 32.134 1.00 0.00 H new
  1025. ATOM 0 HB THR A 41 -0.957 22.929 32.000 1.00 0.00 H new
  1026. ATOM 0 HG1 THR A 41 -2.058 21.524 33.361 1.00 0.00 H new
  1027. ATOM 0 HG21 THR A 41 0.210 22.039 33.807 1.00 0.00 H new
  1028. ATOM 0 HG22 THR A 41 0.673 23.524 33.511 1.00 0.00 H new
  1029. ATOM 0 HG23 THR A 41 -0.306 23.226 34.720 1.00 0.00 H new
  1030. ATOM 226 N CYS A 42 -1.714 25.560 35.036 1.00 0.00 N
  1031. ATOM 227 CA CYS A 42 -2.213 25.905 36.371 1.00 0.00 C
  1032. ATOM 228 C CYS A 42 -1.579 27.147 36.984 1.00 0.00 C
  1033. ATOM 229 O CYS A 42 -0.434 27.481 36.666 1.00 0.00 O
  1034. ATOM 230 CB CYS A 42 -1.992 24.744 37.338 1.00 0.00 C
  1035. ATOM 231 SG CYS A 42 -3.165 23.375 37.244 1.00 0.00 S
  1036. ATOM 0 H CYS A 42 -0.890 25.769 34.903 1.00 0.00 H new
  1037. ATOM 0 HA CYS A 42 -3.155 26.093 36.240 1.00 0.00 H new
  1038. ATOM 0 HB2 CYS A 42 -1.101 24.390 37.188 1.00 0.00 H new
  1039. ATOM 0 HB3 CYS A 42 -2.009 25.096 38.242 1.00 0.00 H new
  1040. ATOM 232 N GLY A 43 -2.148 27.496 38.122 1.00 0.00 N
  1041. ATOM 233 CA GLY A 43 -1.626 28.552 38.990 1.00 0.00 C
  1042. ATOM 234 C GLY A 43 -0.828 27.945 40.142 1.00 0.00 C
  1043. ATOM 235 O GLY A 43 -0.874 26.725 40.347 1.00 0.00 O
  1044. ATOM 0 H GLY A 43 -2.862 27.123 38.424 1.00 0.00 H new
  1045. ATOM 0 HA2 GLY A 43 -1.061 29.151 38.477 1.00 0.00 H new
  1046. ATOM 0 HA3 GLY A 43 -2.358 29.083 39.340 1.00 0.00 H new
  1047. ATOM 236 N GLY A 44 -0.319 28.809 41.000 1.00 0.00 N
  1048. ATOM 237 CA GLY A 44 0.466 28.381 42.164 1.00 0.00 C
  1049. ATOM 238 C GLY A 44 0.856 29.536 43.082 1.00 0.00 C
  1050. ATOM 239 O GLY A 44 0.663 30.708 42.735 1.00 0.00 O
  1051. ATOM 0 H GLY A 44 -0.413 29.661 40.932 1.00 0.00 H new
  1052. ATOM 0 HA2 GLY A 44 -0.046 27.731 42.671 1.00 0.00 H new
  1053. ATOM 0 HA3 GLY A 44 1.270 27.933 41.858 1.00 0.00 H new
  1054. ATOM 240 N THR A 45 1.441 29.175 44.216 1.00 0.00 N
  1055. ATOM 241 CA THR A 45 1.868 30.147 45.230 1.00 0.00 C
  1056. ATOM 242 C THR A 45 3.272 29.901 45.778 1.00 0.00 C
  1057. ATOM 243 O THR A 45 3.557 28.820 46.307 1.00 0.00 O
  1058. ATOM 244 CB THR A 45 0.863 30.184 46.377 1.00 0.00 C
  1059. ATOM 245 OG1 THR A 45 -0.439 30.392 45.844 1.00 0.00 O
  1060. ATOM 246 CG2 THR A 45 1.179 31.282 47.391 1.00 0.00 C
  1061. ATOM 0 H THR A 45 1.605 28.357 44.425 1.00 0.00 H new
  1062. ATOM 0 HA THR A 45 1.901 31.005 44.779 1.00 0.00 H new
  1063. ATOM 0 HB THR A 45 0.913 29.335 46.844 1.00 0.00 H new
  1064. ATOM 0 HG1 THR A 45 -0.842 29.657 45.794 1.00 0.00 H new
  1065. ATOM 0 HG21 THR A 45 0.517 31.269 48.100 1.00 0.00 H new
  1066. ATOM 0 HG22 THR A 45 2.059 31.130 47.769 1.00 0.00 H new
  1067. ATOM 0 HG23 THR A 45 1.162 32.145 46.949 1.00 0.00 H new
  1068. ATOM 247 N LEU A 46 4.162 30.811 45.422 1.00 0.00 N
  1069. ATOM 248 CA LEU A 46 5.549 30.797 45.901 1.00 0.00 C
  1070. ATOM 249 C LEU A 46 5.588 30.998 47.415 1.00 0.00 C
  1071. ATOM 250 O LEU A 46 5.048 32.000 47.896 1.00 0.00 O
  1072. ATOM 251 CB LEU A 46 6.294 31.962 45.255 1.00 0.00 C
  1073. ATOM 252 CG LEU A 46 7.803 31.876 45.465 1.00 0.00 C
  1074. ATOM 253 CD1 LEU A 46 8.410 30.747 44.634 1.00 0.00 C
  1075. ATOM 254 CD2 LEU A 46 8.481 33.208 45.159 1.00 0.00 C
  1076. ATOM 0 H LEU A 46 3.984 31.464 44.891 1.00 0.00 H new
  1077. ATOM 0 HA LEU A 46 5.955 29.946 45.674 1.00 0.00 H new
  1078. ATOM 0 HB2 LEU A 46 6.103 31.977 44.304 1.00 0.00 H new
  1079. ATOM 0 HB3 LEU A 46 5.966 32.797 45.624 1.00 0.00 H new
  1080. ATOM 0 HG LEU A 46 7.959 31.674 46.401 1.00 0.00 H new
  1081. ATOM 0 HD11 LEU A 46 9.368 30.713 44.784 1.00 0.00 H new
  1082. ATOM 0 HD12 LEU A 46 8.012 29.902 44.896 1.00 0.00 H new
  1083. ATOM 0 HD13 LEU A 46 8.236 30.908 43.693 1.00 0.00 H new
  1084. ATOM 0 HD21 LEU A 46 9.437 33.125 45.300 1.00 0.00 H new
  1085. ATOM 0 HD22 LEU A 46 8.311 33.453 44.236 1.00 0.00 H new
  1086. ATOM 0 HD23 LEU A 46 8.126 33.894 45.746 1.00 0.00 H new
  1087. ATOM 255 N ILE A 47 5.853 29.918 48.132 1.00 0.00 N
  1088. ATOM 256 CA ILE A 47 5.884 29.980 49.604 1.00 0.00 C
  1089. ATOM 257 C ILE A 47 7.278 30.130 50.213 1.00 0.00 C
  1090. ATOM 258 O ILE A 47 7.395 30.437 51.406 1.00 0.00 O
  1091. ATOM 259 CB ILE A 47 5.086 28.843 50.239 1.00 0.00 C
  1092. ATOM 260 CG1 ILE A 47 5.522 27.463 49.749 1.00 0.00 C
  1093. ATOM 261 CG2 ILE A 47 3.581 29.055 50.086 1.00 0.00 C
  1094. ATOM 262 CD1 ILE A 47 4.715 26.345 50.402 1.00 0.00 C
  1095. ATOM 0 H ILE A 47 6.017 29.142 47.800 1.00 0.00 H new
  1096. ATOM 0 HA ILE A 47 5.439 30.812 49.827 1.00 0.00 H new
  1097. ATOM 0 HB ILE A 47 5.287 28.866 51.188 1.00 0.00 H new
  1098. ATOM 0 HG12 ILE A 47 5.419 27.415 48.786 1.00 0.00 H new
  1099. ATOM 0 HG13 ILE A 47 6.464 27.335 49.940 1.00 0.00 H new
  1100. ATOM 0 HG21 ILE A 47 3.106 28.317 50.499 1.00 0.00 H new
  1101. ATOM 0 HG22 ILE A 47 3.325 29.885 50.518 1.00 0.00 H new
  1102. ATOM 0 HG23 ILE A 47 3.354 29.098 49.144 1.00 0.00 H new
  1103. ATOM 0 HD11 ILE A 47 5.020 25.487 50.067 1.00 0.00 H new
  1104. ATOM 0 HD12 ILE A 47 4.836 26.377 51.364 1.00 0.00 H new
  1105. ATOM 0 HD13 ILE A 47 3.775 26.458 50.191 1.00 0.00 H new
  1106. ATOM 263 N ARG A 48 8.245 29.565 49.504 1.00 0.00 N
  1107. ATOM 264 CA ARG A 48 9.684 29.729 49.772 1.00 0.00 C
  1108. ATOM 265 C ARG A 48 10.369 30.114 48.466 1.00 0.00 C
  1109. ATOM 266 O ARG A 48 9.801 29.836 47.404 1.00 0.00 O
  1110. ATOM 267 CB ARG A 48 10.321 28.428 50.263 1.00 0.00 C
  1111. ATOM 268 CG ARG A 48 9.802 27.922 51.607 1.00 0.00 C
  1112. ATOM 269 CD ARG A 48 10.103 28.882 52.757 1.00 0.00 C
  1113. ATOM 270 NE ARG A 48 9.819 28.218 54.037 1.00 0.00 N
  1114. ATOM 271 CZ ARG A 48 8.760 28.468 54.792 1.00 0.00 C
  1115. ATOM 272 NH1 ARG A 48 8.605 27.809 55.931 1.00 0.00 N
  1116. ATOM 273 NH2 ARG A 48 7.772 29.218 54.322 1.00 0.00 N
  1117. ATOM 0 H ARG A 48 8.085 29.057 48.829 1.00 0.00 H new
  1118. ATOM 0 HA ARG A 48 9.790 30.407 50.458 1.00 0.00 H new
  1119. ATOM 0 HB2 ARG A 48 10.174 27.740 49.595 1.00 0.00 H new
  1120. ATOM 0 HB3 ARG A 48 11.280 28.558 50.330 1.00 0.00 H new
  1121. ATOM 0 HG2 ARG A 48 8.844 27.785 51.548 1.00 0.00 H new
  1122. ATOM 0 HG3 ARG A 48 10.201 27.059 51.799 1.00 0.00 H new
  1123. ATOM 0 HD2 ARG A 48 11.032 29.160 52.725 1.00 0.00 H new
  1124. ATOM 0 HD3 ARG A 48 9.564 29.684 52.671 1.00 0.00 H new
  1125. ATOM 0 HE ARG A 48 10.379 27.627 54.315 1.00 0.00 H new
  1126. ATOM 0 HH11 ARG A 48 9.189 27.226 56.173 1.00 0.00 H new
  1127. ATOM 0 HH12 ARG A 48 7.921 27.964 56.428 1.00 0.00 H new
  1128. ATOM 0 HH21 ARG A 48 7.819 29.542 53.527 1.00 0.00 H new
  1129. ATOM 0 HH22 ARG A 48 7.084 29.380 54.812 1.00 0.00 H new
  1130. ATOM 274 N GLN A 49 11.611 30.578 48.547 1.00 0.00 N
  1131. ATOM 275 CA GLN A 49 12.365 30.987 47.350 1.00 0.00 C
  1132. ATOM 276 C GLN A 49 12.631 29.823 46.398 1.00 0.00 C
  1133. ATOM 277 O GLN A 49 12.638 30.013 45.176 1.00 0.00 O
  1134. ATOM 278 CB GLN A 49 13.691 31.647 47.726 1.00 0.00 C
  1135. ATOM 279 CG GLN A 49 13.499 32.938 48.520 1.00 0.00 C
  1136. ATOM 280 CD GLN A 49 14.855 33.611 48.721 1.00 0.00 C
  1137. ATOM 281 OE1 GLN A 49 15.312 33.778 49.860 1.00 0.00 O
  1138. ATOM 282 NE2 GLN A 49 15.418 34.079 47.616 1.00 0.00 N
  1139. ATOM 0 H GLN A 49 12.043 30.667 49.286 1.00 0.00 H new
  1140. ATOM 0 HA GLN A 49 11.804 31.630 46.889 1.00 0.00 H new
  1141. ATOM 0 HB2 GLN A 49 14.221 31.025 48.249 1.00 0.00 H new
  1142. ATOM 0 HB3 GLN A 49 14.193 31.839 46.919 1.00 0.00 H new
  1143. ATOM 0 HG2 GLN A 49 12.897 33.534 48.048 1.00 0.00 H new
  1144. ATOM 0 HG3 GLN A 49 13.091 32.745 49.379 1.00 0.00 H new
  1145. ATOM 0 HE21 GLN A 49 15.053 33.931 46.851 1.00 0.00 H new
  1146. ATOM 0 HE22 GLN A 49 16.148 34.531 47.664 1.00 0.00 H new
  1147. ATOM 283 N ASN A 50 12.420 28.640 46.944 1.00 0.00 N
  1148. ATOM 284 CA ASN A 50 12.629 27.375 46.232 1.00 0.00 C
  1149. ATOM 285 C ASN A 50 11.456 26.402 46.344 1.00 0.00 C
  1150. ATOM 286 O ASN A 50 11.592 25.237 45.953 1.00 0.00 O
  1151. ATOM 287 CB ASN A 50 13.905 26.695 46.721 1.00 0.00 C
  1152. ATOM 288 CG ASN A 50 13.769 26.312 48.193 1.00 0.00 C
  1153. ATOM 289 OD1 ASN A 50 13.465 27.170 49.034 1.00 0.00 O
  1154. ATOM 290 ND2 ASN A 50 14.375 25.177 48.498 1.00 0.00 N
  1155. ATOM 0 H ASN A 50 12.146 28.539 47.753 1.00 0.00 H new
  1156. ATOM 0 HA ASN A 50 12.708 27.609 45.294 1.00 0.00 H new
  1157. ATOM 0 HB2 ASN A 50 14.082 25.903 46.189 1.00 0.00 H new
  1158. ATOM 0 HB3 ASN A 50 14.662 27.290 46.604 1.00 0.00 H new
  1159. ATOM 0 HD21 ASN A 50 14.578 25.004 49.316 1.00 0.00 H new
  1160. ATOM 0 HD22 ASN A 50 14.566 24.612 47.879 1.00 0.00 H new
  1161. ATOM 291 N TRP A 51 10.436 26.813 47.088 1.00 0.00 N
  1162. ATOM 292 CA TRP A 51 9.199 26.016 47.253 1.00 0.00 C
  1163. ATOM 293 C TRP A 51 7.936 26.686 46.709 1.00 0.00 C
  1164. ATOM 294 O TRP A 51 7.648 27.844 47.040 1.00 0.00 O
  1165. ATOM 295 CB TRP A 51 8.960 25.583 48.703 1.00 0.00 C
  1166. ATOM 296 CG TRP A 51 9.879 24.433 49.149 1.00 0.00 C
  1167. ATOM 297 CD1 TRP A 51 11.074 24.475 49.772 1.00 0.00 C
  1168. ATOM 298 CD2 TRP A 51 9.594 23.074 49.014 1.00 0.00 C
  1169. ATOM 299 NE1 TRP A 51 11.557 23.200 49.979 1.00 0.00 N
  1170. ATOM 300 CE2 TRP A 51 10.701 22.365 49.538 1.00 0.00 C
  1171. ATOM 301 CE3 TRP A 51 8.498 22.417 48.476 1.00 0.00 C
  1172. ATOM 302 CZ2 TRP A 51 10.781 20.983 49.541 1.00 0.00 C
  1173. ATOM 303 CZ3 TRP A 51 8.571 21.016 48.483 1.00 0.00 C
  1174. ATOM 304 CH2 TRP A 51 9.674 20.322 48.995 1.00 0.00 C
  1175. ATOM 0 H TRP A 51 10.431 27.559 47.515 1.00 0.00 H new
  1176. ATOM 0 HA TRP A 51 9.365 25.230 46.710 1.00 0.00 H new
  1177. ATOM 0 HB2 TRP A 51 9.096 26.344 49.289 1.00 0.00 H new
  1178. ATOM 0 HB3 TRP A 51 8.035 25.309 48.805 1.00 0.00 H new
  1179. ATOM 0 HD1 TRP A 51 11.512 25.255 50.027 1.00 0.00 H new
  1180. ATOM 0 HE1 TRP A 51 12.310 23.002 50.344 1.00 0.00 H new
  1181. ATOM 0 HE3 TRP A 51 7.764 22.874 48.134 1.00 0.00 H new
  1182. ATOM 0 HZ2 TRP A 51 11.517 20.527 49.881 1.00 0.00 H new
  1183. ATOM 0 HZ3 TRP A 51 7.859 20.529 48.134 1.00 0.00 H new
  1184. ATOM 0 HH2 TRP A 51 9.671 19.392 48.972 1.00 0.00 H new
  1185. ATOM 305 N VAL A 52 7.137 25.876 46.015 1.00 0.00 N
  1186. ATOM 306 CA VAL A 52 5.857 26.278 45.395 1.00 0.00 C
  1187. ATOM 307 C VAL A 52 4.675 25.395 45.803 1.00 0.00 C
  1188. ATOM 308 O VAL A 52 4.812 24.170 45.878 1.00 0.00 O
  1189. ATOM 309 CB VAL A 52 6.000 26.298 43.868 1.00 0.00 C
  1190. ATOM 310 CG1 VAL A 52 4.667 26.308 43.120 1.00 0.00 C
  1191. ATOM 311 CG2 VAL A 52 6.930 27.406 43.381 1.00 0.00 C
  1192. ATOM 0 H VAL A 52 7.326 25.047 45.884 1.00 0.00 H new
  1193. ATOM 0 HA VAL A 52 5.658 27.168 45.725 1.00 0.00 H new
  1194. ATOM 0 HB VAL A 52 6.419 25.451 43.648 1.00 0.00 H new
  1195. ATOM 0 HG11 VAL A 52 4.832 26.321 42.164 1.00 0.00 H new
  1196. ATOM 0 HG12 VAL A 52 4.161 25.513 43.350 1.00 0.00 H new
  1197. ATOM 0 HG13 VAL A 52 4.161 27.097 43.371 1.00 0.00 H new
  1198. ATOM 0 HG21 VAL A 52 6.988 27.378 42.413 1.00 0.00 H new
  1199. ATOM 0 HG22 VAL A 52 6.581 28.267 43.659 1.00 0.00 H new
  1200. ATOM 0 HG23 VAL A 52 7.813 27.278 43.761 1.00 0.00 H new
  1201. ATOM 312 N MET A 53 3.606 26.038 46.253 1.00 0.00 N
  1202. ATOM 313 CA MET A 53 2.364 25.360 46.656 1.00 0.00 C
  1203. ATOM 314 C MET A 53 1.282 25.419 45.580 1.00 0.00 C
  1204. ATOM 315 O MET A 53 0.953 26.510 45.099 1.00 0.00 O
  1205. ATOM 316 CB MET A 53 1.824 25.993 47.937 1.00 0.00 C
  1206. ATOM 317 CG MET A 53 0.512 25.356 48.394 1.00 0.00 C
  1207. ATOM 318 SD MET A 53 -0.233 26.098 49.862 1.00 0.00 S
  1208. ATOM 319 CE MET A 53 -0.384 27.799 49.273 1.00 0.00 C
  1209. ATOM 0 H MET A 53 3.574 26.893 46.337 1.00 0.00 H new
  1210. ATOM 0 HA MET A 53 2.587 24.427 46.799 1.00 0.00 H new
  1211. ATOM 0 HB2 MET A 53 2.485 25.906 48.641 1.00 0.00 H new
  1212. ATOM 0 HB3 MET A 53 1.687 26.942 47.793 1.00 0.00 H new
  1213. ATOM 0 HG2 MET A 53 -0.126 25.405 47.665 1.00 0.00 H new
  1214. ATOM 0 HG3 MET A 53 0.670 24.415 48.569 1.00 0.00 H new
  1215. ATOM 0 HE1 MET A 53 -1.055 28.265 49.797 1.00 0.00 H new
  1216. ATOM 0 HE2 MET A 53 0.469 28.251 49.366 1.00 0.00 H new
  1217. ATOM 0 HE3 MET A 53 -0.648 27.796 48.340 1.00 0.00 H new
  1218. ATOM 320 N THR A 54 0.999 24.256 45.011 1.00 0.00 N
  1219. ATOM 321 CA THR A 54 -0.053 24.100 43.993 1.00 0.00 C
  1220. ATOM 322 C THR A 54 -0.996 22.939 44.316 1.00 0.00 C
  1221. ATOM 323 O THR A 54 -1.095 22.558 45.488 1.00 0.00 O
  1222. ATOM 324 CB THR A 54 0.591 23.923 42.616 1.00 0.00 C
  1223. ATOM 325 OG1 THR A 54 -0.379 24.040 41.576 1.00 0.00 O
  1224. ATOM 326 CG2 THR A 54 1.383 22.621 42.484 1.00 0.00 C
  1225. ATOM 0 H THR A 54 1.410 23.525 45.200 1.00 0.00 H new
  1226. ATOM 0 HA THR A 54 -0.596 24.904 43.990 1.00 0.00 H new
  1227. ATOM 0 HB THR A 54 1.234 24.644 42.523 1.00 0.00 H new
  1228. ATOM 0 HG1 THR A 54 -0.422 24.839 41.321 1.00 0.00 H new
  1229. ATOM 0 HG21 THR A 54 1.766 22.564 41.595 1.00 0.00 H new
  1230. ATOM 0 HG22 THR A 54 2.094 22.606 43.144 1.00 0.00 H new
  1231. ATOM 0 HG23 THR A 54 0.792 21.866 42.630 1.00 0.00 H new
  1232. ATOM 327 N ALA A 55 -1.932 22.704 43.411 1.00 0.00 N
  1233. ATOM 328 CA ALA A 55 -2.895 21.605 43.523 1.00 0.00 C
  1234. ATOM 329 C ALA A 55 -2.368 20.325 42.885 1.00 0.00 C
  1235. ATOM 330 O ALA A 55 -1.592 20.383 41.923 1.00 0.00 O
  1236. ATOM 331 CB ALA A 55 -4.220 21.982 42.866 1.00 0.00 C
  1237. ATOM 0 H ALA A 55 -2.032 23.181 42.703 1.00 0.00 H new
  1238. ATOM 0 HA ALA A 55 -3.033 21.444 44.470 1.00 0.00 H new
  1239. ATOM 0 HB1 ALA A 55 -4.844 21.244 42.949 1.00 0.00 H new
  1240. ATOM 0 HB2 ALA A 55 -4.587 22.766 43.303 1.00 0.00 H new
  1241. ATOM 0 HB3 ALA A 55 -4.072 22.175 41.927 1.00 0.00 H new
  1242. ATOM 332 N ALA A 56 -2.527 19.258 43.644 1.00 0.00 N
  1243. ATOM 333 CA ALA A 56 -2.079 17.918 43.248 1.00 0.00 C
  1244. ATOM 334 C ALA A 56 -2.672 17.458 41.918 1.00 0.00 C
  1245. ATOM 335 O ALA A 56 -1.958 16.873 41.092 1.00 0.00 O
  1246. ATOM 336 CB ALA A 56 -2.464 16.931 44.341 1.00 0.00 C
  1247. ATOM 0 H ALA A 56 -2.903 19.282 44.417 1.00 0.00 H new
  1248. ATOM 0 HA ALA A 56 -1.117 17.955 43.129 1.00 0.00 H new
  1249. ATOM 0 HB1 ALA A 56 -2.173 16.040 44.090 1.00 0.00 H new
  1250. ATOM 0 HB2 ALA A 56 -2.038 17.188 45.174 1.00 0.00 H new
  1251. ATOM 0 HB3 ALA A 56 -3.427 16.935 44.456 1.00 0.00 H new
  1252. ATOM 337 N HIS A 57 -3.817 18.052 41.621 1.00 0.00 N
  1253. ATOM 338 CA HIS A 57 -4.612 17.733 40.431 1.00 0.00 C
  1254. ATOM 339 C HIS A 57 -3.922 18.195 39.152 1.00 0.00 C
  1255. ATOM 340 O HIS A 57 -3.791 17.397 38.213 1.00 0.00 O
  1256. ATOM 341 CB HIS A 57 -5.980 18.402 40.537 1.00 0.00 C
  1257. ATOM 342 CG HIS A 57 -6.992 17.713 39.612 1.00 0.00 C
  1258. ATOM 343 ND1 HIS A 57 -6.617 16.713 38.757 1.00 0.00 N
  1259. ATOM 344 CD2 HIS A 57 -8.316 17.907 39.490 1.00 0.00 C
  1260. ATOM 345 CE1 HIS A 57 -7.736 16.298 38.086 1.00 0.00 C
  1261. ATOM 346 NE2 HIS A 57 -8.788 17.043 38.541 1.00 0.00 N
  1262. ATOM 0 H HIS A 57 -4.166 18.666 42.112 1.00 0.00 H new
  1263. ATOM 0 HA HIS A 57 -4.711 16.769 40.388 1.00 0.00 H new
  1264. ATOM 0 HB2 HIS A 57 -6.294 18.363 41.454 1.00 0.00 H new
  1265. ATOM 0 HB3 HIS A 57 -5.906 19.340 40.302 1.00 0.00 H new
  1266. ATOM 0 HD2 HIS A 57 -8.824 18.522 39.968 1.00 0.00 H new
  1267. ATOM 0 HE1 HIS A 57 -7.774 15.631 37.439 1.00 0.00 H new
  1268. ATOM 347 N CYS A 58 -3.067 19.174 39.379 1.00 0.00 N
  1269. ATOM 348 CA CYS A 58 -2.285 19.808 38.311 1.00 0.00 C
  1270. ATOM 349 C CYS A 58 -1.098 18.962 37.877 1.00 0.00 C
  1271. ATOM 350 O CYS A 58 -0.610 19.104 36.750 1.00 0.00 O
  1272. ATOM 351 CB CYS A 58 -1.757 21.151 38.800 1.00 0.00 C
  1273. ATOM 352 SG CYS A 58 -3.009 22.423 39.034 1.00 0.00 S
  1274. ATOM 0 H CYS A 58 -2.916 19.499 40.161 1.00 0.00 H new
  1275. ATOM 0 HA CYS A 58 -2.877 19.914 37.550 1.00 0.00 H new
  1276. ATOM 0 HB2 CYS A 58 -1.294 21.014 39.641 1.00 0.00 H new
  1277. ATOM 0 HB3 CYS A 58 -1.100 21.476 38.164 1.00 0.00 H new
  1278. ATOM 353 N VAL A 59 -0.529 18.285 38.852 1.00 0.00 N
  1279. ATOM 354 CA VAL A 59 0.687 17.507 38.607 1.00 0.00 C
  1280. ATOM 355 C VAL A 59 0.453 16.002 38.518 1.00 0.00 C
  1281. ATOM 356 O VAL A 59 1.346 15.214 38.854 1.00 0.00 O
  1282. ATOM 357 CB VAL A 59 1.770 17.856 39.629 1.00 0.00 C
  1283. ATOM 358 CG1 VAL A 59 2.402 19.220 39.356 1.00 0.00 C
  1284. ATOM 359 CG2 VAL A 59 1.278 17.736 41.070 1.00 0.00 C
  1285. ATOM 0 H VAL A 59 -0.821 18.256 39.660 1.00 0.00 H new
  1286. ATOM 0 HA VAL A 59 1.000 17.764 37.726 1.00 0.00 H new
  1287. ATOM 0 HB VAL A 59 2.469 17.192 39.520 1.00 0.00 H new
  1288. ATOM 0 HG11 VAL A 59 3.081 19.402 40.024 1.00 0.00 H new
  1289. ATOM 0 HG12 VAL A 59 2.808 19.218 38.475 1.00 0.00 H new
  1290. ATOM 0 HG13 VAL A 59 1.718 19.907 39.395 1.00 0.00 H new
  1291. ATOM 0 HG21 VAL A 59 1.998 17.966 41.678 1.00 0.00 H new
  1292. ATOM 0 HG22 VAL A 59 0.532 18.340 41.209 1.00 0.00 H new
  1293. ATOM 0 HG23 VAL A 59 0.991 16.825 41.239 1.00 0.00 H new
  1294. ATOM 360 N ASP A 60 -0.785 15.642 38.195 1.00 0.00 N
  1295. ATOM 361 CA ASP A 60 -1.157 14.230 37.993 1.00 0.00 C
  1296. ATOM 362 C ASP A 60 -0.395 13.541 36.865 1.00 0.00 C
  1297. ATOM 363 O ASP A 60 0.024 12.386 37.007 1.00 0.00 O
  1298. ATOM 364 CB ASP A 60 -2.654 14.071 37.740 1.00 0.00 C
  1299. ATOM 365 CG ASP A 60 -3.407 14.112 39.066 1.00 0.00 C
  1300. ATOM 366 OD1 ASP A 60 -3.012 13.403 39.998 1.00 0.00 O
  1301. ATOM 367 OD2 ASP A 60 -4.480 14.720 39.127 1.00 0.00 O
  1302. ATOM 0 H ASP A 60 -1.432 16.198 38.086 1.00 0.00 H new
  1303. ATOM 0 HA ASP A 60 -0.909 13.795 38.824 1.00 0.00 H new
  1304. ATOM 0 HB2 ASP A 60 -2.969 14.779 37.157 1.00 0.00 H new
  1305. ATOM 0 HB3 ASP A 60 -2.827 13.232 37.286 1.00 0.00 H new
  1306. ATOM 368 N ARG A 61 -0.371 14.199 35.722 1.00 0.00 N
  1307. ATOM 369 CA ARG A 61 0.274 13.646 34.524 1.00 0.00 C
  1308. ATOM 370 C ARG A 61 1.756 13.994 34.437 1.00 0.00 C
  1309. ATOM 371 O ARG A 61 2.142 15.082 34.879 1.00 0.00 O
  1310. ATOM 372 CB ARG A 61 -0.435 14.125 33.259 1.00 0.00 C
  1311. ATOM 373 CG ARG A 61 -1.871 13.613 33.161 1.00 0.00 C
  1312. ATOM 374 CD ARG A 61 -2.563 14.129 31.900 1.00 0.00 C
  1313. ATOM 375 NE ARG A 61 -3.930 13.597 31.802 1.00 0.00 N
  1314. ATOM 376 CZ ARG A 61 -4.511 13.306 30.647 1.00 0.00 C
  1315. ATOM 377 NH1 ARG A 61 -5.745 12.826 30.641 1.00 0.00 N
  1316. ATOM 378 NH2 ARG A 61 -4.000 13.787 29.524 1.00 0.00 N
  1317. ATOM 0 H ARG A 61 -0.723 14.975 35.608 1.00 0.00 H new
  1318. ATOM 0 HA ARG A 61 0.202 12.681 34.597 1.00 0.00 H new
  1319. ATOM 0 HB2 ARG A 61 -0.439 15.095 33.242 1.00 0.00 H new
  1320. ATOM 0 HB3 ARG A 61 0.064 13.830 32.481 1.00 0.00 H new
  1321. ATOM 0 HG2 ARG A 61 -1.871 12.643 33.158 1.00 0.00 H new
  1322. ATOM 0 HG3 ARG A 61 -2.370 13.894 33.944 1.00 0.00 H new
  1323. ATOM 0 HD2 ARG A 61 -2.589 15.099 31.913 1.00 0.00 H new
  1324. ATOM 0 HD3 ARG A 61 -2.053 13.870 31.117 1.00 0.00 H new
  1325. ATOM 0 HE ARG A 61 -4.373 13.469 32.528 1.00 0.00 H new
  1326. ATOM 0 HH11 ARG A 61 -6.163 12.705 31.383 1.00 0.00 H new
  1327. ATOM 0 HH12 ARG A 61 -6.128 12.635 29.895 1.00 0.00 H new
  1328. ATOM 0 HH21 ARG A 61 -3.298 14.283 29.549 1.00 0.00 H new
  1329. ATOM 0 HH22 ARG A 61 -4.370 13.603 28.770 1.00 0.00 H new
  1330. ATOM 379 N GLU A 62 2.537 12.933 34.342 1.00 0.00 N
  1331. ATOM 380 CA GLU A 62 3.997 13.023 34.225 1.00 0.00 C
  1332. ATOM 381 C GLU A 62 4.484 13.799 33.006 1.00 0.00 C
  1333. ATOM 382 O GLU A 62 5.042 13.225 32.062 1.00 0.00 O
  1334. ATOM 383 CB GLU A 62 4.615 11.634 34.291 1.00 0.00 C
  1335. ATOM 384 CG GLU A 62 4.495 11.079 35.707 1.00 0.00 C
  1336. ATOM 385 CD GLU A 62 4.347 9.564 35.648 1.00 0.00 C
  1337. ATOM 386 OE1 GLU A 62 5.060 8.860 36.373 1.00 0.00 O
  1338. ATOM 387 OE2 GLU A 62 3.366 9.093 35.060 1.00 0.00 O
  1339. ATOM 0 H GLU A 62 2.239 12.126 34.343 1.00 0.00 H new
  1340. ATOM 0 HA GLU A 62 4.300 13.545 34.984 1.00 0.00 H new
  1341. ATOM 0 HB2 GLU A 62 4.169 11.043 33.665 1.00 0.00 H new
  1342. ATOM 0 HB3 GLU A 62 5.548 11.674 34.029 1.00 0.00 H new
  1343. ATOM 0 HG2 GLU A 62 5.279 11.317 36.226 1.00 0.00 H new
  1344. ATOM 0 HG3 GLU A 62 3.729 11.471 36.155 1.00 0.00 H new
  1345. ATOM 388 N LEU A 63 4.435 15.107 33.175 1.00 0.00 N
  1346. ATOM 389 CA LEU A 63 4.907 16.096 32.199 1.00 0.00 C
  1347. ATOM 390 C LEU A 63 6.142 16.819 32.732 1.00 0.00 C
  1348. ATOM 391 O LEU A 63 6.662 16.445 33.791 1.00 0.00 O
  1349. ATOM 392 CB LEU A 63 3.802 17.127 31.960 1.00 0.00 C
  1350. ATOM 393 CG LEU A 63 2.510 16.499 31.437 1.00 0.00 C
  1351. ATOM 394 CD1 LEU A 63 1.309 17.430 31.584 1.00 0.00 C
  1352. ATOM 395 CD2 LEU A 63 2.653 15.948 30.019 1.00 0.00 C
  1353. ATOM 0 H LEU A 63 4.114 15.467 33.887 1.00 0.00 H new
  1354. ATOM 0 HA LEU A 63 5.133 15.640 31.373 1.00 0.00 H new
  1355. ATOM 0 HB2 LEU A 63 3.617 17.595 32.789 1.00 0.00 H new
  1356. ATOM 0 HB3 LEU A 63 4.115 17.789 31.324 1.00 0.00 H new
  1357. ATOM 0 HG LEU A 63 2.334 15.733 32.005 1.00 0.00 H new
  1358. ATOM 0 HD11 LEU A 63 0.515 16.991 31.240 1.00 0.00 H new
  1359. ATOM 0 HD12 LEU A 63 1.179 17.645 32.521 1.00 0.00 H new
  1360. ATOM 0 HD13 LEU A 63 1.469 18.246 31.084 1.00 0.00 H new
  1361. ATOM 0 HD21 LEU A 63 1.810 15.562 29.735 1.00 0.00 H new
  1362. ATOM 0 HD22 LEU A 63 2.899 16.667 29.416 1.00 0.00 H new
  1363. ATOM 0 HD23 LEU A 63 3.342 15.265 30.005 1.00 0.00 H new
  1364. ATOM 396 N THR A 64 6.742 17.628 31.883 1.00 0.00 N
  1365. ATOM 397 CA THR A 64 7.889 18.451 32.285 1.00 0.00 C
  1366. ATOM 398 C THR A 64 7.439 19.864 32.636 1.00 0.00 C
  1367. ATOM 399 O THR A 64 6.766 20.496 31.815 1.00 0.00 O
  1368. ATOM 400 CB THR A 64 8.919 18.502 31.160 1.00 0.00 C
  1369. ATOM 401 OG1 THR A 64 9.400 17.184 30.922 1.00 0.00 O
  1370. ATOM 402 CG2 THR A 64 10.101 19.409 31.497 1.00 0.00 C
  1371. ATOM 0 H THR A 64 6.506 17.723 31.061 1.00 0.00 H new
  1372. ATOM 0 HA THR A 64 8.293 18.049 33.070 1.00 0.00 H new
  1373. ATOM 0 HB THR A 64 8.484 18.866 30.373 1.00 0.00 H new
  1374. ATOM 0 HG1 THR A 64 9.967 17.200 30.303 1.00 0.00 H new
  1375. ATOM 0 HG21 THR A 64 10.728 19.412 30.757 1.00 0.00 H new
  1376. ATOM 0 HG22 THR A 64 9.782 20.312 31.653 1.00 0.00 H new
  1377. ATOM 0 HG23 THR A 64 10.544 19.080 32.295 1.00 0.00 H new
  1378. ATOM 403 N PHE A 65 7.464 20.146 33.931 1.00 0.00 N
  1379. ATOM 404 CA PHE A 65 6.975 21.424 34.470 1.00 0.00 C
  1380. ATOM 405 C PHE A 65 8.050 22.479 34.716 1.00 0.00 C
  1381. ATOM 406 O PHE A 65 9.213 22.148 34.981 1.00 0.00 O
  1382. ATOM 407 CB PHE A 65 6.248 21.214 35.800 1.00 0.00 C
  1383. ATOM 408 CG PHE A 65 5.030 20.288 35.680 1.00 0.00 C
  1384. ATOM 409 CD1 PHE A 65 3.859 20.747 35.099 1.00 0.00 C
  1385. ATOM 410 CD2 PHE A 65 5.094 19.000 36.187 1.00 0.00 C
  1386. ATOM 411 CE1 PHE A 65 2.749 19.904 34.995 1.00 0.00 C
  1387. ATOM 412 CE2 PHE A 65 3.989 18.150 36.087 1.00 0.00 C
  1388. ATOM 413 CZ PHE A 65 2.815 18.601 35.487 1.00 0.00 C
  1389. ATOM 0 H PHE A 65 7.764 19.606 34.529 1.00 0.00 H new
  1390. ATOM 0 HA PHE A 65 6.386 21.754 33.774 1.00 0.00 H new
  1391. ATOM 0 HB2 PHE A 65 6.868 20.842 36.446 1.00 0.00 H new
  1392. ATOM 0 HB3 PHE A 65 5.961 22.074 36.145 1.00 0.00 H new
  1393. ATOM 0 HD1 PHE A 65 3.811 21.618 34.777 1.00 0.00 H new
  1394. ATOM 0 HD2 PHE A 65 5.874 18.700 36.595 1.00 0.00 H new
  1395. ATOM 0 HE1 PHE A 65 1.967 20.212 34.598 1.00 0.00 H new
  1396. ATOM 0 HE2 PHE A 65 4.037 17.283 36.421 1.00 0.00 H new
  1397. ATOM 0 HZ PHE A 65 2.080 18.036 35.415 1.00 0.00 H new
  1398. ATOM 414 N ARG A 65A 7.668 23.712 34.409 1.00 0.00 N
  1399. ATOM 415 CA ARG A 65A 8.426 24.902 34.812 1.00 0.00 C
  1400. ATOM 416 C ARG A 65A 7.516 25.948 35.451 1.00 0.00 C
  1401. ATOM 417 O ARG A 65A 6.290 25.876 35.292 1.00 0.00 O
  1402. ATOM 418 CB ARG A 65A 9.227 25.545 33.677 1.00 0.00 C
  1403. ATOM 419 CG ARG A 65A 8.406 26.509 32.821 1.00 0.00 C
  1404. ATOM 420 CD ARG A 65A 9.294 27.317 31.875 1.00 0.00 C
  1405. ATOM 421 NE ARG A 65A 8.485 28.283 31.122 1.00 0.00 N
  1406. ATOM 422 CZ ARG A 65A 8.900 28.891 30.020 1.00 0.00 C
  1407. ATOM 423 NH1 ARG A 65A 8.086 29.745 29.415 1.00 0.00 N
  1408. ATOM 424 NH2 ARG A 65A 10.185 28.875 29.701 1.00 0.00 N
  1409. ATOM 0 H ARG A 65A 6.957 23.888 33.958 1.00 0.00 H new
  1410. ATOM 0 HA ARG A 65A 9.069 24.581 35.464 1.00 0.00 H new
  1411. ATOM 0 HB2 ARG A 65A 9.983 26.022 34.054 1.00 0.00 H new
  1412. ATOM 0 HB3 ARG A 65A 9.587 24.846 33.109 1.00 0.00 H new
  1413. ATOM 0 HG2 ARG A 65A 7.753 26.010 32.306 1.00 0.00 H new
  1414. ATOM 0 HG3 ARG A 65A 7.911 27.113 33.397 1.00 0.00 H new
  1415. ATOM 0 HD2 ARG A 65A 9.978 27.783 32.381 1.00 0.00 H new
  1416. ATOM 0 HD3 ARG A 65A 9.752 26.721 31.262 1.00 0.00 H new
  1417. ATOM 0 HE ARG A 65A 7.696 28.465 31.413 1.00 0.00 H new
  1418. ATOM 0 HH11 ARG A 65A 7.304 29.896 29.739 1.00 0.00 H new
  1419. ATOM 0 HH12 ARG A 65A 8.340 30.148 28.699 1.00 0.00 H new
  1420. ATOM 0 HH21 ARG A 65A 10.749 28.470 30.209 1.00 0.00 H new
  1421. ATOM 0 HH22 ARG A 65A 10.456 29.269 28.986 1.00 0.00 H new
  1422. ATOM 425 N VAL A 66 8.078 26.593 36.454 1.00 0.00 N
  1423. ATOM 426 CA VAL A 66 7.408 27.653 37.212 1.00 0.00 C
  1424. ATOM 427 C VAL A 66 7.955 29.034 36.865 1.00 0.00 C
  1425. ATOM 428 O VAL A 66 9.149 29.150 36.559 1.00 0.00 O
  1426. ATOM 429 CB VAL A 66 7.556 27.377 38.708 1.00 0.00 C
  1427. ATOM 430 CG1 VAL A 66 7.203 28.575 39.587 1.00 0.00 C
  1428. ATOM 431 CG2 VAL A 66 6.814 26.111 39.132 1.00 0.00 C
  1429. ATOM 0 H VAL A 66 8.877 26.430 36.726 1.00 0.00 H new
  1430. ATOM 0 HA VAL A 66 6.468 27.652 36.971 1.00 0.00 H new
  1431. ATOM 0 HB VAL A 66 8.502 27.219 38.854 1.00 0.00 H new
  1432. ATOM 0 HG11 VAL A 66 7.317 28.336 40.520 1.00 0.00 H new
  1433. ATOM 0 HG12 VAL A 66 7.787 29.319 39.370 1.00 0.00 H new
  1434. ATOM 0 HG13 VAL A 66 6.281 28.832 39.429 1.00 0.00 H new
  1435. ATOM 0 HG21 VAL A 66 6.932 25.970 40.085 1.00 0.00 H new
  1436. ATOM 0 HG22 VAL A 66 5.869 26.208 38.934 1.00 0.00 H new
  1437. ATOM 0 HG23 VAL A 66 7.169 25.350 38.647 1.00 0.00 H new
  1438. ATOM 432 N VAL A 67 7.031 29.885 36.446 1.00 0.00 N
  1439. ATOM 433 CA VAL A 67 7.388 31.258 36.085 1.00 0.00 C
  1440. ATOM 434 C VAL A 67 6.862 32.291 37.077 1.00 0.00 C
  1441. ATOM 435 O VAL A 67 5.655 32.327 37.350 1.00 0.00 O
  1442. ATOM 436 CB VAL A 67 6.887 31.602 34.687 1.00 0.00 C
  1443. ATOM 437 CG1 VAL A 67 7.546 32.884 34.185 1.00 0.00 C
  1444. ATOM 438 CG2 VAL A 67 7.124 30.456 33.710 1.00 0.00 C
  1445. ATOM 0 H VAL A 67 6.197 29.694 36.362 1.00 0.00 H new
  1446. ATOM 0 HA VAL A 67 8.357 31.295 36.106 1.00 0.00 H new
  1447. ATOM 0 HB VAL A 67 5.929 31.746 34.742 1.00 0.00 H new
  1448. ATOM 0 HG11 VAL A 67 7.218 33.090 33.296 1.00 0.00 H new
  1449. ATOM 0 HG12 VAL A 67 7.332 33.615 34.786 1.00 0.00 H new
  1450. ATOM 0 HG13 VAL A 67 8.508 32.763 34.154 1.00 0.00 H new
  1451. ATOM 0 HG21 VAL A 67 6.795 30.706 32.832 1.00 0.00 H new
  1452. ATOM 0 HG22 VAL A 67 8.074 30.267 33.657 1.00 0.00 H new
  1453. ATOM 0 HG23 VAL A 67 6.654 29.665 34.018 1.00 0.00 H new
  1454. ATOM 439 N VAL A 68 7.802 32.858 37.818 1.00 0.00 N
  1455. ATOM 440 CA VAL A 68 7.496 33.944 38.756 1.00 0.00 C
  1456. ATOM 441 C VAL A 68 7.707 35.306 38.098 1.00 0.00 C
  1457. ATOM 442 O VAL A 68 8.378 35.380 37.061 1.00 0.00 O
  1458. ATOM 443 CB VAL A 68 8.355 33.838 40.020 1.00 0.00 C
  1459. ATOM 444 CG1 VAL A 68 8.085 32.564 40.812 1.00 0.00 C
  1460. ATOM 445 CG2 VAL A 68 9.844 33.991 39.738 1.00 0.00 C
  1461. ATOM 0 H VAL A 68 8.631 32.631 37.797 1.00 0.00 H new
  1462. ATOM 0 HA VAL A 68 6.563 33.859 39.008 1.00 0.00 H new
  1463. ATOM 0 HB VAL A 68 8.085 34.588 40.572 1.00 0.00 H new
  1464. ATOM 0 HG11 VAL A 68 8.652 32.546 41.599 1.00 0.00 H new
  1465. ATOM 0 HG12 VAL A 68 7.154 32.543 41.084 1.00 0.00 H new
  1466. ATOM 0 HG13 VAL A 68 8.277 31.791 40.258 1.00 0.00 H new
  1467. ATOM 0 HG21 VAL A 68 10.340 33.916 40.568 1.00 0.00 H new
  1468. ATOM 0 HG22 VAL A 68 10.131 33.295 39.126 1.00 0.00 H new
  1469. ATOM 0 HG23 VAL A 68 10.011 34.860 39.340 1.00 0.00 H new
  1470. ATOM 446 N GLY A 69 6.846 36.239 38.463 1.00 0.00 N
  1471. ATOM 447 CA GLY A 69 6.922 37.611 37.947 1.00 0.00 C
  1472. ATOM 448 C GLY A 69 6.201 37.772 36.613 1.00 0.00 C
  1473. ATOM 449 O GLY A 69 6.712 38.465 35.724 1.00 0.00 O
  1474. ATOM 0 H GLY A 69 6.200 36.104 39.015 1.00 0.00 H new
  1475. ATOM 0 HA2 GLY A 69 6.536 38.220 38.596 1.00 0.00 H new
  1476. ATOM 0 HA3 GLY A 69 7.853 37.863 37.841 1.00 0.00 H new
  1477. ATOM 450 N GLU A 70 5.323 36.822 36.357 1.00 0.00 N
  1478. ATOM 451 CA GLU A 70 4.494 36.849 35.145 1.00 0.00 C
  1479. ATOM 452 C GLU A 70 3.336 37.838 35.209 1.00 0.00 C
  1480. ATOM 453 O GLU A 70 2.782 38.099 36.285 1.00 0.00 O
  1481. ATOM 454 CB GLU A 70 3.932 35.463 34.837 1.00 0.00 C
  1482. ATOM 455 CG GLU A 70 4.755 34.691 33.810 1.00 0.00 C
  1483. ATOM 456 CD GLU A 70 4.406 35.118 32.383 1.00 0.00 C
  1484. ATOM 457 OE1 GLU A 70 4.182 36.308 32.122 1.00 0.00 O
  1485. ATOM 458 OE2 GLU A 70 4.380 34.255 31.497 1.00 0.00 O
  1486. ATOM 0 H GLU A 70 5.184 36.145 36.869 1.00 0.00 H new
  1487. ATOM 0 HA GLU A 70 5.091 37.143 34.439 1.00 0.00 H new
  1488. ATOM 0 HB2 GLU A 70 3.888 34.949 35.659 1.00 0.00 H new
  1489. ATOM 0 HB3 GLU A 70 3.023 35.555 34.511 1.00 0.00 H new
  1490. ATOM 0 HG2 GLU A 70 5.700 34.839 33.972 1.00 0.00 H new
  1491. ATOM 0 HG3 GLU A 70 4.595 33.740 33.913 1.00 0.00 H new
  1492. ATOM 459 N HIS A 71 2.993 38.350 34.040 1.00 0.00 N
  1493. ATOM 460 CA HIS A 71 1.818 39.214 33.890 1.00 0.00 C
  1494. ATOM 461 C HIS A 71 1.047 38.895 32.613 1.00 0.00 C
  1495. ATOM 462 O HIS A 71 -0.077 38.383 32.675 1.00 0.00 O
  1496. ATOM 463 CB HIS A 71 2.211 40.688 33.914 1.00 0.00 C
  1497. ATOM 464 CG HIS A 71 0.955 41.564 34.026 1.00 0.00 C
  1498. ATOM 465 ND1 HIS A 71 0.084 41.420 35.065 1.00 0.00 N
  1499. ATOM 466 CD2 HIS A 71 0.493 42.532 33.214 1.00 0.00 C
  1500. ATOM 467 CE1 HIS A 71 -0.926 42.321 34.894 1.00 0.00 C
  1501. ATOM 468 NE2 HIS A 71 -0.675 43.013 33.743 1.00 0.00 N
  1502. ATOM 0 H HIS A 71 3.427 38.212 33.310 1.00 0.00 H new
  1503. ATOM 0 HA HIS A 71 1.236 39.038 34.646 1.00 0.00 H new
  1504. ATOM 0 HB2 HIS A 71 2.803 40.861 34.663 1.00 0.00 H new
  1505. ATOM 0 HB3 HIS A 71 2.701 40.913 33.108 1.00 0.00 H new
  1506. ATOM 0 HD2 HIS A 71 0.897 42.824 32.429 1.00 0.00 H new
  1507. ATOM 0 HE1 HIS A 71 -1.654 42.442 35.459 1.00 0.00 H new
  1508. ATOM 469 N ASN A 72 1.791 38.908 31.516 1.00 0.00 N
  1509. ATOM 470 CA ASN A 72 1.267 38.558 30.189 1.00 0.00 C
  1510. ATOM 471 C ASN A 72 2.005 37.349 29.627 1.00 0.00 C
  1511. ATOM 472 O ASN A 72 3.234 37.409 29.489 1.00 0.00 O
  1512. ATOM 473 CB ASN A 72 1.394 39.736 29.221 1.00 0.00 C
  1513. ATOM 474 CG ASN A 72 0.559 39.520 27.955 1.00 0.00 C
  1514. ATOM 475 OD1 ASN A 72 0.561 38.435 27.356 1.00 0.00 O
  1515. ATOM 476 ND2 ASN A 72 0.195 40.654 27.374 1.00 0.00 N
  1516. ATOM 0 H ASN A 72 2.624 39.122 31.514 1.00 0.00 H new
  1517. ATOM 0 HA ASN A 72 0.327 38.340 30.289 1.00 0.00 H new
  1518. ATOM 0 HB2 ASN A 72 1.108 40.551 29.663 1.00 0.00 H new
  1519. ATOM 0 HB3 ASN A 72 2.325 39.857 28.978 1.00 0.00 H new
  1520. ATOM 0 HD21 ASN A 72 -0.052 40.655 26.550 1.00 0.00 H new
  1521. ATOM 0 HD22 ASN A 72 0.206 41.389 27.821 1.00 0.00 H new
  1522. ATOM 477 N LEU A 73 1.331 36.224 29.791 1.00 0.00 N
  1523. ATOM 478 CA LEU A 73 1.793 34.907 29.321 1.00 0.00 C
  1524. ATOM 479 C LEU A 73 2.461 34.949 27.951 1.00 0.00 C
  1525. ATOM 480 O LEU A 73 3.630 34.566 27.819 1.00 0.00 O
  1526. ATOM 481 CB LEU A 73 0.630 33.921 29.232 1.00 0.00 C
  1527. ATOM 482 CG LEU A 73 0.010 33.567 30.581 1.00 0.00 C
  1528. ATOM 483 CD1 LEU A 73 -1.197 32.648 30.399 1.00 0.00 C
  1529. ATOM 484 CD2 LEU A 73 1.029 32.965 31.548 1.00 0.00 C
  1530. ATOM 0 H LEU A 73 0.569 36.194 30.189 1.00 0.00 H new
  1531. ATOM 0 HA LEU A 73 2.448 34.623 29.977 1.00 0.00 H new
  1532. ATOM 0 HB2 LEU A 73 -0.057 34.297 28.660 1.00 0.00 H new
  1533. ATOM 0 HB3 LEU A 73 0.940 33.107 28.806 1.00 0.00 H new
  1534. ATOM 0 HG LEU A 73 -0.297 34.395 30.983 1.00 0.00 H new
  1535. ATOM 0 HD11 LEU A 73 -1.576 32.435 31.266 1.00 0.00 H new
  1536. ATOM 0 HD12 LEU A 73 -1.865 33.095 29.856 1.00 0.00 H new
  1537. ATOM 0 HD13 LEU A 73 -0.918 31.830 29.959 1.00 0.00 H new
  1538. ATOM 0 HD21 LEU A 73 0.593 32.756 32.389 1.00 0.00 H new
  1539. ATOM 0 HD22 LEU A 73 1.398 32.154 31.165 1.00 0.00 H new
  1540. ATOM 0 HD23 LEU A 73 1.743 33.603 31.704 1.00 0.00 H new
  1541. ATOM 485 N ASN A 74 1.826 35.689 27.061 1.00 0.00 N
  1542. ATOM 486 CA ASN A 74 2.246 35.726 25.655 1.00 0.00 C
  1543. ATOM 487 C ASN A 74 3.200 36.870 25.339 1.00 0.00 C
  1544. ATOM 488 O ASN A 74 3.529 37.094 24.168 1.00 0.00 O
  1545. ATOM 489 CB ASN A 74 1.027 35.858 24.744 1.00 0.00 C
  1546. ATOM 490 CG ASN A 74 0.131 34.632 24.892 1.00 0.00 C
  1547. ATOM 491 OD1 ASN A 74 -1.050 34.768 25.237 1.00 0.00 O
  1548. ATOM 492 ND2 ASN A 74 0.781 33.479 24.908 1.00 0.00 N
  1549. ATOM 0 H ASN A 74 1.145 36.182 27.243 1.00 0.00 H new
  1550. ATOM 0 HA ASN A 74 2.716 34.892 25.497 1.00 0.00 H new
  1551. ATOM 0 HB2 ASN A 74 0.530 36.660 24.970 1.00 0.00 H new
  1552. ATOM 0 HB3 ASN A 74 1.312 35.951 23.821 1.00 0.00 H new
  1553. ATOM 0 HD21 ASN A 74 0.382 32.764 25.170 1.00 0.00 H new
  1554. ATOM 0 HD22 ASN A 74 1.603 33.445 24.656 1.00 0.00 H new
  1555. ATOM 493 N GLN A 75 3.560 37.616 26.369 1.00 0.00 N
  1556. ATOM 494 CA GLN A 75 4.381 38.816 26.146 1.00 0.00 C
  1557. ATOM 495 C GLN A 75 5.426 39.059 27.234 1.00 0.00 C
  1558. ATOM 496 O GLN A 75 5.204 38.678 28.391 1.00 0.00 O
  1559. ATOM 497 CB GLN A 75 3.422 39.999 26.042 1.00 0.00 C
  1560. ATOM 498 CG GLN A 75 4.055 41.328 25.650 1.00 0.00 C
  1561. ATOM 499 CD GLN A 75 2.940 42.369 25.596 1.00 0.00 C
  1562. ATOM 500 OE1 GLN A 75 1.797 42.020 25.269 1.00 0.00 O
  1563. ATOM 501 NE2 GLN A 75 3.199 43.479 26.266 1.00 0.00 N
  1564. ATOM 0 H GLN A 75 3.351 37.459 27.188 1.00 0.00 H new
  1565. ATOM 0 HA GLN A 75 4.895 38.695 25.332 1.00 0.00 H new
  1566. ATOM 0 HB2 GLN A 75 2.736 39.782 25.392 1.00 0.00 H new
  1567. ATOM 0 HB3 GLN A 75 2.978 40.111 26.897 1.00 0.00 H new
  1568. ATOM 0 HG2 GLN A 75 4.732 41.587 26.294 1.00 0.00 H new
  1569. ATOM 0 HG3 GLN A 75 4.496 41.255 24.789 1.00 0.00 H new
  1570. ATOM 0 HE21 GLN A 75 4.010 43.679 26.470 1.00 0.00 H new
  1571. ATOM 0 HE22 GLN A 75 2.556 44.001 26.498 1.00 0.00 H new
  1572. ATOM 502 N ASN A 76 6.635 39.357 26.778 1.00 0.00 N
  1573. ATOM 503 CA ASN A 76 7.767 39.666 27.659 1.00 0.00 C
  1574. ATOM 504 C ASN A 76 7.517 40.864 28.567 1.00 0.00 C
  1575. ATOM 505 O ASN A 76 7.250 41.972 28.083 1.00 0.00 O
  1576. ATOM 506 CB ASN A 76 9.045 39.902 26.863 1.00 0.00 C
  1577. ATOM 507 CG ASN A 76 10.128 40.351 27.839 1.00 0.00 C
  1578. ATOM 508 OD1 ASN A 76 10.501 39.584 28.737 1.00 0.00 O
  1579. ATOM 509 ND2 ASN A 76 10.295 41.663 27.884 1.00 0.00 N
  1580. ATOM 0 H ASN A 76 6.829 39.387 25.941 1.00 0.00 H new
  1581. ATOM 0 HA ASN A 76 7.871 38.884 28.223 1.00 0.00 H new
  1582. ATOM 0 HB2 ASN A 76 9.315 39.090 26.406 1.00 0.00 H new
  1583. ATOM 0 HB3 ASN A 76 8.901 40.577 26.181 1.00 0.00 H new
  1584. ATOM 0 HD21 ASN A 76 10.680 42.024 28.563 1.00 0.00 H new
  1585. ATOM 0 HD22 ASN A 76 10.018 42.154 27.235 1.00 0.00 H new
  1586. ATOM 510 N ASN A 77 7.289 40.535 29.825 1.00 0.00 N
  1587. ATOM 511 CA ASN A 77 7.003 41.553 30.845 1.00 0.00 C
  1588. ATOM 512 C ASN A 77 8.269 42.182 31.412 1.00 0.00 C
  1589. ATOM 513 O ASN A 77 8.192 43.078 32.262 1.00 0.00 O
  1590. ATOM 514 CB ASN A 77 6.183 40.955 31.985 1.00 0.00 C
  1591. ATOM 515 CG ASN A 77 4.822 40.537 31.443 1.00 0.00 C
  1592. ATOM 516 OD1 ASN A 77 4.568 39.330 31.346 1.00 0.00 O
  1593. ATOM 517 ND2 ASN A 77 4.283 41.450 30.651 1.00 0.00 N
  1594. ATOM 0 H ASN A 77 7.293 39.727 30.119 1.00 0.00 H new
  1595. ATOM 0 HA ASN A 77 6.495 42.251 30.403 1.00 0.00 H new
  1596. ATOM 0 HB2 ASN A 77 6.643 40.190 32.364 1.00 0.00 H new
  1597. ATOM 0 HB3 ASN A 77 6.076 41.604 32.698 1.00 0.00 H new
  1598. ATOM 0 HD21 ASN A 77 3.730 41.214 30.036 1.00 0.00 H new
  1599. ATOM 0 HD22 ASN A 77 4.486 42.280 30.751 1.00 0.00 H new
  1600. ATOM 518 N GLY A 78 9.376 41.523 31.104 1.00 0.00 N
  1601. ATOM 519 CA GLY A 78 10.712 41.940 31.557 1.00 0.00 C
  1602. ATOM 520 C GLY A 78 10.986 41.598 33.019 1.00 0.00 C
  1603. ATOM 521 O GLY A 78 12.048 41.939 33.555 1.00 0.00 O
  1604. ATOM 0 H GLY A 78 9.381 40.812 30.621 1.00 0.00 H new
  1605. ATOM 0 HA2 GLY A 78 11.383 41.515 31.000 1.00 0.00 H new
  1606. ATOM 0 HA3 GLY A 78 10.805 42.897 31.432 1.00 0.00 H new
  1607. ATOM 522 N THR A 79 9.988 41.024 33.665 1.00 0.00 N
  1608. ATOM 523 CA THR A 79 10.070 40.721 35.101 1.00 0.00 C
  1609. ATOM 524 C THR A 79 10.018 39.232 35.426 1.00 0.00 C
  1610. ATOM 525 O THR A 79 9.941 38.853 36.601 1.00 0.00 O
  1611. ATOM 526 CB THR A 79 8.919 41.419 35.814 1.00 0.00 C
  1612. ATOM 527 OG1 THR A 79 7.712 41.020 35.180 1.00 0.00 O
  1613. ATOM 528 CG2 THR A 79 9.035 42.938 35.723 1.00 0.00 C
  1614. ATOM 0 H THR A 79 9.245 40.797 33.296 1.00 0.00 H new
  1615. ATOM 0 HA THR A 79 10.935 41.040 35.403 1.00 0.00 H new
  1616. ATOM 0 HB THR A 79 8.936 41.172 36.752 1.00 0.00 H new
  1617. ATOM 0 HG1 THR A 79 7.493 40.255 35.450 1.00 0.00 H new
  1618. ATOM 0 HG21 THR A 79 8.288 43.348 36.186 1.00 0.00 H new
  1619. ATOM 0 HG22 THR A 79 9.866 43.224 36.133 1.00 0.00 H new
  1620. ATOM 0 HG23 THR A 79 9.025 43.208 34.791 1.00 0.00 H new
  1621. ATOM 529 N GLU A 80 9.991 38.418 34.385 1.00 0.00 N
  1622. ATOM 530 CA GLU A 80 9.866 36.963 34.547 1.00 0.00 C
  1623. ATOM 531 C GLU A 80 11.162 36.244 34.921 1.00 0.00 C
  1624. ATOM 532 O GLU A 80 12.247 36.818 34.767 1.00 0.00 O
  1625. ATOM 533 CB GLU A 80 9.300 36.315 33.283 1.00 0.00 C
  1626. ATOM 534 CG GLU A 80 7.969 36.913 32.826 1.00 0.00 C
  1627. ATOM 535 CD GLU A 80 8.200 37.919 31.699 1.00 0.00 C
  1628. ATOM 536 OE1 GLU A 80 8.938 38.893 31.883 1.00 0.00 O
  1629. ATOM 537 OE2 GLU A 80 7.616 37.755 30.621 1.00 0.00 O
  1630. ATOM 0 H GLU A 80 10.044 38.681 33.568 1.00 0.00 H new
  1631. ATOM 0 HA GLU A 80 9.258 36.859 35.295 1.00 0.00 H new
  1632. ATOM 0 HB2 GLU A 80 9.948 36.404 32.566 1.00 0.00 H new
  1633. ATOM 0 HB3 GLU A 80 9.181 35.366 33.442 1.00 0.00 H new
  1634. ATOM 0 HG2 GLU A 80 7.377 36.207 32.522 1.00 0.00 H new
  1635. ATOM 0 HG3 GLU A 80 7.530 37.349 33.573 1.00 0.00 H new
  1636. ATOM 538 N GLN A 81 10.972 35.270 35.801 1.00 0.00 N
  1637. ATOM 539 CA GLN A 81 11.982 34.266 36.177 1.00 0.00 C
  1638. ATOM 540 C GLN A 81 11.495 32.847 35.895 1.00 0.00 C
  1639. ATOM 541 O GLN A 81 10.441 32.432 36.393 1.00 0.00 O
  1640. ATOM 542 CB GLN A 81 12.413 34.364 37.641 1.00 0.00 C
  1641. ATOM 543 CG GLN A 81 13.423 35.475 37.918 1.00 0.00 C
  1642. ATOM 544 CD GLN A 81 13.762 35.494 39.408 1.00 0.00 C
  1643. ATOM 545 OE1 GLN A 81 14.423 34.579 39.920 1.00 0.00 O
  1644. ATOM 546 NE2 GLN A 81 13.193 36.470 40.095 1.00 0.00 N
  1645. ATOM 0 H GLN A 81 10.226 35.165 36.216 1.00 0.00 H new
  1646. ATOM 0 HA GLN A 81 12.754 34.462 35.624 1.00 0.00 H new
  1647. ATOM 0 HB2 GLN A 81 11.627 34.509 38.191 1.00 0.00 H new
  1648. ATOM 0 HB3 GLN A 81 12.797 33.516 37.913 1.00 0.00 H new
  1649. ATOM 0 HG2 GLN A 81 14.227 35.332 37.395 1.00 0.00 H new
  1650. ATOM 0 HG3 GLN A 81 13.058 36.332 37.648 1.00 0.00 H new
  1651. ATOM 0 HE21 GLN A 81 12.745 37.080 39.686 1.00 0.00 H new
  1652. ATOM 0 HE22 GLN A 81 13.271 36.495 40.951 1.00 0.00 H new
  1653. ATOM 547 N TYR A 82 12.243 32.172 35.042 1.00 0.00 N
  1654. ATOM 548 CA TYR A 82 11.929 30.816 34.578 1.00 0.00 C
  1655. ATOM 549 C TYR A 82 12.757 29.763 35.313 1.00 0.00 C
  1656. ATOM 550 O TYR A 82 13.991 29.858 35.330 1.00 0.00 O
  1657. ATOM 551 CB TYR A 82 12.231 30.718 33.081 1.00 0.00 C
  1658. ATOM 552 CG TYR A 82 11.497 31.791 32.258 1.00 0.00 C
  1659. ATOM 553 CD1 TYR A 82 12.178 32.912 31.806 1.00 0.00 C
  1660. ATOM 554 CD2 TYR A 82 10.159 31.624 31.942 1.00 0.00 C
  1661. ATOM 555 CE1 TYR A 82 11.514 33.883 31.046 1.00 0.00 C
  1662. ATOM 556 CE2 TYR A 82 9.487 32.588 31.179 1.00 0.00 C
  1663. ATOM 557 CZ TYR A 82 10.166 33.718 30.731 1.00 0.00 C
  1664. ATOM 558 OH TYR A 82 9.447 34.789 30.238 1.00 0.00 O
  1665. ATOM 0 H TYR A 82 12.967 32.490 34.703 1.00 0.00 H new
  1666. ATOM 0 HA TYR A 82 10.990 30.648 34.756 1.00 0.00 H new
  1667. ATOM 0 HB2 TYR A 82 13.187 30.805 32.941 1.00 0.00 H new
  1668. ATOM 0 HB3 TYR A 82 11.977 29.839 32.760 1.00 0.00 H new
  1669. ATOM 0 HD1 TYR A 82 13.079 33.019 32.009 1.00 0.00 H new
  1670. ATOM 0 HD2 TYR A 82 9.704 30.868 32.238 1.00 0.00 H new
  1671. ATOM 0 HE1 TYR A 82 11.972 34.637 30.752 1.00 0.00 H new
  1672. ATOM 0 HE2 TYR A 82 8.588 32.473 30.972 1.00 0.00 H new
  1673. ATOM 0 HH TYR A 82 8.655 34.551 30.092 1.00 0.00 H new
  1674. ATOM 559 N VAL A 83 12.079 28.976 36.134 1.00 0.00 N
  1675. ATOM 560 CA VAL A 83 12.748 27.925 36.920 1.00 0.00 C
  1676. ATOM 561 C VAL A 83 12.071 26.560 36.784 1.00 0.00 C
  1677. ATOM 562 O VAL A 83 10.872 26.498 36.492 1.00 0.00 O
  1678. ATOM 563 CB VAL A 83 12.813 28.354 38.391 1.00 0.00 C
  1679. ATOM 564 CG1 VAL A 83 11.432 28.490 39.028 1.00 0.00 C
  1680. ATOM 565 CG2 VAL A 83 13.743 27.485 39.235 1.00 0.00 C
  1681. ATOM 0 H VAL A 83 11.229 29.027 36.257 1.00 0.00 H new
  1682. ATOM 0 HA VAL A 83 13.645 27.819 36.566 1.00 0.00 H new
  1683. ATOM 0 HB VAL A 83 13.207 29.240 38.379 1.00 0.00 H new
  1684. ATOM 0 HG11 VAL A 83 11.528 28.762 39.954 1.00 0.00 H new
  1685. ATOM 0 HG12 VAL A 83 10.918 29.157 38.547 1.00 0.00 H new
  1686. ATOM 0 HG13 VAL A 83 10.972 27.637 38.988 1.00 0.00 H new
  1687. ATOM 0 HG21 VAL A 83 13.742 27.804 40.151 1.00 0.00 H new
  1688. ATOM 0 HG22 VAL A 83 13.435 26.565 39.213 1.00 0.00 H new
  1689. ATOM 0 HG23 VAL A 83 14.644 27.533 38.878 1.00 0.00 H new
  1690. ATOM 566 N GLY A 84 12.888 25.518 36.700 1.00 0.00 N
  1691. ATOM 567 CA GLY A 84 12.400 24.135 36.598 1.00 0.00 C
  1692. ATOM 568 C GLY A 84 12.061 23.521 37.956 1.00 0.00 C
  1693. ATOM 569 O GLY A 84 12.323 24.130 39.000 1.00 0.00 O
  1694. ATOM 0 H GLY A 84 13.745 25.587 36.700 1.00 0.00 H new
  1695. ATOM 0 HA2 GLY A 84 11.611 24.116 36.034 1.00 0.00 H new
  1696. ATOM 0 HA3 GLY A 84 13.074 23.591 36.161 1.00 0.00 H new
  1697. ATOM 570 N VAL A 85 11.223 22.501 37.895 1.00 0.00 N
  1698. ATOM 571 CA VAL A 85 10.757 21.769 39.082 1.00 0.00 C
  1699. ATOM 572 C VAL A 85 11.572 20.497 39.308 1.00 0.00 C
  1700. ATOM 573 O VAL A 85 11.672 19.674 38.390 1.00 0.00 O
  1701. ATOM 574 CB VAL A 85 9.284 21.404 38.881 1.00 0.00 C
  1702. ATOM 575 CG1 VAL A 85 8.728 20.541 40.012 1.00 0.00 C
  1703. ATOM 576 CG2 VAL A 85 8.416 22.637 38.633 1.00 0.00 C
  1704. ATOM 0 H VAL A 85 10.899 22.203 37.156 1.00 0.00 H new
  1705. ATOM 0 HA VAL A 85 10.867 22.335 39.862 1.00 0.00 H new
  1706. ATOM 0 HB VAL A 85 9.250 20.861 38.078 1.00 0.00 H new
  1707. ATOM 0 HG11 VAL A 85 7.796 20.339 39.837 1.00 0.00 H new
  1708. ATOM 0 HG12 VAL A 85 9.233 19.715 40.067 1.00 0.00 H new
  1709. ATOM 0 HG13 VAL A 85 8.802 21.021 40.852 1.00 0.00 H new
  1710. ATOM 0 HG21 VAL A 85 7.493 22.364 38.511 1.00 0.00 H new
  1711. ATOM 0 HG22 VAL A 85 8.478 23.235 39.394 1.00 0.00 H new
  1712. ATOM 0 HG23 VAL A 85 8.725 23.096 37.836 1.00 0.00 H new
  1713. ATOM 577 N GLN A 86 12.376 20.491 40.366 1.00 0.00 N
  1714. ATOM 578 CA GLN A 86 13.222 19.315 40.622 1.00 0.00 C
  1715. ATOM 579 C GLN A 86 12.514 18.201 41.389 1.00 0.00 C
  1716. ATOM 580 O GLN A 86 12.809 17.021 41.158 1.00 0.00 O
  1717. ATOM 581 CB GLN A 86 14.547 19.650 41.319 1.00 0.00 C
  1718. ATOM 582 CG GLN A 86 14.425 19.837 42.834 1.00 0.00 C
  1719. ATOM 583 CD GLN A 86 15.814 19.868 43.468 1.00 0.00 C
  1720. ATOM 584 OE1 GLN A 86 16.668 20.651 43.033 1.00 0.00 O
  1721. ATOM 585 NE2 GLN A 86 16.105 18.809 44.211 1.00 0.00 N
  1722. ATOM 0 H GLN A 86 12.451 21.132 40.935 1.00 0.00 H new
  1723. ATOM 0 HA GLN A 86 13.421 18.987 39.731 1.00 0.00 H new
  1724. ATOM 0 HB2 GLN A 86 15.184 18.941 41.140 1.00 0.00 H new
  1725. ATOM 0 HB3 GLN A 86 14.910 20.461 40.931 1.00 0.00 H new
  1726. ATOM 0 HG2 GLN A 86 13.953 20.662 43.029 1.00 0.00 H new
  1727. ATOM 0 HG3 GLN A 86 13.903 19.114 43.216 1.00 0.00 H new
  1728. ATOM 0 HE21 GLN A 86 15.476 18.294 44.490 1.00 0.00 H new
  1729. ATOM 0 HE22 GLN A 86 16.923 18.638 44.414 1.00 0.00 H new
  1730. ATOM 586 N LYS A 87 11.472 18.563 42.123 1.00 0.00 N
  1731. ATOM 587 CA LYS A 87 10.825 17.590 43.015 1.00 0.00 C
  1732. ATOM 588 C LYS A 87 9.357 17.894 43.308 1.00 0.00 C
  1733. ATOM 589 O LYS A 87 8.987 19.066 43.440 1.00 0.00 O
  1734. ATOM 590 CB LYS A 87 11.631 17.506 44.312 1.00 0.00 C
  1735. ATOM 591 CG LYS A 87 11.153 16.386 45.231 1.00 0.00 C
  1736. ATOM 592 CD LYS A 87 12.082 16.180 46.422 1.00 0.00 C
  1737. ATOM 593 CE LYS A 87 11.592 15.045 47.317 1.00 0.00 C
  1738. ATOM 594 NZ LYS A 87 11.477 13.803 46.542 1.00 0.00 N
  1739. ATOM 0 H LYS A 87 11.124 19.349 42.126 1.00 0.00 H new
  1740. ATOM 0 HA LYS A 87 10.819 16.736 42.556 1.00 0.00 H new
  1741. ATOM 0 HB2 LYS A 87 12.567 17.367 44.098 1.00 0.00 H new
  1742. ATOM 0 HB3 LYS A 87 11.570 18.353 44.782 1.00 0.00 H new
  1743. ATOM 0 HG2 LYS A 87 10.261 16.592 45.551 1.00 0.00 H new
  1744. ATOM 0 HG3 LYS A 87 11.090 15.560 44.726 1.00 0.00 H new
  1745. ATOM 0 HD2 LYS A 87 12.977 15.982 46.106 1.00 0.00 H new
  1746. ATOM 0 HD3 LYS A 87 12.138 17.000 46.937 1.00 0.00 H new
  1747. ATOM 0 HE2 LYS A 87 12.208 14.918 48.056 1.00 0.00 H new
  1748. ATOM 0 HE3 LYS A 87 10.732 15.275 47.701 1.00 0.00 H new
  1749. ATOM 0 HZ1 LYS A 87 11.722 13.113 47.048 1.00 0.00 H new
  1750. ATOM 0 HZ2 LYS A 87 10.634 13.694 46.280 1.00 0.00 H new
  1751. ATOM 0 HZ3 LYS A 87 12.006 13.849 45.828 1.00 0.00 H new
  1752. ATOM 595 N ILE A 88 8.523 16.888 43.078 1.00 0.00 N
  1753. ATOM 596 CA ILE A 88 7.067 16.985 43.256 1.00 0.00 C
  1754. ATOM 597 C ILE A 88 6.543 16.115 44.399 1.00 0.00 C
  1755. ATOM 598 O ILE A 88 6.863 14.922 44.463 1.00 0.00 O
  1756. ATOM 599 CB ILE A 88 6.377 16.581 41.952 1.00 0.00 C
  1757. ATOM 600 CG1 ILE A 88 6.830 17.443 40.775 1.00 0.00 C
  1758. ATOM 601 CG2 ILE A 88 4.855 16.545 42.077 1.00 0.00 C
  1759. ATOM 602 CD1 ILE A 88 6.153 17.035 39.469 1.00 0.00 C
  1760. ATOM 0 H ILE A 88 8.785 16.114 42.809 1.00 0.00 H new
  1761. ATOM 0 HA ILE A 88 6.866 17.905 43.487 1.00 0.00 H new
  1762. ATOM 0 HB ILE A 88 6.658 15.671 41.767 1.00 0.00 H new
  1763. ATOM 0 HG12 ILE A 88 6.633 18.374 40.963 1.00 0.00 H new
  1764. ATOM 0 HG13 ILE A 88 7.792 17.372 40.675 1.00 0.00 H new
  1765. ATOM 0 HG21 ILE A 88 4.466 16.285 41.227 1.00 0.00 H new
  1766. ATOM 0 HG22 ILE A 88 4.601 15.903 42.758 1.00 0.00 H new
  1767. ATOM 0 HG23 ILE A 88 4.530 17.425 42.325 1.00 0.00 H new
  1768. ATOM 0 HD11 ILE A 88 6.467 17.605 38.750 1.00 0.00 H new
  1769. ATOM 0 HD12 ILE A 88 6.369 16.111 39.267 1.00 0.00 H new
  1770. ATOM 0 HD13 ILE A 88 5.192 17.129 39.559 1.00 0.00 H new
  1771. ATOM 603 N VAL A 89 6.030 16.788 45.419 1.00 0.00 N
  1772. ATOM 604 CA VAL A 89 5.454 16.124 46.596 1.00 0.00 C
  1773. ATOM 605 C VAL A 89 3.939 16.294 46.684 1.00 0.00 C
  1774. ATOM 606 O VAL A 89 3.453 17.394 46.971 1.00 0.00 O
  1775. ATOM 607 CB VAL A 89 6.080 16.671 47.879 1.00 0.00 C
  1776. ATOM 608 CG1 VAL A 89 5.583 15.917 49.112 1.00 0.00 C
  1777. ATOM 609 CG2 VAL A 89 7.606 16.680 47.814 1.00 0.00 C
  1778. ATOM 0 H VAL A 89 6.003 17.647 45.455 1.00 0.00 H new
  1779. ATOM 0 HA VAL A 89 5.649 15.179 46.498 1.00 0.00 H new
  1780. ATOM 0 HB VAL A 89 5.791 17.593 47.961 1.00 0.00 H new
  1781. ATOM 0 HG11 VAL A 89 5.998 16.287 49.907 1.00 0.00 H new
  1782. ATOM 0 HG12 VAL A 89 4.619 16.006 49.179 1.00 0.00 H new
  1783. ATOM 0 HG13 VAL A 89 5.816 14.979 49.033 1.00 0.00 H new
  1784. ATOM 0 HG21 VAL A 89 7.963 17.033 48.644 1.00 0.00 H new
  1785. ATOM 0 HG22 VAL A 89 7.930 15.775 47.682 1.00 0.00 H new
  1786. ATOM 0 HG23 VAL A 89 7.895 17.238 47.075 1.00 0.00 H new
  1787. ATOM 610 N VAL A 90 3.233 15.282 46.218 1.00 0.00 N
  1788. ATOM 611 CA VAL A 90 1.768 15.244 46.294 1.00 0.00 C
  1789. ATOM 612 C VAL A 90 1.308 14.585 47.594 1.00 0.00 C
  1790. ATOM 613 O VAL A 90 2.090 13.818 48.170 1.00 0.00 O
  1791. ATOM 614 CB VAL A 90 1.232 14.478 45.083 1.00 0.00 C
  1792. ATOM 615 CG1 VAL A 90 1.958 13.154 44.858 1.00 0.00 C
  1793. ATOM 616 CG2 VAL A 90 -0.284 14.309 45.089 1.00 0.00 C
  1794. ATOM 0 H VAL A 90 3.583 14.590 45.845 1.00 0.00 H new
  1795. ATOM 0 HA VAL A 90 1.421 16.150 46.287 1.00 0.00 H new
  1796. ATOM 0 HB VAL A 90 1.430 15.041 44.318 1.00 0.00 H new
  1797. ATOM 0 HG11 VAL A 90 1.584 12.707 44.082 1.00 0.00 H new
  1798. ATOM 0 HG12 VAL A 90 2.901 13.323 44.709 1.00 0.00 H new
  1799. ATOM 0 HG13 VAL A 90 1.850 12.589 45.639 1.00 0.00 H new
  1800. ATOM 0 HG21 VAL A 90 -0.558 13.818 44.299 1.00 0.00 H new
  1801. ATOM 0 HG22 VAL A 90 -0.552 13.820 45.883 1.00 0.00 H new
  1802. ATOM 0 HG23 VAL A 90 -0.707 15.182 45.090 1.00 0.00 H new
  1803. ATOM 617 N HIS A 91 0.351 15.248 48.238 1.00 0.00 N
  1804. ATOM 618 CA HIS A 91 -0.248 14.762 49.493 1.00 0.00 C
  1805. ATOM 619 C HIS A 91 -0.636 13.285 49.407 1.00 0.00 C
  1806. ATOM 620 O HIS A 91 -1.205 12.869 48.390 1.00 0.00 O
  1807. ATOM 621 CB HIS A 91 -1.476 15.599 49.852 1.00 0.00 C
  1808. ATOM 622 CG HIS A 91 -1.871 15.369 51.319 1.00 0.00 C
  1809. ATOM 623 ND1 HIS A 91 -2.390 14.187 51.755 1.00 0.00 N
  1810. ATOM 624 CD2 HIS A 91 -1.773 16.198 52.369 1.00 0.00 C
  1811. ATOM 625 CE1 HIS A 91 -2.615 14.294 53.100 1.00 0.00 C
  1812. ATOM 626 NE2 HIS A 91 -2.232 15.547 53.480 1.00 0.00 N
  1813. ATOM 0 H HIS A 91 0.026 15.995 47.963 1.00 0.00 H new
  1814. ATOM 0 HA HIS A 91 0.423 14.853 50.188 1.00 0.00 H new
  1815. ATOM 0 HB2 HIS A 91 -1.288 16.539 49.705 1.00 0.00 H new
  1816. ATOM 0 HB3 HIS A 91 -2.216 15.364 49.271 1.00 0.00 H new
  1817. ATOM 0 HD2 HIS A 91 -1.448 17.069 52.345 1.00 0.00 H new
  1818. ATOM 0 HE1 HIS A 91 -2.965 13.634 53.654 1.00 0.00 H new
  1819. ATOM 627 N PRO A 92 0.019 12.491 50.246 1.00 0.00 N
  1820. ATOM 628 CA PRO A 92 -0.108 11.019 50.318 1.00 0.00 C
  1821. ATOM 629 C PRO A 92 -1.524 10.449 50.234 1.00 0.00 C
  1822. ATOM 630 O PRO A 92 -1.698 9.328 49.741 1.00 0.00 O
  1823. ATOM 631 CB PRO A 92 0.585 10.591 51.611 1.00 0.00 C
  1824. ATOM 632 CG PRO A 92 0.850 11.883 52.368 1.00 0.00 C
  1825. ATOM 633 CD PRO A 92 0.973 12.940 51.278 1.00 0.00 C
  1826. ATOM 0 HA PRO A 92 0.307 10.652 49.522 1.00 0.00 H new
  1827. ATOM 0 HB2 PRO A 92 0.024 9.991 52.127 1.00 0.00 H new
  1828. ATOM 0 HB3 PRO A 92 1.411 10.118 51.426 1.00 0.00 H new
  1829. ATOM 0 HG2 PRO A 92 0.127 12.089 52.981 1.00 0.00 H new
  1830. ATOM 0 HG3 PRO A 92 1.661 11.824 52.897 1.00 0.00 H new
  1831. ATOM 0 HD2 PRO A 92 0.748 13.823 51.611 1.00 0.00 H new
  1832. ATOM 0 HD3 PRO A 92 1.877 12.990 50.930 1.00 0.00 H new
  1833. ATOM 634 N TYR A 93 -2.514 11.288 50.487 1.00 0.00 N
  1834. ATOM 635 CA TYR A 93 -3.923 10.872 50.423 1.00 0.00 C
  1835. ATOM 636 C TYR A 93 -4.625 11.286 49.131 1.00 0.00 C
  1836. ATOM 637 O TYR A 93 -5.791 10.925 48.922 1.00 0.00 O
  1837. ATOM 638 CB TYR A 93 -4.729 11.373 51.623 1.00 0.00 C
  1838. ATOM 639 CG TYR A 93 -4.456 10.605 52.928 1.00 0.00 C
  1839. ATOM 640 CD1 TYR A 93 -3.910 9.331 52.899 1.00 0.00 C
  1840. ATOM 641 CD2 TYR A 93 -4.802 11.178 54.141 1.00 0.00 C
  1841. ATOM 642 CE1 TYR A 93 -3.681 8.635 54.093 1.00 0.00 C
  1842. ATOM 643 CE2 TYR A 93 -4.579 10.490 55.339 1.00 0.00 C
  1843. ATOM 644 CZ TYR A 93 -4.013 9.216 55.317 1.00 0.00 C
  1844. ATOM 645 OH TYR A 93 -4.212 8.391 56.404 1.00 0.00 O
  1845. ATOM 0 H TYR A 93 -2.399 12.113 50.701 1.00 0.00 H new
  1846. ATOM 0 HA TYR A 93 -3.892 9.903 50.443 1.00 0.00 H new
  1847. ATOM 0 HB2 TYR A 93 -4.531 12.312 51.764 1.00 0.00 H new
  1848. ATOM 0 HB3 TYR A 93 -5.674 11.311 51.414 1.00 0.00 H new
  1849. ATOM 0 HD1 TYR A 93 -3.695 8.937 52.084 1.00 0.00 H new
  1850. ATOM 0 HD2 TYR A 93 -5.185 12.025 54.159 1.00 0.00 H new
  1851. ATOM 0 HE1 TYR A 93 -3.307 7.784 54.070 1.00 0.00 H new
  1852. ATOM 0 HE2 TYR A 93 -4.808 10.883 56.150 1.00 0.00 H new
  1853. ATOM 0 HH TYR A 93 -4.404 8.855 57.077 1.00 0.00 H new
  1854. ATOM 646 N TRP A 94 -3.904 11.996 48.269 1.00 0.00 N
  1855. ATOM 647 CA TRP A 94 -4.473 12.415 46.974 1.00 0.00 C
  1856. ATOM 648 C TRP A 94 -4.760 11.249 46.031 1.00 0.00 C
  1857. ATOM 649 O TRP A 94 -3.999 10.273 46.026 1.00 0.00 O
  1858. ATOM 650 CB TRP A 94 -3.651 13.509 46.281 1.00 0.00 C
  1859. ATOM 651 CG TRP A 94 -4.100 13.773 44.830 1.00 0.00 C
  1860. ATOM 652 CD1 TRP A 94 -3.470 13.459 43.676 1.00 0.00 C
  1861. ATOM 653 CD2 TRP A 94 -5.267 14.428 44.428 1.00 0.00 C
  1862. ATOM 654 NE1 TRP A 94 -4.208 13.875 42.587 1.00 0.00 N
  1863. ATOM 655 CE2 TRP A 94 -5.268 14.443 43.011 1.00 0.00 C
  1864. ATOM 656 CE3 TRP A 94 -6.306 14.982 45.158 1.00 0.00 C
  1865. ATOM 657 CZ2 TRP A 94 -6.296 14.987 42.260 1.00 0.00 C
  1866. ATOM 658 CZ3 TRP A 94 -7.347 15.540 44.402 1.00 0.00 C
  1867. ATOM 659 CH2 TRP A 94 -7.342 15.542 43.002 1.00 0.00 C
  1868. ATOM 0 H TRP A 94 -3.093 12.247 48.405 1.00 0.00 H new
  1869. ATOM 0 HA TRP A 94 -5.332 12.806 47.198 1.00 0.00 H new
  1870. ATOM 0 HB2 TRP A 94 -3.722 14.331 46.791 1.00 0.00 H new
  1871. ATOM 0 HB3 TRP A 94 -2.715 13.254 46.283 1.00 0.00 H new
  1872. ATOM 0 HD1 TRP A 94 -2.651 13.022 43.623 1.00 0.00 H new
  1873. ATOM 0 HE1 TRP A 94 -3.990 13.769 41.762 1.00 0.00 H new
  1874. ATOM 0 HE3 TRP A 94 -6.313 14.984 46.088 1.00 0.00 H new
  1875. ATOM 0 HZ2 TRP A 94 -6.291 14.983 41.330 1.00 0.00 H new
  1876. ATOM 0 HZ3 TRP A 94 -8.068 15.923 44.847 1.00 0.00 H new
  1877. ATOM 0 HH2 TRP A 94 -8.059 15.926 42.551 1.00 0.00 H new
  1878. ATOM 660 N ASN A 95 -6.055 11.147 45.794 1.00 0.00 N
  1879. ATOM 661 CA ASN A 95 -6.680 10.169 44.898 1.00 0.00 C
  1880. ATOM 662 C ASN A 95 -7.447 10.837 43.759 1.00 0.00 C
  1881. ATOM 663 O ASN A 95 -8.402 11.574 44.033 1.00 0.00 O
  1882. ATOM 664 CB ASN A 95 -7.625 9.296 45.718 1.00 0.00 C
  1883. ATOM 665 CG ASN A 95 -8.506 8.455 44.798 1.00 0.00 C
  1884. ATOM 666 OD1 ASN A 95 -9.603 8.059 45.210 1.00 0.00 O
  1885. ATOM 667 ND2 ASN A 95 -7.907 7.967 43.724 1.00 0.00 N
  1886. ATOM 0 H ASN A 95 -6.629 11.669 46.166 1.00 0.00 H new
  1887. ATOM 0 HA ASN A 95 -5.980 9.633 44.493 1.00 0.00 H new
  1888. ATOM 0 HB2 ASN A 95 -7.113 8.717 46.304 1.00 0.00 H new
  1889. ATOM 0 HB3 ASN A 95 -8.180 9.854 46.285 1.00 0.00 H new
  1890. ATOM 0 HD21 ASN A 95 -8.281 7.339 43.271 1.00 0.00 H new
  1891. ATOM 0 HD22 ASN A 95 -7.143 8.278 43.479 1.00 0.00 H new
  1892. ATOM 668 N THR A 96 -6.731 10.937 42.648 1.00 0.00 N
  1893. ATOM 669 CA THR A 96 -7.162 11.569 41.388 1.00 0.00 C
  1894. ATOM 670 C THR A 96 -8.637 11.360 41.051 1.00 0.00 C
  1895. ATOM 671 O THR A 96 -9.314 12.280 40.575 1.00 0.00 O
  1896. ATOM 672 CB THR A 96 -6.301 11.051 40.235 1.00 0.00 C
  1897. ATOM 673 OG1 THR A 96 -4.929 11.087 40.610 1.00 0.00 O
  1898. ATOM 674 CG2 THR A 96 -6.499 11.846 38.945 1.00 0.00 C
  1899. ATOM 0 H THR A 96 -5.932 10.622 42.597 1.00 0.00 H new
  1900. ATOM 0 HA THR A 96 -7.046 12.524 41.514 1.00 0.00 H new
  1901. ATOM 0 HB THR A 96 -6.581 10.140 40.056 1.00 0.00 H new
  1902. ATOM 0 HG1 THR A 96 -4.589 11.813 40.358 1.00 0.00 H new
  1903. ATOM 0 HG21 THR A 96 -5.933 11.479 38.248 1.00 0.00 H new
  1904. ATOM 0 HG22 THR A 96 -7.427 11.790 38.670 1.00 0.00 H new
  1905. ATOM 0 HG23 THR A 96 -6.263 12.774 39.097 1.00 0.00 H new
  1906. ATOM 675 N ASP A 97 -9.113 10.157 41.319 1.00 0.00 N
  1907. ATOM 676 CA ASP A 97 -10.493 9.794 40.982 1.00 0.00 C
  1908. ATOM 677 C ASP A 97 -11.503 10.329 41.989 1.00 0.00 C
  1909. ATOM 678 O ASP A 97 -12.715 10.155 41.813 1.00 0.00 O
  1910. ATOM 679 CB ASP A 97 -10.628 8.278 40.875 1.00 0.00 C
  1911. ATOM 680 CG ASP A 97 -9.646 7.775 39.822 1.00 0.00 C
  1912. ATOM 681 OD1 ASP A 97 -9.415 8.490 38.840 1.00 0.00 O
  1913. ATOM 682 OD2 ASP A 97 -8.926 6.807 40.093 1.00 0.00 O
  1914. ATOM 0 H ASP A 97 -8.659 9.531 41.696 1.00 0.00 H new
  1915. ATOM 0 HA ASP A 97 -10.691 10.206 40.126 1.00 0.00 H new
  1916. ATOM 0 HB2 ASP A 97 -10.445 7.862 41.732 1.00 0.00 H new
  1917. ATOM 0 HB3 ASP A 97 -11.535 8.037 40.631 1.00 0.00 H new
  1918. ATOM 683 N ASP A 98 -10.982 10.840 43.089 1.00 0.00 N
  1919. ATOM 684 CA ASP A 98 -11.858 11.371 44.140 1.00 0.00 C
  1920. ATOM 685 C ASP A 98 -11.425 12.754 44.619 1.00 0.00 C
  1921. ATOM 686 O ASP A 98 -10.800 12.879 45.679 1.00 0.00 O
  1922. ATOM 687 CB ASP A 98 -11.891 10.399 45.316 1.00 0.00 C
  1923. ATOM 688 CG ASP A 98 -13.180 10.571 46.117 1.00 0.00 C
  1924. ATOM 689 OD1 ASP A 98 -13.910 11.547 45.901 1.00 0.00 O
  1925. ATOM 690 OD2 ASP A 98 -13.551 9.641 46.844 1.00 0.00 O
  1926. ATOM 0 H ASP A 98 -10.140 10.893 43.254 1.00 0.00 H new
  1927. ATOM 0 HA ASP A 98 -12.745 11.467 43.760 1.00 0.00 H new
  1928. ATOM 0 HB2 ASP A 98 -11.825 9.487 44.991 1.00 0.00 H new
  1929. ATOM 0 HB3 ASP A 98 -11.124 10.552 45.890 1.00 0.00 H new
  1930. ATOM 691 N VAL A 99 -11.543 13.717 43.722 1.00 0.00 N
  1931. ATOM 692 CA VAL A 99 -11.178 15.101 44.049 1.00 0.00 C
  1932. ATOM 693 C VAL A 99 -12.121 15.687 45.098 1.00 0.00 C
  1933. ATOM 694 O VAL A 99 -11.664 16.435 45.973 1.00 0.00 O
  1934. ATOM 695 CB VAL A 99 -11.153 15.984 42.797 1.00 0.00 C
  1935. ATOM 696 CG1 VAL A 99 -10.570 15.230 41.604 1.00 0.00 C
  1936. ATOM 697 CG2 VAL A 99 -12.515 16.579 42.443 1.00 0.00 C
  1937. ATOM 0 H VAL A 99 -11.830 13.600 42.920 1.00 0.00 H new
  1938. ATOM 0 HA VAL A 99 -10.282 15.083 44.421 1.00 0.00 H new
  1939. ATOM 0 HB VAL A 99 -10.575 16.732 43.012 1.00 0.00 H new
  1940. ATOM 0 HG11 VAL A 99 -10.565 15.809 40.826 1.00 0.00 H new
  1941. ATOM 0 HG12 VAL A 99 -9.662 14.955 41.807 1.00 0.00 H new
  1942. ATOM 0 HG13 VAL A 99 -11.112 14.447 41.420 1.00 0.00 H new
  1943. ATOM 0 HG21 VAL A 99 -12.432 17.125 41.645 1.00 0.00 H new
  1944. ATOM 0 HG22 VAL A 99 -13.149 15.863 42.280 1.00 0.00 H new
  1945. ATOM 0 HG23 VAL A 99 -12.830 17.128 43.178 1.00 0.00 H new
  1946. ATOM 698 N ALA A 99A -13.223 14.968 45.263 1.00 0.00 N
  1947. ATOM 699 CA ALA A 99A -14.281 15.336 46.205 1.00 0.00 C
  1948. ATOM 700 C ALA A 99A -13.908 14.916 47.620 1.00 0.00 C
  1949. ATOM 701 O ALA A 99A -14.311 15.580 48.582 1.00 0.00 O
  1950. ATOM 702 CB ALA A 99A -15.598 14.678 45.801 1.00 0.00 C
  1951. ATOM 0 H ALA A 99A -13.383 14.244 44.828 1.00 0.00 H new
  1952. ATOM 0 HA ALA A 99A -14.387 16.300 46.184 1.00 0.00 H new
  1953. ATOM 0 HB1 ALA A 99A -16.292 14.928 46.431 1.00 0.00 H new
  1954. ATOM 0 HB2 ALA A 99A -15.848 14.973 44.912 1.00 0.00 H new
  1955. ATOM 0 HB3 ALA A 99A -15.492 13.714 45.803 1.00 0.00 H new
  1956. ATOM 703 N ALA A 99B -12.853 14.116 47.664 1.00 0.00 N
  1957. ATOM 704 CA ALA A 99B -12.305 13.657 48.946 1.00 0.00 C
  1958. ATOM 705 C ALA A 99B -11.352 14.682 49.551 1.00 0.00 C
  1959. ATOM 706 O ALA A 99B -11.244 14.781 50.780 1.00 0.00 O
  1960. ATOM 707 CB ALA A 99B -11.585 12.322 48.788 1.00 0.00 C
  1961. ATOM 0 H ALA A 99B -12.437 13.825 46.970 1.00 0.00 H new
  1962. ATOM 0 HA ALA A 99B -13.057 13.543 49.549 1.00 0.00 H new
  1963. ATOM 0 HB1 ALA A 99B -11.233 12.041 49.647 1.00 0.00 H new
  1964. ATOM 0 HB2 ALA A 99B -12.208 11.655 48.460 1.00 0.00 H new
  1965. ATOM 0 HB3 ALA A 99B -10.856 12.420 48.156 1.00 0.00 H new
  1966. ATOM 708 N GLY A 100 -10.876 15.568 48.690 1.00 0.00 N
  1967. ATOM 709 CA GLY A 100 -9.966 16.648 49.106 1.00 0.00 C
  1968. ATOM 710 C GLY A 100 -8.503 16.360 48.781 1.00 0.00 C
  1969. ATOM 711 O GLY A 100 -8.241 15.534 47.898 1.00 0.00 O
  1970. ATOM 0 H GLY A 100 -11.064 15.568 47.851 1.00 0.00 H new
  1971. ATOM 0 HA2 GLY A 100 -10.232 17.473 48.670 1.00 0.00 H new
  1972. ATOM 0 HA3 GLY A 100 -10.057 16.790 50.061 1.00 0.00 H new
  1973. ATOM 712 N TYR A 101 -7.656 16.730 49.740 1.00 0.00 N
  1974. ATOM 713 CA TYR A 101 -6.188 16.562 49.721 1.00 0.00 C
  1975. ATOM 714 C TYR A 101 -5.529 17.024 48.421 1.00 0.00 C
  1976. ATOM 715 O TYR A 101 -4.418 16.586 48.094 1.00 0.00 O
  1977. ATOM 716 CB TYR A 101 -5.807 15.103 49.995 1.00 0.00 C
  1978. ATOM 717 CG TYR A 101 -6.493 14.555 51.258 1.00 0.00 C
  1979. ATOM 718 CD1 TYR A 101 -6.084 14.975 52.513 1.00 0.00 C
  1980. ATOM 719 CD2 TYR A 101 -7.521 13.631 51.139 1.00 0.00 C
  1981. ATOM 720 CE1 TYR A 101 -6.710 14.479 53.662 1.00 0.00 C
  1982. ATOM 721 CE2 TYR A 101 -8.153 13.129 52.281 1.00 0.00 C
  1983. ATOM 722 CZ TYR A 101 -7.747 13.556 53.542 1.00 0.00 C
  1984. ATOM 723 OH TYR A 101 -8.429 13.135 54.664 1.00 0.00 O
  1985. ATOM 0 H TYR A 101 -7.931 17.107 50.462 1.00 0.00 H new
  1986. ATOM 0 HA TYR A 101 -5.852 17.136 50.427 1.00 0.00 H new
  1987. ATOM 0 HB2 TYR A 101 -6.053 14.557 49.232 1.00 0.00 H new
  1988. ATOM 0 HB3 TYR A 101 -4.845 15.034 50.095 1.00 0.00 H new
  1989. ATOM 0 HD1 TYR A 101 -5.390 15.589 52.592 1.00 0.00 H new
  1990. ATOM 0 HD2 TYR A 101 -7.791 13.344 50.296 1.00 0.00 H new
  1991. ATOM 0 HE1 TYR A 101 -6.435 14.765 54.503 1.00 0.00 H new
  1992. ATOM 0 HE2 TYR A 101 -8.843 12.511 52.198 1.00 0.00 H new
  1993. ATOM 0 HH TYR A 101 -9.023 12.584 54.441 1.00 0.00 H new
  1994. ATOM 724 N ASP A 102 -6.208 17.933 47.734 1.00 0.00 N
  1995. ATOM 725 CA ASP A 102 -5.750 18.476 46.446 1.00 0.00 C
  1996. ATOM 726 C ASP A 102 -4.710 19.581 46.620 1.00 0.00 C
  1997. ATOM 727 O ASP A 102 -5.042 20.772 46.557 1.00 0.00 O
  1998. ATOM 728 CB ASP A 102 -6.944 18.992 45.641 1.00 0.00 C
  1999. ATOM 729 CG ASP A 102 -6.519 19.337 44.213 1.00 0.00 C
  2000. ATOM 730 OD1 ASP A 102 -5.434 18.928 43.785 1.00 0.00 O
  2001. ATOM 731 OD2 ASP A 102 -7.325 19.910 43.470 1.00 0.00 O
  2002. ATOM 0 H ASP A 102 -6.958 18.260 48.000 1.00 0.00 H new
  2003. ATOM 0 HA ASP A 102 -5.321 17.753 45.962 1.00 0.00 H new
  2004. ATOM 0 HB2 ASP A 102 -7.643 18.320 45.623 1.00 0.00 H new
  2005. ATOM 0 HB3 ASP A 102 -7.316 19.777 46.072 1.00 0.00 H new
  2006. ATOM 732 N ILE A 103 -3.586 19.163 47.171 1.00 0.00 N
  2007. ATOM 733 CA ILE A 103 -2.436 20.043 47.406 1.00 0.00 C
  2008. ATOM 734 C ILE A 103 -1.097 19.347 47.153 1.00 0.00 C
  2009. ATOM 735 O ILE A 103 -1.015 18.120 47.300 1.00 0.00 O
  2010. ATOM 736 CB ILE A 103 -2.502 20.612 48.828 1.00 0.00 C
  2011. ATOM 737 CG1 ILE A 103 -1.398 21.626 49.128 1.00 0.00 C
  2012. ATOM 738 CG2 ILE A 103 -2.603 19.525 49.898 1.00 0.00 C
  2013. ATOM 739 CD1 ILE A 103 -1.498 22.182 50.546 1.00 0.00 C
  2014. ATOM 0 H ILE A 103 -3.459 18.351 47.425 1.00 0.00 H new
  2015. ATOM 0 HA ILE A 103 -2.487 20.770 46.766 1.00 0.00 H new
  2016. ATOM 0 HB ILE A 103 -3.333 21.110 48.865 1.00 0.00 H new
  2017. ATOM 0 HG12 ILE A 103 -0.533 21.205 49.007 1.00 0.00 H new
  2018. ATOM 0 HG13 ILE A 103 -1.449 22.356 48.491 1.00 0.00 H new
  2019. ATOM 0 HG21 ILE A 103 -2.642 19.937 50.775 1.00 0.00 H new
  2020. ATOM 0 HG22 ILE A 103 -3.406 19.000 49.752 1.00 0.00 H new
  2021. ATOM 0 HG23 ILE A 103 -1.826 18.947 49.847 1.00 0.00 H new
  2022. ATOM 0 HD11 ILE A 103 -0.782 22.819 50.695 1.00 0.00 H new
  2023. ATOM 0 HD12 ILE A 103 -2.353 22.625 50.661 1.00 0.00 H new
  2024. ATOM 0 HD13 ILE A 103 -1.422 21.456 51.185 1.00 0.00 H new
  2025. ATOM 740 N ALA A 104 -0.272 20.027 46.367 1.00 0.00 N
  2026. ATOM 741 CA ALA A 104 1.094 19.575 46.070 1.00 0.00 C
  2027. ATOM 742 C ALA A 104 2.149 20.658 46.285 1.00 0.00 C
  2028. ATOM 743 O ALA A 104 1.815 21.848 46.343 1.00 0.00 O
  2029. ATOM 744 CB ALA A 104 1.189 19.053 44.639 1.00 0.00 C
  2030. ATOM 0 H ALA A 104 -0.484 20.768 45.986 1.00 0.00 H new
  2031. ATOM 0 HA ALA A 104 1.281 18.861 46.699 1.00 0.00 H new
  2032. ATOM 0 HB1 ALA A 104 2.096 18.760 44.461 1.00 0.00 H new
  2033. ATOM 0 HB2 ALA A 104 0.580 18.307 44.526 1.00 0.00 H new
  2034. ATOM 0 HB3 ALA A 104 0.951 19.761 44.020 1.00 0.00 H new
  2035. ATOM 745 N LEU A 105 3.321 20.199 46.694 1.00 0.00 N
  2036. ATOM 746 CA LEU A 105 4.499 21.053 46.901 1.00 0.00 C
  2037. ATOM 747 C LEU A 105 5.615 20.743 45.906 1.00 0.00 C
  2038. ATOM 748 O LEU A 105 5.833 19.573 45.570 1.00 0.00 O
  2039. ATOM 749 CB LEU A 105 5.030 20.928 48.329 1.00 0.00 C
  2040. ATOM 750 CG LEU A 105 4.076 21.488 49.385 1.00 0.00 C
  2041. ATOM 751 CD1 LEU A 105 4.611 21.270 50.800 1.00 0.00 C
  2042. ATOM 752 CD2 LEU A 105 3.747 22.959 49.141 1.00 0.00 C
  2043. ATOM 0 H LEU A 105 3.465 19.368 46.864 1.00 0.00 H new
  2044. ATOM 0 HA LEU A 105 4.207 21.966 46.752 1.00 0.00 H new
  2045. ATOM 0 HB2 LEU A 105 5.202 19.993 48.522 1.00 0.00 H new
  2046. ATOM 0 HB3 LEU A 105 5.880 21.392 48.392 1.00 0.00 H new
  2047. ATOM 0 HG LEU A 105 3.247 20.991 49.302 1.00 0.00 H new
  2048. ATOM 0 HD11 LEU A 105 3.984 21.636 51.443 1.00 0.00 H new
  2049. ATOM 0 HD12 LEU A 105 4.722 20.320 50.961 1.00 0.00 H new
  2050. ATOM 0 HD13 LEU A 105 5.467 21.716 50.895 1.00 0.00 H new
  2051. ATOM 0 HD21 LEU A 105 3.142 23.274 49.830 1.00 0.00 H new
  2052. ATOM 0 HD22 LEU A 105 4.564 23.482 49.165 1.00 0.00 H new
  2053. ATOM 0 HD23 LEU A 105 3.326 23.057 48.272 1.00 0.00 H new
  2054. ATOM 753 N LEU A 106 6.080 21.791 45.245 1.00 0.00 N
  2055. ATOM 754 CA LEU A 106 7.111 21.676 44.203 1.00 0.00 C
  2056. ATOM 755 C LEU A 106 8.433 22.326 44.601 1.00 0.00 C
  2057. ATOM 756 O LEU A 106 8.523 23.559 44.675 1.00 0.00 O
  2058. ATOM 757 CB LEU A 106 6.652 22.352 42.910 1.00 0.00 C
  2059. ATOM 758 CG LEU A 106 5.274 21.910 42.418 1.00 0.00 C
  2060. ATOM 759 CD1 LEU A 106 4.835 22.734 41.209 1.00 0.00 C
  2061. ATOM 760 CD2 LEU A 106 5.190 20.410 42.137 1.00 0.00 C
  2062. ATOM 0 H LEU A 106 5.811 22.596 45.383 1.00 0.00 H new
  2063. ATOM 0 HA LEU A 106 7.247 20.724 44.078 1.00 0.00 H new
  2064. ATOM 0 HB2 LEU A 106 6.641 23.312 43.047 1.00 0.00 H new
  2065. ATOM 0 HB3 LEU A 106 7.304 22.172 42.215 1.00 0.00 H new
  2066. ATOM 0 HG LEU A 106 4.653 22.080 43.144 1.00 0.00 H new
  2067. ATOM 0 HD11 LEU A 106 3.960 22.436 40.915 1.00 0.00 H new
  2068. ATOM 0 HD12 LEU A 106 4.792 23.671 41.455 1.00 0.00 H new
  2069. ATOM 0 HD13 LEU A 106 5.474 22.618 40.489 1.00 0.00 H new
  2070. ATOM 0 HD21 LEU A 106 4.297 20.188 41.829 1.00 0.00 H new
  2071. ATOM 0 HD22 LEU A 106 5.836 20.172 41.454 1.00 0.00 H new
  2072. ATOM 0 HD23 LEU A 106 5.383 19.917 42.950 1.00 0.00 H new
  2073. ATOM 761 N ARG A 107 9.442 21.495 44.803 1.00 0.00 N
  2074. ATOM 762 CA ARG A 107 10.789 22.012 45.062 1.00 0.00 C
  2075. ATOM 763 C ARG A 107 11.502 22.390 43.770 1.00 0.00 C
  2076. ATOM 764 O ARG A 107 11.527 21.579 42.835 1.00 0.00 O
  2077. ATOM 765 CB ARG A 107 11.656 21.040 45.859 1.00 0.00 C
  2078. ATOM 766 CG ARG A 107 13.064 21.610 46.026 1.00 0.00 C
  2079. ATOM 767 CD ARG A 107 14.001 20.717 46.835 1.00 0.00 C
  2080. ATOM 768 NE ARG A 107 15.364 21.267 46.755 1.00 0.00 N
  2081. ATOM 769 CZ ARG A 107 16.016 21.793 47.784 1.00 0.00 C
  2082. ATOM 770 NH1 ARG A 107 17.235 22.271 47.590 1.00 0.00 N
  2083. ATOM 771 NH2 ARG A 107 15.639 21.492 49.017 1.00 0.00 N
  2084. ATOM 0 H ARG A 107 9.377 20.637 44.796 1.00 0.00 H new
  2085. ATOM 0 HA ARG A 107 10.663 22.808 45.602 1.00 0.00 H new
  2086. ATOM 0 HB2 ARG A 107 11.259 20.880 46.729 1.00 0.00 H new
  2087. ATOM 0 HB3 ARG A 107 11.697 20.184 45.404 1.00 0.00 H new
  2088. ATOM 0 HG2 ARG A 107 13.450 21.757 45.148 1.00 0.00 H new
  2089. ATOM 0 HG3 ARG A 107 13.004 22.476 46.458 1.00 0.00 H new
  2090. ATOM 0 HD2 ARG A 107 13.710 20.674 47.759 1.00 0.00 H new
  2091. ATOM 0 HD3 ARG A 107 13.983 19.811 46.489 1.00 0.00 H new
  2092. ATOM 0 HE ARG A 107 15.763 21.246 45.993 1.00 0.00 H new
  2093. ATOM 0 HH11 ARG A 107 17.591 22.237 46.808 1.00 0.00 H new
  2094. ATOM 0 HH12 ARG A 107 17.671 22.615 48.246 1.00 0.00 H new
  2095. ATOM 0 HH21 ARG A 107 14.976 20.959 49.146 1.00 0.00 H new
  2096. ATOM 0 HH22 ARG A 107 16.057 21.829 49.689 1.00 0.00 H new
  2097. ATOM 772 N LEU A 108 11.567 23.699 43.593 1.00 0.00 N
  2098. ATOM 773 CA LEU A 108 12.231 24.326 42.445 1.00 0.00 C
  2099. ATOM 774 C LEU A 108 13.718 23.989 42.371 1.00 0.00 C
  2100. ATOM 775 O LEU A 108 14.383 23.862 43.409 1.00 0.00 O
  2101. ATOM 776 CB LEU A 108 12.080 25.843 42.513 1.00 0.00 C
  2102. ATOM 777 CG LEU A 108 10.621 26.291 42.545 1.00 0.00 C
  2103. ATOM 778 CD1 LEU A 108 10.505 27.800 42.755 1.00 0.00 C
  2104. ATOM 779 CD2 LEU A 108 9.850 25.825 41.312 1.00 0.00 C
  2105. ATOM 0 H LEU A 108 11.223 24.264 44.142 1.00 0.00 H new
  2106. ATOM 0 HA LEU A 108 11.800 23.973 41.651 1.00 0.00 H new
  2107. ATOM 0 HB2 LEU A 108 12.533 26.174 43.304 1.00 0.00 H new
  2108. ATOM 0 HB3 LEU A 108 12.520 26.242 41.746 1.00 0.00 H new
  2109. ATOM 0 HG LEU A 108 10.206 25.861 43.309 1.00 0.00 H new
  2110. ATOM 0 HD11 LEU A 108 9.569 28.054 42.771 1.00 0.00 H new
  2111. ATOM 0 HD12 LEU A 108 10.920 28.042 43.598 1.00 0.00 H new
  2112. ATOM 0 HD13 LEU A 108 10.953 28.263 42.030 1.00 0.00 H new
  2113. ATOM 0 HD21 LEU A 108 8.931 26.129 41.371 1.00 0.00 H new
  2114. ATOM 0 HD22 LEU A 108 10.261 26.193 40.515 1.00 0.00 H new
  2115. ATOM 0 HD23 LEU A 108 9.867 24.856 41.266 1.00 0.00 H new
  2116. ATOM 780 N ALA A 109 14.175 23.779 41.146 1.00 0.00 N
  2117. ATOM 781 CA ALA A 109 15.575 23.468 40.822 1.00 0.00 C
  2118. ATOM 782 C ALA A 109 16.564 24.491 41.377 1.00 0.00 C
  2119. ATOM 783 O ALA A 109 17.678 24.128 41.776 1.00 0.00 O
  2120. ATOM 784 CB ALA A 109 15.748 23.373 39.309 1.00 0.00 C
  2121. ATOM 0 H ALA A 109 13.668 23.813 40.452 1.00 0.00 H new
  2122. ATOM 0 HA ALA A 109 15.773 22.618 41.245 1.00 0.00 H new
  2123. ATOM 0 HB1 ALA A 109 16.673 23.168 39.101 1.00 0.00 H new
  2124. ATOM 0 HB2 ALA A 109 15.176 22.672 38.961 1.00 0.00 H new
  2125. ATOM 0 HB3 ALA A 109 15.506 24.219 38.902 1.00 0.00 H new
  2126. ATOM 785 N GLN A 110 16.058 25.695 41.585 1.00 0.00 N
  2127. ATOM 786 CA GLN A 110 16.841 26.811 42.129 1.00 0.00 C
  2128. ATOM 787 C GLN A 110 15.949 27.859 42.793 1.00 0.00 C
  2129. ATOM 788 O GLN A 110 14.750 27.934 42.501 1.00 0.00 O
  2130. ATOM 789 CB GLN A 110 17.653 27.458 41.007 1.00 0.00 C
  2131. ATOM 790 CG GLN A 110 19.104 27.713 41.416 1.00 0.00 C
  2132. ATOM 791 CD GLN A 110 19.855 28.366 40.259 1.00 0.00 C
  2133. ATOM 792 OE1 GLN A 110 19.239 29.050 39.431 1.00 0.00 O
  2134. ATOM 793 NE2 GLN A 110 21.173 28.372 40.386 1.00 0.00 N
  2135. ATOM 0 H GLN A 110 15.240 25.898 41.414 1.00 0.00 H new
  2136. ATOM 0 HA GLN A 110 17.436 26.457 42.809 1.00 0.00 H new
  2137. ATOM 0 HB2 GLN A 110 17.635 26.884 40.225 1.00 0.00 H new
  2138. ATOM 0 HB3 GLN A 110 17.238 28.297 40.753 1.00 0.00 H new
  2139. ATOM 0 HG2 GLN A 110 19.133 28.287 42.197 1.00 0.00 H new
  2140. ATOM 0 HG3 GLN A 110 19.532 26.878 41.661 1.00 0.00 H new
  2141. ATOM 0 HE21 GLN A 110 21.550 27.876 40.979 1.00 0.00 H new
  2142. ATOM 0 HE22 GLN A 110 21.652 28.872 39.875 1.00 0.00 H new
  2143. ATOM 794 N SER A 111 16.558 28.698 43.614 1.00 0.00 N
  2144. ATOM 795 CA SER A 111 15.828 29.759 44.312 1.00 0.00 C
  2145. ATOM 796 C SER A 111 15.646 31.016 43.470 1.00 0.00 C
  2146. ATOM 797 O SER A 111 16.603 31.514 42.865 1.00 0.00 O
  2147. ATOM 798 CB SER A 111 16.505 30.113 45.632 1.00 0.00 C
  2148. ATOM 799 OG SER A 111 16.425 28.995 46.508 1.00 0.00 O
  2149. ATOM 0 H SER A 111 17.400 28.675 43.786 1.00 0.00 H new
  2150. ATOM 0 HA SER A 111 14.944 29.401 44.488 1.00 0.00 H new
  2151. ATOM 0 HB2 SER A 111 17.432 30.353 45.479 1.00 0.00 H new
  2152. ATOM 0 HB3 SER A 111 16.075 30.884 46.033 1.00 0.00 H new
  2153. ATOM 0 HG SER A 111 16.798 29.183 47.237 1.00 0.00 H new
  2154. ATOM 800 N VAL A 112 14.461 31.586 43.599 1.00 0.00 N
  2155. ATOM 801 CA VAL A 112 14.094 32.803 42.868 1.00 0.00 C
  2156. ATOM 802 C VAL A 112 14.485 34.070 43.623 1.00 0.00 C
  2157. ATOM 803 O VAL A 112 14.851 34.005 44.803 1.00 0.00 O
  2158. ATOM 804 CB VAL A 112 12.593 32.823 42.585 1.00 0.00 C
  2159. ATOM 805 CG1 VAL A 112 12.160 31.634 41.729 1.00 0.00 C
  2160. ATOM 806 CG2 VAL A 112 11.767 32.929 43.864 1.00 0.00 C
  2161. ATOM 0 H VAL A 112 13.840 31.284 44.112 1.00 0.00 H new
  2162. ATOM 0 HA VAL A 112 14.586 32.789 42.032 1.00 0.00 H new
  2163. ATOM 0 HB VAL A 112 12.417 33.626 42.070 1.00 0.00 H new
  2164. ATOM 0 HG11 VAL A 112 11.204 31.680 41.570 1.00 0.00 H new
  2165. ATOM 0 HG12 VAL A 112 12.630 31.658 40.881 1.00 0.00 H new
  2166. ATOM 0 HG13 VAL A 112 12.371 30.808 42.192 1.00 0.00 H new
  2167. ATOM 0 HG21 VAL A 112 10.823 32.939 43.640 1.00 0.00 H new
  2168. ATOM 0 HG22 VAL A 112 11.956 32.168 44.435 1.00 0.00 H new
  2169. ATOM 0 HG23 VAL A 112 11.996 33.748 44.331 1.00 0.00 H new
  2170. ATOM 807 N THR A 113 14.714 35.112 42.847 1.00 0.00 N
  2171. ATOM 808 CA THR A 113 15.102 36.407 43.410 1.00 0.00 C
  2172. ATOM 809 C THR A 113 13.903 37.309 43.685 1.00 0.00 C
  2173. ATOM 810 O THR A 113 13.053 37.498 42.805 1.00 0.00 O
  2174. ATOM 811 CB THR A 113 16.102 37.104 42.492 1.00 0.00 C
  2175. ATOM 812 OG1 THR A 113 17.233 36.257 42.330 1.00 0.00 O
  2176. ATOM 813 CG2 THR A 113 16.556 38.453 43.047 1.00 0.00 C
  2177. ATOM 0 H THR A 113 14.652 35.098 41.989 1.00 0.00 H new
  2178. ATOM 0 HA THR A 113 15.523 36.233 44.267 1.00 0.00 H new
  2179. ATOM 0 HB THR A 113 15.666 37.273 41.642 1.00 0.00 H new
  2180. ATOM 0 HG1 THR A 113 17.792 36.629 41.825 1.00 0.00 H new
  2181. ATOM 0 HG21 THR A 113 17.188 38.859 42.434 1.00 0.00 H new
  2182. ATOM 0 HG22 THR A 113 15.787 39.036 43.151 1.00 0.00 H new
  2183. ATOM 0 HG23 THR A 113 16.981 38.322 43.909 1.00 0.00 H new
  2184. ATOM 814 N LEU A 114 13.666 37.461 44.976 1.00 0.00 N
  2185. ATOM 815 CA LEU A 114 12.553 38.264 45.487 1.00 0.00 C
  2186. ATOM 816 C LEU A 114 12.718 39.759 45.234 1.00 0.00 C
  2187. ATOM 817 O LEU A 114 13.848 40.265 45.255 1.00 0.00 O
  2188. ATOM 818 CB LEU A 114 12.353 38.051 46.987 1.00 0.00 C
  2189. ATOM 819 CG LEU A 114 12.070 36.599 47.369 1.00 0.00 C
  2190. ATOM 820 CD1 LEU A 114 11.945 36.442 48.883 1.00 0.00 C
  2191. ATOM 821 CD2 LEU A 114 10.848 36.031 46.651 1.00 0.00 C
  2192. ATOM 0 H LEU A 114 14.147 37.101 45.591 1.00 0.00 H new
  2193. ATOM 0 HA LEU A 114 11.776 37.956 44.995 1.00 0.00 H new
  2194. ATOM 0 HB2 LEU A 114 13.146 38.352 47.457 1.00 0.00 H new
  2195. ATOM 0 HB3 LEU A 114 11.617 38.606 47.289 1.00 0.00 H new
  2196. ATOM 0 HG LEU A 114 12.833 36.078 47.072 1.00 0.00 H new
  2197. ATOM 0 HD11 LEU A 114 11.766 35.513 49.099 1.00 0.00 H new
  2198. ATOM 0 HD12 LEU A 114 12.773 36.718 49.307 1.00 0.00 H new
  2199. ATOM 0 HD13 LEU A 114 11.217 36.995 49.207 1.00 0.00 H new
  2200. ATOM 0 HD21 LEU A 114 10.710 35.111 46.925 1.00 0.00 H new
  2201. ATOM 0 HD22 LEU A 114 10.065 36.557 46.879 1.00 0.00 H new
  2202. ATOM 0 HD23 LEU A 114 10.991 36.064 45.692 1.00 0.00 H new
  2203. ATOM 822 N ASN A 115 11.706 40.270 44.558 1.00 0.00 N
  2204. ATOM 823 CA ASN A 115 11.518 41.702 44.303 1.00 0.00 C
  2205. ATOM 824 C ASN A 115 10.060 42.121 44.449 1.00 0.00 C
  2206. ATOM 825 O ASN A 115 9.225 41.293 44.833 1.00 0.00 O
  2207. ATOM 826 CB ASN A 115 12.087 42.135 42.952 1.00 0.00 C
  2208. ATOM 827 CG ASN A 115 11.675 41.145 41.868 1.00 0.00 C
  2209. ATOM 828 OD1 ASN A 115 10.478 40.886 41.697 1.00 0.00 O
  2210. ATOM 829 ND2 ASN A 115 12.643 40.295 41.553 1.00 0.00 N
  2211. ATOM 0 H ASN A 115 11.083 39.783 44.220 1.00 0.00 H new
  2212. ATOM 0 HA ASN A 115 12.026 42.167 44.986 1.00 0.00 H new
  2213. ATOM 0 HB2 ASN A 115 11.767 43.023 42.728 1.00 0.00 H new
  2214. ATOM 0 HB3 ASN A 115 13.054 42.187 43.002 1.00 0.00 H new
  2215. ATOM 0 HD21 ASN A 115 12.449 39.528 41.215 1.00 0.00 H new
  2216. ATOM 0 HD22 ASN A 115 13.465 40.511 41.687 1.00 0.00 H new
  2217. ATOM 830 N SER A 116 9.743 43.250 43.853 1.00 0.00 N
  2218. ATOM 831 CA SER A 116 8.390 43.812 43.946 1.00 0.00 C
  2219. ATOM 832 C SER A 116 7.390 43.094 43.047 1.00 0.00 C
  2220. ATOM 833 O SER A 116 6.187 43.093 43.339 1.00 0.00 O
  2221. ATOM 834 CB SER A 116 8.414 45.304 43.635 1.00 0.00 C
  2222. ATOM 835 OG SER A 116 9.055 45.504 42.384 1.00 0.00 O
  2223. ATOM 0 H SER A 116 10.292 43.718 43.384 1.00 0.00 H new
  2224. ATOM 0 HA SER A 116 8.090 43.679 44.859 1.00 0.00 H new
  2225. ATOM 0 HB2 SER A 116 7.510 45.656 43.609 1.00 0.00 H new
  2226. ATOM 0 HB3 SER A 116 8.885 45.785 44.334 1.00 0.00 H new
  2227. ATOM 0 HG SER A 116 9.071 46.325 42.205 1.00 0.00 H new
  2228. ATOM 836 N TYR A 117 7.946 42.207 42.245 1.00 0.00 N
  2229. ATOM 837 CA TYR A 117 7.151 41.380 41.329 1.00 0.00 C
  2230. ATOM 838 C TYR A 117 7.112 39.930 41.802 1.00 0.00 C
  2231. ATOM 839 O TYR A 117 6.288 39.135 41.332 1.00 0.00 O
  2232. ATOM 840 CB TYR A 117 7.712 41.444 39.905 1.00 0.00 C
  2233. ATOM 841 CG TYR A 117 7.807 42.891 39.392 1.00 0.00 C
  2234. ATOM 842 CD1 TYR A 117 6.663 43.569 38.999 1.00 0.00 C
  2235. ATOM 843 CD2 TYR A 117 9.042 43.516 39.315 1.00 0.00 C
  2236. ATOM 844 CE1 TYR A 117 6.749 44.890 38.540 1.00 0.00 C
  2237. ATOM 845 CE2 TYR A 117 9.139 44.835 38.858 1.00 0.00 C
  2238. ATOM 846 CZ TYR A 117 7.990 45.524 38.474 1.00 0.00 C
  2239. ATOM 847 OH TYR A 117 8.114 46.695 37.757 1.00 0.00 O
  2240. ATOM 0 H TYR A 117 8.793 42.060 42.209 1.00 0.00 H new
  2241. ATOM 0 HA TYR A 117 6.248 41.733 41.324 1.00 0.00 H new
  2242. ATOM 0 HB2 TYR A 117 8.592 41.036 39.885 1.00 0.00 H new
  2243. ATOM 0 HB3 TYR A 117 7.146 40.927 39.311 1.00 0.00 H new
  2244. ATOM 0 HD1 TYR A 117 5.836 43.146 39.040 1.00 0.00 H new
  2245. ATOM 0 HD2 TYR A 117 9.810 43.056 39.568 1.00 0.00 H new
  2246. ATOM 0 HE1 TYR A 117 5.980 45.344 38.280 1.00 0.00 H new
  2247. ATOM 0 HE2 TYR A 117 9.969 45.251 38.811 1.00 0.00 H new
  2248. ATOM 0 HH TYR A 117 8.907 46.968 37.801 1.00 0.00 H new
  2249. ATOM 848 N VAL A 118 8.081 39.591 42.646 1.00 0.00 N
  2250. ATOM 849 CA VAL A 118 8.214 38.230 43.197 1.00 0.00 C
  2251. ATOM 850 C VAL A 118 8.385 38.211 44.715 1.00 0.00 C
  2252. ATOM 851 O VAL A 118 9.339 38.817 45.216 1.00 0.00 O
  2253. ATOM 852 CB VAL A 118 9.410 37.510 42.567 1.00 0.00 C
  2254. ATOM 853 CG1 VAL A 118 9.607 36.110 43.145 1.00 0.00 C
  2255. ATOM 854 CG2 VAL A 118 9.351 37.473 41.042 1.00 0.00 C
  2256. ATOM 0 H VAL A 118 8.684 40.139 42.920 1.00 0.00 H new
  2257. ATOM 0 HA VAL A 118 7.385 37.775 42.982 1.00 0.00 H new
  2258. ATOM 0 HB VAL A 118 10.188 38.040 42.803 1.00 0.00 H new
  2259. ATOM 0 HG11 VAL A 118 10.371 35.689 42.721 1.00 0.00 H new
  2260. ATOM 0 HG12 VAL A 118 9.762 36.173 44.101 1.00 0.00 H new
  2261. ATOM 0 HG13 VAL A 118 8.813 35.577 42.981 1.00 0.00 H new
  2262. ATOM 0 HG21 VAL A 118 10.130 37.007 40.699 1.00 0.00 H new
  2263. ATOM 0 HG22 VAL A 118 8.547 37.009 40.760 1.00 0.00 H new
  2264. ATOM 0 HG23 VAL A 118 9.339 38.379 40.696 1.00 0.00 H new
  2265. ATOM 855 N GLN A 119 7.294 37.921 45.408 1.00 0.00 N
  2266. ATOM 856 CA GLN A 119 7.316 37.768 46.872 1.00 0.00 C
  2267. ATOM 857 C GLN A 119 6.828 36.409 47.366 1.00 0.00 C
  2268. ATOM 858 O GLN A 119 6.264 35.626 46.593 1.00 0.00 O
  2269. ATOM 859 CB GLN A 119 6.526 38.873 47.574 1.00 0.00 C
  2270. ATOM 860 CG GLN A 119 7.281 40.200 47.645 1.00 0.00 C
  2271. ATOM 861 CD GLN A 119 8.523 40.042 48.522 1.00 0.00 C
  2272. ATOM 862 OE1 GLN A 119 9.560 40.656 48.235 1.00 0.00 O
  2273. ATOM 863 NE2 GLN A 119 8.310 39.473 49.700 1.00 0.00 N
  2274. ATOM 0 H GLN A 119 6.519 37.806 45.053 1.00 0.00 H new
  2275. ATOM 0 HA GLN A 119 8.255 37.838 47.105 1.00 0.00 H new
  2276. ATOM 0 HB2 GLN A 119 5.687 39.009 47.107 1.00 0.00 H new
  2277. ATOM 0 HB3 GLN A 119 6.306 38.584 48.473 1.00 0.00 H new
  2278. ATOM 0 HG2 GLN A 119 7.538 40.484 46.754 1.00 0.00 H new
  2279. ATOM 0 HG3 GLN A 119 6.705 40.891 48.007 1.00 0.00 H new
  2280. ATOM 0 HE21 GLN A 119 7.572 39.058 49.850 1.00 0.00 H new
  2281. ATOM 0 HE22 GLN A 119 8.910 39.519 50.315 1.00 0.00 H new
  2282. ATOM 864 N LEU A 120 6.942 36.218 48.671 1.00 0.00 N
  2283. ATOM 865 CA LEU A 120 6.454 34.990 49.308 1.00 0.00 C
  2284. ATOM 866 C LEU A 120 5.009 35.133 49.774 1.00 0.00 C
  2285. ATOM 867 O LEU A 120 4.549 36.247 50.055 1.00 0.00 O
  2286. ATOM 868 CB LEU A 120 7.313 34.562 50.499 1.00 0.00 C
  2287. ATOM 869 CG LEU A 120 8.756 34.231 50.124 1.00 0.00 C
  2288. ATOM 870 CD1 LEU A 120 9.511 33.648 51.317 1.00 0.00 C
  2289. ATOM 871 CD2 LEU A 120 8.830 33.295 48.921 1.00 0.00 C
  2290. ATOM 0 H LEU A 120 7.298 36.784 49.212 1.00 0.00 H new
  2291. ATOM 0 HA LEU A 120 6.510 34.305 48.624 1.00 0.00 H new
  2292. ATOM 0 HB2 LEU A 120 7.313 35.272 51.160 1.00 0.00 H new
  2293. ATOM 0 HB3 LEU A 120 6.909 33.785 50.917 1.00 0.00 H new
  2294. ATOM 0 HG LEU A 120 9.186 35.063 49.869 1.00 0.00 H new
  2295. ATOM 0 HD11 LEU A 120 10.423 33.446 51.056 1.00 0.00 H new
  2296. ATOM 0 HD12 LEU A 120 9.518 34.292 52.042 1.00 0.00 H new
  2297. ATOM 0 HD13 LEU A 120 9.072 32.835 51.612 1.00 0.00 H new
  2298. ATOM 0 HD21 LEU A 120 9.759 33.108 48.713 1.00 0.00 H new
  2299. ATOM 0 HD22 LEU A 120 8.372 32.465 49.128 1.00 0.00 H new
  2300. ATOM 0 HD23 LEU A 120 8.406 33.716 48.157 1.00 0.00 H new
  2301. ATOM 872 N GLY A 121 4.282 34.049 49.595 1.00 0.00 N
  2302. ATOM 873 CA GLY A 121 2.866 33.964 49.959 1.00 0.00 C
  2303. ATOM 874 C GLY A 121 2.672 33.706 51.449 1.00 0.00 C
  2304. ATOM 875 O GLY A 121 3.413 32.905 52.033 1.00 0.00 O
  2305. ATOM 0 H GLY A 121 4.595 33.324 49.253 1.00 0.00 H new
  2306. ATOM 0 HA2 GLY A 121 2.420 34.790 49.714 1.00 0.00 H new
  2307. ATOM 0 HA3 GLY A 121 2.445 33.253 49.451 1.00 0.00 H new
  2308. ATOM 876 N VAL A 122 2.037 34.683 52.066 1.00 0.00 N
  2309. ATOM 877 CA VAL A 122 1.718 34.624 53.494 1.00 0.00 C
  2310. ATOM 878 C VAL A 122 0.660 33.568 53.803 1.00 0.00 C
  2311. ATOM 879 O VAL A 122 -0.374 33.522 53.124 1.00 0.00 O
  2312. ATOM 880 CB VAL A 122 1.247 35.991 53.984 1.00 0.00 C
  2313. ATOM 881 CG1 VAL A 122 0.814 35.957 55.448 1.00 0.00 C
  2314. ATOM 882 CG2 VAL A 122 2.296 37.072 53.733 1.00 0.00 C
  2315. ATOM 0 H VAL A 122 1.775 35.403 51.676 1.00 0.00 H new
  2316. ATOM 0 HA VAL A 122 2.529 34.371 53.962 1.00 0.00 H new
  2317. ATOM 0 HB VAL A 122 0.463 36.222 53.462 1.00 0.00 H new
  2318. ATOM 0 HG11 VAL A 122 0.523 36.841 55.720 1.00 0.00 H new
  2319. ATOM 0 HG12 VAL A 122 0.082 35.329 55.555 1.00 0.00 H new
  2320. ATOM 0 HG13 VAL A 122 1.561 35.679 56.000 1.00 0.00 H new
  2321. ATOM 0 HG21 VAL A 122 1.965 37.925 54.055 1.00 0.00 H new
  2322. ATOM 0 HG22 VAL A 122 3.114 36.845 54.202 1.00 0.00 H new
  2323. ATOM 0 HG23 VAL A 122 2.476 37.134 52.782 1.00 0.00 H new
  2324. ATOM 883 N LEU A 123 1.135 32.522 54.454 1.00 0.00 N
  2325. ATOM 884 CA LEU A 123 0.274 31.416 54.894 1.00 0.00 C
  2326. ATOM 885 C LEU A 123 -0.440 31.729 56.206 1.00 0.00 C
  2327. ATOM 886 O LEU A 123 0.065 32.512 57.020 1.00 0.00 O
  2328. ATOM 887 CB LEU A 123 1.097 30.141 55.066 1.00 0.00 C
  2329. ATOM 888 CG LEU A 123 1.693 29.648 53.749 1.00 0.00 C
  2330. ATOM 889 CD1 LEU A 123 2.615 28.449 53.961 1.00 0.00 C
  2331. ATOM 890 CD2 LEU A 123 0.613 29.354 52.708 1.00 0.00 C
  2332. ATOM 0 H LEU A 123 1.965 32.424 54.658 1.00 0.00 H new
  2333. ATOM 0 HA LEU A 123 -0.398 31.290 54.206 1.00 0.00 H new
  2334. ATOM 0 HB2 LEU A 123 1.812 30.304 55.700 1.00 0.00 H new
  2335. ATOM 0 HB3 LEU A 123 0.536 29.446 55.444 1.00 0.00 H new
  2336. ATOM 0 HG LEU A 123 2.237 30.370 53.396 1.00 0.00 H new
  2337. ATOM 0 HD11 LEU A 123 2.975 28.162 53.107 1.00 0.00 H new
  2338. ATOM 0 HD12 LEU A 123 3.343 28.701 54.550 1.00 0.00 H new
  2339. ATOM 0 HD13 LEU A 123 2.113 27.721 54.360 1.00 0.00 H new
  2340. ATOM 0 HD21 LEU A 123 1.029 29.044 51.888 1.00 0.00 H new
  2341. ATOM 0 HD22 LEU A 123 0.016 28.668 53.046 1.00 0.00 H new
  2342. ATOM 0 HD23 LEU A 123 0.108 30.162 52.528 1.00 0.00 H new
  2343. ATOM 891 N PRO A 124 -1.666 31.243 56.311 1.00 0.00 N
  2344. ATOM 892 CA PRO A 124 -2.523 31.393 57.504 1.00 0.00 C
  2345. ATOM 893 C PRO A 124 -2.102 30.505 58.672 1.00 0.00 C
  2346. ATOM 894 O PRO A 124 -1.225 29.643 58.535 1.00 0.00 O
  2347. ATOM 895 CB PRO A 124 -3.903 30.944 57.041 1.00 0.00 C
  2348. ATOM 896 CG PRO A 124 -3.616 29.921 55.957 1.00 0.00 C
  2349. ATOM 897 CD PRO A 124 -2.369 30.464 55.270 1.00 0.00 C
  2350. ATOM 0 HA PRO A 124 -2.477 32.306 57.828 1.00 0.00 H new
  2351. ATOM 0 HB2 PRO A 124 -4.412 30.555 57.769 1.00 0.00 H new
  2352. ATOM 0 HB3 PRO A 124 -4.421 31.688 56.698 1.00 0.00 H new
  2353. ATOM 0 HG2 PRO A 124 -3.462 29.039 56.331 1.00 0.00 H new
  2354. ATOM 0 HG3 PRO A 124 -4.358 29.841 55.337 1.00 0.00 H new
  2355. ATOM 0 HD2 PRO A 124 -1.812 29.745 54.934 1.00 0.00 H new
  2356. ATOM 0 HD3 PRO A 124 -2.601 31.022 54.511 1.00 0.00 H new
  2357. ATOM 898 N ARG A 125 -2.599 30.882 59.836 1.00 0.00 N
  2358. ATOM 899 CA ARG A 125 -2.427 30.102 61.064 1.00 0.00 C
  2359. ATOM 900 C ARG A 125 -3.237 28.809 60.991 1.00 0.00 C
  2360. ATOM 901 O ARG A 125 -4.232 28.763 60.256 1.00 0.00 O
  2361. ATOM 902 CB ARG A 125 -2.903 30.929 62.260 1.00 0.00 C
  2362. ATOM 903 CG ARG A 125 -2.818 30.164 63.580 1.00 0.00 C
  2363. ATOM 904 CD ARG A 125 -3.424 30.942 64.745 1.00 0.00 C
  2364. ATOM 905 NE ARG A 125 -3.354 30.140 65.975 1.00 0.00 N
  2365. ATOM 906 CZ ARG A 125 -4.346 30.053 66.850 1.00 0.00 C
  2366. ATOM 907 NH1 ARG A 125 -4.194 29.303 67.931 1.00 0.00 N
  2367. ATOM 908 NH2 ARG A 125 -5.330 30.938 66.810 1.00 0.00 N
  2368. ATOM 0 H ARG A 125 -3.052 31.605 59.944 1.00 0.00 H new
  2369. ATOM 0 HA ARG A 125 -1.488 29.880 61.166 1.00 0.00 H new
  2370. ATOM 0 HB2 ARG A 125 -2.368 31.736 62.323 1.00 0.00 H new
  2371. ATOM 0 HB3 ARG A 125 -3.820 31.208 62.111 1.00 0.00 H new
  2372. ATOM 0 HG2 ARG A 125 -3.277 29.314 63.488 1.00 0.00 H new
  2373. ATOM 0 HG3 ARG A 125 -1.889 29.965 63.776 1.00 0.00 H new
  2374. ATOM 0 HD2 ARG A 125 -2.948 31.778 64.868 1.00 0.00 H new
  2375. ATOM 0 HD3 ARG A 125 -4.347 31.167 64.548 1.00 0.00 H new
  2376. ATOM 0 HE ARG A 125 -2.630 29.704 66.136 1.00 0.00 H new
  2377. ATOM 0 HH11 ARG A 125 -3.457 28.879 68.060 1.00 0.00 H new
  2378. ATOM 0 HH12 ARG A 125 -4.832 29.241 68.504 1.00 0.00 H new
  2379. ATOM 0 HH21 ARG A 125 -5.322 31.563 66.219 1.00 0.00 H new
  2380. ATOM 0 HH22 ARG A 125 -5.977 30.888 67.375 1.00 0.00 H new
  2381. ATOM 909 N ALA A 126 -2.551 27.731 61.316 1.00 0.00 N
  2382. ATOM 910 CA ALA A 126 -3.148 26.394 61.359 1.00 0.00 C
  2383. ATOM 911 C ALA A 126 -4.500 26.340 62.072 1.00 0.00 C
  2384. ATOM 912 O ALA A 126 -4.675 26.988 63.112 1.00 0.00 O
  2385. ATOM 913 CB ALA A 126 -2.184 25.410 62.018 1.00 0.00 C
  2386. ATOM 0 H ALA A 126 -1.716 27.746 61.522 1.00 0.00 H new
  2387. ATOM 0 HA ALA A 126 -3.313 26.146 60.436 1.00 0.00 H new
  2388. ATOM 0 HB1 ALA A 126 -2.588 24.528 62.042 1.00 0.00 H new
  2389. ATOM 0 HB2 ALA A 126 -1.359 25.374 61.508 1.00 0.00 H new
  2390. ATOM 0 HB3 ALA A 126 -1.992 25.702 62.923 1.00 0.00 H new
  2391. ATOM 914 N GLY A 127 -5.489 25.958 61.283 1.00 0.00 N
  2392. ATOM 915 CA GLY A 127 -6.853 25.707 61.771 1.00 0.00 C
  2393. ATOM 916 C GLY A 127 -7.791 26.901 61.627 1.00 0.00 C
  2394. ATOM 917 O GLY A 127 -8.984 26.790 61.938 1.00 0.00 O
  2395. ATOM 0 H GLY A 127 -5.396 25.833 60.437 1.00 0.00 H new
  2396. ATOM 0 HA2 GLY A 127 -7.226 24.954 61.287 1.00 0.00 H new
  2397. ATOM 0 HA3 GLY A 127 -6.811 25.451 62.706 1.00 0.00 H new
  2398. ATOM 918 N THR A 128 -7.289 27.928 60.966 1.00 0.00 N
  2399. ATOM 919 CA THR A 128 -8.044 29.176 60.774 1.00 0.00 C
  2400. ATOM 920 C THR A 128 -9.202 29.076 59.782 1.00 0.00 C
  2401. ATOM 921 O THR A 128 -9.034 28.533 58.683 1.00 0.00 O
  2402. ATOM 922 CB THR A 128 -7.101 30.305 60.369 1.00 0.00 C
  2403. ATOM 923 OG1 THR A 128 -6.140 30.483 61.401 1.00 0.00 O
  2404. ATOM 924 CG2 THR A 128 -7.833 31.626 60.141 1.00 0.00 C
  2405. ATOM 0 H THR A 128 -6.505 27.932 60.613 1.00 0.00 H new
  2406. ATOM 0 HA THR A 128 -8.453 29.366 61.633 1.00 0.00 H new
  2407. ATOM 0 HB THR A 128 -6.682 30.056 59.531 1.00 0.00 H new
  2408. ATOM 0 HG1 THR A 128 -5.500 29.952 61.283 1.00 0.00 H new
  2409. ATOM 0 HG21 THR A 128 -7.194 32.310 59.887 1.00 0.00 H new
  2410. ATOM 0 HG22 THR A 128 -8.487 31.516 59.433 1.00 0.00 H new
  2411. ATOM 0 HG23 THR A 128 -8.283 31.892 60.958 1.00 0.00 H new
  2412. ATOM 925 N ILE A 129 -10.392 29.240 60.340 1.00 0.00 N
  2413. ATOM 926 CA ILE A 129 -11.645 29.262 59.570 1.00 0.00 C
  2414. ATOM 927 C ILE A 129 -12.176 30.688 59.451 1.00 0.00 C
  2415. ATOM 928 O ILE A 129 -12.210 31.415 60.452 1.00 0.00 O
  2416. ATOM 929 CB ILE A 129 -12.715 28.439 60.291 1.00 0.00 C
  2417. ATOM 930 CG1 ILE A 129 -12.210 27.072 60.739 1.00 0.00 C
  2418. ATOM 931 CG2 ILE A 129 -13.982 28.297 59.447 1.00 0.00 C
  2419. ATOM 932 CD1 ILE A 129 -11.926 26.156 59.554 1.00 0.00 C
  2420. ATOM 0 H ILE A 129 -10.505 29.344 61.186 1.00 0.00 H new
  2421. ATOM 0 HA ILE A 129 -11.458 28.896 58.691 1.00 0.00 H new
  2422. ATOM 0 HB ILE A 129 -12.937 28.936 61.094 1.00 0.00 H new
  2423. ATOM 0 HG12 ILE A 129 -11.402 27.182 61.264 1.00 0.00 H new
  2424. ATOM 0 HG13 ILE A 129 -12.869 26.657 61.317 1.00 0.00 H new
  2425. ATOM 0 HG21 ILE A 129 -14.637 27.772 59.932 1.00 0.00 H new
  2426. ATOM 0 HG22 ILE A 129 -14.347 29.176 59.261 1.00 0.00 H new
  2427. ATOM 0 HG23 ILE A 129 -13.767 27.853 58.612 1.00 0.00 H new
  2428. ATOM 0 HD11 ILE A 129 -11.608 25.298 59.877 1.00 0.00 H new
  2429. ATOM 0 HD12 ILE A 129 -12.740 26.027 59.042 1.00 0.00 H new
  2430. ATOM 0 HD13 ILE A 129 -11.249 26.559 58.988 1.00 0.00 H new
  2431. ATOM 933 N LEU A 130 -12.387 31.131 58.224 1.00 0.00 N
  2432. ATOM 934 CA LEU A 130 -12.978 32.453 57.984 1.00 0.00 C
  2433. ATOM 935 C LEU A 130 -14.487 32.453 58.199 1.00 0.00 C
  2434. ATOM 936 O LEU A 130 -15.159 31.474 57.852 1.00 0.00 O
  2435. ATOM 937 CB LEU A 130 -12.703 32.919 56.558 1.00 0.00 C
  2436. ATOM 938 CG LEU A 130 -11.227 33.205 56.310 1.00 0.00 C
  2437. ATOM 939 CD1 LEU A 130 -10.955 33.468 54.832 1.00 0.00 C
  2438. ATOM 940 CD2 LEU A 130 -10.709 34.337 57.195 1.00 0.00 C
  2439. ATOM 0 H LEU A 130 -12.198 30.688 57.511 1.00 0.00 H new
  2440. ATOM 0 HA LEU A 130 -12.566 33.056 58.622 1.00 0.00 H new
  2441. ATOM 0 HB2 LEU A 130 -13.007 32.240 55.935 1.00 0.00 H new
  2442. ATOM 0 HB3 LEU A 130 -13.219 33.720 56.378 1.00 0.00 H new
  2443. ATOM 0 HG LEU A 130 -10.732 32.409 56.559 1.00 0.00 H new
  2444. ATOM 0 HD11 LEU A 130 -10.010 33.647 54.703 1.00 0.00 H new
  2445. ATOM 0 HD12 LEU A 130 -11.210 32.690 54.312 1.00 0.00 H new
  2446. ATOM 0 HD13 LEU A 130 -11.471 34.235 54.539 1.00 0.00 H new
  2447. ATOM 0 HD21 LEU A 130 -9.769 34.489 57.009 1.00 0.00 H new
  2448. ATOM 0 HD22 LEU A 130 -11.210 35.147 57.011 1.00 0.00 H new
  2449. ATOM 0 HD23 LEU A 130 -10.818 34.095 58.128 1.00 0.00 H new
  2450. ATOM 941 N ALA A 131 -14.997 33.650 58.419 1.00 0.00 N
  2451. ATOM 942 CA ALA A 131 -16.437 33.863 58.570 1.00 0.00 C
  2452. ATOM 943 C ALA A 131 -17.100 34.009 57.206 1.00 0.00 C
  2453. ATOM 944 O ALA A 131 -16.400 34.079 56.189 1.00 0.00 O
  2454. ATOM 945 CB ALA A 131 -16.696 35.123 59.392 1.00 0.00 C
  2455. ATOM 0 H ALA A 131 -14.525 34.366 58.486 1.00 0.00 H new
  2456. ATOM 0 HA ALA A 131 -16.813 33.094 59.026 1.00 0.00 H new
  2457. ATOM 0 HB1 ALA A 131 -17.652 35.257 59.487 1.00 0.00 H new
  2458. ATOM 0 HB2 ALA A 131 -16.295 35.025 60.270 1.00 0.00 H new
  2459. ATOM 0 HB3 ALA A 131 -16.306 35.889 58.942 1.00 0.00 H new
  2460. ATOM 946 N ASN A 132 -18.383 33.712 57.173 1.00 0.00 N
  2461. ATOM 947 CA ASN A 132 -19.145 33.828 55.929 1.00 0.00 C
  2462. ATOM 948 C ASN A 132 -19.131 35.256 55.392 1.00 0.00 C
  2463. ATOM 949 O ASN A 132 -19.009 36.191 56.195 1.00 0.00 O
  2464. ATOM 950 CB ASN A 132 -20.586 33.382 56.140 1.00 0.00 C
  2465. ATOM 951 CG ASN A 132 -21.288 33.366 54.787 1.00 0.00 C
  2466. ATOM 952 OD1 ASN A 132 -21.134 32.403 54.024 1.00 0.00 O
  2467. ATOM 953 ND2 ASN A 132 -21.919 34.485 54.465 1.00 0.00 N
  2468. ATOM 0 H ASN A 132 -18.837 33.442 57.851 1.00 0.00 H new
  2469. ATOM 0 HA ASN A 132 -18.719 33.250 55.277 1.00 0.00 H new
  2470. ATOM 0 HB2 ASN A 132 -20.611 32.500 56.543 1.00 0.00 H new
  2471. ATOM 0 HB3 ASN A 132 -21.040 33.985 56.749 1.00 0.00 H new
  2472. ATOM 0 HD21 ASN A 132 -22.255 34.578 53.679 1.00 0.00 H new
  2473. ATOM 0 HD22 ASN A 132 -21.992 35.119 55.042 1.00 0.00 H new
  2474. ATOM 954 N ASN A 133 -18.778 35.329 54.116 1.00 0.00 N
  2475. ATOM 955 CA ASN A 133 -18.675 36.583 53.344 1.00 0.00 C
  2476. ATOM 956 C ASN A 133 -17.342 37.314 53.455 1.00 0.00 C
  2477. ATOM 957 O ASN A 133 -17.308 38.535 53.257 1.00 0.00 O
  2478. ATOM 958 CB ASN A 133 -19.832 37.549 53.595 1.00 0.00 C
  2479. ATOM 959 CG ASN A 133 -20.834 37.450 52.452 1.00 0.00 C
  2480. ATOM 960 OD1 ASN A 133 -21.906 36.849 52.606 1.00 0.00 O
  2481. ATOM 961 ND2 ASN A 133 -20.538 38.208 51.410 1.00 0.00 N
  2482. ATOM 0 H ASN A 133 -18.583 34.632 53.651 1.00 0.00 H new
  2483. ATOM 0 HA ASN A 133 -18.732 36.267 52.429 1.00 0.00 H new
  2484. ATOM 0 HB2 ASN A 133 -20.265 37.338 54.437 1.00 0.00 H new
  2485. ATOM 0 HB3 ASN A 133 -19.498 38.457 53.667 1.00 0.00 H new
  2486. ATOM 0 HD21 ASN A 133 -21.111 38.311 50.777 1.00 0.00 H new
  2487. ATOM 0 HD22 ASN A 133 -19.773 38.598 51.366 1.00 0.00 H new
  2488. ATOM 962 N SER A 134 -16.384 36.645 54.080 1.00 0.00 N
  2489. ATOM 963 CA SER A 134 -15.014 37.180 54.182 1.00 0.00 C
  2490. ATOM 964 C SER A 134 -14.407 37.551 52.829 1.00 0.00 C
  2491. ATOM 965 O SER A 134 -14.514 36.787 51.861 1.00 0.00 O
  2492. ATOM 966 CB SER A 134 -14.087 36.214 54.917 1.00 0.00 C
  2493. ATOM 967 OG SER A 134 -14.505 36.101 56.273 1.00 0.00 O
  2494. ATOM 0 H SER A 134 -16.497 35.879 54.455 1.00 0.00 H new
  2495. ATOM 0 HA SER A 134 -15.095 37.998 54.696 1.00 0.00 H new
  2496. ATOM 0 HB2 SER A 134 -14.104 35.344 54.489 1.00 0.00 H new
  2497. ATOM 0 HB3 SER A 134 -13.172 36.533 54.875 1.00 0.00 H new
  2498. ATOM 0 HG SER A 134 -15.080 35.492 56.339 1.00 0.00 H new
  2499. ATOM 968 N PRO A 135 -13.912 38.781 52.776 1.00 0.00 N
  2500. ATOM 969 CA PRO A 135 -13.318 39.420 51.581 1.00 0.00 C
  2501. ATOM 970 C PRO A 135 -12.079 38.717 51.032 1.00 0.00 C
  2502. ATOM 971 O PRO A 135 -11.043 38.656 51.707 1.00 0.00 O
  2503. ATOM 972 CB PRO A 135 -12.959 40.840 52.012 1.00 0.00 C
  2504. ATOM 973 CG PRO A 135 -12.845 40.765 53.525 1.00 0.00 C
  2505. ATOM 974 CD PRO A 135 -13.882 39.721 53.915 1.00 0.00 C
  2506. ATOM 0 HA PRO A 135 -13.960 39.382 50.855 1.00 0.00 H new
  2507. ATOM 0 HB2 PRO A 135 -12.126 41.131 51.610 1.00 0.00 H new
  2508. ATOM 0 HB3 PRO A 135 -13.641 41.474 51.741 1.00 0.00 H new
  2509. ATOM 0 HG2 PRO A 135 -11.953 40.502 53.802 1.00 0.00 H new
  2510. ATOM 0 HG3 PRO A 135 -13.030 41.623 53.939 1.00 0.00 H new
  2511. ATOM 0 HD2 PRO A 135 -13.636 39.270 54.738 1.00 0.00 H new
  2512. ATOM 0 HD3 PRO A 135 -14.751 40.125 54.062 1.00 0.00 H new
  2513. ATOM 975 N CYS A 136 -12.313 37.952 49.976 1.00 0.00 N
  2514. ATOM 976 CA CYS A 136 -11.242 37.235 49.268 1.00 0.00 C
  2515. ATOM 977 C CYS A 136 -11.223 37.526 47.767 1.00 0.00 C
  2516. ATOM 978 O CYS A 136 -12.279 37.742 47.162 1.00 0.00 O
  2517. ATOM 979 CB CYS A 136 -11.396 35.730 49.465 1.00 0.00 C
  2518. ATOM 980 SG CYS A 136 -11.495 35.133 51.168 1.00 0.00 S
  2519. ATOM 0 H CYS A 136 -13.096 37.829 49.643 1.00 0.00 H new
  2520. ATOM 0 HA CYS A 136 -10.407 37.550 49.647 1.00 0.00 H new
  2521. ATOM 0 HB2 CYS A 136 -12.197 35.445 48.998 1.00 0.00 H new
  2522. ATOM 0 HB3 CYS A 136 -10.646 35.291 49.035 1.00 0.00 H new
  2523. ATOM 981 N TYR A 137 -10.052 37.347 47.175 1.00 0.00 N
  2524. ATOM 982 CA TYR A 137 -9.815 37.512 45.730 1.00 0.00 C
  2525. ATOM 983 C TYR A 137 -9.212 36.265 45.089 1.00 0.00 C
  2526. ATOM 984 O TYR A 137 -8.407 35.571 45.721 1.00 0.00 O
  2527. ATOM 985 CB TYR A 137 -8.865 38.683 45.459 1.00 0.00 C
  2528. ATOM 986 CG TYR A 137 -9.557 40.056 45.510 1.00 0.00 C
  2529. ATOM 987 CD1 TYR A 137 -10.074 40.605 44.347 1.00 0.00 C
  2530. ATOM 988 CD2 TYR A 137 -9.622 40.766 46.698 1.00 0.00 C
  2531. ATOM 989 CE1 TYR A 137 -10.696 41.858 44.373 1.00 0.00 C
  2532. ATOM 990 CE2 TYR A 137 -10.242 42.021 46.735 1.00 0.00 C
  2533. ATOM 991 CZ TYR A 137 -10.780 42.563 45.571 1.00 0.00 C
  2534. ATOM 992 OH TYR A 137 -11.430 43.779 45.611 1.00 0.00 O
  2535. ATOM 0 H TYR A 137 -9.345 37.119 47.609 1.00 0.00 H new
  2536. ATOM 0 HA TYR A 137 -10.686 37.680 45.339 1.00 0.00 H new
  2537. ATOM 0 HB2 TYR A 137 -8.147 38.666 46.111 1.00 0.00 H new
  2538. ATOM 0 HB3 TYR A 137 -8.458 38.565 44.586 1.00 0.00 H new
  2539. ATOM 0 HD1 TYR A 137 -10.007 40.138 43.545 1.00 0.00 H new
  2540. ATOM 0 HD2 TYR A 137 -9.253 40.408 47.473 1.00 0.00 H new
  2541. ATOM 0 HE1 TYR A 137 -11.052 42.219 43.593 1.00 0.00 H new
  2542. ATOM 0 HE2 TYR A 137 -10.294 42.491 47.536 1.00 0.00 H new
  2543. ATOM 0 HH TYR A 137 -11.403 44.086 46.392 1.00 0.00 H new
  2544. ATOM 993 N ILE A 138 -9.700 35.923 43.908 1.00 0.00 N
  2545. ATOM 994 CA ILE A 138 -9.100 34.822 43.144 1.00 0.00 C
  2546. ATOM 995 C ILE A 138 -8.389 35.341 41.899 1.00 0.00 C
  2547. ATOM 996 O ILE A 138 -8.832 36.343 41.327 1.00 0.00 O
  2548. ATOM 997 CB ILE A 138 -10.123 33.753 42.750 1.00 0.00 C
  2549. ATOM 998 CG1 ILE A 138 -9.445 32.544 42.102 1.00 0.00 C
  2550. ATOM 999 CG2 ILE A 138 -11.238 34.310 41.867 1.00 0.00 C
  2551. ATOM 1000 CD1 ILE A 138 -10.443 31.494 41.622 1.00 0.00 C
  2552. ATOM 0 H ILE A 138 -10.370 36.306 43.528 1.00 0.00 H new
  2553. ATOM 0 HA ILE A 138 -8.451 34.405 43.732 1.00 0.00 H new
  2554. ATOM 0 HB ILE A 138 -10.543 33.452 43.571 1.00 0.00 H new
  2555. ATOM 0 HG12 ILE A 138 -8.910 32.843 41.350 1.00 0.00 H new
  2556. ATOM 0 HG13 ILE A 138 -8.837 32.139 42.740 1.00 0.00 H new
  2557. ATOM 0 HG21 ILE A 138 -11.860 33.600 41.644 1.00 0.00 H new
  2558. ATOM 0 HG22 ILE A 138 -11.708 35.012 42.343 1.00 0.00 H new
  2559. ATOM 0 HG23 ILE A 138 -10.856 34.672 41.053 1.00 0.00 H new
  2560. ATOM 0 HD11 ILE A 138 -9.964 30.752 41.221 1.00 0.00 H new
  2561. ATOM 0 HD12 ILE A 138 -10.963 31.173 42.375 1.00 0.00 H new
  2562. ATOM 0 HD13 ILE A 138 -11.037 31.888 40.964 1.00 0.00 H new
  2563. ATOM 1001 N THR A 139 -7.114 35.011 41.842 1.00 0.00 N
  2564. ATOM 1002 CA THR A 139 -6.277 35.404 40.710 1.00 0.00 C
  2565. ATOM 1003 C THR A 139 -5.812 34.211 39.884 1.00 0.00 C
  2566. ATOM 1004 O THR A 139 -5.716 33.093 40.404 1.00 0.00 O
  2567. ATOM 1005 CB THR A 139 -5.072 36.182 41.218 1.00 0.00 C
  2568. ATOM 1006 OG1 THR A 139 -4.374 35.362 42.147 1.00 0.00 O
  2569. ATOM 1007 CG2 THR A 139 -5.511 37.461 41.920 1.00 0.00 C
  2570. ATOM 0 H THR A 139 -6.706 34.558 42.448 1.00 0.00 H new
  2571. ATOM 0 HA THR A 139 -6.817 35.960 40.127 1.00 0.00 H new
  2572. ATOM 0 HB THR A 139 -4.505 36.421 40.468 1.00 0.00 H new
  2573. ATOM 0 HG1 THR A 139 -3.831 34.871 41.735 1.00 0.00 H new
  2574. ATOM 0 HG21 THR A 139 -4.730 37.942 42.236 1.00 0.00 H new
  2575. ATOM 0 HG22 THR A 139 -6.004 38.019 41.298 1.00 0.00 H new
  2576. ATOM 0 HG23 THR A 139 -6.079 37.238 42.674 1.00 0.00 H new
  2577. ATOM 1008 N GLY A 140 -5.615 34.462 38.601 1.00 0.00 N
  2578. ATOM 1009 CA GLY A 140 -5.155 33.431 37.662 1.00 0.00 C
  2579. ATOM 1010 C GLY A 140 -5.379 33.778 36.191 1.00 0.00 C
  2580. ATOM 1011 O GLY A 140 -5.990 34.803 35.863 1.00 0.00 O
  2581. ATOM 0 H GLY A 140 -5.742 35.233 38.242 1.00 0.00 H new
  2582. ATOM 0 HA2 GLY A 140 -4.209 33.275 37.807 1.00 0.00 H new
  2583. ATOM 0 HA3 GLY A 140 -5.613 32.599 37.861 1.00 0.00 H new
  2584. ATOM 1012 N TRP A 141 -4.773 32.956 35.350 1.00 0.00 N
  2585. ATOM 1013 CA TRP A 141 -4.811 33.096 33.889 1.00 0.00 C
  2586. ATOM 1014 C TRP A 141 -5.777 32.114 33.240 1.00 0.00 C
  2587. ATOM 1015 O TRP A 141 -5.793 32.013 32.007 1.00 0.00 O
  2588. ATOM 1016 CB TRP A 141 -3.429 32.838 33.294 1.00 0.00 C
  2589. ATOM 1017 CG TRP A 141 -2.430 33.971 33.570 1.00 0.00 C
  2590. ATOM 1018 CD1 TRP A 141 -2.278 35.138 32.920 1.00 0.00 C
  2591. ATOM 1019 CD2 TRP A 141 -1.455 33.983 34.566 1.00 0.00 C
  2592. ATOM 1020 NE1 TRP A 141 -1.248 35.869 33.466 1.00 0.00 N
  2593. ATOM 1021 CE2 TRP A 141 -0.750 35.204 34.435 1.00 0.00 C
  2594. ATOM 1022 CE3 TRP A 141 -1.126 33.052 35.538 1.00 0.00 C
  2595. ATOM 1023 CZ2 TRP A 141 0.293 35.567 35.270 1.00 0.00 C
  2596. ATOM 1024 CZ3 TRP A 141 -0.064 33.409 36.380 1.00 0.00 C
  2597. ATOM 1025 CH2 TRP A 141 0.621 34.625 36.252 1.00 0.00 C
  2598. ATOM 0 H TRP A 141 -4.313 32.279 35.614 1.00 0.00 H new
  2599. ATOM 0 HA TRP A 141 -5.107 34.002 33.710 1.00 0.00 H new
  2600. ATOM 0 HB2 TRP A 141 -3.077 32.009 33.656 1.00 0.00 H new
  2601. ATOM 0 HB3 TRP A 141 -3.514 32.716 32.335 1.00 0.00 H new
  2602. ATOM 0 HD1 TRP A 141 -2.798 35.414 32.200 1.00 0.00 H new
  2603. ATOM 0 HE1 TRP A 141 -0.984 36.643 33.199 1.00 0.00 H new
  2604. ATOM 0 HE3 TRP A 141 -1.579 32.245 35.626 1.00 0.00 H new
  2605. ATOM 0 HZ2 TRP A 141 0.742 36.377 35.185 1.00 0.00 H new
  2606. ATOM 0 HZ3 TRP A 141 0.196 32.817 37.049 1.00 0.00 H new
  2607. ATOM 0 HH2 TRP A 141 1.317 34.812 36.840 1.00 0.00 H new
  2608. ATOM 1026 N GLY A 142 -6.779 31.735 34.017 1.00 0.00 N
  2609. ATOM 1027 CA GLY A 142 -7.784 30.763 33.568 1.00 0.00 C
  2610. ATOM 1028 C GLY A 142 -8.843 31.355 32.643 1.00 0.00 C
  2611. ATOM 1029 O GLY A 142 -8.700 32.498 32.188 1.00 0.00 O
  2612. ATOM 0 H GLY A 142 -6.902 32.028 34.816 1.00 0.00 H new
  2613. ATOM 0 HA2 GLY A 142 -7.336 30.036 33.109 1.00 0.00 H new
  2614. ATOM 0 HA3 GLY A 142 -8.222 30.381 34.345 1.00 0.00 H new
  2615. ATOM 1030 N LEU A 143 -9.637 30.436 32.109 1.00 0.00 N
  2616. ATOM 1031 CA LEU A 143 -10.697 30.753 31.141 1.00 0.00 C
  2617. ATOM 1032 C LEU A 143 -11.613 31.878 31.621 1.00 0.00 C
  2618. ATOM 1033 O LEU A 143 -11.967 31.935 32.805 1.00 0.00 O
  2619. ATOM 1034 CB LEU A 143 -11.571 29.541 30.814 1.00 0.00 C
  2620. ATOM 1035 CG LEU A 143 -10.835 28.270 30.389 1.00 0.00 C
  2621. ATOM 1036 CD1 LEU A 143 -11.830 27.172 30.022 1.00 0.00 C
  2622. ATOM 1037 CD2 LEU A 143 -9.834 28.487 29.260 1.00 0.00 C
  2623. ATOM 0 H LEU A 143 -9.580 29.599 32.297 1.00 0.00 H new
  2624. ATOM 0 HA LEU A 143 -10.224 31.039 30.344 1.00 0.00 H new
  2625. ATOM 0 HB2 LEU A 143 -12.109 29.335 31.594 1.00 0.00 H new
  2626. ATOM 0 HB3 LEU A 143 -12.184 29.790 30.104 1.00 0.00 H new
  2627. ATOM 0 HG LEU A 143 -10.314 27.992 31.158 1.00 0.00 H new
  2628. ATOM 0 HD11 LEU A 143 -11.348 26.374 29.755 1.00 0.00 H new
  2629. ATOM 0 HD12 LEU A 143 -12.388 26.971 30.790 1.00 0.00 H new
  2630. ATOM 0 HD13 LEU A 143 -12.388 27.473 29.288 1.00 0.00 H new
  2631. ATOM 0 HD21 LEU A 143 -9.405 27.645 29.041 1.00 0.00 H new
  2632. ATOM 0 HD22 LEU A 143 -10.297 28.827 28.478 1.00 0.00 H new
  2633. ATOM 0 HD23 LEU A 143 -9.162 29.128 29.541 1.00 0.00 H new
  2634. ATOM 1038 N THR A 144 -11.706 32.897 30.794 1.00 0.00 N
  2635. ATOM 1039 CA THR A 144 -12.560 34.051 31.096 1.00 0.00 C
  2636. ATOM 1040 C THR A 144 -14.045 33.737 30.932 1.00 0.00 C
  2637. ATOM 1041 O THR A 144 -14.890 34.595 31.217 1.00 0.00 O
  2638. ATOM 1042 CB THR A 144 -12.174 35.219 30.201 1.00 0.00 C
  2639. ATOM 1043 OG1 THR A 144 -12.340 34.817 28.846 1.00 0.00 O
  2640. ATOM 1044 CG2 THR A 144 -10.724 35.641 30.430 1.00 0.00 C
  2641. ATOM 0 H THR A 144 -11.285 32.950 30.046 1.00 0.00 H new
  2642. ATOM 0 HA THR A 144 -12.419 34.283 32.027 1.00 0.00 H new
  2643. ATOM 0 HB THR A 144 -12.741 35.977 30.411 1.00 0.00 H new
  2644. ATOM 0 HG1 THR A 144 -12.132 35.452 28.338 1.00 0.00 H new
  2645. ATOM 0 HG21 THR A 144 -10.508 36.385 29.847 1.00 0.00 H new
  2646. ATOM 0 HG22 THR A 144 -10.607 35.910 31.355 1.00 0.00 H new
  2647. ATOM 0 HG23 THR A 144 -10.135 34.896 30.234 1.00 0.00 H new
  2648. ATOM 1045 N ARG A 145 -14.282 32.694 30.156 1.00 0.00 N
  2649. ATOM 1046 CA ARG A 145 -15.615 32.127 29.884 1.00 0.00 C
  2650. ATOM 1047 C ARG A 145 -15.609 30.604 29.986 1.00 0.00 C
  2651. ATOM 1048 O ARG A 145 -14.556 29.978 29.821 1.00 0.00 O
  2652. ATOM 1049 CB ARG A 145 -16.055 32.486 28.463 1.00 0.00 C
  2653. ATOM 1050 CG ARG A 145 -16.693 33.867 28.307 1.00 0.00 C
  2654. ATOM 1051 CD ARG A 145 -18.158 33.892 28.746 1.00 0.00 C
  2655. ATOM 1052 NE ARG A 145 -18.952 34.629 27.748 1.00 0.00 N
  2656. ATOM 1053 CZ ARG A 145 -20.077 34.170 27.212 1.00 0.00 C
  2657. ATOM 1054 NH1 ARG A 145 -20.677 34.891 26.277 1.00 0.00 N
  2658. ATOM 1055 NH2 ARG A 145 -20.809 33.310 27.904 1.00 0.00 N
  2659. ATOM 0 H ARG A 145 -13.652 32.272 29.751 1.00 0.00 H new
  2660. ATOM 0 HA ARG A 145 -16.221 32.496 30.545 1.00 0.00 H new
  2661. ATOM 0 HB2 ARG A 145 -15.283 32.435 27.878 1.00 0.00 H new
  2662. ATOM 0 HB3 ARG A 145 -16.687 31.817 28.157 1.00 0.00 H new
  2663. ATOM 0 HG2 ARG A 145 -16.191 34.512 28.830 1.00 0.00 H new
  2664. ATOM 0 HG3 ARG A 145 -16.632 34.145 27.380 1.00 0.00 H new
  2665. ATOM 0 HD2 ARG A 145 -18.494 32.987 28.838 1.00 0.00 H new
  2666. ATOM 0 HD3 ARG A 145 -18.239 34.315 29.615 1.00 0.00 H new
  2667. ATOM 0 HE ARG A 145 -18.670 35.402 27.498 1.00 0.00 H new
  2668. ATOM 0 HH11 ARG A 145 -20.337 35.641 26.028 1.00 0.00 H new
  2669. ATOM 0 HH12 ARG A 145 -21.406 34.609 25.919 1.00 0.00 H new
  2670. ATOM 0 HH21 ARG A 145 -20.553 33.059 28.686 1.00 0.00 H new
  2671. ATOM 0 HH22 ARG A 145 -21.540 33.003 27.572 1.00 0.00 H new
  2672. ATOM 1056 N THR A 147 -16.759 30.046 30.324 1.00 0.00 N
  2673. ATOM 1057 CA THR A 147 -16.934 28.590 30.312 1.00 0.00 C
  2674. ATOM 1058 C THR A 147 -16.792 28.065 28.885 1.00 0.00 C
  2675. ATOM 1059 O THR A 147 -17.320 28.702 27.963 1.00 0.00 O
  2676. ATOM 1060 CB THR A 147 -18.303 28.216 30.881 1.00 0.00 C
  2677. ATOM 1061 OG1 THR A 147 -18.380 28.641 32.241 1.00 0.00 O
  2678. ATOM 1062 CG2 THR A 147 -18.568 26.714 30.814 1.00 0.00 C
  2679. ATOM 0 H THR A 147 -17.456 30.488 30.565 1.00 0.00 H new
  2680. ATOM 0 HA THR A 147 -16.250 28.185 30.867 1.00 0.00 H new
  2681. ATOM 0 HB THR A 147 -18.975 28.660 30.341 1.00 0.00 H new
  2682. ATOM 0 HG1 THR A 147 -18.694 29.419 32.274 1.00 0.00 H new
  2683. ATOM 0 HG21 THR A 147 -19.444 26.523 31.184 1.00 0.00 H new
  2684. ATOM 0 HG22 THR A 147 -18.537 26.421 29.890 1.00 0.00 H new
  2685. ATOM 0 HG23 THR A 147 -17.892 26.243 31.325 1.00 0.00 H new
  2686. ATOM 1063 N ASN A 148 -15.754 27.251 28.722 1.00 0.00 N
  2687. ATOM 1064 CA ASN A 148 -15.318 26.674 27.438 1.00 0.00 C
  2688. ATOM 1065 C ASN A 148 -14.670 27.716 26.533 1.00 0.00 C
  2689. ATOM 1066 O ASN A 148 -14.884 27.697 25.315 1.00 0.00 O
  2690. ATOM 1067 CB ASN A 148 -16.439 25.950 26.689 1.00 0.00 C
  2691. ATOM 1068 CG ASN A 148 -16.799 24.649 27.402 1.00 0.00 C
  2692. ATOM 1069 OD1 ASN A 148 -15.918 23.978 27.954 1.00 0.00 O
  2693. ATOM 1070 ND2 ASN A 148 -18.096 24.431 27.533 1.00 0.00 N
  2694. ATOM 0 H ASN A 148 -15.259 27.005 29.381 1.00 0.00 H new
  2695. ATOM 0 HA ASN A 148 -14.651 26.009 27.672 1.00 0.00 H new
  2696. ATOM 0 HB2 ASN A 148 -17.220 26.522 26.632 1.00 0.00 H new
  2697. ATOM 0 HB3 ASN A 148 -16.159 25.761 25.780 1.00 0.00 H new
  2698. ATOM 0 HD21 ASN A 148 -18.376 23.786 28.029 1.00 0.00 H new
  2699. ATOM 0 HD22 ASN A 148 -18.660 24.934 27.122 1.00 0.00 H new
  2700. ATOM 1071 N GLY A 149 -14.229 28.776 27.191 1.00 0.00 N
  2701. ATOM 1072 CA GLY A 149 -13.536 29.894 26.535 1.00 0.00 C
  2702. ATOM 1073 C GLY A 149 -12.025 29.690 26.455 1.00 0.00 C
  2703. ATOM 1074 O GLY A 149 -11.562 28.600 26.093 1.00 0.00 O
  2704. ATOM 0 H GLY A 149 -14.321 28.875 28.040 1.00 0.00 H new
  2705. ATOM 0 HA2 GLY A 149 -13.890 30.008 25.639 1.00 0.00 H new
  2706. ATOM 0 HA3 GLY A 149 -13.722 30.713 27.020 1.00 0.00 H new
  2707. ATOM 1075 N GLN A 150 -11.311 30.802 26.501 1.00 0.00 N
  2708. ATOM 1076 CA GLN A 150 -9.846 30.800 26.405 1.00 0.00 C
  2709. ATOM 1077 C GLN A 150 -9.141 31.495 27.567 1.00 0.00 C
  2710. ATOM 1078 O GLN A 150 -9.784 32.197 28.360 1.00 0.00 O
  2711. ATOM 1079 CB GLN A 150 -9.418 31.430 25.084 1.00 0.00 C
  2712. ATOM 1080 CG GLN A 150 -10.023 32.820 24.902 1.00 0.00 C
  2713. ATOM 1081 CD GLN A 150 -9.620 33.374 23.538 1.00 0.00 C
  2714. ATOM 1082 OE1 GLN A 150 -10.003 34.499 23.192 1.00 0.00 O
  2715. ATOM 1083 NE2 GLN A 150 -9.110 32.480 22.706 1.00 0.00 N
  2716. ATOM 0 H GLN A 150 -11.656 31.585 26.589 1.00 0.00 H new
  2717. ATOM 0 HA GLN A 150 -9.573 29.870 26.447 1.00 0.00 H new
  2718. ATOM 0 HB2 GLN A 150 -8.450 31.491 25.052 1.00 0.00 H new
  2719. ATOM 0 HB3 GLN A 150 -9.691 30.859 24.349 1.00 0.00 H new
  2720. ATOM 0 HG2 GLN A 150 -10.989 32.775 24.971 1.00 0.00 H new
  2721. ATOM 0 HG3 GLN A 150 -9.716 33.412 25.606 1.00 0.00 H new
  2722. ATOM 0 HE21 GLN A 150 -8.859 31.712 23.001 1.00 0.00 H new
  2723. ATOM 0 HE22 GLN A 150 -9.029 32.667 21.871 1.00 0.00 H new
  2724. ATOM 1084 N LEU A 151 -7.905 31.056 27.775 1.00 0.00 N
  2725. ATOM 1085 CA LEU A 151 -7.020 31.577 28.822 1.00 0.00 C
  2726. ATOM 1086 C LEU A 151 -6.785 33.074 28.665 1.00 0.00 C
  2727. ATOM 1087 O LEU A 151 -6.637 33.576 27.543 1.00 0.00 O
  2728. ATOM 1088 CB LEU A 151 -5.657 30.882 28.780 1.00 0.00 C
  2729. ATOM 1089 CG LEU A 151 -5.713 29.382 29.066 1.00 0.00 C
  2730. ATOM 1090 CD1 LEU A 151 -4.358 28.717 28.826 1.00 0.00 C
  2731. ATOM 1091 CD2 LEU A 151 -6.248 29.071 30.463 1.00 0.00 C
  2732. ATOM 0 H LEU A 151 -7.546 30.433 27.303 1.00 0.00 H new
  2733. ATOM 0 HA LEU A 151 -7.462 31.403 29.668 1.00 0.00 H new
  2734. ATOM 0 HB2 LEU A 151 -5.261 31.020 27.905 1.00 0.00 H new
  2735. ATOM 0 HB3 LEU A 151 -5.070 31.303 29.427 1.00 0.00 H new
  2736. ATOM 0 HG LEU A 151 -6.346 29.003 28.436 1.00 0.00 H new
  2737. ATOM 0 HD11 LEU A 151 -4.425 27.768 29.015 1.00 0.00 H new
  2738. ATOM 0 HD12 LEU A 151 -4.094 28.844 27.901 1.00 0.00 H new
  2739. ATOM 0 HD13 LEU A 151 -3.694 29.116 29.409 1.00 0.00 H new
  2740. ATOM 0 HD21 LEU A 151 -6.265 28.110 30.597 1.00 0.00 H new
  2741. ATOM 0 HD22 LEU A 151 -5.673 29.480 31.128 1.00 0.00 H new
  2742. ATOM 0 HD23 LEU A 151 -7.147 29.425 30.552 1.00 0.00 H new
  2743. ATOM 1092 N ALA A 152 -6.732 33.746 29.796 1.00 0.00 N
  2744. ATOM 1093 CA ALA A 152 -6.444 35.182 29.817 1.00 0.00 C
  2745. ATOM 1094 C ALA A 152 -4.960 35.453 29.586 1.00 0.00 C
  2746. ATOM 1095 O ALA A 152 -4.144 34.569 29.876 1.00 0.00 O
  2747. ATOM 1096 CB ALA A 152 -6.845 35.752 31.172 1.00 0.00 C
  2748. ATOM 0 H ALA A 152 -6.859 33.396 30.571 1.00 0.00 H new
  2749. ATOM 0 HA ALA A 152 -6.949 35.604 29.104 1.00 0.00 H new
  2750. ATOM 0 HB1 ALA A 152 -6.656 36.703 31.192 1.00 0.00 H new
  2751. ATOM 0 HB2 ALA A 152 -7.793 35.608 31.316 1.00 0.00 H new
  2752. ATOM 0 HB3 ALA A 152 -6.341 35.308 31.872 1.00 0.00 H new
  2753. ATOM 1097 N GLN A 153 -4.692 36.389 28.692 1.00 0.00 N
  2754. ATOM 1098 CA GLN A 153 -3.301 36.782 28.434 1.00 0.00 C
  2755. ATOM 1099 C GLN A 153 -2.648 37.403 29.663 1.00 0.00 C
  2756. ATOM 1100 O GLN A 153 -1.545 37.004 30.056 1.00 0.00 O
  2757. ATOM 1101 CB GLN A 153 -3.185 37.753 27.262 1.00 0.00 C
  2758. ATOM 1102 CG GLN A 153 -3.540 37.110 25.925 1.00 0.00 C
  2759. ATOM 1103 CD GLN A 153 -3.117 38.060 24.809 1.00 0.00 C
  2760. ATOM 1104 OE1 GLN A 153 -3.626 37.955 23.685 1.00 0.00 O
  2761. ATOM 1105 NE2 GLN A 153 -1.959 38.666 25.037 1.00 0.00 N
  2762. ATOM 0 H GLN A 153 -5.283 36.807 28.227 1.00 0.00 H new
  2763. ATOM 0 HA GLN A 153 -2.833 35.963 28.208 1.00 0.00 H new
  2764. ATOM 0 HB2 GLN A 153 -3.769 38.512 27.417 1.00 0.00 H new
  2765. ATOM 0 HB3 GLN A 153 -2.279 38.097 27.221 1.00 0.00 H new
  2766. ATOM 0 HG2 GLN A 153 -3.090 36.256 25.831 1.00 0.00 H new
  2767. ATOM 0 HG3 GLN A 153 -4.493 36.935 25.877 1.00 0.00 H new
  2768. ATOM 0 HE21 GLN A 153 -1.648 38.712 25.838 1.00 0.00 H new
  2769. ATOM 0 HE22 GLN A 153 -1.519 39.013 24.384 1.00 0.00 H new
  2770. ATOM 1106 N THR A 154 -3.396 38.293 30.291 1.00 0.00 N
  2771. ATOM 1107 CA THR A 154 -2.954 38.985 31.507 1.00 0.00 C
  2772. ATOM 1108 C THR A 154 -3.647 38.451 32.755 1.00 0.00 C
  2773. ATOM 1109 O THR A 154 -4.838 38.121 32.696 1.00 0.00 O
  2774. ATOM 1110 CB THR A 154 -3.182 40.491 31.405 1.00 0.00 C
  2775. ATOM 1111 OG1 THR A 154 -4.580 40.757 31.339 1.00 0.00 O
  2776. ATOM 1112 CG2 THR A 154 -2.472 41.108 30.202 1.00 0.00 C
  2777. ATOM 0 H THR A 154 -4.183 38.520 30.028 1.00 0.00 H new
  2778. ATOM 0 HA THR A 154 -2.003 38.812 31.588 1.00 0.00 H new
  2779. ATOM 0 HB THR A 154 -2.802 40.900 32.198 1.00 0.00 H new
  2780. ATOM 0 HG1 THR A 154 -4.703 41.566 31.148 1.00 0.00 H new
  2781. ATOM 0 HG21 THR A 154 -2.645 42.062 30.178 1.00 0.00 H new
  2782. ATOM 0 HG22 THR A 154 -1.517 40.955 30.276 1.00 0.00 H new
  2783. ATOM 0 HG23 THR A 154 -2.802 40.700 29.387 1.00 0.00 H new
  2784. ATOM 1113 N LEU A 155 -2.976 38.659 33.876 1.00 0.00 N
  2785. ATOM 1114 CA LEU A 155 -3.413 38.165 35.190 1.00 0.00 C
  2786. ATOM 1115 C LEU A 155 -4.712 38.812 35.665 1.00 0.00 C
  2787. ATOM 1116 O LEU A 155 -4.839 40.042 35.591 1.00 0.00 O
  2788. ATOM 1117 CB LEU A 155 -2.302 38.390 36.218 1.00 0.00 C
  2789. ATOM 1118 CG LEU A 155 -2.572 37.701 37.557 1.00 0.00 C
  2790. ATOM 1119 CD1 LEU A 155 -2.754 36.195 37.398 1.00 0.00 C
  2791. ATOM 1120 CD2 LEU A 155 -1.488 38.017 38.586 1.00 0.00 C
  2792. ATOM 0 H LEU A 155 -2.238 39.099 33.904 1.00 0.00 H new
  2793. ATOM 0 HA LEU A 155 -3.593 37.217 35.097 1.00 0.00 H new
  2794. ATOM 0 HB2 LEU A 155 -1.463 38.063 35.856 1.00 0.00 H new
  2795. ATOM 0 HB3 LEU A 155 -2.195 39.343 36.367 1.00 0.00 H new
  2796. ATOM 0 HG LEU A 155 -3.409 38.061 37.891 1.00 0.00 H new
  2797. ATOM 0 HD11 LEU A 155 -2.923 35.796 38.266 1.00 0.00 H new
  2798. ATOM 0 HD12 LEU A 155 -3.506 36.020 36.811 1.00 0.00 H new
  2799. ATOM 0 HD13 LEU A 155 -1.950 35.810 37.016 1.00 0.00 H new
  2800. ATOM 0 HD21 LEU A 155 -1.691 37.565 39.420 1.00 0.00 H new
  2801. ATOM 0 HD22 LEU A 155 -0.629 37.713 38.255 1.00 0.00 H new
  2802. ATOM 0 HD23 LEU A 155 -1.455 38.974 38.738 1.00 0.00 H new
  2803. ATOM 1121 N GLN A 156 -5.747 37.984 35.630 1.00 0.00 N
  2804. ATOM 1122 CA GLN A 156 -7.092 38.375 36.069 1.00 0.00 C
  2805. ATOM 1123 C GLN A 156 -7.326 38.143 37.559 1.00 0.00 C
  2806. ATOM 1124 O GLN A 156 -6.653 37.300 38.164 1.00 0.00 O
  2807. ATOM 1125 CB GLN A 156 -8.144 37.583 35.294 1.00 0.00 C
  2808. ATOM 1126 CG GLN A 156 -8.018 37.749 33.782 1.00 0.00 C
  2809. ATOM 1127 CD GLN A 156 -8.231 39.209 33.392 1.00 0.00 C
  2810. ATOM 1128 OE1 GLN A 156 -9.322 39.757 33.601 1.00 0.00 O
  2811. ATOM 1129 NE2 GLN A 156 -7.186 39.804 32.830 1.00 0.00 N
  2812. ATOM 0 H GLN A 156 -5.694 37.173 35.350 1.00 0.00 H new
  2813. ATOM 0 HA GLN A 156 -7.168 39.326 35.896 1.00 0.00 H new
  2814. ATOM 0 HB2 GLN A 156 -8.065 36.643 35.519 1.00 0.00 H new
  2815. ATOM 0 HB3 GLN A 156 -9.028 37.868 35.574 1.00 0.00 H new
  2816. ATOM 0 HG2 GLN A 156 -7.142 37.454 33.490 1.00 0.00 H new
  2817. ATOM 0 HG3 GLN A 156 -8.670 37.189 33.333 1.00 0.00 H new
  2818. ATOM 0 HE21 GLN A 156 -6.455 39.367 32.712 1.00 0.00 H new
  2819. ATOM 0 HE22 GLN A 156 -7.240 40.626 32.584 1.00 0.00 H new
  2820. ATOM 1130 N GLN A 157 -8.056 39.081 38.147 1.00 0.00 N
  2821. ATOM 1131 CA GLN A 157 -8.508 39.012 39.544 1.00 0.00 C
  2822. ATOM 1132 C GLN A 157 -10.013 39.234 39.700 1.00 0.00 C
  2823. ATOM 1133 O GLN A 157 -10.602 40.057 38.988 1.00 0.00 O
  2824. ATOM 1134 CB GLN A 157 -7.744 39.987 40.441 1.00 0.00 C
  2825. ATOM 1135 CG GLN A 157 -7.867 41.440 39.989 1.00 0.00 C
  2826. ATOM 1136 CD GLN A 157 -7.321 42.358 41.080 1.00 0.00 C
  2827. ATOM 1137 OE1 GLN A 157 -6.155 42.769 41.020 1.00 0.00 O
  2828. ATOM 1138 NE2 GLN A 157 -8.257 42.916 41.833 1.00 0.00 N
  2829. ATOM 0 H GLN A 157 -8.312 39.795 37.741 1.00 0.00 H new
  2830. ATOM 0 HA GLN A 157 -8.315 38.106 39.830 1.00 0.00 H new
  2831. ATOM 0 HB2 GLN A 157 -8.074 39.908 41.350 1.00 0.00 H new
  2832. ATOM 0 HB3 GLN A 157 -6.807 39.737 40.456 1.00 0.00 H new
  2833. ATOM 0 HG2 GLN A 157 -7.376 41.575 39.163 1.00 0.00 H new
  2834. ATOM 0 HG3 GLN A 157 -8.795 41.655 39.806 1.00 0.00 H new
  2835. ATOM 0 HE21 GLN A 157 -9.054 42.592 41.839 1.00 0.00 H new
  2836. ATOM 0 HE22 GLN A 157 -8.068 43.602 42.315 1.00 0.00 H new
  2837. ATOM 1139 N ALA A 158 -10.601 38.511 40.645 1.00 0.00 N
  2838. ATOM 1140 CA ALA A 158 -12.043 38.602 40.929 1.00 0.00 C
  2839. ATOM 1141 C ALA A 158 -12.394 38.527 42.413 1.00 0.00 C
  2840. ATOM 1142 O ALA A 158 -12.019 37.559 43.088 1.00 0.00 O
  2841. ATOM 1143 CB ALA A 158 -12.803 37.511 40.180 1.00 0.00 C
  2842. ATOM 0 H ALA A 158 -10.181 37.951 41.144 1.00 0.00 H new
  2843. ATOM 0 HA ALA A 158 -12.311 39.482 40.622 1.00 0.00 H new
  2844. ATOM 0 HB1 ALA A 158 -13.750 37.583 40.376 1.00 0.00 H new
  2845. ATOM 0 HB2 ALA A 158 -12.662 37.615 39.226 1.00 0.00 H new
  2846. ATOM 0 HB3 ALA A 158 -12.480 36.640 40.461 1.00 0.00 H new
  2847. ATOM 1144 N TYR A 159 -13.335 39.385 42.790 1.00 0.00 N
  2848. ATOM 1145 CA TYR A 159 -13.852 39.457 44.162 1.00 0.00 C
  2849. ATOM 1146 C TYR A 159 -14.794 38.293 44.451 1.00 0.00 C
  2850. ATOM 1147 O TYR A 159 -15.812 38.143 43.760 1.00 0.00 O
  2851. ATOM 1148 CB TYR A 159 -14.578 40.784 44.405 1.00 0.00 C
  2852. ATOM 1149 CG TYR A 159 -14.959 40.967 45.885 1.00 0.00 C
  2853. ATOM 1150 CD1 TYR A 159 -13.967 40.982 46.852 1.00 0.00 C
  2854. ATOM 1151 CD2 TYR A 159 -16.285 41.138 46.253 1.00 0.00 C
  2855. ATOM 1152 CE1 TYR A 159 -14.296 41.152 48.201 1.00 0.00 C
  2856. ATOM 1153 CE2 TYR A 159 -16.625 41.308 47.602 1.00 0.00 C
  2857. ATOM 1154 CZ TYR A 159 -15.627 41.314 48.576 1.00 0.00 C
  2858. ATOM 1155 OH TYR A 159 -15.967 41.288 49.913 1.00 0.00 O
  2859. ATOM 0 H TYR A 159 -13.699 39.950 42.254 1.00 0.00 H new
  2860. ATOM 0 HA TYR A 159 -13.093 39.402 44.764 1.00 0.00 H new
  2861. ATOM 0 HB2 TYR A 159 -14.011 41.519 44.124 1.00 0.00 H new
  2862. ATOM 0 HB3 TYR A 159 -15.379 40.819 43.859 1.00 0.00 H new
  2863. ATOM 0 HD1 TYR A 159 -13.077 40.878 46.603 1.00 0.00 H new
  2864. ATOM 0 HD2 TYR A 159 -16.950 41.140 45.603 1.00 0.00 H new
  2865. ATOM 0 HE1 TYR A 159 -13.627 41.157 48.846 1.00 0.00 H new
  2866. ATOM 0 HE2 TYR A 159 -17.515 41.417 47.847 1.00 0.00 H new
  2867. ATOM 0 HH TYR A 159 -16.796 41.398 49.994 1.00 0.00 H new
  2868. ATOM 1156 N LEU A 160 -14.184 37.301 45.076 1.00 0.00 N
  2869. ATOM 1157 CA LEU A 160 -14.864 36.065 45.495 1.00 0.00 C
  2870. ATOM 1158 C LEU A 160 -14.951 35.929 47.015 1.00 0.00 C
  2871. ATOM 1159 O LEU A 160 -14.050 35.333 47.615 1.00 0.00 O
  2872. ATOM 1160 CB LEU A 160 -14.077 34.868 44.959 1.00 0.00 C
  2873. ATOM 1161 CG LEU A 160 -14.835 34.066 43.901 1.00 0.00 C
  2874. ATOM 1162 CD1 LEU A 160 -15.290 34.920 42.721 1.00 0.00 C
  2875. ATOM 1163 CD2 LEU A 160 -14.049 32.839 43.444 1.00 0.00 C
  2876. ATOM 0 H LEU A 160 -13.348 37.318 45.277 1.00 0.00 H new
  2877. ATOM 0 HA LEU A 160 -15.767 36.096 45.142 1.00 0.00 H new
  2878. ATOM 0 HB2 LEU A 160 -13.242 35.183 44.579 1.00 0.00 H new
  2879. ATOM 0 HB3 LEU A 160 -13.850 34.282 45.698 1.00 0.00 H new
  2880. ATOM 0 HG LEU A 160 -15.643 33.747 44.333 1.00 0.00 H new
  2881. ATOM 0 HD11 LEU A 160 -15.763 34.364 42.083 1.00 0.00 H new
  2882. ATOM 0 HD12 LEU A 160 -15.880 35.622 43.038 1.00 0.00 H new
  2883. ATOM 0 HD13 LEU A 160 -14.516 35.318 42.292 1.00 0.00 H new
  2884. ATOM 0 HD21 LEU A 160 -14.561 32.357 42.775 1.00 0.00 H new
  2885. ATOM 0 HD22 LEU A 160 -13.203 33.120 43.063 1.00 0.00 H new
  2886. ATOM 0 HD23 LEU A 160 -13.884 32.259 44.204 1.00 0.00 H new
  2887. ATOM 1164 N PRO A 161 -15.930 36.581 47.638 1.00 0.00 N
  2888. ATOM 1165 CA PRO A 161 -16.243 36.390 49.070 1.00 0.00 C
  2889. ATOM 1166 C PRO A 161 -16.636 34.956 49.423 1.00 0.00 C
  2890. ATOM 1167 O PRO A 161 -17.361 34.303 48.662 1.00 0.00 O
  2891. ATOM 1168 CB PRO A 161 -17.384 37.353 49.373 1.00 0.00 C
  2892. ATOM 1169 CG PRO A 161 -18.091 37.519 48.041 1.00 0.00 C
  2893. ATOM 1170 CD PRO A 161 -16.976 37.415 47.006 1.00 0.00 C
  2894. ATOM 0 HA PRO A 161 -15.454 36.566 49.606 1.00 0.00 H new
  2895. ATOM 0 HB2 PRO A 161 -17.980 36.995 50.049 1.00 0.00 H new
  2896. ATOM 0 HB3 PRO A 161 -17.053 38.201 49.707 1.00 0.00 H new
  2897. ATOM 0 HG2 PRO A 161 -18.762 36.831 47.908 1.00 0.00 H new
  2898. ATOM 0 HG3 PRO A 161 -18.546 38.374 47.986 1.00 0.00 H new
  2899. ATOM 0 HD2 PRO A 161 -17.297 37.010 46.185 1.00 0.00 H new
  2900. ATOM 0 HD3 PRO A 161 -16.631 38.292 46.774 1.00 0.00 H new
  2901. ATOM 1171 N THR A 162 -16.419 34.627 50.685 1.00 0.00 N
  2902. ATOM 1172 CA THR A 162 -16.590 33.253 51.175 1.00 0.00 C
  2903. ATOM 1173 C THR A 162 -18.014 32.841 51.535 1.00 0.00 C
  2904. ATOM 1174 O THR A 162 -18.892 33.685 51.750 1.00 0.00 O
  2905. ATOM 1175 CB THR A 162 -15.736 33.019 52.412 1.00 0.00 C
  2906. ATOM 1176 OG1 THR A 162 -16.171 33.916 53.423 1.00 0.00 O
  2907. ATOM 1177 CG2 THR A 162 -14.247 33.211 52.145 1.00 0.00 C
  2908. ATOM 0 H THR A 162 -16.168 35.187 51.288 1.00 0.00 H new
  2909. ATOM 0 HA THR A 162 -16.319 32.711 50.417 1.00 0.00 H new
  2910. ATOM 0 HB THR A 162 -15.846 32.097 52.691 1.00 0.00 H new
  2911. ATOM 0 HG1 THR A 162 -16.067 33.560 54.177 1.00 0.00 H new
  2912. ATOM 0 HG21 THR A 162 -13.748 33.051 52.962 1.00 0.00 H new
  2913. ATOM 0 HG22 THR A 162 -13.957 32.586 51.462 1.00 0.00 H new
  2914. ATOM 0 HG23 THR A 162 -14.087 34.118 51.841 1.00 0.00 H new
  2915. ATOM 1178 N VAL A 163 -18.232 31.561 51.294 1.00 0.00 N
  2916. ATOM 1179 CA VAL A 163 -19.434 30.814 51.672 1.00 0.00 C
  2917. ATOM 1180 C VAL A 163 -19.033 29.702 52.637 1.00 0.00 C
  2918. ATOM 1181 O VAL A 163 -18.113 28.941 52.307 1.00 0.00 O
  2919. ATOM 1182 CB VAL A 163 -20.049 30.173 50.427 1.00 0.00 C
  2920. ATOM 1183 CG1 VAL A 163 -21.308 29.372 50.756 1.00 0.00 C
  2921. ATOM 1184 CG2 VAL A 163 -20.305 31.187 49.315 1.00 0.00 C
  2922. ATOM 0 H VAL A 163 -17.656 31.072 50.884 1.00 0.00 H new
  2923. ATOM 0 HA VAL A 163 -20.075 31.414 52.085 1.00 0.00 H new
  2924. ATOM 0 HB VAL A 163 -19.389 29.547 50.090 1.00 0.00 H new
  2925. ATOM 0 HG11 VAL A 163 -21.666 28.983 49.943 1.00 0.00 H new
  2926. ATOM 0 HG12 VAL A 163 -21.087 28.665 51.382 1.00 0.00 H new
  2927. ATOM 0 HG13 VAL A 163 -21.971 29.959 51.152 1.00 0.00 H new
  2928. ATOM 0 HG21 VAL A 163 -20.694 30.736 48.549 1.00 0.00 H new
  2929. ATOM 0 HG22 VAL A 163 -20.917 31.869 49.633 1.00 0.00 H new
  2930. ATOM 0 HG23 VAL A 163 -19.467 31.601 49.055 1.00 0.00 H new
  2931. ATOM 1185 N ASP A 164 -19.413 29.866 53.903 1.00 0.00 N
  2932. ATOM 1186 CA ASP A 164 -19.037 28.871 54.920 1.00 0.00 C
  2933. ATOM 1187 C ASP A 164 -19.526 27.456 54.626 1.00 0.00 C
  2934. ATOM 1188 O ASP A 164 -20.580 27.310 53.993 1.00 0.00 O
  2935. ATOM 1189 CB ASP A 164 -19.372 29.291 56.355 1.00 0.00 C
  2936. ATOM 1190 CG ASP A 164 -20.873 29.484 56.574 1.00 0.00 C
  2937. ATOM 1191 OD1 ASP A 164 -21.690 28.767 55.985 1.00 0.00 O
  2938. ATOM 1192 OD2 ASP A 164 -21.241 30.296 57.431 1.00 0.00 O
  2939. ATOM 0 H ASP A 164 -19.878 30.528 54.194 1.00 0.00 H new
  2940. ATOM 0 HA ASP A 164 -18.070 28.843 54.856 1.00 0.00 H new
  2941. ATOM 0 HB2 ASP A 164 -19.042 28.618 56.971 1.00 0.00 H new
  2942. ATOM 0 HB3 ASP A 164 -18.909 30.118 56.563 1.00 0.00 H new
  2943. ATOM 1193 N TYR A 165 -19.024 26.556 55.452 1.00 0.00 N
  2944. ATOM 1194 CA TYR A 165 -19.282 25.116 55.330 1.00 0.00 C
  2945. ATOM 1195 C TYR A 165 -20.763 24.779 55.446 1.00 0.00 C
  2946. ATOM 1196 O TYR A 165 -21.326 24.280 54.464 1.00 0.00 O
  2947. ATOM 1197 CB TYR A 165 -18.498 24.330 56.382 1.00 0.00 C
  2948. ATOM 1198 CG TYR A 165 -18.615 22.822 56.114 1.00 0.00 C
  2949. ATOM 1199 CD1 TYR A 165 -18.267 22.325 54.869 1.00 0.00 C
  2950. ATOM 1200 CD2 TYR A 165 -19.078 21.963 57.100 1.00 0.00 C
  2951. ATOM 1201 CE1 TYR A 165 -18.382 20.960 54.599 1.00 0.00 C
  2952. ATOM 1202 CE2 TYR A 165 -19.192 20.590 56.840 1.00 0.00 C
  2953. ATOM 1203 CZ TYR A 165 -18.844 20.094 55.584 1.00 0.00 C
  2954. ATOM 1204 OH TYR A 165 -18.966 18.748 55.306 1.00 0.00 O
  2955. ATOM 0 H TYR A 165 -18.514 26.759 56.114 1.00 0.00 H new
  2956. ATOM 0 HA TYR A 165 -18.985 24.859 54.443 1.00 0.00 H new
  2957. ATOM 0 HB2 TYR A 165 -17.566 24.597 56.366 1.00 0.00 H new
  2958. ATOM 0 HB3 TYR A 165 -18.837 24.535 57.268 1.00 0.00 H new
  2959. ATOM 0 HD1 TYR A 165 -17.955 22.903 54.210 1.00 0.00 H new
  2960. ATOM 0 HD2 TYR A 165 -19.313 22.298 57.935 1.00 0.00 H new
  2961. ATOM 0 HE1 TYR A 165 -18.150 20.630 53.761 1.00 0.00 H new
  2962. ATOM 0 HE2 TYR A 165 -19.498 20.013 57.502 1.00 0.00 H new
  2963. ATOM 0 HH TYR A 165 -19.253 18.346 55.986 1.00 0.00 H new
  2964. ATOM 1205 N ALA A 166 -21.383 25.507 56.362 1.00 0.00 N
  2965. ATOM 1206 CA ALA A 166 -22.796 25.326 56.722 1.00 0.00 C
  2966. ATOM 1207 C ALA A 166 -23.723 25.504 55.526 1.00 0.00 C
  2967. ATOM 1208 O ALA A 166 -24.289 24.509 55.050 1.00 0.00 O
  2968. ATOM 1209 CB ALA A 166 -23.185 26.323 57.811 1.00 0.00 C
  2969. ATOM 0 H ALA A 166 -20.994 26.134 56.804 1.00 0.00 H new
  2970. ATOM 0 HA ALA A 166 -22.896 24.417 57.045 1.00 0.00 H new
  2971. ATOM 0 HB1 ALA A 166 -24.118 26.199 58.045 1.00 0.00 H new
  2972. ATOM 0 HB2 ALA A 166 -22.633 26.177 58.595 1.00 0.00 H new
  2973. ATOM 0 HB3 ALA A 166 -23.051 27.227 57.485 1.00 0.00 H new
  2974. ATOM 1210 N ILE A 167 -23.349 26.521 54.779 1.00 0.00 N
  2975. ATOM 1211 CA ILE A 167 -24.113 26.903 53.593 1.00 0.00 C
  2976. ATOM 1212 C ILE A 167 -23.649 26.174 52.339 1.00 0.00 C
  2977. ATOM 1213 O ILE A 167 -24.479 25.552 51.670 1.00 0.00 O
  2978. ATOM 1214 CB ILE A 167 -24.045 28.413 53.374 1.00 0.00 C
  2979. ATOM 1215 CG1 ILE A 167 -24.602 29.188 54.565 1.00 0.00 C
  2980. ATOM 1216 CG2 ILE A 167 -24.725 28.836 52.075 1.00 0.00 C
  2981. ATOM 1217 CD1 ILE A 167 -24.519 30.697 54.347 1.00 0.00 C
  2982. ATOM 0 H ILE A 167 -22.657 27.008 54.934 1.00 0.00 H new
  2983. ATOM 0 HA ILE A 167 -25.032 26.641 53.757 1.00 0.00 H new
  2984. ATOM 0 HB ILE A 167 -23.105 28.637 53.294 1.00 0.00 H new
  2985. ATOM 0 HG12 ILE A 167 -25.526 28.933 54.714 1.00 0.00 H new
  2986. ATOM 0 HG13 ILE A 167 -24.109 28.949 55.366 1.00 0.00 H new
  2987. ATOM 0 HG21 ILE A 167 -24.660 29.799 51.974 1.00 0.00 H new
  2988. ATOM 0 HG22 ILE A 167 -24.289 28.402 51.325 1.00 0.00 H new
  2989. ATOM 0 HG23 ILE A 167 -25.659 28.576 52.099 1.00 0.00 H new
  2990. ATOM 0 HD11 ILE A 167 -24.881 31.156 55.121 1.00 0.00 H new
  2991. ATOM 0 HD12 ILE A 167 -23.593 30.956 54.222 1.00 0.00 H new
  2992. ATOM 0 HD13 ILE A 167 -25.031 30.939 53.560 1.00 0.00 H new
  2993. ATOM 1218 N CYS A 168 -22.360 25.894 52.298 1.00 0.00 N
  2994. ATOM 1219 CA CYS A 168 -21.793 25.293 51.084 1.00 0.00 C
  2995. ATOM 1220 C CYS A 168 -22.082 23.799 50.989 1.00 0.00 C
  2996. ATOM 1221 O CYS A 168 -22.354 23.288 49.895 1.00 0.00 O
  2997. ATOM 1222 CB CYS A 168 -20.292 25.542 50.998 1.00 0.00 C
  2998. ATOM 1223 SG CYS A 168 -19.571 25.199 49.380 1.00 0.00 S
  2999. ATOM 0 H CYS A 168 -21.802 26.035 52.937 1.00 0.00 H new
  3000. ATOM 0 HA CYS A 168 -22.228 25.725 50.332 1.00 0.00 H new
  3001. ATOM 0 HB2 CYS A 168 -20.115 26.467 51.229 1.00 0.00 H new
  3002. ATOM 0 HB3 CYS A 168 -19.846 24.993 51.662 1.00 0.00 H new
  3003. ATOM 1224 N SER A 169 -22.463 23.271 52.131 1.00 0.00 N
  3004. ATOM 1225 CA SER A 169 -22.803 21.852 52.207 1.00 0.00 C
  3005. ATOM 1226 C SER A 169 -24.308 21.642 52.122 1.00 0.00 C
  3006. ATOM 1227 O SER A 169 -24.802 20.530 52.340 1.00 0.00 O
  3007. ATOM 1228 CB SER A 169 -22.261 21.222 53.484 1.00 0.00 C
  3008. ATOM 1229 OG SER A 169 -22.870 21.865 54.595 1.00 0.00 O
  3009. ATOM 0 H SER A 169 -22.534 23.703 52.871 1.00 0.00 H new
  3010. ATOM 0 HA SER A 169 -22.387 21.415 51.447 1.00 0.00 H new
  3011. ATOM 0 HB2 SER A 169 -22.452 20.271 53.498 1.00 0.00 H new
  3012. ATOM 0 HB3 SER A 169 -21.297 21.319 53.525 1.00 0.00 H new
  3013. ATOM 0 HG SER A 169 -22.521 22.621 54.707 1.00 0.00 H new
  3014. ATOM 1230 N SER A 170 -24.996 22.713 51.761 1.00 0.00 N
  3015. ATOM 1231 CA SER A 170 -26.441 22.615 51.524 1.00 0.00 C
  3016. ATOM 1232 C SER A 170 -26.720 22.000 50.159 1.00 0.00 C
  3017. ATOM 1233 O SER A 170 -25.831 22.012 49.298 1.00 0.00 O
  3018. ATOM 1234 CB SER A 170 -27.125 23.978 51.596 1.00 0.00 C
  3019. ATOM 1235 OG SER A 170 -26.910 24.550 52.882 1.00 0.00 O
  3020. ATOM 0 H SER A 170 -24.659 23.496 51.647 1.00 0.00 H new
  3021. ATOM 0 HA SER A 170 -26.801 22.049 52.225 1.00 0.00 H new
  3022. ATOM 0 HB2 SER A 170 -26.773 24.564 50.908 1.00 0.00 H new
  3023. ATOM 0 HB3 SER A 170 -28.076 23.883 51.429 1.00 0.00 H new
  3024. ATOM 0 HG SER A 170 -26.154 24.915 52.904 1.00 0.00 H new
  3025. ATOM 1236 N SER A 171A -27.709 21.128 50.167 1.00 0.00 N
  3026. ATOM 1237 CA SER A 171A -28.184 20.450 48.955 1.00 0.00 C
  3027. ATOM 1238 C SER A 171A -28.496 21.434 47.830 1.00 0.00 C
  3028. ATOM 1239 O SER A 171A -28.281 21.121 46.652 1.00 0.00 O
  3029. ATOM 1240 CB SER A 171A -29.428 19.631 49.277 1.00 0.00 C
  3030. ATOM 1241 OG SER A 171A -30.432 20.507 49.774 1.00 0.00 O
  3031. ATOM 0 H SER A 171A -28.135 20.904 50.880 1.00 0.00 H new
  3032. ATOM 0 HA SER A 171A -27.471 19.868 48.648 1.00 0.00 H new
  3033. ATOM 0 HB2 SER A 171A -29.744 19.173 48.483 1.00 0.00 H new
  3034. ATOM 0 HB3 SER A 171A -29.221 18.949 49.935 1.00 0.00 H new
  3035. ATOM 0 HG SER A 171A -31.124 20.067 49.954 1.00 0.00 H new
  3036. ATOM 1242 N SER A 171B -28.775 22.662 48.232 1.00 0.00 N
  3037. ATOM 1243 CA SER A 171B -29.036 23.770 47.306 1.00 0.00 C
  3038. ATOM 1244 C SER A 171B -27.742 24.304 46.702 1.00 0.00 C
  3039. ATOM 1245 O SER A 171B -27.732 24.802 45.569 1.00 0.00 O
  3040. ATOM 1246 CB SER A 171B -29.747 24.903 48.039 1.00 0.00 C
  3041. ATOM 1247 OG SER A 171B -29.990 25.963 47.120 1.00 0.00 O
  3042. ATOM 0 H SER A 171B -28.821 22.887 49.061 1.00 0.00 H new
  3043. ATOM 0 HA SER A 171B -29.597 23.432 46.590 1.00 0.00 H new
  3044. ATOM 0 HB2 SER A 171B -30.583 24.587 48.416 1.00 0.00 H new
  3045. ATOM 0 HB3 SER A 171B -29.204 25.218 48.779 1.00 0.00 H new
  3046. ATOM 0 HG SER A 171B -30.383 26.592 47.515 1.00 0.00 H new
  3047. ATOM 1248 N TYR A 171 -26.658 23.946 47.373 1.00 0.00 N
  3048. ATOM 1249 CA TYR A 171 -25.294 24.307 46.957 1.00 0.00 C
  3049. ATOM 1250 C TYR A 171 -24.521 23.089 46.448 1.00 0.00 C
  3050. ATOM 1251 O TYR A 171 -25.109 22.291 45.708 1.00 0.00 O
  3051. ATOM 1252 CB TYR A 171 -24.523 25.022 48.073 1.00 0.00 C
  3052. ATOM 1253 CG TYR A 171 -24.910 26.504 48.243 1.00 0.00 C
  3053. ATOM 1254 CD1 TYR A 171 -26.158 26.860 48.734 1.00 0.00 C
  3054. ATOM 1255 CD2 TYR A 171 -23.984 27.491 47.938 1.00 0.00 C
  3055. ATOM 1256 CE1 TYR A 171 -26.499 28.208 48.892 1.00 0.00 C
  3056. ATOM 1257 CE2 TYR A 171 -24.315 28.843 48.095 1.00 0.00 C
  3057. ATOM 1258 CZ TYR A 171 -25.575 29.201 48.570 1.00 0.00 C
  3058. ATOM 1259 OH TYR A 171 -25.995 30.511 48.468 1.00 0.00 O
  3059. ATOM 0 H TYR A 171 -26.686 23.479 48.095 1.00 0.00 H new
  3060. ATOM 0 HA TYR A 171 -25.382 24.932 46.220 1.00 0.00 H new
  3061. ATOM 0 HB2 TYR A 171 -24.677 24.558 48.911 1.00 0.00 H new
  3062. ATOM 0 HB3 TYR A 171 -23.573 24.963 47.887 1.00 0.00 H new
  3063. ATOM 0 HD1 TYR A 171 -26.772 26.199 48.960 1.00 0.00 H new
  3064. ATOM 0 HD2 TYR A 171 -23.140 27.254 47.628 1.00 0.00 H new
  3065. ATOM 0 HE1 TYR A 171 -27.341 28.441 49.211 1.00 0.00 H new
  3066. ATOM 0 HE2 TYR A 171 -23.694 29.502 47.882 1.00 0.00 H new
  3067. ATOM 0 HH TYR A 171 -25.341 31.000 48.271 1.00 0.00 H new
  3068. ATOM 1260 N TRP A 172 -23.501 22.709 47.203 1.00 0.00 N
  3069. ATOM 1261 CA TRP A 172 -22.639 21.578 46.808 1.00 0.00 C
  3070. ATOM 1262 C TRP A 172 -22.999 20.231 47.429 1.00 0.00 C
  3071. ATOM 1263 O TRP A 172 -22.483 19.192 46.994 1.00 0.00 O
  3072. ATOM 1264 CB TRP A 172 -21.160 21.869 47.058 1.00 0.00 C
  3073. ATOM 1265 CG TRP A 172 -20.529 22.687 45.922 1.00 0.00 C
  3074. ATOM 1266 CD1 TRP A 172 -20.212 23.996 45.869 1.00 0.00 C
  3075. ATOM 1267 CD2 TRP A 172 -20.134 22.170 44.689 1.00 0.00 C
  3076. ATOM 1268 NE1 TRP A 172 -19.646 24.304 44.647 1.00 0.00 N
  3077. ATOM 1269 CE2 TRP A 172 -19.592 23.243 43.944 1.00 0.00 C
  3078. ATOM 1270 CE3 TRP A 172 -20.199 20.884 44.174 1.00 0.00 C
  3079. ATOM 1271 CZ2 TRP A 172 -19.092 23.096 42.661 1.00 0.00 C
  3080. ATOM 1272 CZ3 TRP A 172 -19.700 20.728 42.875 1.00 0.00 C
  3081. ATOM 1273 CH2 TRP A 172 -19.164 21.797 42.144 1.00 0.00 C
  3082. ATOM 0 H TRP A 172 -23.283 23.084 47.946 1.00 0.00 H new
  3083. ATOM 0 HA TRP A 172 -22.807 21.494 45.856 1.00 0.00 H new
  3084. ATOM 0 HB2 TRP A 172 -21.064 22.352 47.894 1.00 0.00 H new
  3085. ATOM 0 HB3 TRP A 172 -20.680 21.032 47.157 1.00 0.00 H new
  3086. ATOM 0 HD1 TRP A 172 -20.354 24.605 46.557 1.00 0.00 H new
  3087. ATOM 0 HE1 TRP A 172 -19.375 25.083 44.402 1.00 0.00 H new
  3088. ATOM 0 HE3 TRP A 172 -20.551 20.173 44.659 1.00 0.00 H new
  3089. ATOM 0 HZ2 TRP A 172 -18.735 23.807 42.179 1.00 0.00 H new
  3090. ATOM 0 HZ3 TRP A 172 -19.725 19.885 42.483 1.00 0.00 H new
  3091. ATOM 0 HH2 TRP A 172 -18.845 21.638 41.285 1.00 0.00 H new
  3092. ATOM 1274 N GLY A 173 -23.670 20.293 48.564 1.00 0.00 N
  3093. ATOM 1275 CA GLY A 173 -24.036 19.064 49.276 1.00 0.00 C
  3094. ATOM 1276 C GLY A 173 -22.850 18.467 50.029 1.00 0.00 C
  3095. ATOM 1277 O GLY A 173 -21.946 19.208 50.431 1.00 0.00 O
  3096. ATOM 0 H GLY A 173 -23.924 21.022 48.942 1.00 0.00 H new
  3097. ATOM 0 HA2 GLY A 173 -24.753 19.254 49.901 1.00 0.00 H new
  3098. ATOM 0 HA3 GLY A 173 -24.377 18.413 48.643 1.00 0.00 H new
  3099. ATOM 1278 N SER A 174 -22.686 17.173 49.871 1.00 0.00 N
  3100. ATOM 1279 CA SER A 174 -21.626 16.457 50.588 1.00 0.00 C
  3101. ATOM 1280 C SER A 174 -20.326 16.376 49.797 1.00 0.00 C
  3102. ATOM 1281 O SER A 174 -19.444 15.587 50.154 1.00 0.00 O
  3103. ATOM 1282 CB SER A 174 -22.091 15.045 50.920 1.00 0.00 C
  3104. ATOM 1283 OG SER A 174 -22.331 14.354 49.700 1.00 0.00 O
  3105. ATOM 0 H SER A 174 -23.170 16.681 49.358 1.00 0.00 H new
  3106. ATOM 0 HA SER A 174 -21.447 16.961 51.397 1.00 0.00 H new
  3107. ATOM 0 HB2 SER A 174 -21.418 14.582 51.443 1.00 0.00 H new
  3108. ATOM 0 HB3 SER A 174 -22.898 15.073 51.457 1.00 0.00 H new
  3109. ATOM 0 HG SER A 174 -22.587 13.572 49.867 1.00 0.00 H new
  3110. ATOM 1284 N THR A 175 -20.362 16.958 48.611 1.00 0.00 N
  3111. ATOM 1285 CA THR A 175 -19.186 16.976 47.726 1.00 0.00 C
  3112. ATOM 1286 C THR A 175 -18.035 17.767 48.338 1.00 0.00 C
  3113. ATOM 1287 O THR A 175 -16.885 17.308 48.330 1.00 0.00 O
  3114. ATOM 1288 CB THR A 175 -19.561 17.575 46.372 1.00 0.00 C
  3115. ATOM 1289 OG1 THR A 175 -20.599 16.791 45.795 1.00 0.00 O
  3116. ATOM 1290 CG2 THR A 175 -18.377 17.634 45.407 1.00 0.00 C
  3117. ATOM 0 H THR A 175 -21.055 17.352 48.290 1.00 0.00 H new
  3118. ATOM 0 HA THR A 175 -18.891 16.060 47.608 1.00 0.00 H new
  3119. ATOM 0 HB THR A 175 -19.854 18.487 46.524 1.00 0.00 H new
  3120. ATOM 0 HG1 THR A 175 -20.813 17.114 45.050 1.00 0.00 H new
  3121. ATOM 0 HG21 THR A 175 -18.665 18.020 44.565 1.00 0.00 H new
  3122. ATOM 0 HG22 THR A 175 -17.674 18.182 45.790 1.00 0.00 H new
  3123. ATOM 0 HG23 THR A 175 -18.040 16.738 45.253 1.00 0.00 H new
  3124. ATOM 1291 N VAL A 176 -18.442 18.695 49.181 1.00 0.00 N
  3125. ATOM 1292 CA VAL A 176 -17.505 19.585 49.870 1.00 0.00 C
  3126. ATOM 1293 C VAL A 176 -17.271 19.175 51.321 1.00 0.00 C
  3127. ATOM 1294 O VAL A 176 -18.183 18.620 51.948 1.00 0.00 O
  3128. ATOM 1295 CB VAL A 176 -17.981 21.037 49.764 1.00 0.00 C
  3129. ATOM 1296 CG1 VAL A 176 -19.464 21.199 50.076 1.00 0.00 C
  3130. ATOM 1297 CG2 VAL A 176 -17.115 22.028 50.538 1.00 0.00 C
  3131. ATOM 0 H VAL A 176 -19.268 18.834 49.376 1.00 0.00 H new
  3132. ATOM 0 HA VAL A 176 -16.646 19.508 49.427 1.00 0.00 H new
  3133. ATOM 0 HB VAL A 176 -17.867 21.268 48.829 1.00 0.00 H new
  3134. ATOM 0 HG11 VAL A 176 -19.712 22.133 49.995 1.00 0.00 H new
  3135. ATOM 0 HG12 VAL A 176 -19.986 20.671 49.452 1.00 0.00 H new
  3136. ATOM 0 HG13 VAL A 176 -19.640 20.896 50.981 1.00 0.00 H new
  3137. ATOM 0 HG21 VAL A 176 -17.471 22.924 50.428 1.00 0.00 H new
  3138. ATOM 0 HG22 VAL A 176 -17.116 21.793 51.479 1.00 0.00 H new
  3139. ATOM 0 HG23 VAL A 176 -16.207 21.998 50.199 1.00 0.00 H new
  3140. ATOM 1298 N LYS A 177 -15.993 18.978 51.596 1.00 0.00 N
  3141. ATOM 1299 CA LYS A 177 -15.473 18.607 52.917 1.00 0.00 C
  3142. ATOM 1300 C LYS A 177 -15.038 19.845 53.695 1.00 0.00 C
  3143. ATOM 1301 O LYS A 177 -14.907 20.922 53.102 1.00 0.00 O
  3144. ATOM 1302 CB LYS A 177 -14.252 17.709 52.735 1.00 0.00 C
  3145. ATOM 1303 CG LYS A 177 -14.542 16.524 51.818 1.00 0.00 C
  3146. ATOM 1304 CD LYS A 177 -15.591 15.578 52.396 1.00 0.00 C
  3147. ATOM 1305 CE LYS A 177 -16.040 14.546 51.366 1.00 0.00 C
  3148. ATOM 1306 NZ LYS A 177 -16.636 15.234 50.212 1.00 0.00 N
  3149. ATOM 0 H LYS A 177 -15.376 19.058 51.002 1.00 0.00 H new
  3150. ATOM 0 HA LYS A 177 -16.175 18.150 53.406 1.00 0.00 H new
  3151. ATOM 0 HB2 LYS A 177 -13.521 18.230 52.367 1.00 0.00 H new
  3152. ATOM 0 HB3 LYS A 177 -13.960 17.383 53.601 1.00 0.00 H new
  3153. ATOM 0 HG2 LYS A 177 -14.846 16.852 50.957 1.00 0.00 H new
  3154. ATOM 0 HG3 LYS A 177 -13.721 16.033 51.660 1.00 0.00 H new
  3155. ATOM 0 HD2 LYS A 177 -15.227 15.125 53.173 1.00 0.00 H new
  3156. ATOM 0 HD3 LYS A 177 -16.358 16.089 52.699 1.00 0.00 H new
  3157. ATOM 0 HE2 LYS A 177 -15.284 14.010 51.080 1.00 0.00 H new
  3158. ATOM 0 HE3 LYS A 177 -16.685 13.939 51.762 1.00 0.00 H new
  3159. ATOM 0 HZ1 LYS A 177 -17.418 14.859 50.014 1.00 0.00 H new
  3160. ATOM 0 HZ2 LYS A 177 -16.761 16.093 50.410 1.00 0.00 H new
  3161. ATOM 0 HZ3 LYS A 177 -16.090 15.168 49.512 1.00 0.00 H new
  3162. ATOM 1307 N ASN A 178 -15.072 19.729 55.015 1.00 0.00 N
  3163. ATOM 1308 CA ASN A 178 -14.702 20.817 55.937 1.00 0.00 C
  3164. ATOM 1309 C ASN A 178 -13.307 21.390 55.681 1.00 0.00 C
  3165. ATOM 1310 O ASN A 178 -13.135 22.616 55.701 1.00 0.00 O
  3166. ATOM 1311 CB ASN A 178 -14.808 20.338 57.383 1.00 0.00 C
  3167. ATOM 1312 CG ASN A 178 -14.492 21.508 58.309 1.00 0.00 C
  3168. ATOM 1313 OD1 ASN A 178 -13.609 21.401 59.170 1.00 0.00 O
  3169. ATOM 1314 ND2 ASN A 178 -14.977 22.666 57.893 1.00 0.00 N
  3170. ATOM 0 H ASN A 178 -15.314 19.007 55.415 1.00 0.00 H new
  3171. ATOM 0 HA ASN A 178 -15.331 21.537 55.773 1.00 0.00 H new
  3172. ATOM 0 HB2 ASN A 178 -15.699 20.000 57.561 1.00 0.00 H new
  3173. ATOM 0 HB3 ASN A 178 -14.190 19.607 57.541 1.00 0.00 H new
  3174. ATOM 0 HD21 ASN A 178 -14.678 23.401 58.224 1.00 0.00 H new
  3175. ATOM 0 HD22 ASN A 178 -15.591 22.684 57.291 1.00 0.00 H new
  3176. ATOM 1315 N SER A 179 -12.540 20.574 54.978 1.00 0.00 N
  3177. ATOM 1316 CA SER A 179 -11.167 20.884 54.561 1.00 0.00 C
  3178. ATOM 1317 C SER A 179 -11.133 21.759 53.311 1.00 0.00 C
  3179. ATOM 1318 O SER A 179 -10.144 21.731 52.567 1.00 0.00 O
  3180. ATOM 1319 CB SER A 179 -10.436 19.584 54.245 1.00 0.00 C
  3181. ATOM 1320 OG SER A 179 -11.085 18.961 53.141 1.00 0.00 O
  3182. ATOM 0 H SER A 179 -12.805 19.798 54.718 1.00 0.00 H new
  3183. ATOM 0 HA SER A 179 -10.742 21.365 55.288 1.00 0.00 H new
  3184. ATOM 0 HB2 SER A 179 -9.506 19.762 54.033 1.00 0.00 H new
  3185. ATOM 0 HB3 SER A 179 -10.444 18.996 55.017 1.00 0.00 H new
  3186. ATOM 0 HG SER A 179 -10.536 18.862 52.513 1.00 0.00 H new
  3187. ATOM 1321 N MET A 180 -12.318 22.207 52.929 1.00 0.00 N
  3188. ATOM 1322 CA MET A 180 -12.475 23.077 51.755 1.00 0.00 C
  3189. ATOM 1323 C MET A 180 -13.059 24.448 52.090 1.00 0.00 C
  3190. ATOM 1324 O MET A 180 -13.528 24.660 53.215 1.00 0.00 O
  3191. ATOM 1325 CB MET A 180 -13.366 22.412 50.707 1.00 0.00 C
  3192. ATOM 1326 CG MET A 180 -12.834 21.056 50.249 1.00 0.00 C
  3193. ATOM 1327 SD MET A 180 -13.867 20.201 49.039 1.00 0.00 S
  3194. ATOM 1328 CE MET A 180 -12.923 18.674 48.881 1.00 0.00 C
  3195. ATOM 0 H MET A 180 -13.054 22.022 53.334 1.00 0.00 H new
  3196. ATOM 0 HA MET A 180 -11.579 23.212 51.408 1.00 0.00 H new
  3197. ATOM 0 HB2 MET A 180 -14.257 22.298 51.072 1.00 0.00 H new
  3198. ATOM 0 HB3 MET A 180 -13.447 22.999 49.939 1.00 0.00 H new
  3199. ATOM 0 HG2 MET A 180 -11.951 21.182 49.869 1.00 0.00 H new
  3200. ATOM 0 HG3 MET A 180 -12.730 20.485 51.026 1.00 0.00 H new
  3201. ATOM 0 HE1 MET A 180 -12.716 18.516 47.947 1.00 0.00 H new
  3202. ATOM 0 HE2 MET A 180 -12.098 18.749 49.386 1.00 0.00 H new
  3203. ATOM 0 HE3 MET A 180 -13.446 17.933 49.225 1.00 0.00 H new
  3204. ATOM 1329 N VAL A 181 -12.736 25.405 51.232 1.00 0.00 N
  3205. ATOM 1330 CA VAL A 181 -13.268 26.775 51.309 1.00 0.00 C
  3206. ATOM 1331 C VAL A 181 -14.093 27.086 50.063 1.00 0.00 C
  3207. ATOM 1332 O VAL A 181 -13.805 26.522 49.001 1.00 0.00 O
  3208. ATOM 1333 CB VAL A 181 -12.119 27.786 51.384 1.00 0.00 C
  3209. ATOM 1334 CG1 VAL A 181 -12.614 29.218 51.584 1.00 0.00 C
  3210. ATOM 1335 CG2 VAL A 181 -11.093 27.421 52.450 1.00 0.00 C
  3211. ATOM 0 H VAL A 181 -12.194 25.283 50.576 1.00 0.00 H new
  3212. ATOM 0 HA VAL A 181 -13.821 26.840 52.103 1.00 0.00 H new
  3213. ATOM 0 HB VAL A 181 -11.677 27.744 50.522 1.00 0.00 H new
  3214. ATOM 0 HG11 VAL A 181 -11.855 29.820 51.625 1.00 0.00 H new
  3215. ATOM 0 HG12 VAL A 181 -13.186 29.470 50.842 1.00 0.00 H new
  3216. ATOM 0 HG13 VAL A 181 -13.116 29.274 52.412 1.00 0.00 H new
  3217. ATOM 0 HG21 VAL A 181 -10.387 28.086 52.461 1.00 0.00 H new
  3218. ATOM 0 HG22 VAL A 181 -11.524 27.393 53.318 1.00 0.00 H new
  3219. ATOM 0 HG23 VAL A 181 -10.714 26.551 52.250 1.00 0.00 H new
  3220. ATOM 1336 N CYS A 182 -15.283 27.623 50.274 1.00 0.00 N
  3221. ATOM 1337 CA CYS A 182 -16.116 28.036 49.141 1.00 0.00 C
  3222. ATOM 1338 C CYS A 182 -16.202 29.554 49.027 1.00 0.00 C
  3223. ATOM 1339 O CYS A 182 -16.042 30.238 50.044 1.00 0.00 O
  3224. ATOM 1340 CB CYS A 182 -17.521 27.461 49.260 1.00 0.00 C
  3225. ATOM 1341 SG CYS A 182 -17.603 25.680 49.529 1.00 0.00 S
  3226. ATOM 0 H CYS A 182 -15.629 27.758 51.050 1.00 0.00 H new
  3227. ATOM 0 HA CYS A 182 -15.692 27.689 48.340 1.00 0.00 H new
  3228. ATOM 0 HB2 CYS A 182 -17.976 27.905 49.993 1.00 0.00 H new
  3229. ATOM 0 HB3 CYS A 182 -18.012 27.674 48.451 1.00 0.00 H new
  3230. ATOM 1342 N ALA A 183 -15.972 30.009 47.807 1.00 0.00 N
  3231. ATOM 1343 CA ALA A 183 -16.038 31.438 47.483 1.00 0.00 C
  3232. ATOM 1344 C ALA A 183 -16.749 31.739 46.166 1.00 0.00 C
  3233. ATOM 1345 O ALA A 183 -16.548 31.036 45.167 1.00 0.00 O
  3234. ATOM 1346 CB ALA A 183 -14.641 32.053 47.472 1.00 0.00 C
  3235. ATOM 0 H ALA A 183 -15.773 29.505 47.139 1.00 0.00 H new
  3236. ATOM 0 HA ALA A 183 -16.572 31.842 48.184 1.00 0.00 H new
  3237. ATOM 0 HB1 ALA A 183 -14.704 32.997 47.256 1.00 0.00 H new
  3238. ATOM 0 HB2 ALA A 183 -14.234 31.948 48.346 1.00 0.00 H new
  3239. ATOM 0 HB3 ALA A 183 -14.095 31.606 46.806 1.00 0.00 H new
  3240. ATOM 1347 N GLY A 184 -17.661 32.698 46.239 1.00 0.00 N
  3241. ATOM 1348 CA GLY A 184 -18.428 33.162 45.073 1.00 0.00 C
  3242. ATOM 1349 C GLY A 184 -19.789 32.482 44.942 1.00 0.00 C
  3243. ATOM 1350 O GLY A 184 -20.593 32.517 45.883 1.00 0.00 O
  3244. ATOM 0 H GLY A 184 -17.859 33.106 46.970 1.00 0.00 H new
  3245. ATOM 0 HA2 GLY A 184 -18.557 34.121 45.138 1.00 0.00 H new
  3246. ATOM 0 HA3 GLY A 184 -17.912 32.999 44.268 1.00 0.00 H new
  3247. ATOM 1351 N GLY A 185 -20.115 32.128 43.711 1.00 0.00 N
  3248. ATOM 1352 CA GLY A 185 -21.363 31.420 43.398 1.00 0.00 C
  3249. ATOM 1353 C GLY A 185 -22.471 32.352 42.920 1.00 0.00 C
  3250. ATOM 1354 O GLY A 185 -23.654 31.995 43.007 1.00 0.00 O
  3251. ATOM 0 H GLY A 185 -19.622 32.288 43.025 1.00 0.00 H new
  3252. ATOM 0 HA2 GLY A 185 -21.189 30.755 42.714 1.00 0.00 H new
  3253. ATOM 0 HA3 GLY A 185 -21.666 30.943 44.187 1.00 0.00 H new
  3254. ATOM 1355 N ASP A 186 -22.095 33.613 42.752 1.00 0.00 N
  3255. ATOM 1356 CA ASP A 186 -23.022 34.658 42.284 1.00 0.00 C
  3256. ATOM 1357 C ASP A 186 -23.513 34.430 40.856 1.00 0.00 C
  3257. ATOM 1358 O ASP A 186 -24.315 35.216 40.338 1.00 0.00 O
  3258. ATOM 1359 CB ASP A 186 -22.418 36.060 42.420 1.00 0.00 C
  3259. ATOM 1360 CG ASP A 186 -21.202 36.261 41.511 1.00 0.00 C
  3260. ATOM 1361 OD1 ASP A 186 -20.694 37.388 41.452 1.00 0.00 O
  3261. ATOM 1362 OD2 ASP A 186 -20.615 35.278 41.042 1.00 0.00 O
  3262. ATOM 0 H ASP A 186 -21.297 33.895 42.904 1.00 0.00 H new
  3263. ATOM 0 HA ASP A 186 -23.795 34.596 42.866 1.00 0.00 H new
  3264. ATOM 0 HB2 ASP A 186 -23.093 36.723 42.205 1.00 0.00 H new
  3265. ATOM 0 HB3 ASP A 186 -22.158 36.209 43.342 1.00 0.00 H new
  3266. ATOM 1363 N GLY A 187 -22.781 33.573 40.173 1.00 0.00 N
  3267. ATOM 1364 CA GLY A 187 -23.098 33.207 38.788 1.00 0.00 C
  3268. ATOM 1365 C GLY A 187 -22.420 34.121 37.774 1.00 0.00 C
  3269. ATOM 1366 O GLY A 187 -22.666 33.997 36.567 1.00 0.00 O
  3270. ATOM 0 H GLY A 187 -22.084 33.181 40.490 1.00 0.00 H new
  3271. ATOM 0 HA2 GLY A 187 -22.823 32.291 38.628 1.00 0.00 H new
  3272. ATOM 0 HA3 GLY A 187 -24.059 33.242 38.659 1.00 0.00 H new
  3273. ATOM 1367 N VAL A 188 -21.808 35.171 38.293 1.00 0.00 N
  3274. ATOM 1368 CA VAL A 188 -21.107 36.134 37.432 1.00 0.00 C
  3275. ATOM 1369 C VAL A 188 -19.592 35.969 37.487 1.00 0.00 C
  3276. ATOM 1370 O VAL A 188 -18.954 35.699 36.461 1.00 0.00 O
  3277. ATOM 1371 CB VAL A 188 -21.482 37.562 37.823 1.00 0.00 C
  3278. ATOM 1372 CG1 VAL A 188 -20.667 38.606 37.060 1.00 0.00 C
  3279. ATOM 1373 CG2 VAL A 188 -22.983 37.811 37.692 1.00 0.00 C
  3280. ATOM 0 H VAL A 188 -21.781 35.352 39.133 1.00 0.00 H new
  3281. ATOM 0 HA VAL A 188 -21.388 35.956 36.521 1.00 0.00 H new
  3282. ATOM 0 HB VAL A 188 -21.254 37.661 38.761 1.00 0.00 H new
  3283. ATOM 0 HG11 VAL A 188 -20.937 39.495 37.339 1.00 0.00 H new
  3284. ATOM 0 HG12 VAL A 188 -19.724 38.481 37.248 1.00 0.00 H new
  3285. ATOM 0 HG13 VAL A 188 -20.822 38.505 36.108 1.00 0.00 H new
  3286. ATOM 0 HG21 VAL A 188 -23.183 38.725 37.948 1.00 0.00 H new
  3287. ATOM 0 HG22 VAL A 188 -23.256 37.666 36.773 1.00 0.00 H new
  3288. ATOM 0 HG23 VAL A 188 -23.464 37.201 38.272 1.00 0.00 H new
  3289. ATOM 1374 N ARG A 188A -19.127 35.782 38.709 1.00 0.00 N
  3290. ATOM 1375 CA ARG A 188A -17.697 35.653 39.001 1.00 0.00 C
  3291. ATOM 1376 C ARG A 188A -17.326 34.281 39.553 1.00 0.00 C
  3292. ATOM 1377 O ARG A 188A -17.993 33.786 40.471 1.00 0.00 O
  3293. ATOM 1378 CB ARG A 188A -17.294 36.715 40.018 1.00 0.00 C
  3294. ATOM 1379 CG ARG A 188A -17.497 38.129 39.484 1.00 0.00 C
  3295. ATOM 1380 CD ARG A 188A -17.141 39.183 40.528 1.00 0.00 C
  3296. ATOM 1381 NE ARG A 188A -18.101 39.137 41.639 1.00 0.00 N
  3297. ATOM 1382 CZ ARG A 188A -18.520 40.232 42.254 1.00 0.00 C
  3298. ATOM 1383 NH1 ARG A 188A -19.413 40.116 43.224 1.00 0.00 N
  3299. ATOM 1384 NH2 ARG A 188A -17.758 41.315 42.212 1.00 0.00 N
  3300. ATOM 0 H ARG A 188A -19.631 35.725 39.404 1.00 0.00 H new
  3301. ATOM 0 HA ARG A 188A -17.224 35.769 38.162 1.00 0.00 H new
  3302. ATOM 0 HB2 ARG A 188A -17.815 36.599 40.828 1.00 0.00 H new
  3303. ATOM 0 HB3 ARG A 188A -16.363 36.593 40.259 1.00 0.00 H new
  3304. ATOM 0 HG2 ARG A 188A -16.950 38.258 38.694 1.00 0.00 H new
  3305. ATOM 0 HG3 ARG A 188A -18.421 38.243 39.211 1.00 0.00 H new
  3306. ATOM 0 HD2 ARG A 188A -16.243 39.029 40.861 1.00 0.00 H new
  3307. ATOM 0 HD3 ARG A 188A -17.146 40.064 40.123 1.00 0.00 H new
  3308. ATOM 0 HE ARG A 188A -18.401 38.374 41.898 1.00 0.00 H new
  3309. ATOM 0 HH11 ARG A 188A -19.710 39.340 43.444 1.00 0.00 H new
  3310. ATOM 0 HH12 ARG A 188A -19.696 40.817 43.634 1.00 0.00 H new
  3311. ATOM 0 HH21 ARG A 188A -17.008 41.297 41.791 1.00 0.00 H new
  3312. ATOM 0 HH22 ARG A 188A -18.013 42.036 42.605 1.00 0.00 H new
  3313. ATOM 1385 N SER A 189 -16.204 33.765 39.069 1.00 0.00 N
  3314. ATOM 1386 CA SER A 189 -15.667 32.479 39.535 1.00 0.00 C
  3315. ATOM 1387 C SER A 189 -14.255 32.200 39.034 1.00 0.00 C
  3316. ATOM 1388 O SER A 189 -13.799 32.852 38.087 1.00 0.00 O
  3317. ATOM 1389 CB SER A 189 -16.539 31.330 39.035 1.00 0.00 C
  3318. ATOM 1390 OG SER A 189 -16.363 31.196 37.628 1.00 0.00 O
  3319. ATOM 0 H SER A 189 -15.728 34.145 38.462 1.00 0.00 H new
  3320. ATOM 0 HA SER A 189 -15.657 32.539 40.503 1.00 0.00 H new
  3321. ATOM 0 HB2 SER A 189 -16.296 30.505 39.484 1.00 0.00 H new
  3322. ATOM 0 HB3 SER A 189 -17.471 31.502 39.242 1.00 0.00 H new
  3323. ATOM 0 HG SER A 189 -15.755 30.637 37.473 1.00 0.00 H new
  3324. ATOM 1391 N GLY A 190 -13.882 30.966 39.316 1.00 0.00 N
  3325. ATOM 1392 CA GLY A 190 -12.648 30.346 38.829 1.00 0.00 C
  3326. ATOM 1393 C GLY A 190 -12.992 29.379 37.702 1.00 0.00 C
  3327. ATOM 1394 O GLY A 190 -14.180 29.102 37.496 1.00 0.00 O
  3328. ATOM 0 H GLY A 190 -14.350 30.443 39.812 1.00 0.00 H new
  3329. ATOM 0 HA2 GLY A 190 -12.034 31.026 38.511 1.00 0.00 H new
  3330. ATOM 0 HA3 GLY A 190 -12.202 29.875 39.550 1.00 0.00 H new
  3331. ATOM 1395 N CYS A 191 -12.034 29.175 36.816 1.00 0.00 N
  3332. ATOM 1396 CA CYS A 191 -12.243 28.329 35.635 1.00 0.00 C
  3333. ATOM 1397 C CYS A 191 -10.970 27.571 35.261 1.00 0.00 C
  3334. ATOM 1398 O CYS A 191 -10.039 27.548 36.078 1.00 0.00 O
  3335. ATOM 1399 CB CYS A 191 -12.684 29.247 34.494 1.00 0.00 C
  3336. ATOM 1400 SG CYS A 191 -13.863 28.568 33.306 1.00 0.00 S
  3337. ATOM 0 H CYS A 191 -11.247 29.516 36.873 1.00 0.00 H new
  3338. ATOM 0 HA CYS A 191 -12.920 27.659 35.818 1.00 0.00 H new
  3339. ATOM 0 HB2 CYS A 191 -13.074 30.046 34.883 1.00 0.00 H new
  3340. ATOM 0 HB3 CYS A 191 -11.892 29.526 34.008 1.00 0.00 H new
  3341. ATOM 1401 N GLN A 192 -11.130 26.644 34.322 1.00 0.00 N
  3342. ATOM 1402 CA GLN A 192 -10.012 25.856 33.784 1.00 0.00 C
  3343. ATOM 1403 C GLN A 192 -8.750 26.675 33.523 1.00 0.00 C
  3344. ATOM 1404 O GLN A 192 -8.804 27.692 32.822 1.00 0.00 O
  3345. ATOM 1405 CB GLN A 192 -10.397 25.091 32.518 1.00 0.00 C
  3346. ATOM 1406 CG GLN A 192 -11.297 23.884 32.784 1.00 0.00 C
  3347. ATOM 1407 CD GLN A 192 -12.677 24.332 33.254 1.00 0.00 C
  3348. ATOM 1408 OE1 GLN A 192 -13.237 25.276 32.683 1.00 0.00 O
  3349. ATOM 1409 NE2 GLN A 192 -13.328 23.419 33.958 1.00 0.00 N
  3350. ATOM 0 H GLN A 192 -11.892 26.450 33.974 1.00 0.00 H new
  3351. ATOM 0 HA GLN A 192 -9.805 25.221 34.487 1.00 0.00 H new
  3352. ATOM 0 HB2 GLN A 192 -10.850 25.695 31.909 1.00 0.00 H new
  3353. ATOM 0 HB3 GLN A 192 -9.590 24.791 32.072 1.00 0.00 H new
  3354. ATOM 0 HG2 GLN A 192 -11.382 23.354 31.976 1.00 0.00 H new
  3355. ATOM 0 HG3 GLN A 192 -10.891 23.314 33.456 1.00 0.00 H new
  3356. ATOM 0 HE21 GLN A 192 -12.896 22.780 34.338 1.00 0.00 H new
  3357. ATOM 0 HE22 GLN A 192 -14.183 23.465 34.035 1.00 0.00 H new
  3358. ATOM 1410 N GLY A 193 -7.783 26.436 34.385 1.00 0.00 N
  3359. ATOM 1411 CA GLY A 193 -6.474 27.089 34.302 1.00 0.00 C
  3360. ATOM 1412 C GLY A 193 -6.078 27.771 35.606 1.00 0.00 C
  3361. ATOM 1413 O GLY A 193 -4.928 28.208 35.746 1.00 0.00 O
  3362. ATOM 0 H GLY A 193 -7.859 25.888 35.043 1.00 0.00 H new
  3363. ATOM 0 HA2 GLY A 193 -5.802 26.430 34.068 1.00 0.00 H new
  3364. ATOM 0 HA3 GLY A 193 -6.488 27.746 33.588 1.00 0.00 H new
  3365. ATOM 1414 N ASP A 194 -7.101 28.152 36.356 1.00 0.00 N
  3366. ATOM 1415 CA ASP A 194 -6.895 28.821 37.648 1.00 0.00 C
  3367. ATOM 1416 C ASP A 194 -6.380 27.891 38.741 1.00 0.00 C
  3368. ATOM 1417 O ASP A 194 -6.062 28.378 39.835 1.00 0.00 O
  3369. ATOM 1418 CB ASP A 194 -8.175 29.500 38.130 1.00 0.00 C
  3370. ATOM 1419 CG ASP A 194 -8.533 30.633 37.174 1.00 0.00 C
  3371. ATOM 1420 OD1 ASP A 194 -7.627 31.352 36.737 1.00 0.00 O
  3372. ATOM 1421 OD2 ASP A 194 -9.689 30.723 36.748 1.00 0.00 O
  3373. ATOM 0 H ASP A 194 -7.926 28.036 36.141 1.00 0.00 H new
  3374. ATOM 0 HA ASP A 194 -6.208 29.486 37.484 1.00 0.00 H new
  3375. ATOM 0 HB2 ASP A 194 -8.899 28.856 38.171 1.00 0.00 H new
  3376. ATOM 0 HB3 ASP A 194 -8.052 29.847 39.028 1.00 0.00 H new
  3377. ATOM 1422 N SER A 195 -6.651 26.604 38.533 1.00 0.00 N
  3378. ATOM 1423 CA SER A 195 -6.289 25.523 39.474 1.00 0.00 C
  3379. ATOM 1424 C SER A 195 -4.940 25.680 40.163 1.00 0.00 C
  3380. ATOM 1425 O SER A 195 -3.922 25.926 39.513 1.00 0.00 O
  3381. ATOM 1426 CB SER A 195 -6.335 24.137 38.837 1.00 0.00 C
  3382. ATOM 1427 OG SER A 195 -7.669 23.561 38.722 1.00 0.00 O
  3383. ATOM 0 H SER A 195 -7.058 26.322 37.830 1.00 0.00 H new
  3384. ATOM 0 HA SER A 195 -6.978 25.606 40.152 1.00 0.00 H new
  3385. ATOM 0 HB2 SER A 195 -5.941 24.188 37.952 1.00 0.00 H new
  3386. ATOM 0 HB3 SER A 195 -5.781 23.536 39.359 1.00 0.00 H new
  3387. ATOM 1428 N GLY A 196 -4.936 25.352 41.434 1.00 0.00 N
  3388. ATOM 1429 CA GLY A 196 -3.712 25.365 42.233 1.00 0.00 C
  3389. ATOM 1430 C GLY A 196 -3.349 26.759 42.719 1.00 0.00 C
  3390. ATOM 1431 O GLY A 196 -2.303 26.925 43.360 1.00 0.00 O
  3391. ATOM 0 H GLY A 196 -5.639 25.114 41.868 1.00 0.00 H new
  3392. ATOM 0 HA2 GLY A 196 -3.822 24.778 42.997 1.00 0.00 H new
  3393. ATOM 0 HA3 GLY A 196 -2.981 25.009 41.705 1.00 0.00 H new
  3394. ATOM 1432 N GLY A 197 -3.951 27.719 42.040 1.00 0.00 N
  3395. ATOM 1433 CA GLY A 197 -3.742 29.138 42.337 1.00 0.00 C
  3396. ATOM 1434 C GLY A 197 -4.634 29.659 43.459 1.00 0.00 C
  3397. ATOM 1435 O GLY A 197 -5.291 28.872 44.152 1.00 0.00 O
  3398. ATOM 0 H GLY A 197 -4.495 27.573 41.390 1.00 0.00 H new
  3399. ATOM 0 HA2 GLY A 197 -2.813 29.277 42.580 1.00 0.00 H new
  3400. ATOM 0 HA3 GLY A 197 -3.906 29.657 41.534 1.00 0.00 H new
  3401. ATOM 1436 N PRO A 198 -4.295 30.867 43.856 1.00 0.00 N
  3402. ATOM 1437 CA PRO A 198 -4.460 31.300 45.258 1.00 0.00 C
  3403. ATOM 1438 C PRO A 198 -5.687 32.177 45.497 1.00 0.00 C
  3404. ATOM 1439 O PRO A 198 -6.256 32.711 44.535 1.00 0.00 O
  3405. ATOM 1440 CB PRO A 198 -3.198 32.083 45.596 1.00 0.00 C
  3406. ATOM 1441 CG PRO A 198 -2.723 32.625 44.262 1.00 0.00 C
  3407. ATOM 1442 CD PRO A 198 -3.140 31.566 43.253 1.00 0.00 C
  3408. ATOM 0 HA PRO A 198 -4.594 30.520 45.818 1.00 0.00 H new
  3409. ATOM 0 HB2 PRO A 198 -3.384 32.799 46.223 1.00 0.00 H new
  3410. ATOM 0 HB3 PRO A 198 -2.528 31.514 46.006 1.00 0.00 H new
  3411. ATOM 0 HG2 PRO A 198 -3.131 33.483 44.063 1.00 0.00 H new
  3412. ATOM 0 HG3 PRO A 198 -1.762 32.760 44.257 1.00 0.00 H new
  3413. ATOM 0 HD2 PRO A 198 -3.382 31.970 42.405 1.00 0.00 H new
  3414. ATOM 0 HD3 PRO A 198 -2.413 30.948 43.076 1.00 0.00 H new
  3415. ATOM 1443 N LEU A 199 -6.299 31.894 46.637 1.00 0.00 N
  3416. ATOM 1444 CA LEU A 199 -7.437 32.667 47.151 1.00 0.00 C
  3417. ATOM 1445 C LEU A 199 -6.999 33.583 48.291 1.00 0.00 C
  3418. ATOM 1446 O LEU A 199 -6.600 33.090 49.356 1.00 0.00 O
  3419. ATOM 1447 CB LEU A 199 -8.544 31.744 47.654 1.00 0.00 C
  3420. ATOM 1448 CG LEU A 199 -9.767 32.520 48.143 1.00 0.00 C
  3421. ATOM 1449 CD1 LEU A 199 -10.504 33.210 46.996 1.00 0.00 C
  3422. ATOM 1450 CD2 LEU A 199 -10.709 31.642 48.961 1.00 0.00 C
  3423. ATOM 0 H LEU A 199 -6.067 31.240 47.146 1.00 0.00 H new
  3424. ATOM 0 HA LEU A 199 -7.777 33.203 46.418 1.00 0.00 H new
  3425. ATOM 0 HB2 LEU A 199 -8.809 31.142 46.941 1.00 0.00 H new
  3426. ATOM 0 HB3 LEU A 199 -8.201 31.195 48.377 1.00 0.00 H new
  3427. ATOM 0 HG LEU A 199 -9.437 33.216 48.732 1.00 0.00 H new
  3428. ATOM 0 HD11 LEU A 199 -11.271 33.690 47.346 1.00 0.00 H new
  3429. ATOM 0 HD12 LEU A 199 -9.906 33.834 46.556 1.00 0.00 H new
  3430. ATOM 0 HD13 LEU A 199 -10.804 32.545 46.357 1.00 0.00 H new
  3431. ATOM 0 HD21 LEU A 199 -11.470 32.168 49.253 1.00 0.00 H new
  3432. ATOM 0 HD22 LEU A 199 -11.018 30.902 48.415 1.00 0.00 H new
  3433. ATOM 0 HD23 LEU A 199 -10.239 31.297 49.736 1.00 0.00 H new
  3434. ATOM 1451 N HIS A 200 -6.676 34.796 47.878 1.00 0.00 N
  3435. ATOM 1452 CA HIS A 200 -6.192 35.858 48.767 1.00 0.00 C
  3436. ATOM 1453 C HIS A 200 -7.309 36.438 49.625 1.00 0.00 C
  3437. ATOM 1454 O HIS A 200 -8.054 37.300 49.147 1.00 0.00 O
  3438. ATOM 1455 CB HIS A 200 -5.633 37.006 47.932 1.00 0.00 C
  3439. ATOM 1456 CG HIS A 200 -4.619 36.524 46.886 1.00 0.00 C
  3440. ATOM 1457 ND1 HIS A 200 -3.319 36.246 47.201 1.00 0.00 N
  3441. ATOM 1458 CD2 HIS A 200 -4.789 36.321 45.569 1.00 0.00 C
  3442. ATOM 1459 CE1 HIS A 200 -2.685 35.859 46.054 1.00 0.00 C
  3443. ATOM 1460 NE2 HIS A 200 -3.602 35.907 45.041 1.00 0.00 N
  3444. ATOM 0 H HIS A 200 -6.731 35.038 47.055 1.00 0.00 H new
  3445. ATOM 0 HA HIS A 200 -5.517 35.461 49.339 1.00 0.00 H new
  3446. ATOM 0 HB2 HIS A 200 -6.362 37.464 47.486 1.00 0.00 H new
  3447. ATOM 0 HB3 HIS A 200 -5.208 37.652 48.517 1.00 0.00 H new
  3448. ATOM 0 HD2 HIS A 200 -5.581 36.442 45.098 1.00 0.00 H new
  3449. ATOM 0 HE1 HIS A 200 -1.793 35.609 45.977 1.00 0.00 H new
  3450. ATOM 1461 N CYS A 201 -7.188 36.237 50.922 1.00 0.00 N
  3451. ATOM 1462 CA CYS A 201 -8.180 36.763 51.868 1.00 0.00 C
  3452. ATOM 1463 C CYS A 201 -7.609 37.810 52.825 1.00 0.00 C
  3453. ATOM 1464 O CYS A 201 -6.513 37.639 53.376 1.00 0.00 O
  3454. ATOM 1465 CB CYS A 201 -8.815 35.618 52.645 1.00 0.00 C
  3455. ATOM 1466 SG CYS A 201 -9.670 34.369 51.655 1.00 0.00 S
  3456. ATOM 0 H CYS A 201 -6.543 35.800 51.285 1.00 0.00 H new
  3457. ATOM 0 HA CYS A 201 -8.856 37.218 51.342 1.00 0.00 H new
  3458. ATOM 0 HB2 CYS A 201 -8.122 35.177 53.162 1.00 0.00 H new
  3459. ATOM 0 HB3 CYS A 201 -9.447 35.992 53.279 1.00 0.00 H new
  3460. ATOM 1467 N LEU A 202 -8.376 38.877 52.991 1.00 0.00 N
  3461. ATOM 1468 CA LEU A 202 -7.975 40.044 53.790 1.00 0.00 C
  3462. ATOM 1469 C LEU A 202 -8.280 39.863 55.276 1.00 0.00 C
  3463. ATOM 1470 O LEU A 202 -9.455 39.775 55.655 1.00 0.00 O
  3464. ATOM 1471 CB LEU A 202 -8.685 41.291 53.250 1.00 0.00 C
  3465. ATOM 1472 CG LEU A 202 -8.063 42.621 53.695 1.00 0.00 C
  3466. ATOM 1473 CD1 LEU A 202 -8.541 43.154 55.046 1.00 0.00 C
  3467. ATOM 1474 CD2 LEU A 202 -6.549 42.680 53.510 1.00 0.00 C
  3468. ATOM 0 H LEU A 202 -9.158 38.952 52.640 1.00 0.00 H new
  3469. ATOM 0 HA LEU A 202 -7.014 40.146 53.711 1.00 0.00 H new
  3470. ATOM 0 HB2 LEU A 202 -8.684 41.255 52.281 1.00 0.00 H new
  3471. ATOM 0 HB3 LEU A 202 -9.612 41.270 53.534 1.00 0.00 H new
  3472. ATOM 0 HG LEU A 202 -8.428 43.261 53.065 1.00 0.00 H new
  3473. ATOM 0 HD11 LEU A 202 -8.094 43.993 55.239 1.00 0.00 H new
  3474. ATOM 0 HD12 LEU A 202 -9.500 43.298 55.016 1.00 0.00 H new
  3475. ATOM 0 HD13 LEU A 202 -8.332 42.510 55.740 1.00 0.00 H new
  3476. ATOM 0 HD21 LEU A 202 -6.220 43.542 53.809 1.00 0.00 H new
  3477. ATOM 0 HD22 LEU A 202 -6.131 41.977 54.031 1.00 0.00 H new
  3478. ATOM 0 HD23 LEU A 202 -6.332 42.559 52.572 1.00 0.00 H new
  3479. ATOM 1475 N VAL A 203 -7.249 39.438 55.988 1.00 0.00 N
  3480. ATOM 1476 CA VAL A 203 -7.295 39.281 57.449 1.00 0.00 C
  3481. ATOM 1477 C VAL A 203 -6.252 40.169 58.130 1.00 0.00 C
  3482. ATOM 1478 O VAL A 203 -5.056 40.021 57.848 1.00 0.00 O
  3483. ATOM 1479 CB VAL A 203 -7.062 37.812 57.817 1.00 0.00 C
  3484. ATOM 1480 CG1 VAL A 203 -7.144 37.554 59.322 1.00 0.00 C
  3485. ATOM 1481 CG2 VAL A 203 -8.004 36.880 57.058 1.00 0.00 C
  3486. ATOM 0 H VAL A 203 -6.491 39.228 55.641 1.00 0.00 H new
  3487. ATOM 0 HA VAL A 203 -8.171 39.556 57.761 1.00 0.00 H new
  3488. ATOM 0 HB VAL A 203 -6.153 37.613 57.544 1.00 0.00 H new
  3489. ATOM 0 HG11 VAL A 203 -6.990 36.613 59.498 1.00 0.00 H new
  3490. ATOM 0 HG12 VAL A 203 -6.471 38.083 59.778 1.00 0.00 H new
  3491. ATOM 0 HG13 VAL A 203 -8.024 37.803 59.646 1.00 0.00 H new
  3492. ATOM 0 HG21 VAL A 203 -7.828 35.962 57.316 1.00 0.00 H new
  3493. ATOM 0 HG22 VAL A 203 -8.923 37.105 57.271 1.00 0.00 H new
  3494. ATOM 0 HG23 VAL A 203 -7.860 36.981 56.104 1.00 0.00 H new
  3495. ATOM 1482 N ASN A 204 -6.697 40.854 59.182 1.00 0.00 N
  3496. ATOM 1483 CA ASN A 204 -5.897 41.790 59.991 1.00 0.00 C
  3497. ATOM 1484 C ASN A 204 -5.081 42.774 59.159 1.00 0.00 C
  3498. ATOM 1485 O ASN A 204 -3.854 42.834 59.311 1.00 0.00 O
  3499. ATOM 1486 CB ASN A 204 -4.991 41.061 60.984 1.00 0.00 C
  3500. ATOM 1487 CG ASN A 204 -5.842 40.362 62.041 1.00 0.00 C
  3501. ATOM 1488 OD1 ASN A 204 -5.579 39.206 62.394 1.00 0.00 O
  3502. ATOM 1489 ND2 ASN A 204 -6.869 41.067 62.489 1.00 0.00 N
  3503. ATOM 0 H ASN A 204 -7.508 40.786 59.460 1.00 0.00 H new
  3504. ATOM 0 HA ASN A 204 -6.548 42.310 60.487 1.00 0.00 H new
  3505. ATOM 0 HB2 ASN A 204 -4.442 40.412 60.517 1.00 0.00 H new
  3506. ATOM 0 HB3 ASN A 204 -4.387 41.691 61.407 1.00 0.00 H new
  3507. ATOM 0 HD21 ASN A 204 -7.407 40.724 63.065 1.00 0.00 H new
  3508. ATOM 0 HD22 ASN A 204 -6.998 41.868 62.204 1.00 0.00 H new
  3509. ATOM 1490 N GLY A 205 -5.709 43.174 58.067 1.00 0.00 N
  3510. ATOM 1491 CA GLY A 205 -5.157 44.163 57.133 1.00 0.00 C
  3511. ATOM 1492 C GLY A 205 -4.110 43.563 56.201 1.00 0.00 C
  3512. ATOM 1493 O GLY A 205 -3.296 44.295 55.624 1.00 0.00 O
  3513. ATOM 0 H GLY A 205 -6.483 42.878 57.836 1.00 0.00 H new
  3514. ATOM 0 HA2 GLY A 205 -5.877 44.542 56.605 1.00 0.00 H new
  3515. ATOM 0 HA3 GLY A 205 -4.760 44.892 57.635 1.00 0.00 H new
  3516. ATOM 1494 N GLN A 206 -3.997 42.248 56.279 1.00 0.00 N
  3517. ATOM 1495 CA GLN A 206 -3.004 41.513 55.485 1.00 0.00 C
  3518. ATOM 1496 C GLN A 206 -3.621 40.412 54.623 1.00 0.00 C
  3519. ATOM 1497 O GLN A 206 -4.599 39.779 55.035 1.00 0.00 O
  3520. ATOM 1498 CB GLN A 206 -1.994 40.898 56.453 1.00 0.00 C
  3521. ATOM 1499 CG GLN A 206 -0.800 40.249 55.757 1.00 0.00 C
  3522. ATOM 1500 CD GLN A 206 0.038 39.528 56.807 1.00 0.00 C
  3523. ATOM 1501 OE1 GLN A 206 1.268 39.667 56.837 1.00 0.00 O
  3524. ATOM 1502 NE2 GLN A 206 -0.638 38.666 57.549 1.00 0.00 N
  3525. ATOM 0 H GLN A 206 -4.484 41.753 56.786 1.00 0.00 H new
  3526. ATOM 0 HA GLN A 206 -2.584 42.137 54.873 1.00 0.00 H new
  3527. ATOM 0 HB2 GLN A 206 -1.673 41.587 57.055 1.00 0.00 H new
  3528. ATOM 0 HB3 GLN A 206 -2.443 40.232 56.998 1.00 0.00 H new
  3529. ATOM 0 HG2 GLN A 206 -1.103 39.624 55.080 1.00 0.00 H new
  3530. ATOM 0 HG3 GLN A 206 -0.267 40.921 55.304 1.00 0.00 H new
  3531. ATOM 0 HE21 GLN A 206 -1.494 38.618 57.481 1.00 0.00 H new
  3532. ATOM 0 HE22 GLN A 206 -0.221 38.153 58.100 1.00 0.00 H new
  3533. ATOM 1503 N TYR A 207 -3.199 40.371 53.368 1.00 0.00 N
  3534. ATOM 1504 CA TYR A 207 -3.616 39.319 52.431 1.00 0.00 C
  3535. ATOM 1505 C TYR A 207 -2.841 38.017 52.613 1.00 0.00 C
  3536. ATOM 1506 O TYR A 207 -1.609 38.042 52.734 1.00 0.00 O
  3537. ATOM 1507 CB TYR A 207 -3.484 39.776 50.979 1.00 0.00 C
  3538. ATOM 1508 CG TYR A 207 -4.634 40.703 50.560 1.00 0.00 C
  3539. ATOM 1509 CD1 TYR A 207 -5.899 40.174 50.359 1.00 0.00 C
  3540. ATOM 1510 CD2 TYR A 207 -4.407 42.055 50.358 1.00 0.00 C
  3541. ATOM 1511 CE1 TYR A 207 -6.956 41.001 49.967 1.00 0.00 C
  3542. ATOM 1512 CE2 TYR A 207 -5.459 42.892 49.965 1.00 0.00 C
  3543. ATOM 1513 CZ TYR A 207 -6.733 42.361 49.772 1.00 0.00 C
  3544. ATOM 1514 OH TYR A 207 -7.789 43.196 49.474 1.00 0.00 O
  3545. ATOM 0 H TYR A 207 -2.662 40.950 53.028 1.00 0.00 H new
  3546. ATOM 0 HA TYR A 207 -4.548 39.147 52.636 1.00 0.00 H new
  3547. ATOM 0 HB2 TYR A 207 -2.639 40.237 50.862 1.00 0.00 H new
  3548. ATOM 0 HB3 TYR A 207 -3.467 39.000 50.397 1.00 0.00 H new
  3549. ATOM 0 HD1 TYR A 207 -6.046 39.264 50.485 1.00 0.00 H new
  3550. ATOM 0 HD2 TYR A 207 -3.555 42.407 50.483 1.00 0.00 H new
  3551. ATOM 0 HE1 TYR A 207 -7.805 40.644 49.837 1.00 0.00 H new
  3552. ATOM 0 HE2 TYR A 207 -5.308 43.800 49.833 1.00 0.00 H new
  3553. ATOM 0 HH TYR A 207 -7.508 43.983 49.385 1.00 0.00 H new
  3554. ATOM 1515 N ALA A 208 -3.591 36.997 52.992 1.00 0.00 N
  3555. ATOM 1516 CA ALA A 208 -3.049 35.640 53.147 1.00 0.00 C
  3556. ATOM 1517 C ALA A 208 -3.725 34.632 52.219 1.00 0.00 C
  3557. ATOM 1518 O ALA A 208 -4.833 34.884 51.731 1.00 0.00 O
  3558. ATOM 1519 CB ALA A 208 -3.162 35.177 54.597 1.00 0.00 C
  3559. ATOM 0 H ALA A 208 -4.430 37.063 53.169 1.00 0.00 H new
  3560. ATOM 0 HA ALA A 208 -2.113 35.682 52.896 1.00 0.00 H new
  3561. ATOM 0 HB1 ALA A 208 -2.800 34.281 54.680 1.00 0.00 H new
  3562. ATOM 0 HB2 ALA A 208 -2.664 35.781 55.170 1.00 0.00 H new
  3563. ATOM 0 HB3 ALA A 208 -4.094 35.175 54.864 1.00 0.00 H new
  3564. ATOM 1520 N VAL A 209 -2.936 33.669 51.776 1.00 0.00 N
  3565. ATOM 1521 CA VAL A 209 -3.412 32.638 50.844 1.00 0.00 C
  3566. ATOM 1522 C VAL A 209 -4.153 31.509 51.555 1.00 0.00 C
  3567. ATOM 1523 O VAL A 209 -3.523 30.674 52.216 1.00 0.00 O
  3568. ATOM 1524 CB VAL A 209 -2.243 32.075 50.037 1.00 0.00 C
  3569. ATOM 1525 CG1 VAL A 209 -2.687 30.980 49.068 1.00 0.00 C
  3570. ATOM 1526 CG2 VAL A 209 -1.478 33.181 49.313 1.00 0.00 C
  3571. ATOM 0 H VAL A 209 -2.110 33.587 52.001 1.00 0.00 H new
  3572. ATOM 0 HA VAL A 209 -4.044 33.064 50.244 1.00 0.00 H new
  3573. ATOM 0 HB VAL A 209 -1.636 31.663 50.672 1.00 0.00 H new
  3574. ATOM 0 HG11 VAL A 209 -1.918 30.651 48.577 1.00 0.00 H new
  3575. ATOM 0 HG12 VAL A 209 -3.089 30.251 49.566 1.00 0.00 H new
  3576. ATOM 0 HG13 VAL A 209 -3.336 31.343 48.445 1.00 0.00 H new
  3577. ATOM 0 HG21 VAL A 209 -0.744 32.792 48.811 1.00 0.00 H new
  3578. ATOM 0 HG22 VAL A 209 -2.076 33.644 48.705 1.00 0.00 H new
  3579. ATOM 0 HG23 VAL A 209 -1.127 33.811 49.962 1.00 0.00 H new
  3580. ATOM 1527 N HIS A 210 -5.445 31.735 51.715 1.00 0.00 N
  3581. ATOM 1528 CA HIS A 210 -6.330 30.784 52.405 1.00 0.00 C
  3582. ATOM 1529 C HIS A 210 -6.802 29.614 51.545 1.00 0.00 C
  3583. ATOM 1530 O HIS A 210 -7.131 28.547 52.081 1.00 0.00 O
  3584. ATOM 1531 CB HIS A 210 -7.547 31.499 52.989 1.00 0.00 C
  3585. ATOM 1532 CG HIS A 210 -7.220 32.216 54.308 1.00 0.00 C
  3586. ATOM 1533 ND1 HIS A 210 -7.571 31.687 55.519 1.00 0.00 N
  3587. ATOM 1534 CD2 HIS A 210 -6.607 33.392 54.525 1.00 0.00 C
  3588. ATOM 1535 CE1 HIS A 210 -7.157 32.552 56.493 1.00 0.00 C
  3589. ATOM 1536 NE2 HIS A 210 -6.555 33.610 55.872 1.00 0.00 N
  3590. ATOM 0 H HIS A 210 -5.843 32.442 51.430 1.00 0.00 H new
  3591. ATOM 0 HA HIS A 210 -5.783 30.406 53.111 1.00 0.00 H new
  3592. ATOM 0 HB2 HIS A 210 -7.881 32.144 52.346 1.00 0.00 H new
  3593. ATOM 0 HB3 HIS A 210 -8.257 30.855 53.140 1.00 0.00 H new
  3594. ATOM 0 HD2 HIS A 210 -6.274 33.961 53.869 1.00 0.00 H new
  3595. ATOM 0 HE1 HIS A 210 -7.265 32.441 57.410 1.00 0.00 H new
  3596. ATOM 1537 N GLY A 211 -6.720 29.780 50.233 1.00 0.00 N
  3597. ATOM 1538 CA GLY A 211 -7.253 28.752 49.323 1.00 0.00 C
  3598. ATOM 1539 C GLY A 211 -6.386 28.407 48.113 1.00 0.00 C
  3599. ATOM 1540 O GLY A 211 -5.500 29.183 47.734 1.00 0.00 O
  3600. ATOM 0 H GLY A 211 -6.369 30.463 49.847 1.00 0.00 H new
  3601. ATOM 0 HA2 GLY A 211 -7.401 27.940 49.833 1.00 0.00 H new
  3602. ATOM 0 HA3 GLY A 211 -8.119 29.048 49.003 1.00 0.00 H new
  3603. ATOM 1541 N VAL A 212 -6.486 27.134 47.739 1.00 0.00 N
  3604. ATOM 1542 CA VAL A 212 -5.841 26.535 46.557 1.00 0.00 C
  3605. ATOM 1543 C VAL A 212 -6.881 25.963 45.593 1.00 0.00 C
  3606. ATOM 1544 O VAL A 212 -7.574 25.007 45.964 1.00 0.00 O
  3607. ATOM 1545 CB VAL A 212 -4.893 25.413 46.990 1.00 0.00 C
  3608. ATOM 1546 CG1 VAL A 212 -4.279 24.675 45.803 1.00 0.00 C
  3609. ATOM 1547 CG2 VAL A 212 -3.818 25.895 47.960 1.00 0.00 C
  3610. ATOM 0 H VAL A 212 -6.952 26.565 48.184 1.00 0.00 H new
  3611. ATOM 0 HA VAL A 212 -5.343 27.234 46.104 1.00 0.00 H new
  3612. ATOM 0 HB VAL A 212 -5.444 24.775 47.470 1.00 0.00 H new
  3613. ATOM 0 HG11 VAL A 212 -3.689 23.977 46.126 1.00 0.00 H new
  3614. ATOM 0 HG12 VAL A 212 -4.984 24.279 45.268 1.00 0.00 H new
  3615. ATOM 0 HG13 VAL A 212 -3.773 25.300 45.260 1.00 0.00 H new
  3616. ATOM 0 HG21 VAL A 212 -3.245 25.151 48.204 1.00 0.00 H new
  3617. ATOM 0 HG22 VAL A 212 -3.286 26.587 47.536 1.00 0.00 H new
  3618. ATOM 0 HG23 VAL A 212 -4.238 26.254 48.757 1.00 0.00 H new
  3619. ATOM 1548 N THR A 213 -7.177 26.756 44.561 1.00 0.00 N
  3620. ATOM 1549 CA THR A 213 -8.192 26.452 43.530 1.00 0.00 C
  3621. ATOM 1550 C THR A 213 -8.234 24.983 43.122 1.00 0.00 C
  3622. ATOM 1551 O THR A 213 -7.202 24.415 42.744 1.00 0.00 O
  3623. ATOM 1552 CB THR A 213 -7.993 27.295 42.273 1.00 0.00 C
  3624. ATOM 1553 OG1 THR A 213 -7.794 28.664 42.602 1.00 0.00 O
  3625. ATOM 1554 CG2 THR A 213 -9.155 27.154 41.291 1.00 0.00 C
  3626. ATOM 0 H THR A 213 -6.784 27.510 44.432 1.00 0.00 H new
  3627. ATOM 0 HA THR A 213 -9.037 26.672 43.952 1.00 0.00 H new
  3628. ATOM 0 HB THR A 213 -7.196 26.957 41.836 1.00 0.00 H new
  3629. ATOM 0 HG1 THR A 213 -8.278 28.868 43.257 1.00 0.00 H new
  3630. ATOM 0 HG21 THR A 213 -8.988 27.704 40.510 1.00 0.00 H new
  3631. ATOM 0 HG22 THR A 213 -9.239 26.226 41.020 1.00 0.00 H new
  3632. ATOM 0 HG23 THR A 213 -9.977 27.442 41.718 1.00 0.00 H new
  3633. ATOM 1555 N SER A 214 -9.288 24.330 43.566 1.00 0.00 N
  3634. ATOM 1556 CA SER A 214 -9.451 22.904 43.287 1.00 0.00 C
  3635. ATOM 1557 C SER A 214 -10.379 22.606 42.112 1.00 0.00 C
  3636. ATOM 1558 O SER A 214 -9.925 22.064 41.097 1.00 0.00 O
  3637. ATOM 1559 CB SER A 214 -9.926 22.170 44.535 1.00 0.00 C
  3638. ATOM 1560 OG SER A 214 -9.912 20.776 44.267 1.00 0.00 O
  3639. ATOM 0 H SER A 214 -9.921 24.684 44.028 1.00 0.00 H new
  3640. ATOM 0 HA SER A 214 -8.574 22.580 43.027 1.00 0.00 H new
  3641. ATOM 0 HB2 SER A 214 -9.349 22.375 45.287 1.00 0.00 H new
  3642. ATOM 0 HB3 SER A 214 -10.820 22.458 44.776 1.00 0.00 H new
  3643. ATOM 0 HG SER A 214 -9.140 20.543 44.033 1.00 0.00 H new
  3644. ATOM 1561 N PHE A 215 -11.672 22.837 42.314 1.00 0.00 N
  3645. ATOM 1562 CA PHE A 215 -12.677 22.533 41.278 1.00 0.00 C
  3646. ATOM 1563 C PHE A 215 -13.874 23.481 41.194 1.00 0.00 C
  3647. ATOM 1564 O PHE A 215 -13.972 24.445 41.966 1.00 0.00 O
  3648. ATOM 1565 CB PHE A 215 -13.158 21.077 41.361 1.00 0.00 C
  3649. ATOM 1566 CG PHE A 215 -13.870 20.728 42.682 1.00 0.00 C
  3650. ATOM 1567 CD1 PHE A 215 -13.140 20.258 43.761 1.00 0.00 C
  3651. ATOM 1568 CD2 PHE A 215 -15.250 20.818 42.775 1.00 0.00 C
  3652. ATOM 1569 CE1 PHE A 215 -13.781 19.931 44.961 1.00 0.00 C
  3653. ATOM 1570 CE2 PHE A 215 -15.900 20.493 43.971 1.00 0.00 C
  3654. ATOM 1571 CZ PHE A 215 -15.164 20.054 45.070 1.00 0.00 C
  3655. ATOM 0 H PHE A 215 -11.995 23.168 43.039 1.00 0.00 H new
  3656. ATOM 0 HA PHE A 215 -12.189 22.677 40.452 1.00 0.00 H new
  3657. ATOM 0 HB2 PHE A 215 -13.762 20.903 40.623 1.00 0.00 H new
  3658. ATOM 0 HB3 PHE A 215 -12.396 20.487 41.249 1.00 0.00 H new
  3659. ATOM 0 HD1 PHE A 215 -12.218 20.159 43.688 1.00 0.00 H new
  3660. ATOM 0 HD2 PHE A 215 -15.746 21.096 42.039 1.00 0.00 H new
  3661. ATOM 0 HE1 PHE A 215 -13.283 19.631 45.687 1.00 0.00 H new
  3662. ATOM 0 HE2 PHE A 215 -16.825 20.570 44.033 1.00 0.00 H new
  3663. ATOM 0 HZ PHE A 215 -15.592 19.845 45.869 1.00 0.00 H new
  3664. ATOM 1572 N VAL A 216 -14.553 23.353 40.059 1.00 0.00 N
  3665. ATOM 1573 CA VAL A 216 -15.833 24.009 39.746 1.00 0.00 C
  3666. ATOM 1574 C VAL A 216 -16.885 22.989 39.316 1.00 0.00 C
  3667. ATOM 1575 O VAL A 216 -16.586 21.792 39.217 1.00 0.00 O
  3668. ATOM 1576 CB VAL A 216 -15.668 25.055 38.642 1.00 0.00 C
  3669. ATOM 1577 CG1 VAL A 216 -14.934 26.305 39.121 1.00 0.00 C
  3670. ATOM 1578 CG2 VAL A 216 -15.067 24.480 37.361 1.00 0.00 C
  3671. ATOM 0 H VAL A 216 -14.271 22.858 39.415 1.00 0.00 H new
  3672. ATOM 0 HA VAL A 216 -16.129 24.450 40.558 1.00 0.00 H new
  3673. ATOM 0 HB VAL A 216 -16.567 25.338 38.411 1.00 0.00 H new
  3674. ATOM 0 HG11 VAL A 216 -14.855 26.935 38.388 1.00 0.00 H new
  3675. ATOM 0 HG12 VAL A 216 -15.431 26.714 39.846 1.00 0.00 H new
  3676. ATOM 0 HG13 VAL A 216 -14.049 26.061 39.434 1.00 0.00 H new
  3677. ATOM 0 HG21 VAL A 216 -14.985 25.183 36.698 1.00 0.00 H new
  3678. ATOM 0 HG22 VAL A 216 -14.190 24.112 37.552 1.00 0.00 H new
  3679. ATOM 0 HG23 VAL A 216 -15.644 23.779 37.019 1.00 0.00 H new
  3680. ATOM 1579 N SER A 217 -18.072 23.482 39.004 1.00 0.00 N
  3681. ATOM 1580 CA SER A 217 -19.162 22.613 38.554 1.00 0.00 C
  3682. ATOM 1581 C SER A 217 -18.997 22.147 37.114 1.00 0.00 C
  3683. ATOM 1582 O SER A 217 -18.401 22.869 36.305 1.00 0.00 O
  3684. ATOM 1583 CB SER A 217 -20.510 23.311 38.680 1.00 0.00 C
  3685. ATOM 1584 OG SER A 217 -21.483 22.497 38.034 1.00 0.00 O
  3686. ATOM 0 H SER A 217 -18.273 24.317 39.044 1.00 0.00 H new
  3687. ATOM 0 HA SER A 217 -19.128 21.836 39.134 1.00 0.00 H new
  3688. ATOM 0 HB2 SER A 217 -20.740 23.440 39.613 1.00 0.00 H new
  3689. ATOM 0 HB3 SER A 217 -20.477 24.190 38.272 1.00 0.00 H new
  3690. ATOM 0 HG SER A 217 -22.237 22.862 38.092 1.00 0.00 H new
  3691. ATOM 1585 N ARG A 217A -19.150 20.847 36.961 1.00 0.00 N
  3692. ATOM 1586 CA ARG A 217A -19.144 20.189 35.649 1.00 0.00 C
  3693. ATOM 1587 C ARG A 217A -20.059 20.876 34.638 1.00 0.00 C
  3694. ATOM 1588 O ARG A 217A -19.718 20.954 33.452 1.00 0.00 O
  3695. ATOM 1589 CB ARG A 217A -19.561 18.731 35.799 1.00 0.00 C
  3696. ATOM 1590 CG ARG A 217A -18.456 17.855 36.384 1.00 0.00 C
  3697. ATOM 1591 CD ARG A 217A -18.974 16.461 36.734 1.00 0.00 C
  3698. ATOM 1592 NE ARG A 217A -19.810 15.942 35.642 1.00 0.00 N
  3699. ATOM 1593 CZ ARG A 217A -21.068 15.561 35.822 1.00 0.00 C
  3700. ATOM 1594 NH1 ARG A 217A -21.782 15.130 34.795 1.00 0.00 N
  3701. ATOM 1595 NH2 ARG A 217A -21.540 15.420 37.052 1.00 0.00 N
  3702. ATOM 0 H ARG A 217A -19.263 20.305 37.619 1.00 0.00 H new
  3703. ATOM 0 HA ARG A 217A -18.238 20.249 35.308 1.00 0.00 H new
  3704. ATOM 0 HB2 ARG A 217A -20.344 18.680 36.369 1.00 0.00 H new
  3705. ATOM 0 HB3 ARG A 217A -19.819 18.382 34.931 1.00 0.00 H new
  3706. ATOM 0 HG2 ARG A 217A -17.729 17.781 35.747 1.00 0.00 H new
  3707. ATOM 0 HG3 ARG A 217A -18.094 18.276 37.179 1.00 0.00 H new
  3708. ATOM 0 HD2 ARG A 217A -18.228 15.862 36.892 1.00 0.00 H new
  3709. ATOM 0 HD3 ARG A 217A -19.489 16.497 37.556 1.00 0.00 H new
  3710. ATOM 0 HE ARG A 217A -19.470 15.883 34.854 1.00 0.00 H new
  3711. ATOM 0 HH11 ARG A 217A -21.431 15.097 34.011 1.00 0.00 H new
  3712. ATOM 0 HH12 ARG A 217A -22.597 14.883 34.912 1.00 0.00 H new
  3713. ATOM 0 HH21 ARG A 217A -21.032 15.575 37.728 1.00 0.00 H new
  3714. ATOM 0 HH22 ARG A 217A -22.355 15.173 37.174 1.00 0.00 H new
  3715. ATOM 1596 N LEU A 218 -21.080 21.536 35.166 1.00 0.00 N
  3716. ATOM 1597 CA LEU A 218 -22.049 22.288 34.356 1.00 0.00 C
  3717. ATOM 1598 C LEU A 218 -21.442 23.565 33.789 1.00 0.00 C
  3718. ATOM 1599 O LEU A 218 -21.952 24.124 32.810 1.00 0.00 O
  3719. ATOM 1600 CB LEU A 218 -23.260 22.697 35.191 1.00 0.00 C
  3720. ATOM 1601 CG LEU A 218 -24.101 21.514 35.656 1.00 0.00 C
  3721. ATOM 1602 CD1 LEU A 218 -25.254 21.979 36.543 1.00 0.00 C
  3722. ATOM 1603 CD2 LEU A 218 -24.602 20.679 34.479 1.00 0.00 C
  3723. ATOM 0 H LEU A 218 -21.237 21.565 36.011 1.00 0.00 H new
  3724. ATOM 0 HA LEU A 218 -22.312 21.696 33.634 1.00 0.00 H new
  3725. ATOM 0 HB2 LEU A 218 -22.957 23.195 35.967 1.00 0.00 H new
  3726. ATOM 0 HB3 LEU A 218 -23.817 23.296 34.670 1.00 0.00 H new
  3727. ATOM 0 HG LEU A 218 -23.529 20.939 36.189 1.00 0.00 H new
  3728. ATOM 0 HD11 LEU A 218 -25.774 21.211 36.826 1.00 0.00 H new
  3729. ATOM 0 HD12 LEU A 218 -24.899 22.434 37.323 1.00 0.00 H new
  3730. ATOM 0 HD13 LEU A 218 -25.821 22.587 36.044 1.00 0.00 H new
  3731. ATOM 0 HD21 LEU A 218 -25.132 19.937 34.811 1.00 0.00 H new
  3732. ATOM 0 HD22 LEU A 218 -25.148 21.232 33.899 1.00 0.00 H new
  3733. ATOM 0 HD23 LEU A 218 -23.844 20.337 33.979 1.00 0.00 H new
  3734. ATOM 1604 N GLY A 219 -20.315 23.938 34.365 1.00 0.00 N
  3735. ATOM 1605 CA GLY A 219 -19.635 25.181 33.986 1.00 0.00 C
  3736. ATOM 1606 C GLY A 219 -18.971 25.878 35.170 1.00 0.00 C
  3737. ATOM 1607 O GLY A 219 -19.245 25.538 36.328 1.00 0.00 O
  3738. ATOM 0 H GLY A 219 -19.918 23.489 34.982 1.00 0.00 H new
  3739. ATOM 0 HA2 GLY A 219 -18.964 24.985 33.314 1.00 0.00 H new
  3740. ATOM 0 HA3 GLY A 219 -20.276 25.784 33.579 1.00 0.00 H new
  3741. ATOM 1608 N CYS A 220 -18.288 26.959 34.853 1.00 0.00 N
  3742. ATOM 1609 CA CYS A 220 -17.486 27.709 35.824 1.00 0.00 C
  3743. ATOM 1610 C CYS A 220 -18.290 28.653 36.709 1.00 0.00 C
  3744. ATOM 1611 O CYS A 220 -18.278 28.523 37.939 1.00 0.00 O
  3745. ATOM 1612 CB CYS A 220 -16.382 28.462 35.089 1.00 0.00 C
  3746. ATOM 1613 SG CYS A 220 -15.121 27.385 34.380 1.00 0.00 S
  3747. ATOM 0 H CYS A 220 -18.271 27.290 34.060 1.00 0.00 H new
  3748. ATOM 0 HA CYS A 220 -17.106 27.058 36.434 1.00 0.00 H new
  3749. ATOM 0 HB2 CYS A 220 -16.779 28.992 34.380 1.00 0.00 H new
  3750. ATOM 0 HB3 CYS A 220 -15.959 29.082 35.704 1.00 0.00 H new
  3751. ATOM 1614 N ASN A 221 -19.015 29.545 36.070 1.00 0.00 N
  3752. ATOM 1615 CA ASN A 221 -19.808 30.538 36.799 1.00 0.00 C
  3753. ATOM 1616 C ASN A 221 -21.286 30.171 36.928 1.00 0.00 C
  3754. ATOM 1617 O ASN A 221 -22.086 30.385 36.009 1.00 0.00 O
  3755. ATOM 1618 CB ASN A 221 -19.582 31.952 36.260 1.00 0.00 C
  3756. ATOM 1619 CG ASN A 221 -19.951 32.039 34.781 1.00 0.00 C
  3757. ATOM 1620 OD1 ASN A 221 -19.361 31.340 33.945 1.00 0.00 O
  3758. ATOM 1621 ND2 ASN A 221 -21.118 32.622 34.567 1.00 0.00 N
  3759. ATOM 0 H ASN A 221 -19.069 29.601 35.214 1.00 0.00 H new
  3760. ATOM 0 HA ASN A 221 -19.477 30.531 37.711 1.00 0.00 H new
  3761. ATOM 0 HB2 ASN A 221 -20.115 32.584 36.767 1.00 0.00 H new
  3762. ATOM 0 HB3 ASN A 221 -18.653 32.203 36.380 1.00 0.00 H new
  3763. ATOM 0 HD21 ASN A 221 -21.514 32.527 33.810 1.00 0.00 H new
  3764. ATOM 0 HD22 ASN A 221 -21.481 33.097 35.185 1.00 0.00 H new
  3765. ATOM 1622 N VAL A 221A -21.502 29.243 37.842 1.00 0.00 N
  3766. ATOM 1623 CA VAL A 221A -22.849 28.724 38.123 1.00 0.00 C
  3767. ATOM 1624 C VAL A 221A -23.379 29.122 39.500 1.00 0.00 C
  3768. ATOM 1625 O VAL A 221A -22.602 29.156 40.463 1.00 0.00 O
  3769. ATOM 1626 CB VAL A 221A -22.883 27.203 37.951 1.00 0.00 C
  3770. ATOM 1627 CG1 VAL A 221A -24.223 26.594 38.358 1.00 0.00 C
  3771. ATOM 1628 CG2 VAL A 221A -22.490 26.777 36.538 1.00 0.00 C
  3772. ATOM 0 H VAL A 221A -20.881 28.891 38.321 1.00 0.00 H new
  3773. ATOM 0 HA VAL A 221A -23.442 29.136 37.475 1.00 0.00 H new
  3774. ATOM 0 HB VAL A 221A -22.216 26.851 38.561 1.00 0.00 H new
  3775. ATOM 0 HG11 VAL A 221A -24.194 25.633 38.231 1.00 0.00 H new
  3776. ATOM 0 HG12 VAL A 221A -24.398 26.791 39.291 1.00 0.00 H new
  3777. ATOM 0 HG13 VAL A 221A -24.930 26.971 37.810 1.00 0.00 H new
  3778. ATOM 0 HG21 VAL A 221A -22.524 25.810 36.470 1.00 0.00 H new
  3779. ATOM 0 HG22 VAL A 221A -23.107 27.167 35.899 1.00 0.00 H new
  3780. ATOM 0 HG23 VAL A 221A -21.590 27.083 36.346 1.00 0.00 H new
  3781. ATOM 1629 N THR A 222 -24.493 29.839 39.441 1.00 0.00 N
  3782. ATOM 1630 CA THR A 222 -25.244 30.295 40.617 1.00 0.00 C
  3783. ATOM 1631 C THR A 222 -25.478 29.162 41.616 1.00 0.00 C
  3784. ATOM 1632 O THR A 222 -25.818 28.047 41.201 1.00 0.00 O
  3785. ATOM 1633 CB THR A 222 -26.581 30.875 40.164 1.00 0.00 C
  3786. ATOM 1634 OG1 THR A 222 -26.372 31.717 39.035 1.00 0.00 O
  3787. ATOM 1635 CG2 THR A 222 -27.287 31.659 41.269 1.00 0.00 C
  3788. ATOM 0 H THR A 222 -24.848 30.084 38.697 1.00 0.00 H new
  3789. ATOM 0 HA THR A 222 -24.720 30.976 41.067 1.00 0.00 H new
  3790. ATOM 0 HB THR A 222 -27.157 30.130 39.931 1.00 0.00 H new
  3791. ATOM 0 HG1 THR A 222 -27.107 32.036 38.783 1.00 0.00 H new
  3792. ATOM 0 HG21 THR A 222 -28.128 32.006 40.933 1.00 0.00 H new
  3793. ATOM 0 HG22 THR A 222 -27.457 31.073 42.023 1.00 0.00 H new
  3794. ATOM 0 HG23 THR A 222 -26.724 32.396 41.553 1.00 0.00 H new
  3795. ATOM 1636 N ARG A 223 -24.897 29.369 42.790 1.00 0.00 N
  3796. ATOM 1637 CA ARG A 223 -24.900 28.425 43.924 1.00 0.00 C
  3797. ATOM 1638 C ARG A 223 -23.943 27.257 43.767 1.00 0.00 C
  3798. ATOM 1639 O ARG A 223 -24.206 26.168 44.292 1.00 0.00 O
  3799. ATOM 1640 CB ARG A 223 -26.277 27.936 44.356 1.00 0.00 C
  3800. ATOM 1641 CG ARG A 223 -27.021 29.022 45.114 1.00 0.00 C
  3801. ATOM 1642 CD ARG A 223 -28.455 28.621 45.429 1.00 0.00 C
  3802. ATOM 1643 NE ARG A 223 -29.259 29.844 45.414 1.00 0.00 N
  3803. ATOM 1644 CZ ARG A 223 -29.881 30.249 44.318 1.00 0.00 C
  3804. ATOM 1645 NH1 ARG A 223 -30.536 31.398 44.337 1.00 0.00 N
  3805. ATOM 1646 NH2 ARG A 223 -30.199 29.351 43.395 1.00 0.00 N
  3806. ATOM 0 H ARG A 223 -24.468 30.094 42.965 1.00 0.00 H new
  3807. ATOM 0 HA ARG A 223 -24.567 28.979 44.647 1.00 0.00 H new
  3808. ATOM 0 HB2 ARG A 223 -26.790 27.670 43.577 1.00 0.00 H new
  3809. ATOM 0 HB3 ARG A 223 -26.185 27.150 44.916 1.00 0.00 H new
  3810. ATOM 0 HG2 ARG A 223 -26.552 29.217 45.940 1.00 0.00 H new
  3811. ATOM 0 HG3 ARG A 223 -27.022 29.838 44.589 1.00 0.00 H new
  3812. ATOM 0 HD2 ARG A 223 -28.785 27.986 44.774 1.00 0.00 H new
  3813. ATOM 0 HD3 ARG A 223 -28.507 28.188 46.295 1.00 0.00 H new
  3814. ATOM 0 HE ARG A 223 -29.329 30.310 46.133 1.00 0.00 H new
  3815. ATOM 0 HH11 ARG A 223 -30.554 31.871 45.055 1.00 0.00 H new
  3816. ATOM 0 HH12 ARG A 223 -30.944 31.672 43.631 1.00 0.00 H new
  3817. ATOM 0 HH21 ARG A 223 -30.001 28.523 43.515 1.00 0.00 H new
  3818. ATOM 0 HH22 ARG A 223 -30.603 29.597 42.677 1.00 0.00 H new
  3819. ATOM 1647 N LYS A 224 -23.084 27.404 42.781 1.00 0.00 N
  3820. ATOM 1648 CA LYS A 224 -21.953 26.478 42.658 1.00 0.00 C
  3821. ATOM 1649 C LYS A 224 -20.602 27.181 42.777 1.00 0.00 C
  3822. ATOM 1650 O LYS A 224 -19.892 27.288 41.770 1.00 0.00 O
  3823. ATOM 1651 CB LYS A 224 -22.026 25.701 41.345 1.00 0.00 C
  3824. ATOM 1652 CG LYS A 224 -23.179 24.701 41.346 1.00 0.00 C
  3825. ATOM 1653 CD LYS A 224 -22.955 23.584 42.364 1.00 0.00 C
  3826. ATOM 1654 CE LYS A 224 -24.202 22.728 42.561 1.00 0.00 C
  3827. ATOM 1655 NZ LYS A 224 -25.267 23.541 43.171 1.00 0.00 N
  3828. ATOM 0 H LYS A 224 -23.126 28.016 42.179 1.00 0.00 H new
  3829. ATOM 0 HA LYS A 224 -22.023 25.858 43.401 1.00 0.00 H new
  3830. ATOM 0 HB2 LYS A 224 -22.135 26.321 40.607 1.00 0.00 H new
  3831. ATOM 0 HB3 LYS A 224 -21.190 25.231 41.199 1.00 0.00 H new
  3832. ATOM 0 HG2 LYS A 224 -24.008 25.162 41.548 1.00 0.00 H new
  3833. ATOM 0 HG3 LYS A 224 -23.276 24.318 40.460 1.00 0.00 H new
  3834. ATOM 0 HD2 LYS A 224 -22.222 23.022 42.069 1.00 0.00 H new
  3835. ATOM 0 HD3 LYS A 224 -22.692 23.971 43.214 1.00 0.00 H new
  3836. ATOM 0 HE2 LYS A 224 -24.501 22.374 41.709 1.00 0.00 H new
  3837. ATOM 0 HE3 LYS A 224 -23.998 21.968 43.128 1.00 0.00 H new
  3838. ATOM 0 HZ1 LYS A 224 -25.494 23.192 43.958 1.00 0.00 H new
  3839. ATOM 0 HZ2 LYS A 224 -24.975 24.373 43.289 1.00 0.00 H new
  3840. ATOM 0 HZ3 LYS A 224 -25.978 23.550 42.635 1.00 0.00 H new
  3841. ATOM 1656 N PRO A 225 -20.231 27.608 43.989 1.00 0.00 N
  3842. ATOM 1657 CA PRO A 225 -19.018 28.417 44.223 1.00 0.00 C
  3843. ATOM 1658 C PRO A 225 -17.720 27.642 44.020 1.00 0.00 C
  3844. ATOM 1659 O PRO A 225 -17.738 26.411 43.896 1.00 0.00 O
  3845. ATOM 1660 CB PRO A 225 -19.108 28.887 45.672 1.00 0.00 C
  3846. ATOM 1661 CG PRO A 225 -19.983 27.855 46.353 1.00 0.00 C
  3847. ATOM 1662 CD PRO A 225 -20.969 27.453 45.266 1.00 0.00 C
  3848. ATOM 0 HA PRO A 225 -18.989 29.145 43.583 1.00 0.00 H new
  3849. ATOM 0 HB2 PRO A 225 -18.231 28.933 46.083 1.00 0.00 H new
  3850. ATOM 0 HB3 PRO A 225 -19.496 29.774 45.732 1.00 0.00 H new
  3851. ATOM 0 HG2 PRO A 225 -19.465 27.096 46.664 1.00 0.00 H new
  3852. ATOM 0 HG3 PRO A 225 -20.436 28.225 47.127 1.00 0.00 H new
  3853. ATOM 0 HD2 PRO A 225 -21.270 26.539 45.387 1.00 0.00 H new
  3854. ATOM 0 HD3 PRO A 225 -21.759 28.016 45.284 1.00 0.00 H new
  3855. ATOM 1663 N THR A 226 -16.703 28.396 43.647 1.00 0.00 N
  3856. ATOM 1664 CA THR A 226 -15.370 27.830 43.430 1.00 0.00 C
  3857. ATOM 1665 C THR A 226 -14.821 27.236 44.725 1.00 0.00 C
  3858. ATOM 1666 O THR A 226 -15.121 27.766 45.803 1.00 0.00 O
  3859. ATOM 1667 CB THR A 226 -14.427 28.905 42.890 1.00 0.00 C
  3860. ATOM 1668 OG1 THR A 226 -15.031 29.544 41.768 1.00 0.00 O
  3861. ATOM 1669 CG2 THR A 226 -13.070 28.336 42.476 1.00 0.00 C
  3862. ATOM 0 H THR A 226 -16.757 29.244 43.511 1.00 0.00 H new
  3863. ATOM 0 HA THR A 226 -15.437 27.117 42.776 1.00 0.00 H new
  3864. ATOM 0 HB THR A 226 -14.272 29.542 43.605 1.00 0.00 H new
  3865. ATOM 0 HG1 THR A 226 -15.171 30.353 41.947 1.00 0.00 H new
  3866. ATOM 0 HG21 THR A 226 -12.507 29.052 42.141 1.00 0.00 H new
  3867. ATOM 0 HG22 THR A 226 -12.644 27.923 43.243 1.00 0.00 H new
  3868. ATOM 0 HG23 THR A 226 -13.196 27.672 41.780 1.00 0.00 H new
  3869. ATOM 1670 N VAL A 227 -14.520 25.953 44.632 1.00 0.00 N
  3870. ATOM 1671 CA VAL A 227 -14.021 25.202 45.789 1.00 0.00 C
  3871. ATOM 1672 C VAL A 227 -12.497 25.130 45.854 1.00 0.00 C
  3872. ATOM 1673 O VAL A 227 -11.842 24.956 44.818 1.00 0.00 O
  3873. ATOM 1674 CB VAL A 227 -14.626 23.801 45.814 1.00 0.00 C
  3874. ATOM 1675 CG1 VAL A 227 -14.194 23.028 47.056 1.00 0.00 C
  3875. ATOM 1676 CG2 VAL A 227 -16.147 23.853 45.711 1.00 0.00 C
  3876. ATOM 0 H VAL A 227 -14.595 25.491 43.911 1.00 0.00 H new
  3877. ATOM 0 HA VAL A 227 -14.303 25.691 46.577 1.00 0.00 H new
  3878. ATOM 0 HB VAL A 227 -14.288 23.328 45.038 1.00 0.00 H new
  3879. ATOM 0 HG11 VAL A 227 -14.594 22.144 47.043 1.00 0.00 H new
  3880. ATOM 0 HG12 VAL A 227 -13.228 22.945 47.066 1.00 0.00 H new
  3881. ATOM 0 HG13 VAL A 227 -14.486 23.502 47.850 1.00 0.00 H new
  3882. ATOM 0 HG21 VAL A 227 -16.504 22.951 45.729 1.00 0.00 H new
  3883. ATOM 0 HG22 VAL A 227 -16.505 24.357 46.458 1.00 0.00 H new
  3884. ATOM 0 HG23 VAL A 227 -16.401 24.284 44.880 1.00 0.00 H new
  3885. ATOM 1677 N PHE A 228 -12.006 25.663 46.966 1.00 0.00 N
  3886. ATOM 1678 CA PHE A 228 -10.579 25.770 47.296 1.00 0.00 C
  3887. ATOM 1679 C PHE A 228 -10.156 24.770 48.371 1.00 0.00 C
  3888. ATOM 1680 O PHE A 228 -10.978 24.345 49.191 1.00 0.00 O
  3889. ATOM 1681 CB PHE A 228 -10.284 27.176 47.827 1.00 0.00 C
  3890. ATOM 1682 CG PHE A 228 -10.702 28.289 46.851 1.00 0.00 C
  3891. ATOM 1683 CD1 PHE A 228 -9.832 28.710 45.861 1.00 0.00 C
  3892. ATOM 1684 CD2 PHE A 228 -11.937 28.902 46.987 1.00 0.00 C
  3893. ATOM 1685 CE1 PHE A 228 -10.211 29.724 44.973 1.00 0.00 C
  3894. ATOM 1686 CE2 PHE A 228 -12.323 29.913 46.102 1.00 0.00 C
  3895. ATOM 1687 CZ PHE A 228 -11.461 30.324 45.090 1.00 0.00 C
  3896. ATOM 0 H PHE A 228 -12.514 25.988 47.579 1.00 0.00 H new
  3897. ATOM 0 HA PHE A 228 -10.084 25.582 46.483 1.00 0.00 H new
  3898. ATOM 0 HB2 PHE A 228 -10.747 27.301 48.670 1.00 0.00 H new
  3899. ATOM 0 HB3 PHE A 228 -9.335 27.254 48.011 1.00 0.00 H new
  3900. ATOM 0 HD1 PHE A 228 -8.992 28.318 45.785 1.00 0.00 H new
  3901. ATOM 0 HD2 PHE A 228 -12.512 28.640 47.670 1.00 0.00 H new
  3902. ATOM 0 HE1 PHE A 228 -9.626 29.997 44.304 1.00 0.00 H new
  3903. ATOM 0 HE2 PHE A 228 -13.158 30.312 46.190 1.00 0.00 H new
  3904. ATOM 0 HZ PHE A 228 -11.718 30.993 44.498 1.00 0.00 H new
  3905. ATOM 1688 N THR A 229 -8.883 24.415 48.346 1.00 0.00 N
  3906. ATOM 1689 CA THR A 229 -8.266 23.551 49.361 1.00 0.00 C
  3907. ATOM 1690 C THR A 229 -7.776 24.401 50.531 1.00 0.00 C
  3908. ATOM 1691 O THR A 229 -7.123 25.423 50.281 1.00 0.00 O
  3909. ATOM 1692 CB THR A 229 -7.087 22.799 48.738 1.00 0.00 C
  3910. ATOM 1693 OG1 THR A 229 -7.532 22.064 47.601 1.00 0.00 O
  3911. ATOM 1694 CG2 THR A 229 -6.406 21.849 49.720 1.00 0.00 C
  3912. ATOM 0 H THR A 229 -8.337 24.669 47.732 1.00 0.00 H new
  3913. ATOM 0 HA THR A 229 -8.921 22.913 49.685 1.00 0.00 H new
  3914. ATOM 0 HB THR A 229 -6.432 23.465 48.478 1.00 0.00 H new
  3915. ATOM 0 HG1 THR A 229 -6.879 21.670 47.249 1.00 0.00 H new
  3916. ATOM 0 HG21 THR A 229 -5.669 21.399 49.277 1.00 0.00 H new
  3917. ATOM 0 HG22 THR A 229 -6.069 22.353 50.477 1.00 0.00 H new
  3918. ATOM 0 HG23 THR A 229 -7.047 21.190 50.030 1.00 0.00 H new
  3919. ATOM 1695 N ARG A 230 -8.495 24.254 51.641 1.00 0.00 N
  3920. ATOM 1696 CA ARG A 230 -8.268 25.051 52.862 1.00 0.00 C
  3921. ATOM 1697 C ARG A 230 -6.864 24.904 53.445 1.00 0.00 C
  3922. ATOM 1698 O ARG A 230 -6.626 23.985 54.237 1.00 0.00 O
  3923. ATOM 1699 CB ARG A 230 -9.276 24.678 53.945 1.00 0.00 C
  3924. ATOM 1700 CG ARG A 230 -9.415 25.786 54.986 1.00 0.00 C
  3925. ATOM 1701 CD ARG A 230 -10.323 25.399 56.149 1.00 0.00 C
  3926. ATOM 1702 NE ARG A 230 -9.541 24.737 57.201 1.00 0.00 N
  3927. ATOM 1703 CZ ARG A 230 -9.959 23.697 57.910 1.00 0.00 C
  3928. ATOM 1704 NH1 ARG A 230 -9.191 23.230 58.883 1.00 0.00 N
  3929. ATOM 1705 NH2 ARG A 230 -11.119 23.105 57.639 1.00 0.00 N
  3930. ATOM 0 H ARG A 230 -9.136 23.685 51.714 1.00 0.00 H new
  3931. ATOM 0 HA ARG A 230 -8.378 25.974 52.585 1.00 0.00 H new
  3932. ATOM 0 HB2 ARG A 230 -10.139 24.504 53.539 1.00 0.00 H new
  3933. ATOM 0 HB3 ARG A 230 -8.997 23.857 54.380 1.00 0.00 H new
  3934. ATOM 0 HG2 ARG A 230 -8.537 26.013 55.329 1.00 0.00 H new
  3935. ATOM 0 HG3 ARG A 230 -9.767 26.583 54.559 1.00 0.00 H new
  3936. ATOM 0 HD2 ARG A 230 -10.756 26.189 56.507 1.00 0.00 H new
  3937. ATOM 0 HD3 ARG A 230 -11.025 24.807 55.837 1.00 0.00 H new
  3938. ATOM 0 HE ARG A 230 -8.756 25.046 57.369 1.00 0.00 H new
  3939. ATOM 0 HH11 ARG A 230 -8.433 23.601 59.048 1.00 0.00 H new
  3940. ATOM 0 HH12 ARG A 230 -9.451 22.556 59.350 1.00 0.00 H new
  3941. ATOM 0 HH21 ARG A 230 -11.610 23.396 56.996 1.00 0.00 H new
  3942. ATOM 0 HH22 ARG A 230 -11.378 22.431 58.107 1.00 0.00 H new
  3943. ATOM 1706 N VAL A 231 -5.956 25.721 52.925 1.00 0.00 N
  3944. ATOM 1707 CA VAL A 231 -4.528 25.771 53.300 1.00 0.00 C
  3945. ATOM 1708 C VAL A 231 -4.231 25.638 54.795 1.00 0.00 C
  3946. ATOM 1709 O VAL A 231 -3.372 24.831 55.177 1.00 0.00 O
  3947. ATOM 1710 CB VAL A 231 -3.899 27.059 52.764 1.00 0.00 C
  3948. ATOM 1711 CG1 VAL A 231 -2.443 27.230 53.196 1.00 0.00 C
  3949. ATOM 1712 CG2 VAL A 231 -4.043 27.170 51.250 1.00 0.00 C
  3950. ATOM 0 H VAL A 231 -6.156 26.292 52.314 1.00 0.00 H new
  3951. ATOM 0 HA VAL A 231 -4.133 24.984 52.893 1.00 0.00 H new
  3952. ATOM 0 HB VAL A 231 -4.396 27.789 53.164 1.00 0.00 H new
  3953. ATOM 0 HG11 VAL A 231 -2.092 28.058 52.832 1.00 0.00 H new
  3954. ATOM 0 HG12 VAL A 231 -2.394 27.257 54.164 1.00 0.00 H new
  3955. ATOM 0 HG13 VAL A 231 -1.918 26.484 52.866 1.00 0.00 H new
  3956. ATOM 0 HG21 VAL A 231 -3.635 27.995 50.946 1.00 0.00 H new
  3957. ATOM 0 HG22 VAL A 231 -3.603 26.417 50.827 1.00 0.00 H new
  3958. ATOM 0 HG23 VAL A 231 -4.984 27.169 51.013 1.00 0.00 H new
  3959. ATOM 1713 N SER A 232 -5.151 26.158 55.596 1.00 0.00 N
  3960. ATOM 1714 CA SER A 232 -4.977 26.212 57.056 1.00 0.00 C
  3961. ATOM 1715 C SER A 232 -5.098 24.838 57.706 1.00 0.00 C
  3962. ATOM 1716 O SER A 232 -4.728 24.657 58.871 1.00 0.00 O
  3963. ATOM 1717 CB SER A 232 -6.019 27.128 57.684 1.00 0.00 C
  3964. ATOM 1718 OG SER A 232 -7.260 26.435 57.738 1.00 0.00 O
  3965. ATOM 0 H SER A 232 -5.894 26.490 55.317 1.00 0.00 H new
  3966. ATOM 0 HA SER A 232 -4.082 26.553 57.212 1.00 0.00 H new
  3967. ATOM 0 HB2 SER A 232 -5.742 27.392 58.575 1.00 0.00 H new
  3968. ATOM 0 HB3 SER A 232 -6.110 27.941 57.163 1.00 0.00 H new
  3969. ATOM 0 HG SER A 232 -7.864 26.960 57.993 1.00 0.00 H new
  3970. ATOM 1719 N ALA A 233 -5.603 23.899 56.930 1.00 0.00 N
  3971. ATOM 1720 CA ALA A 233 -5.769 22.521 57.405 1.00 0.00 C
  3972. ATOM 1721 C ALA A 233 -4.496 21.705 57.232 1.00 0.00 C
  3973. ATOM 1722 O ALA A 233 -4.422 20.562 57.702 1.00 0.00 O
  3974. ATOM 1723 CB ALA A 233 -6.883 21.827 56.624 1.00 0.00 C
  3975. ATOM 0 H ALA A 233 -5.860 24.030 56.120 1.00 0.00 H new
  3976. ATOM 0 HA ALA A 233 -5.988 22.572 58.349 1.00 0.00 H new
  3977. ATOM 0 HB1 ALA A 233 -6.985 20.917 56.945 1.00 0.00 H new
  3978. ATOM 0 HB2 ALA A 233 -7.715 22.309 56.750 1.00 0.00 H new
  3979. ATOM 0 HB3 ALA A 233 -6.657 21.813 55.681 1.00 0.00 H new
  3980. ATOM 1724 N TYR A 234 -3.665 22.187 56.327 1.00 0.00 N
  3981. ATOM 1725 CA TYR A 234 -2.479 21.431 55.906 1.00 0.00 C
  3982. ATOM 1726 C TYR A 234 -1.153 22.007 56.394 1.00 0.00 C
  3983. ATOM 1727 O TYR A 234 -0.100 21.536 55.950 1.00 0.00 O
  3984. ATOM 1728 CB TYR A 234 -2.452 21.282 54.382 1.00 0.00 C
  3985. ATOM 1729 CG TYR A 234 -3.668 20.495 53.865 1.00 0.00 C
  3986. ATOM 1730 CD1 TYR A 234 -4.770 21.170 53.363 1.00 0.00 C
  3987. ATOM 1731 CD2 TYR A 234 -3.657 19.109 53.884 1.00 0.00 C
  3988. ATOM 1732 CE1 TYR A 234 -5.883 20.459 52.899 1.00 0.00 C
  3989. ATOM 1733 CE2 TYR A 234 -4.765 18.389 53.417 1.00 0.00 C
  3990. ATOM 1734 CZ TYR A 234 -5.879 19.069 52.927 1.00 0.00 C
  3991. ATOM 1735 OH TYR A 234 -7.012 18.375 52.554 1.00 0.00 O
  3992. ATOM 0 H TYR A 234 -3.761 22.948 55.939 1.00 0.00 H new
  3993. ATOM 0 HA TYR A 234 -2.565 20.563 56.330 1.00 0.00 H new
  3994. ATOM 0 HB2 TYR A 234 -2.436 22.161 53.971 1.00 0.00 H new
  3995. ATOM 0 HB3 TYR A 234 -1.636 20.830 54.115 1.00 0.00 H new
  3996. ATOM 0 HD1 TYR A 234 -4.770 22.100 53.334 1.00 0.00 H new
  3997. ATOM 0 HD2 TYR A 234 -2.912 18.656 54.208 1.00 0.00 H new
  3998. ATOM 0 HE1 TYR A 234 -6.624 20.916 52.572 1.00 0.00 H new
  3999. ATOM 0 HE2 TYR A 234 -4.757 17.459 53.434 1.00 0.00 H new
  4000. ATOM 0 HH TYR A 234 -7.636 18.917 52.405 1.00 0.00 H new
  4001. ATOM 1736 N ILE A 235 -1.241 23.135 57.089 1.00 0.00 N
  4002. ATOM 1737 CA ILE A 235 -0.066 23.873 57.598 1.00 0.00 C
  4003. ATOM 1738 C ILE A 235 1.030 22.986 58.190 1.00 0.00 C
  4004. ATOM 1739 O ILE A 235 2.159 22.999 57.679 1.00 0.00 O
  4005. ATOM 1740 CB ILE A 235 -0.482 24.942 58.609 1.00 0.00 C
  4006. ATOM 1741 CG1 ILE A 235 -1.458 25.951 58.007 1.00 0.00 C
  4007. ATOM 1742 CG2 ILE A 235 0.723 25.642 59.238 1.00 0.00 C
  4008. ATOM 1743 CD1 ILE A 235 -0.849 26.726 56.840 1.00 0.00 C
  4009. ATOM 0 H ILE A 235 -1.991 23.506 57.286 1.00 0.00 H new
  4010. ATOM 0 HA ILE A 235 0.323 24.295 56.816 1.00 0.00 H new
  4011. ATOM 0 HB ILE A 235 -0.948 24.478 59.322 1.00 0.00 H new
  4012. ATOM 0 HG12 ILE A 235 -2.253 25.486 57.703 1.00 0.00 H new
  4013. ATOM 0 HG13 ILE A 235 -1.739 26.575 58.694 1.00 0.00 H new
  4014. ATOM 0 HG21 ILE A 235 0.416 26.310 59.871 1.00 0.00 H new
  4015. ATOM 0 HG22 ILE A 235 1.272 24.989 59.699 1.00 0.00 H new
  4016. ATOM 0 HG23 ILE A 235 1.247 26.072 58.544 1.00 0.00 H new
  4017. ATOM 0 HD11 ILE A 235 -1.502 27.352 56.491 1.00 0.00 H new
  4018. ATOM 0 HD12 ILE A 235 -0.068 27.212 57.147 1.00 0.00 H new
  4019. ATOM 0 HD13 ILE A 235 -0.590 26.106 56.140 1.00 0.00 H new
  4020. ATOM 1744 N SER A 236 0.572 21.997 58.945 1.00 0.00 N
  4021. ATOM 1745 CA SER A 236 1.436 21.014 59.615 1.00 0.00 C
  4022. ATOM 1746 C SER A 236 2.245 20.183 58.630 1.00 0.00 C
  4023. ATOM 1747 O SER A 236 3.482 20.194 58.669 1.00 0.00 O
  4024. ATOM 1748 CB SER A 236 0.590 20.048 60.436 1.00 0.00 C
  4025. ATOM 1749 OG SER A 236 1.420 18.958 60.826 1.00 0.00 O
  4026. ATOM 0 H SER A 236 -0.266 21.870 59.090 1.00 0.00 H new
  4027. ATOM 0 HA SER A 236 2.043 21.522 60.176 1.00 0.00 H new
  4028. ATOM 0 HB2 SER A 236 0.227 20.494 61.217 1.00 0.00 H new
  4029. ATOM 0 HB3 SER A 236 -0.164 19.731 59.915 1.00 0.00 H new
  4030. ATOM 0 HG SER A 236 0.972 18.413 61.282 1.00 0.00 H new
  4031. ATOM 1750 N TRP A 237 1.518 19.752 57.621 1.00 0.00 N
  4032. ATOM 1751 CA TRP A 237 2.047 18.909 56.548 1.00 0.00 C
  4033. ATOM 1752 C TRP A 237 3.046 19.672 55.686 1.00 0.00 C
  4034. ATOM 1753 O TRP A 237 4.218 19.274 55.637 1.00 0.00 O
  4035. ATOM 1754 CB TRP A 237 0.881 18.398 55.698 1.00 0.00 C
  4036. ATOM 1755 CG TRP A 237 1.351 17.542 54.512 1.00 0.00 C
  4037. ATOM 1756 CD1 TRP A 237 1.782 16.265 54.489 1.00 0.00 C
  4038. ATOM 1757 CD2 TRP A 237 1.391 17.963 53.182 1.00 0.00 C
  4039. ATOM 1758 NE1 TRP A 237 2.126 15.901 53.205 1.00 0.00 N
  4040. ATOM 1759 CE2 TRP A 237 1.919 16.889 52.426 1.00 0.00 C
  4041. ATOM 1760 CE3 TRP A 237 1.057 19.175 52.595 1.00 0.00 C
  4042. ATOM 1761 CZ2 TRP A 237 2.192 16.983 51.071 1.00 0.00 C
  4043. ATOM 1762 CZ3 TRP A 237 1.301 19.266 51.218 1.00 0.00 C
  4044. ATOM 1763 CH2 TRP A 237 1.855 18.209 50.482 1.00 0.00 C
  4045. ATOM 0 H TRP A 237 0.684 19.940 57.530 1.00 0.00 H new
  4046. ATOM 0 HA TRP A 237 2.520 18.158 56.940 1.00 0.00 H new
  4047. ATOM 0 HB2 TRP A 237 0.284 17.874 56.255 1.00 0.00 H new
  4048. ATOM 0 HB3 TRP A 237 0.371 19.153 55.366 1.00 0.00 H new
  4049. ATOM 0 HD1 TRP A 237 1.839 15.709 55.233 1.00 0.00 H new
  4050. ATOM 0 HE1 TRP A 237 2.431 15.133 52.968 1.00 0.00 H new
  4051. ATOM 0 HE3 TRP A 237 0.696 19.880 53.083 1.00 0.00 H new
  4052. ATOM 0 HZ2 TRP A 237 2.571 16.284 50.588 1.00 0.00 H new
  4053. ATOM 0 HZ3 TRP A 237 1.088 20.056 50.776 1.00 0.00 H new
  4054. ATOM 0 HH2 TRP A 237 2.004 18.326 49.571 1.00 0.00 H new
  4055. ATOM 1764 N ILE A 238 2.679 20.924 55.449 1.00 0.00 N
  4056. ATOM 1765 CA ILE A 238 3.467 21.828 54.600 1.00 0.00 C
  4057. ATOM 1766 C ILE A 238 4.837 22.114 55.202 1.00 0.00 C
  4058. ATOM 1767 O ILE A 238 5.844 21.752 54.577 1.00 0.00 O
  4059. ATOM 1768 CB ILE A 238 2.710 23.133 54.343 1.00 0.00 C
  4060. ATOM 1769 CG1 ILE A 238 1.443 22.914 53.518 1.00 0.00 C
  4061. ATOM 1770 CG2 ILE A 238 3.599 24.216 53.736 1.00 0.00 C
  4062. ATOM 1771 CD1 ILE A 238 0.635 24.200 53.350 1.00 0.00 C
  4063. ATOM 0 H ILE A 238 1.966 21.280 55.773 1.00 0.00 H new
  4064. ATOM 0 HA ILE A 238 3.606 21.380 53.751 1.00 0.00 H new
  4065. ATOM 0 HB ILE A 238 2.430 23.457 55.213 1.00 0.00 H new
  4066. ATOM 0 HG12 ILE A 238 1.684 22.568 52.644 1.00 0.00 H new
  4067. ATOM 0 HG13 ILE A 238 0.892 22.241 53.947 1.00 0.00 H new
  4068. ATOM 0 HG21 ILE A 238 3.077 25.021 53.592 1.00 0.00 H new
  4069. ATOM 0 HG22 ILE A 238 4.331 24.411 54.341 1.00 0.00 H new
  4070. ATOM 0 HG23 ILE A 238 3.954 23.906 52.888 1.00 0.00 H new
  4071. ATOM 0 HD11 ILE A 238 -0.158 24.017 52.822 1.00 0.00 H new
  4072. ATOM 0 HD12 ILE A 238 0.373 24.534 54.222 1.00 0.00 H new
  4073. ATOM 0 HD13 ILE A 238 1.177 24.866 52.899 1.00 0.00 H new
  4074. ATOM 1772 N ASN A 239 4.798 22.142 56.525 1.00 0.00 N
  4075. ATOM 1773 CA ASN A 239 6.009 22.405 57.310 1.00 0.00 C
  4076. ATOM 1774 C ASN A 239 6.911 21.184 57.429 1.00 0.00 C
  4077. ATOM 1775 O ASN A 239 8.066 21.255 56.990 1.00 0.00 O
  4078. ATOM 1776 CB ASN A 239 5.678 22.964 58.691 1.00 0.00 C
  4079. ATOM 1777 CG ASN A 239 5.203 24.405 58.540 1.00 0.00 C
  4080. ATOM 1778 OD1 ASN A 239 4.407 24.895 59.351 1.00 0.00 O
  4081. ATOM 1779 ND2 ASN A 239 5.795 25.081 57.567 1.00 0.00 N
  4082. ATOM 0 H ASN A 239 4.087 22.013 56.992 1.00 0.00 H new
  4083. ATOM 0 HA ASN A 239 6.503 23.080 56.818 1.00 0.00 H new
  4084. ATOM 0 HB2 ASN A 239 4.990 22.427 59.114 1.00 0.00 H new
  4085. ATOM 0 HB3 ASN A 239 6.460 22.927 59.264 1.00 0.00 H new
  4086. ATOM 0 HD21 ASN A 239 5.635 25.920 57.467 1.00 0.00 H new
  4087. ATOM 0 HD22 ASN A 239 6.340 24.681 57.035 1.00 0.00 H new
  4088. ATOM 1780 N ASN A 240 6.242 20.049 57.573 1.00 0.00 N
  4089. ATOM 1781 CA ASN A 240 6.926 18.753 57.716 1.00 0.00 C
  4090. ATOM 1782 C ASN A 240 7.677 18.342 56.456 1.00 0.00 C
  4091. ATOM 1783 O ASN A 240 8.901 18.161 56.513 1.00 0.00 O
  4092. ATOM 1784 CB ASN A 240 5.955 17.640 58.112 1.00 0.00 C
  4093. ATOM 1785 CG ASN A 240 5.553 17.800 59.575 1.00 0.00 C
  4094. ATOM 1786 OD1 ASN A 240 4.428 17.455 59.961 1.00 0.00 O
  4095. ATOM 1787 ND2 ASN A 240 6.463 18.379 60.341 1.00 0.00 N
  4096. ATOM 0 H ASN A 240 5.384 19.999 57.592 1.00 0.00 H new
  4097. ATOM 0 HA ASN A 240 7.574 18.878 58.427 1.00 0.00 H new
  4098. ATOM 0 HB2 ASN A 240 5.167 17.670 57.547 1.00 0.00 H new
  4099. ATOM 0 HB3 ASN A 240 6.370 16.774 57.975 1.00 0.00 H new
  4100. ATOM 0 HD21 ASN A 240 6.290 18.539 61.168 1.00 0.00 H new
  4101. ATOM 0 HD22 ASN A 240 7.228 18.595 60.012 1.00 0.00 H new
  4102. ATOM 1788 N VAL A 241 7.039 18.674 55.349 1.00 0.00 N
  4103. ATOM 1789 CA VAL A 241 7.567 18.341 54.021 1.00 0.00 C
  4104. ATOM 1790 C VAL A 241 8.770 19.194 53.641 1.00 0.00 C
  4105. ATOM 1791 O VAL A 241 9.872 18.642 53.502 1.00 0.00 O
  4106. ATOM 1792 CB VAL A 241 6.473 18.455 52.960 1.00 0.00 C
  4107. ATOM 1793 CG1 VAL A 241 7.025 18.479 51.535 1.00 0.00 C
  4108. ATOM 1794 CG2 VAL A 241 5.414 17.373 53.139 1.00 0.00 C
  4109. ATOM 0 H VAL A 241 6.290 19.097 55.336 1.00 0.00 H new
  4110. ATOM 0 HA VAL A 241 7.872 17.421 54.062 1.00 0.00 H new
  4111. ATOM 0 HB VAL A 241 6.045 19.315 53.095 1.00 0.00 H new
  4112. ATOM 0 HG11 VAL A 241 6.291 18.552 50.905 1.00 0.00 H new
  4113. ATOM 0 HG12 VAL A 241 7.618 19.240 51.430 1.00 0.00 H new
  4114. ATOM 0 HG13 VAL A 241 7.517 17.661 51.364 1.00 0.00 H new
  4115. ATOM 0 HG21 VAL A 241 4.734 17.469 52.454 1.00 0.00 H new
  4116. ATOM 0 HG22 VAL A 241 5.828 16.499 53.063 1.00 0.00 H new
  4117. ATOM 0 HG23 VAL A 241 5.005 17.462 54.014 1.00 0.00 H new
  4118. ATOM 1795 N ILE A 242 8.636 20.454 54.015 1.00 0.00 N
  4119. ATOM 1796 CA ILE A 242 9.659 21.451 53.691 1.00 0.00 C
  4120. ATOM 1797 C ILE A 242 10.902 21.329 54.565 1.00 0.00 C
  4121. ATOM 1798 O ILE A 242 12.007 21.246 54.013 1.00 0.00 O
  4122. ATOM 1799 CB ILE A 242 9.075 22.864 53.724 1.00 0.00 C
  4123. ATOM 1800 CG1 ILE A 242 8.142 23.125 52.543 1.00 0.00 C
  4124. ATOM 1801 CG2 ILE A 242 10.133 23.955 53.880 1.00 0.00 C
  4125. ATOM 1802 CD1 ILE A 242 7.641 24.568 52.510 1.00 0.00 C
  4126. ATOM 0 H ILE A 242 7.964 20.759 54.457 1.00 0.00 H new
  4127. ATOM 0 HA ILE A 242 9.953 21.270 52.785 1.00 0.00 H new
  4128. ATOM 0 HB ILE A 242 8.536 22.909 54.529 1.00 0.00 H new
  4129. ATOM 0 HG12 ILE A 242 8.608 22.927 51.715 1.00 0.00 H new
  4130. ATOM 0 HG13 ILE A 242 7.384 22.522 52.593 1.00 0.00 H new
  4131. ATOM 0 HG21 ILE A 242 9.702 24.824 53.894 1.00 0.00 H new
  4132. ATOM 0 HG22 ILE A 242 10.617 23.821 54.710 1.00 0.00 H new
  4133. ATOM 0 HG23 ILE A 242 10.753 23.914 53.135 1.00 0.00 H new
  4134. ATOM 0 HD11 ILE A 242 7.054 24.690 51.747 1.00 0.00 H new
  4135. ATOM 0 HD12 ILE A 242 7.154 24.760 53.326 1.00 0.00 H new
  4136. ATOM 0 HD13 ILE A 242 8.397 25.171 52.435 1.00 0.00 H new
  4137. ATOM 1803 N ALA A 243 10.660 20.758 55.732 1.00 0.00 N
  4138. ATOM 1804 CA ALA A 243 11.732 20.603 56.722 1.00 0.00 C
  4139. ATOM 1805 C ALA A 243 12.482 19.286 56.563 1.00 0.00 C
  4140. ATOM 1806 O ALA A 243 13.689 19.216 56.825 1.00 0.00 O
  4141. ATOM 1807 CB ALA A 243 11.179 20.711 58.139 1.00 0.00 C
  4142. ATOM 0 H ALA A 243 9.894 20.454 55.976 1.00 0.00 H new
  4143. ATOM 0 HA ALA A 243 12.362 21.324 56.565 1.00 0.00 H new
  4144. ATOM 0 HB1 ALA A 243 11.902 20.606 58.777 1.00 0.00 H new
  4145. ATOM 0 HB2 ALA A 243 10.765 21.580 58.260 1.00 0.00 H new
  4146. ATOM 0 HB3 ALA A 243 10.518 20.016 58.282 1.00 0.00 H new
  4147. ATOM 1808 N SER A 244 11.809 18.345 55.934 1.00 0.00 N
  4148. ATOM 1809 CA SER A 244 12.417 17.035 55.692 1.00 0.00 C
  4149. ATOM 1810 C SER A 244 13.036 16.986 54.303 1.00 0.00 C
  4150. ATOM 1811 O SER A 244 13.154 15.899 53.724 1.00 0.00 O
  4151. ATOM 1812 CB SER A 244 11.366 15.938 55.806 1.00 0.00 C
  4152. ATOM 1813 OG SER A 244 10.378 16.162 54.808 1.00 0.00 O
  4153. ATOM 0 H SER A 244 11.006 18.434 55.638 1.00 0.00 H new
  4154. ATOM 0 HA SER A 244 13.108 16.894 56.358 1.00 0.00 H new
  4155. ATOM 0 HB2 SER A 244 11.774 15.066 55.688 1.00 0.00 H new
  4156. ATOM 0 HB3 SER A 244 10.963 15.946 56.688 1.00 0.00 H new
  4157. ATOM 0 HG SER A 244 10.440 16.950 54.524 1.00 0.00 H new
  4158. ATOM 1814 N ASN A 245 12.943 18.148 53.670 1.00 0.00 N
  4159. ATOM 1815 CA ASN A 245 13.496 18.377 52.324 1.00 0.00 C
  4160. ATOM 1816 C ASN A 245 14.439 19.571 52.232 1.00 0.00 C
  4161. ATOM 1817 O ASN A 245 14.421 20.270 51.213 1.00 0.00 O
  4162. ATOM 1818 CB ASN A 245 12.396 18.523 51.278 1.00 0.00 C
  4163. ATOM 1819 CG ASN A 245 11.999 17.148 50.753 1.00 0.00 C
  4164. ATOM 1820 OD1 ASN A 245 12.719 16.615 49.899 1.00 0.00 O
  4165. ATOM 1821 ND2 ASN A 245 11.248 16.460 51.601 1.00 0.00 N
  4166. ATOM 1822 OXT ASN A 245 15.222 19.801 53.161 1.00 0.00 O
  4167. ATOM 0 H ASN A 245 12.555 18.838 54.006 1.00 0.00 H new
  4168. ATOM 0 HA ASN A 245 14.021 17.582 52.140 1.00 0.00 H new
  4169. ATOM 0 HB2 ASN A 245 11.625 18.965 51.666 1.00 0.00 H new
  4170. ATOM 0 HB3 ASN A 245 12.705 19.081 50.547 1.00 0.00 H new
  4171. ATOM 0 HD21 ASN A 245 11.246 15.600 51.574 1.00 0.00 H new
  4172. ATOM 0 HD22 ASN A 245 10.763 16.873 52.178 1.00 0.00 H new
  4173. TER 1823 ASN A 245
  4174. HETATM 1824 S SO4 A 246 -8.300 21.800 60.900 1.00 0.00 S
  4175. HETATM 1825 S TSU A 247 -8.299 23.390 37.426 1.00 0.00 S
  4176. HETATM 1826 O2 TSU A 247 -9.721 23.151 37.607 1.00 0.00 O
  4177. HETATM 1827 O3 TSU A 247 -8.087 24.591 36.631 1.00 0.00 O
  4178. HETATM 1828 C1 TSU A 247 -7.585 22.020 36.603 1.00 0.00 C
  4179. HETATM 1829 C2 TSU A 247 -6.545 22.217 35.689 1.00 0.00 C
  4180. HETATM 1830 C3 TSU A 247 -5.969 21.121 35.034 1.00 0.00 C
  4181. HETATM 1831 C4 TSU A 247 -6.435 19.824 35.280 1.00 0.00 C
  4182. HETATM 1832 C5 TSU A 247 -7.498 19.635 36.172 1.00 0.00 C
  4183. HETATM 1833 C6 TSU A 247 -8.075 20.730 36.830 1.00 0.00 C
  4184. HETATM 1834 C7 TSU A 247 -5.482 18.657 35.033 1.00 0.00 C
  4185. HETATM 1835 O HOH A 248 -18.700 26.100 40.100 1.00 0.00 O
  4186. HETATM 1836 O HOH A 249 -19.400 30.200 40.400 1.00 0.00 O
  4187. HETATM 1837 O HOH A 250 -21.000 32.200 40.100 1.00 0.00 O
  4188. HETATM 1838 O HOH A 251 -17.800 31.500 42.000 1.00 0.00 O
  4189. HETATM 1839 O HOH A 252 -16.100 27.400 53.300 1.00 0.00 O
  4190. HETATM 1840 O HOH A 253 -16.500 24.800 53.400 1.00 0.00 O
  4191. HETATM 1841 O HOH A 254 -16.100 31.300 55.300 1.00 0.00 O
  4192. HETATM 1842 O HOH A 255 -13.900 29.100 55.600 1.00 0.00 O
  4193. HETATM 1843 O HOH A 256 0.900 40.600 37.500 1.00 0.00 O
  4194. HETATM 1844 O HOH A 257 4.400 40.700 37.300 1.00 0.00 O
  4195. HETATM 1845 O HOH A 258 5.700 42.300 35.700 1.00 0.00 O
  4196. HETATM 1846 O HOH A 259 3.800 39.600 39.900 1.00 0.00 O
  4197. HETATM 1847 O HOH A 260 -6.400 30.900 41.800 1.00 0.00 O
  4198. HETATM 1848 O HOH A 261 -4.400 30.900 39.600 1.00 0.00 O
  4199. HETATM 1849 O HOH A 262 -3.800 30.400 36.400 1.00 0.00 O
  4200. HETATM 1850 O HOH A 263 -1.900 28.200 45.600 1.00 0.00 O
  4201. HETATM 1851 O HOH A 264 -9.600 29.500 56.100 1.00 0.00 O
  4202. HETATM 1852 O HOH A 265 -7.100 28.500 54.700 1.00 0.00 O
  4203. HETATM 1853 O HOH A 266 -9.600 18.600 46.400 1.00 0.00 O
  4204. HETATM 1854 O HOH A 267 -9.200 19.600 48.300 1.00 0.00 O
  4205. HETATM 1855 O HOH A 268 -8.900 18.800 51.100 1.00 0.00 O
  4206. HETATM 1856 O HOH A 269 5.100 36.100 41.200 1.00 0.00 O
  4207. HETATM 1857 O HOH A 270 4.400 35.100 38.200 1.00 0.00 O
  4208. HETATM 1858 O HOH A 271 2.200 36.800 38.600 1.00 0.00 O
  4209. HETATM 1859 O HOH A 272 5.200 37.800 30.100 1.00 0.00 O
  4210. CONECT 231 352
  4211. CONECT 352 231
  4212. CONECT 980 1466
  4213. CONECT 1223 1341
  4214. CONECT 1341 1223
  4215. CONECT 1400 1613
  4216. CONECT 1466 980
  4217. CONECT 1613 1400
  4218. CONECT 1825 1826 1827 1828
  4219. CONECT 1826 1825
  4220. CONECT 1827 1825
  4221. CONECT 1828 1825 1829 1833
  4222. CONECT 1829 1828 1830
  4223. CONECT 1830 1829 1831
  4224. CONECT 1831 1830 1832 1834
  4225. CONECT 1832 1831 1833
  4226. CONECT 1833 1828 1832
  4227. CONECT 1834 1831
  4228. END