IMMUNOGLOBULIN FAB FRAGMENT (MC/PC$603) MOUSE (MUS $MUSCULUS) Y.SATOW,G.H.COHEN,E.A.PADLAN,D.R.DAVIES REMARK JRNL Y.SATOW,G.H.COHEN,E.A.PADLAN,D.R.DAVIES PHOSPHOCHOLINE BINDING IMMUNOGLOBULIN FAB MC/PC603$. AN X-RAY DIFFRACTION STUDY AT 2.7 ANGSTROMS J.MOL.BIOL. V. 190 593 1987 ASTM JMOBAK UK ISSN 0022-2836 070 E 1 S.RUDIKOFF,Y.SATOW,E.PADLAN,D.DAVIES,M.POTTER KAPPA CHAIN STRUCTURE FROM A CRYSTALLIZED MURINE FAB(PRIME). ROLE OF JOINING SEGMENT IN HAPTEN BINDING MOL.IMMUNOL. V. 18 705 1981 ASTM MOIMD5 UK ISSN 0161-5890 921 E 2 D.R.DAVIES,E.A.PADLAN,D.M.SEGAL IMMUNOGLOBULIN STRUCTURES AT HIGH RESOLUTION CONTEMP.TOP.MOL.IMMUNOL. V. 4 127 1975 ASTM CTMIB4 US ISSN 0090-8800 912 E 3 E.A.PADLAN,D.M.SEGAL,G.H.COHEN,D.R.DAVIES, S.RUDIKOFF,M.POTTER THE THREE-*DIMENSIONAL STRUCTURE OF THE ANTIGEN BINDING SITE OF MC/PC$ 603 PROTEIN E.E.SERCARZ,A.R.WILLIAMSON,C.F.COX THE IMMUNE SYSTEM. 7 1974 GENES,RECEPTORS,SIGNALS. PROCEEDINGS OF THE 1974 I.C.N.-U.C.L.A. SYMPOSIUM ON MOLECULAR BIOLOGY ACADEMIC PRESS,NEW YORK ISBN 0-12-637150-4 987 E 4 D.M.SEGAL,E.A.PADLAN,G.H.COHEN,S.RUDIKOFF, M.POTTER,D.R.DAVIES THE THREE-*DIMENSIONAL STRUCTURE OF A PHOSPHORYLCHOLINE-*BINDING MOUSE IMMUNOGLOBULIN FAB AND THE NATURE OF THE ANTIGEN BINDING SITE PROC.NAT.ACAD.SCI.USA V. 71 4298 1974 ASTM PNASA6 US ISSN 0027-8424 040 E 5 E.A.PADLAN,D.M.SEGAL,T.F.SPANDE,D.R.DAVIES, S.RUDIKOFF,M.POTTER STRUCTURE AT 4.5 ANGSTROMS RESOLUTION OF A PHOSPHORYLCHOLINE-BINDING FAB NATURE NEW BIOL. V. 245 167 1973 ASTM NNBYA7 UK ISSN 0369-4887 192 E 6 S.RUDIKOFF,M.POTTER,D.M.SEGAL,E.A.PADLAN,D.R.DAVIES CRYSTALS OF PHOSPHORYLCHOLINE-*BINDING FAB-*FRAGMENTS FROM MOUSE MYELOMA PROTEINS. PREPARATION AND X-*RAY ANALYSIS PROC.NAT.ACAD.SCI.USA V. 69 3689 1972 ASTM PNASA6 US ISSN 0027-8424 040 RESOLUTION. 2.7 ANGSTROMS. REFINEMENT. RESTRAINED REFINEMENT BY THE METHOD OF KONNERT AND HENDRICKSON. THE FINAL R-VALUE IS 0.225. THE RMS DEVIATION FROM IDEALITY OF THE BOND LENGTHS IS 0.02 ANGSTROMS. THE RMS DEVIATION FROM IDEALITY OF THE BOND ANGLES IS 3.5 DEGREES. CORRECTION. UPDATE JRNL REFERENCE TO REFLECT PUBLICATION. 16-JUL-87. CORRECTION. INSERT MISSING COMMA IN REFERENCE 5. 15-JUL-92. DIVMTQSPSSLSVSAGERVTMSCKSSQSLLNSGNQKNFLAWYQQKPGQPPKLLIYGASTRESGVPDRFTGSGSGTDFTLTISSVQAEDLAVYYCQNDHSYPLTFGAGTKLEIKRADAAPTVSIFPPSSEQLTSGGASVVCFLNNFYPKDINVKWKIDGSERQNGVLNSWTDQDSKDSTYSMSSTLTLTKDEYERHNSYTCEATHKTSTSPIVKSFNRNEC ASP ILE VAL MET THR GLN SER PRO SER SER LEU SER VAL SER ALA GLY GLU ARG VAL THR MET SER CYS LYS SER SER GLN SER LEU LEU ASN SER GLY ASN GLN LYS ASN PHE LEU ALA TRP TYR GLN GLN LYS PRO GLY GLN PRO PRO LYS LEU LEU ILE TYR GLY ALA SER THR ARG GLU SER GLY VAL PRO ASP ARG PHE THR GLY SER GLY SER GLY THR ASP PHE THR LEU THR ILE SER SER VAL GLN ALA GLU ASP LEU ALA VAL TYR TYR CYS GLN ASN ASP HIS SER TYR PRO LEU THR PHE GLY ALA GLY THR LYS LEU GLU ILE LYS ARG ALA ASP ALA ALA PRO THR VAL SER ILE PHE PRO PRO SER SER GLU GLN LEU THR SER GLY GLY ALA SER VAL VAL CYS PHE LEU ASN ASN PHE TYR PRO LYS ASP ILE ASN VAL LYS TRP LYS ILE ASP GLY SER GLU ARG GLN ASN GLY VAL LEU ASN SER TRP THR ASP GLN ASP SER LYS ASP SER THR TYR SER MET SER SER THR LEU THR LEU THR LYS ASP GLU TYR GLU ARG HIS ASN SER TYR THR CYS GLU ALA THR HIS LYS THR SER THR SER PRO ILE VAL LYS SER PHE ASN ARG ASN GLU CYS Aspartic Acid D ASP 145.834406967622 None 115.02695 C4H5NO3 3 3.5 Isoleucine I ILE -118.924452889728 118.326263990502 None 113.08407 C6H11NO -1.8 -4.5 Valine V VAL -94.9992256001774 138.676696298665 None 99.06842 C5H9NO -1.5 -4.2 Methionine M MET -111.914532110789 116.830413000473 None 131.04049 C5H9NOS -1.3 -1.9 Threonine T THR -100.014586917422 119.577914753278 None 101.04768 C4H7NO2 -0.4 0.7 Glutamine Q GLN -113.502145556565 134.94729729202 None 128.05858 C5H8N2O2 0.2 3.5 Serine S SER -153.101198450505 150.23698499175 None 87.03203 C3H5NO2 0.3 0.8 Proline P PRO -69.8389025178602 178.175591493374 None 97.05277 C5H7NO 0.0 1.6 Serine S SER -108.201414926184 -0.463602636871325 None 87.03203 C3H5NO2 0.3 0.8 Serine S SER -148.308728775112 136.646884824819 None 87.03203 C3H5NO2 0.3 0.8 Leucine L LEU -138.581443452332 127.355694754437 None 113.08407 C6H11NO -1.8 -3.8 Serine S SER -127.089681940601 104.145025587514 None 87.03203 C3H5NO2 0.3 0.8 Valine V VAL -124.664798247097 160.537085501718 None 99.06842 C5H9NO -1.5 -4.2 Serine S SER -87.6570813551818 0.712266630641259 None 87.03203 C3H5NO2 0.3 0.8 alanine A ALA 85.2656115512386 137.329541480245 None 71.03712 C3H5NO -0.5 -1.8 Glycine G GLY 83.17705237262 -14.4915549366132 bII 57.02147 C2H3NO 0.0 0.4 Glutamic Acid E GLU -77.8891781033909 173.634932985804 None 129.0426 C5H7NO3 3 3.5 Arginine R ARG -123.869438671429 133.496686481656 None 156.10112 C6H12N4O 3 4.5 Valine V VAL -134.666477991461 156.63165580078 None 99.06842 C5H9NO -1.5 -4.2 Threonine T THR -148.803439165033 117.726854772614 None 101.04768 C4H7NO2 -0.4 0.7 Methionine M MET -100.889329418678 157.419276112561 None 131.04049 C5H9NOS -1.3 -1.9 Serine S SER -124.154489298388 171.475368536098 None 87.03203 C3H5NO2 0.3 0.8 Cysteine C CYS -162.769805879672 103.382163688365 None 103.00919 C3H5NOS -1 -2.5 Lysine K LYS -97.3927960923536 163.784291753993 None 128.09497 C6H12N2O 3 3.9 Serine S SER -124.784890159697 162.608565096062 None 87.03203 C3H5NO2 0.3 0.8 Serine S SER -85.6020218100604 -10.9575727362931 None 87.03203 C3H5NO2 0.3 0.8 Glutamine Q GLN -146.426322290114 147.505249386077 None 128.05858 C5H8N2O2 0.2 3.5 Serine S SER -57.539668176114 138.466305067417 bII 87.03203 C3H5NO2 0.3 0.8 Leucine L LEU -109.05262562458 2.47883940057485 None 113.08407 C6H11NO -1.8 -3.8 Leucine L LEU -87.7104475097104 131.894646239314 None 113.08407 C6H11NO -1.8 -3.8 Asparagine N ASN -72.4044500445597 165.064154355989 None 114.04293 C4H6N2O2 0.2 3.5 Serine S SER -101.599199807342 22.9584216295948 None 87.03203 C3H5NO2 0.3 0.8 Glycine G GLY -142.282855705478 -42.5470859151739 None 57.02147 C2H3NO 0.0 0.4 Asparagine N ASN -113.71595995161 -20.3884082366347 None 114.04293 C4H6N2O2 0.2 3.5 Glutamine Q GLN 62.2491398674635 81.7073858727034 lf 128.05858 C5H8N2O2 0.2 3.5 Lysine K LYS -163.15206503477 143.281019933271 None 128.09497 C6H12N2O 3 3.9 Asparagine N ASN -95.7935616556381 144.792044358295 None 114.04293 C4H6N2O2 0.2 3.5 Phenylalanine F PHE -101.891156783636 69.7549265271714 None 147.06842 C9H9NO -2.5 -2.8 Leucine L LEU -128.835710900691 128.077927357071 None 113.08407 C6H11NO -1.8 -3.8 alanine A ALA -121.242295833256 159.860696823922 None 71.03712 C3H5NO -0.5 -1.8 Tryptophan W TRP -126.506082298442 134.694343523976 None 186.07932 C11H10N2O -3.4 0.9 Tyrosine Y TYR -127.406135049985 148.569116587751 None 163.06333 C9H9NO2 -2.3 1.3 Glutamine Q GLN -112.355009549514 134.178922439603 None 128.05858 C5H8N2O2 0.2 3.5 Glutamine Q GLN -124.293952381683 96.6746016498252 None 128.05858 C5H8N2O2 0.2 3.5 Lysine K LYS -71.0661188940895 160.430673720202 None 128.09497 C6H12N2O 3 3.9 Proline P PRO -58.8377449336289 115.870227024947 bII 97.05277 C5H7NO 0.0 1.6 Glycine G GLY 75.3092675605134 32.3621033978107 lf 57.02147 C2H3NO 0.0 0.4 Glutamine Q GLN -136.729182843508 163.589716432426 None 128.05858 C5H8N2O2 0.2 3.5 Proline P PRO -72.4593013518724 168.615378505651 None 97.05277 C5H7NO 0.0 1.6 Proline P PRO -69.0622841222622 155.751817499964 None 97.05277 C5H7NO 0.0 1.6 Lysine K LYS -140.437802882394 132.579256007536 None 128.09497 C6H12N2O 3 3.9 Leucine L LEU -51.2968842870917 125.684998505087 bII 113.08407 C6H11NO -1.8 -3.8 Leucine L LEU -106.299177398786 -66.3308174412387 None 113.08407 C6H11NO -1.8 -3.8 Isoleucine I ILE -131.183079930118 139.682175426338 None 113.08407 C6H11NO -1.8 -4.5 Tyrosine Y TYR -125.218823741157 169.219178430524 None 163.06333 C9H9NO2 -2.3 1.3 Glycine G GLY 65.8912330672117 -167.030468250667 None 57.02147 C2H3NO 0.0 0.4 alanine A ALA -96.2933647982593 -10.8734521465769 None 71.03712 C3H5NO -0.5 -1.8 Serine S SER -130.645101502915 -2.52238214375734 None 87.03203 C3H5NO2 0.3 0.8 Threonine T THR -86.9347868191834 124.037616512585 None 101.04768 C4H7NO2 -0.4 0.7 Arginine R ARG -83.1909851999834 128.572360838603 None 156.10112 C6H12N4O 3 4.5 Glutamic Acid E GLU -76.0667351213411 139.366457279321 bII 129.0426 C5H7NO3 3 3.5 Serine S SER -47.7150805124213 133.34763018209 bII 87.03203 C3H5NO2 0.3 0.8 Glycine G GLY 94.6564849529029 -22.6473136068151 None 57.02147 C2H3NO 0.0 0.4 Valine V VAL -74.6265158901955 140.207202477985 None 99.06842 C5H9NO -1.5 -4.2 Proline P PRO -68.3147308984603 146.399479770203 None 97.05277 C5H7NO 0.0 1.6 Aspartic Acid D ASP -70.2213672425278 4.74203853501786 None 115.02695 C4H5NO3 3 3.5 Arginine R ARG -69.2308433538586 -30.1111745824063 bI 156.10112 C6H12N4O 3 4.5 Phenylalanine F PHE -92.9865266184872 129.217507490426 None 147.06842 C9H9NO -2.5 -2.8 Threonine T THR -142.398406361524 150.464357983802 None 101.04768 C4H7NO2 -0.4 0.7 Glycine G GLY -141.399402765994 148.359442219156 None 57.02147 C2H3NO 0.0 0.4 Serine S SER -132.055383109177 -177.711875243993 None 87.03203 C3H5NO2 0.3 0.8 Glycine G GLY 106.684905330253 169.590082535624 None 57.02147 C2H3NO 0.0 0.4 Serine S SER -166.614308644684 161.119930988494 None 87.03203 C3H5NO2 0.3 0.8 Glycine G GLY 70.3873298055794 -102.158702340474 None 57.02147 C2H3NO 0.0 0.4 Threonine T THR -114.849896755473 -19.6389557398877 None 101.04768 C4H7NO2 -0.4 0.7 Aspartic Acid D ASP -118.975055057901 114.819511944519 None 115.02695 C4H5NO3 3 3.5 Phenylalanine F PHE -118.287443706452 158.557514144576 None 147.06842 C9H9NO -2.5 -2.8 Threonine T THR -143.093631338667 165.910078997002 None 101.04768 C4H7NO2 -0.4 0.7 Leucine L LEU -139.62898803116 116.753442935449 None 113.08407 C6H11NO -1.8 -3.8 Threonine T THR -108.38578999646 134.839843476201 None 101.04768 C4H7NO2 -0.4 0.7 Isoleucine I ILE -111.531073652313 120.416338268934 None 113.08407 C6H11NO -1.8 -4.5 Serine S SER -73.5353807286276 -34.2523957535905 bI 87.03203 C3H5NO2 0.3 0.8 Serine S SER -144.558764074927 86.0671867988978 None 87.03203 C3H5NO2 0.3 0.8 Valine V VAL -48.267594090751 136.365279893696 bII 99.06842 C5H9NO -1.5 -4.2 Glutamine Q GLN -132.876274629361 158.293992526982 None 128.05858 C5H8N2O2 0.2 3.5 alanine A ALA -59.7657232444744 -12.3526435945261 bI 71.03712 C3H5NO -0.5 -1.8 Glutamic Acid E GLU -88.9702758672279 -23.7829668687497 None 129.0426 C5H7NO3 3 3.5 Aspartic Acid D ASP -62.1012224654215 -8.61865121815826 None 115.02695 C4H5NO3 3 3.5 Leucine L LEU -62.2825044037692 111.116237618795 bII 113.08407 C6H11NO -1.8 -3.8 alanine A ALA -168.797435954134 -179.152517576368 None 71.03712 C3H5NO -0.5 -1.8 Valine V VAL -107.178298466022 141.565884030525 None 99.06842 C5H9NO -1.5 -4.2 Tyrosine Y TYR -117.661158964946 109.285490278523 None 163.06333 C9H9NO2 -2.3 1.3 Tyrosine Y TYR -98.0035413776789 148.575813030097 None 163.06333 C9H9NO2 -2.3 1.3 Cysteine C CYS -120.700029655632 146.145291869203 None 103.00919 C3H5NOS -1 -2.5 Glutamine Q GLN -139.963263608596 145.44269109576 None 128.05858 C5H8N2O2 0.2 3.5 Asparagine N ASN -85.1436069085213 110.729111731394 None 114.04293 C4H6N2O2 0.2 3.5 Aspartic Acid D ASP -108.282353478097 30.4490939215697 None 115.02695 C4H5NO3 3 3.5 Histidine H HIS -82.2403918790186 -58.3010578797034 None 137.05891 C6H7N3O -0.5 3.2 Serine S SER -158.693901140799 165.713966302203 None 87.03203 C3H5NO2 0.3 0.8 Tyrosine Y TYR -76.7206271636057 135.95462632978 bII 163.06333 C9H9NO2 -2.3 1.3 Proline P PRO -78.4124480811235 149.297303789238 None 97.05277 C5H7NO 0.0 1.6 Leucine L LEU -71.7473060989411 140.171732475798 None 113.08407 C6H11NO -1.8 -3.8 Threonine T THR -124.918451018471 158.461872058059 None 101.04768 C4H7NO2 -0.4 0.7 Phenylalanine F PHE -116.967000746254 166.413101134708 None 147.06842 C9H9NO -2.5 -2.8 Glycine G GLY -105.813125135283 166.501432530063 None 57.02147 C2H3NO 0.0 0.4 alanine A ALA -52.0715743467643 -38.0335457523268 bI 71.03712 C3H5NO -0.5 -1.8 Glycine G GLY 111.831107574962 168.09294501059 None 57.02147 C2H3NO 0.0 0.4 Threonine T THR -149.753058551034 111.338126954135 None 101.04768 C4H7NO2 -0.4 0.7 Lysine K LYS -82.2326424342558 140.317139119449 None 128.09497 C6H12N2O 3 3.9 Leucine L LEU -115.449450372104 122.407507438408 None 113.08407 C6H11NO -1.8 -3.8 Glutamic Acid E GLU -117.717705177818 155.164183110888 None 129.0426 C5H7NO3 3 3.5 Isoleucine I ILE -111.274044820858 134.869143717507 None 113.08407 C6H11NO -1.8 -4.5 Lysine K LYS -89.5363938581312 148.101267205567 None 128.09497 C6H12N2O 3 3.9 Arginine R ARG -151.804401323046 175.946217160285 None 156.10112 C6H12N4O 3 4.5 alanine A ALA -73.2644930184455 141.022870701107 None 71.03712 C3H5NO -0.5 -1.8 Aspartic Acid D ASP -48.08060020764 125.378909221426 bII 115.02695 C4H5NO3 3 3.5 alanine A ALA -114.004633016812 156.54249495117 None 71.03712 C3H5NO -0.5 -1.8 alanine A ALA -109.494555681195 147.975897045528 None 71.03712 C3H5NO -0.5 -1.8 Proline P PRO -73.5239732520698 144.608616551821 None 97.05277 C5H7NO 0.0 1.6 Threonine T THR -97.3083165428686 137.510587856804 None 101.04768 C4H7NO2 -0.4 0.7 Valine V VAL -117.908311835951 154.67547332947 None 99.06842 C5H9NO -1.5 -4.2 Serine S SER -146.052557446675 143.194943046826 None 87.03203 C3H5NO2 0.3 0.8 Isoleucine I ILE -123.051734245591 124.594889303365 None 113.08407 C6H11NO -1.8 -4.5 Phenylalanine F PHE -118.726864910227 117.265378776411 None 147.06842 C9H9NO -2.5 -2.8 Proline P PRO -59.8425123334438 160.682839500414 None 97.05277 C5H7NO 0.0 1.6 Proline P PRO -64.1135700736318 153.522035200205 None 97.05277 C5H7NO 0.0 1.6 Serine S SER -85.7370151230605 149.225989671483 None 87.03203 C3H5NO2 0.3 0.8 Serine S SER -66.1466729294622 -56.5555438091206 None 87.03203 C3H5NO2 0.3 0.8 Glutamic Acid E GLU -36.3505417784024 -39.4863054500077 None 129.0426 C5H7NO3 3 3.5 Glutamine Q GLN -86.061973296726 -37.5904895434414 None 128.05858 C5H8N2O2 0.2 3.5 Leucine L LEU -49.4560638675617 -54.3052917227081 None 113.08407 C6H11NO -1.8 -3.8 Threonine T THR -56.1204527654759 39.4802136461694 None 101.04768 C4H7NO2 -0.4 0.7 Serine S SER -168.456651895276 9.8215624380364 None 87.03203 C3H5NO2 0.3 0.8 Glycine G GLY 116.950429356113 -68.7061553756264 None 57.02147 C2H3NO 0.0 0.4 Glycine G GLY -81.5264347635731 172.027681441098 None 57.02147 C2H3NO 0.0 0.4 alanine A ALA -163.04823866208 118.968613934981 None 71.03712 C3H5NO -0.5 -1.8 Serine S SER -118.293245860443 118.71975380533 None 87.03203 C3H5NO2 0.3 0.8 Valine V VAL -99.6754875718481 121.244818852651 None 99.06842 C5H9NO -1.5 -4.2 Valine V VAL -106.774847577409 133.608169114796 None 99.06842 C5H9NO -1.5 -4.2 Cysteine C CYS -118.094334735868 123.252770290375 None 103.00919 C3H5NOS -1 -2.5 Phenylalanine F PHE -112.347479429197 123.250377088876 None 147.06842 C9H9NO -2.5 -2.8 Leucine L LEU -110.668120527375 115.169759966679 None 113.08407 C6H11NO -1.8 -3.8 Asparagine N ASN -111.081421239783 137.345313785854 None 114.04293 C4H6N2O2 0.2 3.5 Asparagine N ASN 63.5050555132555 59.9683596712898 lf 114.04293 C4H6N2O2 0.2 3.5 Phenylalanine F PHE -125.462374723905 160.467435279427 None 147.06842 C9H9NO -2.5 -2.8 Tyrosine Y TYR -159.188376238784 138.800539305322 None 163.06333 C9H9NO2 -2.3 1.3 Proline P PRO -70.3340013789803 178.412320078304 None 97.05277 C5H7NO 0.0 1.6 Lysine K LYS -78.0228556264635 -35.2894659411475 bI 128.09497 C6H12N2O 3 3.9 Aspartic Acid D ASP -53.6178885556677 116.224423591328 bII 115.02695 C4H5NO3 3 3.5 Isoleucine I ILE -156.360292112927 120.53460445169 None 113.08407 C6H11NO -1.8 -4.5 Asparagine N ASN -96.3182482231322 142.384341159887 None 114.04293 C4H6N2O2 0.2 3.5 Valine V VAL -125.822325593273 134.665589423247 None 99.06842 C5H9NO -1.5 -4.2 Lysine K LYS -123.285902085557 135.887793697697 None 128.09497 C6H12N2O 3 3.9 Tryptophan W TRP -119.102943113258 105.346809933453 None 186.07932 C11H10N2O -3.4 0.9 Lysine K LYS -107.548688124108 87.305628958383 None 128.09497 C6H12N2O 3 3.9 Isoleucine I ILE -42.6783063457506 -66.6538805434862 None 113.08407 C6H11NO -1.8 -4.5 Aspartic Acid D ASP -130.387041571928 -66.9832949977225 None 115.02695 C4H5NO3 3 3.5 Glycine G GLY -67.1570655061662 -101.166622526379 None 57.02147 C2H3NO 0.0 0.4 Serine S SER -135.725715379476 131.905925239123 None 87.03203 C3H5NO2 0.3 0.8 Glutamic Acid E GLU -154.53436604391 -160.33867362009 None 129.0426 C5H7NO3 3 3.5 Arginine R ARG 155.283130777857 156.67224416882 None 156.10112 C6H12N4O 3 4.5 Glutamine Q GLN 176.817806169817 -174.709413699803 None 128.05858 C5H8N2O2 0.2 3.5 Asparagine N ASN -97.7848059615499 19.2255392314369 None 114.04293 C4H6N2O2 0.2 3.5 Glycine G GLY -101.027880035577 33.9085327232333 None 57.02147 C2H3NO 0.0 0.4 Valine V VAL -126.411234154376 123.559014963162 None 99.06842 C5H9NO -1.5 -4.2 Leucine L LEU -106.263693592827 142.017032338441 None 113.08407 C6H11NO -1.8 -3.8 Asparagine N ASN -134.522933070868 138.655340971474 None 114.04293 C4H6N2O2 0.2 3.5 Serine S SER -145.159721591317 121.205793719668 None 87.03203 C3H5NO2 0.3 0.8 Tryptophan W TRP -93.5381974205347 144.258400253864 None 186.07932 C11H10N2O -3.4 0.9 Threonine T THR -83.7017935605896 172.020677407801 None 101.04768 C4H7NO2 -0.4 0.7 Aspartic Acid D ASP -88.2498226284514 177.876098432282 None 115.02695 C4H5NO3 3 3.5 Glutamine Q GLN -69.7392580557172 134.029068373531 bII 128.05858 C5H8N2O2 0.2 3.5 Aspartic Acid D ASP -66.6682143226516 131.335172671811 bII 115.02695 C4H5NO3 3 3.5 Serine S SER -86.1559282679499 26.1891345696467 None 87.03203 C3H5NO2 0.3 0.8 Lysine K LYS -127.446068409268 -49.6248093502474 None 128.09497 C6H12N2O 3 3.9 Aspartic Acid D ASP -118.120914395903 -6.49138764604795 None 115.02695 C4H5NO3 3 3.5 Serine S SER 72.230783873548 15.0179948648274 lf 87.03203 C3H5NO2 0.3 0.8 Threonine T THR -87.2170009753832 151.841251554114 None 101.04768 C4H7NO2 -0.4 0.7 Tyrosine Y TYR -103.050029325923 172.459749712964 None 163.06333 C9H9NO2 -2.3 1.3 Serine S SER -143.887511544348 159.71607020055 None 87.03203 C3H5NO2 0.3 0.8 Methionine M MET -153.224236637424 149.720607451905 None 131.04049 C5H9NOS -1.3 -1.9 Serine S SER -122.062380684935 144.33845689463 None 87.03203 C3H5NO2 0.3 0.8 Serine S SER -128.873651917524 127.732070163683 None 87.03203 C3H5NO2 0.3 0.8 Threonine T THR -123.765421342959 124.504895777111 None 101.04768 C4H7NO2 -0.4 0.7 Leucine L LEU -105.465668079526 115.351447303176 None 113.08407 C6H11NO -1.8 -3.8 Threonine T THR -120.562437953333 109.88662692187 None 101.04768 C4H7NO2 -0.4 0.7 Leucine L LEU -113.154552237644 -158.591287989495 None 113.08407 C6H11NO -1.8 -3.8 Threonine T THR -101.837180156939 148.605049310209 None 101.04768 C4H7NO2 -0.4 0.7 Lysine K LYS -51.6915851978058 -45.1036978937795 bI 128.09497 C6H12N2O 3 3.9 Aspartic Acid D ASP -59.337480054271 -66.6215987862038 pi 115.02695 C4H5NO3 3 3.5 Glutamic Acid E GLU -44.0552106590427 -54.3906191781021 None 129.0426 C5H7NO3 3 3.5 Tyrosine Y TYR -49.1157160403914 -62.7476469587891 pi 163.06333 C9H9NO2 -2.3 1.3 Glutamic Acid E GLU -67.1655342925322 21.5551149434612 None 129.0426 C5H7NO3 3 3.5 Arginine R ARG -92.7135886192548 -70.5790108288677 None 156.10112 C6H12N4O 3 4.5 Histidine H HIS -76.3904209924439 -168.799219936385 None 137.05891 C6H7N3O -0.5 3.2 Asparagine N ASN -163.458833132548 -9.68600298527929 None 114.04293 C4H6N2O2 0.2 3.5 Serine S SER -104.524457674314 117.147308414989 None 87.03203 C3H5NO2 0.3 0.8 Tyrosine Y TYR -116.365583372062 126.958256063082 None 163.06333 C9H9NO2 -2.3 1.3 Threonine T THR -130.209717875728 158.808182223792 None 101.04768 C4H7NO2 -0.4 0.7 Cysteine C CYS -132.974129719031 132.686642251738 None 103.00919 C3H5NOS -1 -2.5 Glutamic Acid E GLU -154.157874532125 117.272553313523 None 129.0426 C5H7NO3 3 3.5 alanine A ALA -92.778529336936 156.34646871209 None 71.03712 C3H5NO -0.5 -1.8 Threonine T THR -128.353717100572 94.6905004425148 None 101.04768 C4H7NO2 -0.4 0.7 Histidine H HIS -102.955967408461 140.948880468387 None 137.05891 C6H7N3O -0.5 3.2 Lysine K LYS -54.2985405069815 -22.4108780578569 3h 128.09497 C6H12N2O 3 3.9 Threonine T THR -63.1749348754105 -67.7826569210559 pi 101.04768 C4H7NO2 -0.4 0.7 Serine S SER -93.6220524508651 168.959740900738 None 87.03203 C3H5NO2 0.3 0.8 Threonine T THR -97.9376666110976 -48.2115654053445 None 101.04768 C4H7NO2 -0.4 0.7 Serine S SER -53.8923346986235 121.30064661201 bII 87.03203 C3H5NO2 0.3 0.8 Proline P PRO -52.7854920650387 132.416052645464 bII 97.05277 C5H7NO 0.0 1.6 Isoleucine I ILE -100.637562400822 133.555397890553 None 113.08407 C6H11NO -1.8 -4.5 Valine V VAL -141.688933911104 88.9736750343202 None 99.06842 C5H9NO -1.5 -4.2 Lysine K LYS -77.7372570015348 145.068088447309 None 128.09497 C6H12N2O 3 3.9 Serine S SER -143.526048555106 163.548562812071 None 87.03203 C3H5NO2 0.3 0.8 Phenylalanine F PHE -161.904038504157 139.108886170875 None 147.06842 C9H9NO -2.5 -2.8 Asparagine N ASN -124.010778332398 132.083863742667 None 114.04293 C4H6N2O2 0.2 3.5 Arginine R ARG 167.461310458114 167.749927468066 None 156.10112 C6H12N4O 3 4.5 Asparagine N ASN 158.285259849348 -35.9190639242033 None 114.04293 C4H6N2O2 0.2 3.5 Glutamic Acid E GLU -54.8937597947718 -54.4001902897381 None 129.0426 C5H7NO3 3 3.5 Cysteine C CYS -65.136382463335 -128.290053660784 None 103.00919 C3H5NOS -1 -2.5 EVKLVESGGGLVQPGGSLRLSCATSGFTFSDFYMEWVRQPPGKRLEWIAASRNKGNKYTTEYSASVKGRFIVSRDTSQSILYLQMNALRAEDTAIYYCARNYYGSTWYFDVWGAGTTVTVSSESARNPTIYPLTLPPALSSDPVIIGCLIHDYFPSGTMNVTWGKSGKDITTVNFPPALASGGRYTMSNQLTLPAVECPEGESVKCSVQHDSNPVQELDVNC GLU VAL LYS LEU VAL GLU SER GLY GLY GLY LEU VAL GLN PRO GLY GLY SER LEU ARG LEU SER CYS ALA THR SER GLY PHE THR PHE SER ASP PHE TYR MET GLU TRP VAL ARG GLN PRO PRO GLY LYS ARG LEU GLU TRP ILE ALA ALA SER ARG ASN LYS GLY ASN LYS TYR THR THR GLU TYR SER ALA SER VAL LYS GLY ARG PHE ILE VAL SER ARG ASP THR SER GLN SER ILE LEU TYR LEU GLN MET ASN ALA LEU ARG ALA GLU ASP THR ALA ILE TYR TYR CYS ALA ARG ASN TYR TYR GLY SER THR TRP TYR PHE ASP VAL TRP GLY ALA GLY THR THR VAL THR VAL SER SER GLU SER ALA ARG ASN PRO THR ILE TYR PRO LEU THR LEU PRO PRO ALA LEU SER SER ASP PRO VAL ILE ILE GLY CYS LEU ILE HIS ASP TYR PHE PRO SER GLY THR MET ASN VAL THR TRP GLY LYS SER GLY LYS ASP ILE THR THR VAL ASN PHE PRO PRO ALA LEU ALA SER GLY GLY ARG TYR THR MET SER ASN GLN LEU THR LEU PRO ALA VAL GLU CYS PRO GLU GLY GLU SER VAL LYS CYS SER VAL GLN HIS ASP SER ASN PRO VAL GLN GLU LEU ASP VAL ASN CYS Glutamic Acid E GLU -89.3789325655576 -11.3317597083371 None 129.0426 C5H7NO3 3 3.5 Valine V VAL -75.8930947561901 104.077941725457 bII 99.06842 C5H9NO -1.5 -4.2 Lysine K LYS -128.080513762339 143.475352008986 None 128.09497 C6H12N2O 3 3.9 Leucine L LEU -127.599524798469 123.250859088471 None 113.08407 C6H11NO -1.8 -3.8 Valine V VAL -127.209510853665 120.167416750413 None 99.06842 C5H9NO -1.5 -4.2 Glutamic Acid E GLU -106.296124972159 143.993170037104 None 129.0426 C5H7NO3 3 3.5 Serine S SER -141.614241388059 168.147906121235 None 87.03203 C3H5NO2 0.3 0.8 Glycine G GLY 96.6850401538957 87.7753817256135 None 57.02147 C2H3NO 0.0 0.4 Glycine G GLY -175.127451732022 142.434677974496 None 57.02147 C2H3NO 0.0 0.4 Glycine G GLY 166.126716577109 -149.10311338388 None 57.02147 C2H3NO 0.0 0.4 Leucine L LEU -68.0211302443371 148.554647923128 None 113.08407 C6H11NO -1.8 -3.8 Valine V VAL -159.300271330271 141.457038979231 None 99.06842 C5H9NO -1.5 -4.2 Glutamine Q GLN -84.3781464615551 152.48894907768 None 128.05858 C5H8N2O2 0.2 3.5 Proline P PRO -52.2464374987642 131.726894533765 bII 97.05277 C5H7NO 0.0 1.6 Glycine G GLY 98.5732177852681 -19.9690727901964 bII 57.02147 C2H3NO 0.0 0.4 Glycine G GLY -70.2727633354578 -165.120675374038 None 57.02147 C2H3NO 0.0 0.4 Serine S SER -147.153624157124 158.726212084133 None 87.03203 C3H5NO2 0.3 0.8 Leucine L LEU -147.524284085132 154.06145612769 None 113.08407 C6H11NO -1.8 -3.8 Arginine R ARG -122.27405318574 107.007117710182 None 156.10112 C6H12N4O 3 4.5 Leucine L LEU -91.0815817934105 139.728515008473 None 113.08407 C6H11NO -1.8 -3.8 Serine S SER -125.519348782675 151.594940798379 None 87.03203 C3H5NO2 0.3 0.8 Cysteine C CYS -132.52361558464 102.728895015515 None 103.00919 C3H5NOS -1 -2.5 alanine A ALA -78.6072859215652 118.135535187583 bII 71.03712 C3H5NO -0.5 -1.8 Threonine T THR -109.368331420262 114.677498615166 None 101.04768 C4H7NO2 -0.4 0.7 Serine S SER -131.154273932808 175.625331463882 None 87.03203 C3H5NO2 0.3 0.8 Glycine G GLY 84.3543609460589 9.14443366025538 bII 57.02147 C2H3NO 0.0 0.4 Phenylalanine F PHE -162.475844782453 168.036931813444 None 147.06842 C9H9NO -2.5 -2.8 Threonine T THR -80.8436327978525 99.3976468012594 None 101.04768 C4H7NO2 -0.4 0.7 Phenylalanine F PHE -66.453759266011 -39.4574440942234 bI 147.06842 C9H9NO -2.5 -2.8 Serine S SER -54.5684618484976 19.5723876008528 None 87.03203 C3H5NO2 0.3 0.8 Aspartic Acid D ASP 179.02821898263 35.6768063139057 None 115.02695 C4H5NO3 3 3.5 Phenylalanine F PHE -126.729618108838 142.597579232987 None 147.06842 C9H9NO -2.5 -2.8 Tyrosine Y TYR -73.2071886003302 136.914529515033 bII 163.06333 C9H9NO2 -2.3 1.3 Methionine M MET -113.602189090115 145.766587420297 None 131.04049 C5H9NOS -1.3 -1.9 Glutamic Acid E GLU -134.840611473463 148.9802178943 None 129.0426 C5H7NO3 3 3.5 Tryptophan W TRP -112.384363422388 136.064594471441 None 186.07932 C11H10N2O -3.4 0.9 Valine V VAL -132.547900918842 137.824841359151 None 99.06842 C5H9NO -1.5 -4.2 Arginine R ARG -116.444087163717 159.704992978281 None 156.10112 C6H12N4O 3 4.5 Glutamine Q GLN -134.575338558477 98.5580550021139 None 128.05858 C5H8N2O2 0.2 3.5 Proline P PRO -63.1403842800701 166.43743387089 None 97.05277 C5H7NO 0.0 1.6 Proline P PRO -54.9633031364476 -50.3243293074458 None 97.05277 C5H7NO 0.0 1.6 Glycine G GLY -125.371467760152 61.903714731912 None 57.02147 C2H3NO 0.0 0.4 Lysine K LYS -154.547960413858 164.818304410472 None 128.09497 C6H12N2O 3 3.9 Arginine R ARG -66.0223028507891 170.031525485813 None 156.10112 C6H12N4O 3 4.5 Leucine L LEU -75.3920013391388 139.026644726474 bII 113.08407 C6H11NO -1.8 -3.8 Glutamic Acid E GLU -131.951015497092 133.383308054878 None 129.0426 C5H7NO3 3 3.5 Tryptophan W TRP -90.8789567909878 138.910229244007 None 186.07932 C11H10N2O -3.4 0.9 Isoleucine I ILE -125.654659011192 -104.620718218078 None 113.08407 C6H11NO -1.8 -4.5 alanine A ALA -73.1952786509912 179.730901627493 None 71.03712 C3H5NO -0.5 -1.8 alanine A ALA -160.6871437571 134.15500769056 None 71.03712 C3H5NO -0.5 -1.8 Serine S SER -106.537239465223 173.36343228333 None 87.03203 C3H5NO2 0.3 0.8 Arginine R ARG -139.144725265021 161.356510621199 None 156.10112 C6H12N4O 3 4.5 Asparagine N ASN -69.002133808167 145.284808435545 None 114.04293 C4H6N2O2 0.2 3.5 Lysine K LYS -56.9981857601255 68.3374981336367 None 128.09497 C6H12N2O 3 3.9 Glycine G GLY -142.329435032239 -39.1033995344522 None 57.02147 C2H3NO 0.0 0.4 Asparagine N ASN -134.970619612502 49.6856543791425 None 114.04293 C4H6N2O2 0.2 3.5 Lysine K LYS 66.4120666846242 124.925974500732 lf 128.09497 C6H12N2O 3 3.9 Tyrosine Y TYR -64.8958556574632 65.7022125015992 None 163.06333 C9H9NO2 -2.3 1.3 Threonine T THR -60.7645683969272 158.565992819187 None 101.04768 C4H7NO2 -0.4 0.7 Threonine T THR -129.949935739028 166.564875525326 None 101.04768 C4H7NO2 -0.4 0.7 Glutamic Acid E GLU -152.146925392914 134.039058778728 None 129.0426 C5H7NO3 3 3.5 Tyrosine Y TYR -124.504442703587 148.125374724596 None 163.06333 C9H9NO2 -2.3 1.3 Serine S SER -73.7116680802119 153.796469400542 None 87.03203 C3H5NO2 0.3 0.8 alanine A ALA -52.9098196139585 -40.932311194103 bI 71.03712 C3H5NO -0.5 -1.8 Serine S SER -48.0935626109156 -28.1569900443353 3h 87.03203 C3H5NO2 0.3 0.8 Valine V VAL -133.970513272744 -12.7243875497236 None 99.06842 C5H9NO -1.5 -4.2 Lysine K LYS -56.3930286340419 124.928793283223 bII 128.09497 C6H12N2O 3 3.9 Glycine G GLY 110.531711441215 -33.4270589467119 None 57.02147 C2H3NO 0.0 0.4 Arginine R ARG -106.243690214825 -40.8532948275719 None 156.10112 C6H12N4O 3 4.5 Phenylalanine F PHE -86.3402170486764 143.061350729036 None 147.06842 C9H9NO -2.5 -2.8 Isoleucine I ILE -134.534153448144 126.780299875973 None 113.08407 C6H11NO -1.8 -4.5 Valine V VAL -97.3177925218495 137.188612669709 None 99.06842 C5H9NO -1.5 -4.2 Serine S SER -152.610278861431 170.468372023868 None 87.03203 C3H5NO2 0.3 0.8 Arginine R ARG -138.360232867143 139.622738226178 None 156.10112 C6H12N4O 3 4.5 Aspartic Acid D ASP -91.5256098375843 89.6264875896251 None 115.02695 C4H5NO3 3 3.5 Threonine T THR -59.4547389172764 -25.9079278522831 bI 101.04768 C4H7NO2 -0.4 0.7 Serine S SER -78.2339611700202 -34.5758674397758 bI 87.03203 C3H5NO2 0.3 0.8 Glutamine Q GLN -95.2456273492079 -15.9481747548958 None 128.05858 C5H8N2O2 0.2 3.5 Serine S SER 76.6175297640775 42.490688560242 lf 87.03203 C3H5NO2 0.3 0.8 Isoleucine I ILE -123.934017839054 135.425404795015 None 113.08407 C6H11NO -1.8 -4.5 Leucine L LEU -107.895952315269 127.991044124994 None 113.08407 C6H11NO -1.8 -3.8 Tyrosine Y TYR -103.2332871392 155.185622770558 None 163.06333 C9H9NO2 -2.3 1.3 Leucine L LEU -138.772129546326 103.984986839841 None 113.08407 C6H11NO -1.8 -3.8 Glutamine Q GLN -84.5827100951532 122.286484134209 None 128.05858 C5H8N2O2 0.2 3.5 Methionine M MET -118.082978350016 113.154924742432 None 131.04049 C5H9NOS -1.3 -1.9 Asparagine N ASN -105.480433206843 151.698965988463 None 114.04293 C4H6N2O2 0.2 3.5 alanine A ALA 55.356208093199 60.7163604120994 lf 71.03712 C3H5NO -0.5 -1.8 Leucine L LEU -76.2943800173122 158.418660308099 None 113.08407 C6H11NO -1.8 -3.8 Arginine R ARG -132.523799975949 166.601576725446 None 156.10112 C6H12N4O 3 4.5 alanine A ALA -53.6203543965592 -37.4639351905196 bI 71.03712 C3H5NO -0.5 -1.8 Glutamic Acid E GLU -53.9460321877929 -20.4815116353427 3h 129.0426 C5H7NO3 3 3.5 Aspartic Acid D ASP -89.7300948187521 -0.923662707843081 None 115.02695 C4H5NO3 3 3.5 Threonine T THR -68.9007222873076 118.588765894249 bII 101.04768 C4H7NO2 -0.4 0.7 alanine A ALA -172.491164943003 166.628473148443 None 71.03712 C3H5NO -0.5 -1.8 Isoleucine I ILE -83.6151252518665 130.109547124865 None 113.08407 C6H11NO -1.8 -4.5 Tyrosine Y TYR -111.629436460893 134.500683245424 None 163.06333 C9H9NO2 -2.3 1.3 Tyrosine Y TYR -124.560125325413 145.947820994211 None 163.06333 C9H9NO2 -2.3 1.3 Cysteine C CYS -105.658415787179 155.399494120081 None 103.00919 C3H5NOS -1 -2.5 alanine A ALA -145.517023124632 154.291948733652 None 71.03712 C3H5NO -0.5 -1.8 Arginine R ARG -98.4046268387142 120.592343940764 None 156.10112 C6H12N4O 3 4.5 Asparagine N ASN -91.98987651593 89.1462401866179 None 114.04293 C4H6N2O2 0.2 3.5 Tyrosine Y TYR -72.4532329274952 151.750922184354 None 163.06333 C9H9NO2 -2.3 1.3 Tyrosine Y TYR -137.071640663967 120.340058845181 None 163.06333 C9H9NO2 -2.3 1.3 Glycine G GLY -132.037304870527 -78.2189062072661 None 57.02147 C2H3NO 0.0 0.4 Serine S SER -87.4010182210615 -53.4531605421028 None 87.03203 C3H5NO2 0.3 0.8 Threonine T THR -124.913569255558 175.553794755273 None 101.04768 C4H7NO2 -0.4 0.7 Tryptophan W TRP -98.7208306515261 146.520771020632 None 186.07932 C11H10N2O -3.4 0.9 Tyrosine Y TYR -163.241894956235 166.304949315544 None 163.06333 C9H9NO2 -2.3 1.3 Phenylalanine F PHE -103.363920121693 106.512642978641 None 147.06842 C9H9NO -2.5 -2.8 Aspartic Acid D ASP -84.916649455298 -28.7392825178569 None 115.02695 C4H5NO3 3 3.5 Valine V VAL -137.904123001106 130.892657794751 None 99.06842 C5H9NO -1.5 -4.2 Tryptophan W TRP -116.559120079003 160.041568380193 None 186.07932 C11H10N2O -3.4 0.9 Glycine G GLY -86.3765761972628 -177.157209675168 None 57.02147 C2H3NO 0.0 0.4 alanine A ALA -83.5286144705068 -20.0026113092919 None 71.03712 C3H5NO -0.5 -1.8 Glycine G GLY 99.3342113301038 160.206965292507 None 57.02147 C2H3NO 0.0 0.4 Threonine T THR -146.574220153365 128.931872684007 None 101.04768 C4H7NO2 -0.4 0.7 Threonine T THR -90.4987195403494 127.970584519853 None 101.04768 C4H7NO2 -0.4 0.7 Valine V VAL -120.291267197375 113.693818103086 None 99.06842 C5H9NO -1.5 -4.2 Threonine T THR -104.217781032358 119.691065433466 None 101.04768 C4H7NO2 -0.4 0.7 Valine V VAL -99.7629087062365 103.488667145133 None 99.06842 C5H9NO -1.5 -4.2 Serine S SER -141.704816104584 148.506883127508 None 87.03203 C3H5NO2 0.3 0.8 Serine S SER -71.5501832719916 -36.0453820830083 bI 87.03203 C3H5NO2 0.3 0.8 Glutamic Acid E GLU -56.3299594991009 -173.209239518732 None 129.0426 C5H7NO3 3 3.5 Serine S SER -150.245847129994 156.120288523554 None 87.03203 C3H5NO2 0.3 0.8 alanine A ALA -48.126916541689 131.353797524128 bII 71.03712 C3H5NO -0.5 -1.8 Arginine R ARG -140.191773202376 114.776885177667 None 156.10112 C6H12N4O 3 4.5 Asparagine N ASN -74.5131909787123 148.370210564431 None 114.04293 C4H6N2O2 0.2 3.5 Proline P PRO -65.4919047089509 166.27454461676 None 97.05277 C5H7NO 0.0 1.6 Threonine T THR -128.914466267273 108.064093334934 None 101.04768 C4H7NO2 -0.4 0.7 Isoleucine I ILE -80.930187539882 120.886634477806 None 113.08407 C6H11NO -1.8 -4.5 Tyrosine Y TYR -109.788370809057 140.19143278761 None 163.06333 C9H9NO2 -2.3 1.3 Proline P PRO -73.1395549338965 143.972591204514 None 97.05277 C5H7NO 0.0 1.6 Leucine L LEU -116.030759017218 99.6893364686374 None 113.08407 C6H11NO -1.8 -3.8 Threonine T THR -133.627119057155 166.872438093783 None 101.04768 C4H7NO2 -0.4 0.7 Leucine L LEU -128.809720207144 138.896872542865 None 113.08407 C6H11NO -1.8 -3.8 Proline P PRO -60.2381475528073 127.926032435167 bII 97.05277 C5H7NO 0.0 1.6 Proline P PRO -54.2776226784458 63.0051326537962 None 97.05277 C5H7NO 0.0 1.6 alanine A ALA -159.418420856655 8.24903909314804 None 71.03712 C3H5NO -0.5 -1.8 Leucine L LEU -137.217671800922 -21.5571467222929 None 113.08407 C6H11NO -1.8 -3.8 Serine S SER -86.8491462759597 117.932814127832 None 87.03203 C3H5NO2 0.3 0.8 Serine S SER -101.576432217779 -1.51701465632654 None 87.03203 C3H5NO2 0.3 0.8 Aspartic Acid D ASP 65.9588489421798 124.960046492165 lf 115.02695 C4H5NO3 3 3.5 Proline P PRO -56.3535614450684 158.737993602095 None 97.05277 C5H7NO 0.0 1.6 Valine V VAL -79.0195677244217 159.123223028981 None 99.06842 C5H9NO -1.5 -4.2 Isoleucine I ILE -135.524334166626 128.997713962683 None 113.08407 C6H11NO -1.8 -4.5 Isoleucine I ILE -139.779352043932 157.490347039249 None 113.08407 C6H11NO -1.8 -4.5 Glycine G GLY -161.102487224929 -174.77505021575 None 57.02147 C2H3NO 0.0 0.4 Cysteine C CYS -130.505843006331 125.424947608497 None 103.00919 C3H5NOS -1 -2.5 Leucine L LEU -93.680759417563 120.049416649232 None 113.08407 C6H11NO -1.8 -3.8 Isoleucine I ILE -95.4505328429663 105.270181967732 None 113.08407 C6H11NO -1.8 -4.5 Histidine H HIS -128.606102689554 134.575451992697 None 137.05891 C6H7N3O -0.5 3.2 Aspartic Acid D ASP 61.2982755156279 85.899171968235 lf 115.02695 C4H5NO3 3 3.5 Tyrosine Y TYR -147.912833445133 165.179137652845 None 163.06333 C9H9NO2 -2.3 1.3 Phenylalanine F PHE -156.635740217035 131.810226091421 None 147.06842 C9H9NO -2.5 -2.8 Proline P PRO -83.7433359038357 -168.847477494688 None 97.05277 C5H7NO 0.0 1.6 Serine S SER -85.1872705505145 -53.0855725949143 None 87.03203 C3H5NO2 0.3 0.8 Glycine G GLY 42.8767551176328 -129.335365968644 None 57.02147 C2H3NO 0.0 0.4 Threonine T THR -122.278674550189 131.366862874353 None 101.04768 C4H7NO2 -0.4 0.7 Methionine M MET -125.280543422891 112.943031530088 None 131.04049 C5H9NOS -1.3 -1.9 Asparagine N ASN -99.2828003412059 126.444187719689 None 114.04293 C4H6N2O2 0.2 3.5 Valine V VAL -125.136687466581 129.836408305184 None 99.06842 C5H9NO -1.5 -4.2 Threonine T THR -131.260093543495 151.148999389054 None 101.04768 C4H7NO2 -0.4 0.7 Tryptophan W TRP -112.500816210635 151.005839800198 None 186.07932 C11H10N2O -3.4 0.9 Glycine G GLY -79.6350957589303 43.1215251984535 None 57.02147 C2H3NO 0.0 0.4 Lysine K LYS -165.616699565269 139.364415020697 None 128.09497 C6H12N2O 3 3.9 Serine S SER -165.886342269074 170.967092115497 None 87.03203 C3H5NO2 0.3 0.8 Glycine G GLY 145.16261559853 -152.56167534119 None 57.02147 C2H3NO 0.0 0.4 Lysine K LYS -58.0554544126711 -92.1783998495653 None 128.09497 C6H12N2O 3 3.9 Aspartic Acid D ASP -75.2456059043438 111.45512369431 bII 115.02695 C4H5NO3 3 3.5 Isoleucine I ILE 167.485422154376 109.860247000052 None 113.08407 C6H11NO -1.8 -4.5 Threonine T THR -110.069238621412 147.391710495102 None 101.04768 C4H7NO2 -0.4 0.7 Threonine T THR -120.045523281078 132.240763742749 None 101.04768 C4H7NO2 -0.4 0.7 Valine V VAL -122.290143541078 119.747696260191 None 99.06842 C5H9NO -1.5 -4.2 Asparagine N ASN -107.245414047792 120.827196097141 None 114.04293 C4H6N2O2 0.2 3.5 Phenylalanine F PHE -88.8209071635162 145.021694765826 None 147.06842 C9H9NO -2.5 -2.8 Proline P PRO -61.1644740772168 159.726016454497 None 97.05277 C5H7NO 0.0 1.6 Proline P PRO -71.7711468558546 150.171928859759 None 97.05277 C5H7NO 0.0 1.6 alanine A ALA -126.129837971946 131.989120462825 None 71.03712 C3H5NO -0.5 -1.8 Leucine L LEU -73.6912174132803 119.527948219345 bII 113.08407 C6H11NO -1.8 -3.8 alanine A ALA -89.7376620338696 -141.581384900963 None 71.03712 C3H5NO -0.5 -1.8 Serine S SER -106.241837012326 105.402004438415 None 87.03203 C3H5NO2 0.3 0.8 Glycine G GLY 147.17869408177 -32.1774004518747 None 57.02147 C2H3NO 0.0 0.4 Glycine G GLY 102.098877451823 19.4586854904331 None 57.02147 C2H3NO 0.0 0.4 Arginine R ARG -120.097445015057 156.258044534537 None 156.10112 C6H12N4O 3 4.5 Tyrosine Y TYR -96.6080379510133 160.89591728987 None 163.06333 C9H9NO2 -2.3 1.3 Threonine T THR -146.343811047885 144.323502349161 None 101.04768 C4H7NO2 -0.4 0.7 Methionine M MET -142.985219356717 163.102667707147 None 131.04049 C5H9NOS -1.3 -1.9 Serine S SER -135.322627129655 164.78582534684 None 87.03203 C3H5NO2 0.3 0.8 Asparagine N ASN -153.80153448795 116.740555743233 None 114.04293 C4H6N2O2 0.2 3.5 Glutamine Q GLN -116.090815960213 149.722132545704 None 128.05858 C5H8N2O2 0.2 3.5 Leucine L LEU -131.548079251071 121.907955051749 None 113.08407 C6H11NO -1.8 -3.8 Threonine T THR -116.72913716009 139.454774355379 None 101.04768 C4H7NO2 -0.4 0.7 Leucine L LEU -160.688800344794 150.895401213317 None 113.08407 C6H11NO -1.8 -3.8 Proline P PRO -40.4679567168175 124.984765544677 bII 97.05277 C5H7NO 0.0 1.6 alanine A ALA -53.2644591980888 -19.2766649601203 3h 71.03712 C3H5NO -0.5 -1.8 Valine V VAL -94.0427827453871 6.31241438131191 None 99.06842 C5H9NO -1.5 -4.2 Glutamic Acid E GLU -110.427018829341 3.6157222175772 None 129.0426 C5H7NO3 3 3.5 Cysteine C CYS -162.227920140836 54.9655829858335 None 103.00919 C3H5NOS -1 -2.5 Proline P PRO -57.9306062769261 -119.168658596883 None 97.05277 C5H7NO 0.0 1.6 Glutamic Acid E GLU -130.58891965133 157.83510459151 None 129.0426 C5H7NO3 3 3.5 Glycine G GLY 49.2186170045518 22.2460683444812 lf 57.02147 C2H3NO 0.0 0.4 Glutamic Acid E GLU -98.7306108756098 -98.5234520915243 None 129.0426 C5H7NO3 3 3.5 Serine S SER 112.560800354928 149.333068990483 None 87.03203 C3H5NO2 0.3 0.8 Valine V VAL -132.106696273467 135.170208764365 None 99.06842 C5H9NO -1.5 -4.2 Lysine K LYS -87.5781564339663 133.344281586214 None 128.09497 C6H12N2O 3 3.9 Cysteine C CYS -106.589305506597 132.686420127868 None 103.00919 C3H5NOS -1 -2.5 Serine S SER -115.768609268892 123.821810973986 None 87.03203 C3H5NO2 0.3 0.8 Valine V VAL -101.851906966297 136.390624153941 None 99.06842 C5H9NO -1.5 -4.2 Glutamine Q GLN -126.168181491846 118.063613548678 None 128.05858 C5H8N2O2 0.2 3.5 Histidine H HIS -111.482877203088 120.540211172955 None 137.05891 C6H7N3O -0.5 3.2 Aspartic Acid D ASP 42.8792786624104 -123.314871679544 None 115.02695 C4H5NO3 3 3.5 Serine S SER -82.1382169739171 -14.8542077490347 None 87.03203 C3H5NO2 0.3 0.8 Asparagine N ASN -98.3836078886776 173.376888469567 None 114.04293 C4H6N2O2 0.2 3.5 Proline P PRO -57.8929031867294 151.828295093082 None 97.05277 C5H7NO 0.0 1.6 Valine V VAL -61.4409772773821 154.117380064693 None 99.06842 C5H9NO -1.5 -4.2 Glutamine Q GLN -135.892918785363 135.507959810763 None 128.05858 C5H8N2O2 0.2 3.5 Glutamic Acid E GLU -144.085177114193 151.311184165606 None 129.0426 C5H7NO3 3 3.5 Leucine L LEU -134.622384133317 153.290846946694 None 113.08407 C6H11NO -1.8 -3.8 Aspartic Acid D ASP -110.848010409456 117.450675967874 None 115.02695 C4H5NO3 3 3.5 Valine V VAL -106.723610201195 131.529304357501 None 99.06842 C5H9NO -1.5 -4.2 Asparagine N ASN -78.351888099595 140.354773375637 None 114.04293 C4H6N2O2 0.2 3.5 Cysteine C CYS -58.5888153461162 None 103.00919 C3H5NOS -1 -2.5 FOR RESIDUES 28-37 AND 162-163 OF THE LIGHT CHAIN AND RESIDUE 202 OF THE HEAVY CHAIN, THE DENSITY WAS POOR. THESE RESIDUES WERE BUILT MAINLY BY STEREOCHEMISTRY. RESIDUES PRO L 8, PRO L 101, PRO L 147, PRO H 143, PRO H 155 ARE CIS PROLINES. SO4 1 5 SULFATE O4 S1 138(H2 O1) CYS L 23 CYS L 94 CYS L 140 CYS L 200 CYS H 22 CYS H 98 CYS H 148 CYS H 206 CYS H 198 CYS H 222 162.531 162.531 60.719 90.00 90.00 120.00 P 63 6 1.000000 0.000000 0.000000 0.00000 0.000000 1.000000 0.000000 0.00000 0.000000 0.000000 1.000000 0.00000 .007104 0.000000 0.000000 0.00000 .003552 .006153 0.000000 0.00000 0.000000 0.000000 .016469 0.00000 N ASP L 1 62.830 59.940 -41.975 1.00 16.89 1MCP 1 27 CA ASP L 1 63.007 60.607 -40.684 1.00 16.66 1MCP 1 28 C ASP L 1 63.032 62.116 -40.864 1.00 15.96 1MCP 1 29 O ASP L 1 63.418 62.715 -41.870 1.00 16.30 1MCP 1 30 CB ASP L 1 64.103 59.931 -39.904 1.00 17.67 1MCP 1 31 CG ASP L 1 63.949 58.404 -40.008 1.00 18.53 1MCP 1 32 OD1 ASP L 1 63.524 57.731 -39.071 1.00 19.13 1MCP 1 33 OD2 ASP L 1 64.290 57.847 -41.059 1.00 19.05 1MCP 1 34 N ILE L 2 62.501 62.758 -39.879 1.00 14.82 1MCP 1 35 CA ILE L 2 62.321 64.242 -39.786 1.00 13.65 1MCP 1 36 C ILE L 2 63.137 64.575 -38.577 1.00 12.88 1MCP 1 37 O ILE L 2 63.081 63.828 -37.568 1.00 12.55 1MCP 1 38 CB ILE L 2 60.849 64.455 -40.010 1.00 13.88 1MCP 1 39 CG1 ILE L 2 60.005 65.452 -39.241 1.00 13.82 1MCP 1 40 CG2 ILE L 2 60.073 63.065 -40.069 1.00 14.03 1MCP 1 41 CD1 ILE L 2 58.463 65.062 -39.600 1.00 13.67 1MCP 1 42 N VAL L 3 64.138 65.391 -38.858 1.00 12.04 1MCP 1 43 CA VAL L 3 65.200 65.756 -37.892 1.00 11.29 1MCP 1 44 C VAL L 3 64.815 67.066 -37.220 1.00 10.96 1MCP 1 45 O VAL L 3 64.258 67.942 -37.894 1.00 11.17 1MCP 1 46 CB VAL L 3 66.487 65.832 -38.740 1.00 11.18 1MCP 1 47 CG1 VAL L 3 67.695 66.376 -38.017 1.00 11.04 1MCP 1 48 CG2 VAL L 3 66.762 64.479 -39.394 1.00 11.07 1MCP 1 49 N MET L 4 65.029 67.174 -35.931 1.00 10.27 1MCP 1 50 CA MET L 4 64.701 68.308 -35.095 1.00 9.42 1MCP 1 51 C MET L 4 66.014 68.959 -34.631 1.00 9.66 1MCP 1 52 O MET L 4 66.768 68.310 -33.858 1.00 9.93 1MCP 1 53 CB MET L 4 63.986 67.837 -33.826 1.00 8.88 1MCP 1 54 CG MET L 4 62.867 66.927 -34.164 1.00 8.59 1MCP 1 55 SD MET L 4 61.606 67.775 -35.057 1.00 8.43 1MCP 1 56 CE MET L 4 61.464 69.332 -34.174 1.00 8.33 1MCP 1 57 N THR L 5 66.206 70.204 -35.048 1.00 9.35 1MCP 1 58 CA THR L 5 67.442 70.879 -34.639 1.00 8.93 1MCP 1 59 C THR L 5 67.213 71.813 -33.475 1.00 8.70 1MCP 1 60 O THR L 5 66.450 72.776 -33.606 1.00 8.80 1MCP 1 61 CB THR L 5 68.191 71.562 -35.832 1.00 8.83 1MCP 1 62 OG1 THR L 5 68.372 70.529 -36.833 1.00 8.69 1MCP 1 63 CG2 THR L 5 69.547 72.156 -35.373 1.00 8.83 1MCP 1 64 N GLN L 6 67.896 71.543 -32.382 1.00 8.50 1MCP 1 65 CA GLN L 6 67.832 72.379 -31.190 1.00 8.57 1MCP 1 66 C GLN L 6 69.182 73.076 -30.911 1.00 8.89 1MCP 1 67 O GLN L 6 70.253 72.444 -30.832 1.00 8.93 1MCP 1 68 CB GLN L 6 67.327 71.653 -29.989 1.00 8.23 1MCP 1 69 CG GLN L 6 65.872 71.298 -29.929 1.00 8.31 1MCP 1 70 CD GLN L 6 65.524 70.787 -28.552 1.00 8.57 1MCP 1 71 OE1 GLN L 6 65.405 69.617 -28.278 1.00 8.51 1MCP 1 72 NE2 GLN L 6 65.496 71.776 -27.634 1.00 8.96 1MCP 1 73 N SER L 7 69.046 74.343 -30.609 1.00 9.09 1MCP 1 74 CA SER L 7 70.128 75.257 -30.281 1.00 9.60 1MCP 1 75 C SER L 7 69.640 76.387 -29.380 1.00 9.87 1MCP 1 76 O SER L 7 68.477 76.826 -29.480 1.00 9.70 1MCP 1 77 CB SER L 7 70.504 75.840 -31.663 1.00 9.97 1MCP 1 78 OG SER L 7 69.846 77.110 -31.756 1.00 10.79 1MCP 1 79 N PRO L 8 70.470 76.942 -28.525 1.00 10.35 1MCP 1 80 CA PRO L 8 71.869 76.488 -28.279 1.00 10.73 1MCP 1 81 C PRO L 8 71.593 75.148 -27.568 1.00 11.23 1MCP 1 82 O PRO L 8 70.379 74.952 -27.281 1.00 11.23 1MCP 1 83 CB PRO L 8 72.437 77.478 -27.295 1.00 10.41 1MCP 1 84 CG PRO L 8 71.303 78.217 -26.716 1.00 10.33 1MCP 1 85 CD PRO L 8 70.089 77.985 -27.588 1.00 10.38 1MCP 1 86 N SER L 9 72.667 74.468 -27.246 1.00 11.62 1MCP 1 87 CA SER L 9 72.417 73.140 -26.599 1.00 11.92 1MCP 1 88 C SER L 9 72.786 73.231 -25.132 1.00 11.86 1MCP 1 89 O SER L 9 72.748 72.168 -24.510 1.00 12.14 1MCP 1 90 CB SER L 9 73.367 72.132 -27.233 1.00 12.34 1MCP 1 91 OG SER L 9 74.697 72.615 -26.907 1.00 12.89 1MCP 1 92 N SER L 10 73.233 74.376 -24.739 1.00 11.89 1MCP 1 93 CA SER L 10 73.602 74.772 -23.398 1.00 11.82 1MCP 1 94 C SER L 10 73.291 76.293 -23.267 1.00 11.41 1MCP 1 95 O SER L 10 73.425 77.030 -24.250 1.00 11.27 1MCP 1 96 CB SER L 10 75.040 74.539 -23.017 1.00 12.23 1MCP 1 97 OG SER L 10 75.068 74.560 -21.531 1.00 13.34 1MCP 1 98 N LEU L 11 72.719 76.651 -22.164 1.00 10.97 1MCP 1 99 CA LEU L 11 72.264 77.958 -21.764 1.00 10.66 1MCP 2 00 C LEU L 11 72.646 78.142 -20.279 1.00 10.54 1MCP 2 01 O LEU L 11 72.344 77.331 -19.375 1.00 10.13 1MCP 2 02 CB LEU L 11 70.763 78.171 -21.943 1.00 10.79 1MCP 2 03 CG LEU L 11 70.229 78.961 -23.099 1.00 11.16 1MCP 2 04 CD1 LEU L 11 69.228 78.177 -23.959 1.00 11.05 1MCP 2 05 CD2 LEU L 11 69.479 80.199 -22.575 1.00 11.34 1MCP 2 06 N SER L 12 73.323 79.275 -20.115 1.00 10.43 1MCP 2 07 CA SER L 12 73.787 79.651 -18.771 1.00 10.34 1MCP 2 08 C SER L 12 73.301 81.067 -18.479 1.00 10.20 1MCP 2 09 O SER L 12 73.910 81.988 -19.038 1.00 10.38 1MCP 2 10 CB SER L 12 75.316 79.535 -18.699 1.00 10.24 1MCP 2 11 OG SER L 12 75.675 79.935 -17.349 1.00 10.47 1MCP 2 12 N VAL L 13 72.277 81.172 -17.656 1.00 9.82 1MCP 2 13 CA VAL L 13 71.663 82.454 -17.310 1.00 9.49 1MCP 2 14 C VAL L 13 71.648 82.646 -15.798 1.00 9.49 1MCP 2 15 O VAL L 13 71.586 81.665 -15.046 1.00 9.24 1MCP 2 16 CB VAL L 13 70.193 82.482 -17.853 1.00 9.38 1MCP 2 17 CG1 VAL L 13 70.092 82.362 -19.352 1.00 9.14 1MCP 2 18 CG2 VAL L 13 69.386 81.398 -17.166 1.00 9.27 1MCP 2 19 N SER L 14 71.495 83.923 -15.407 1.00 9.73 1MCP 2 20 CA SER L 14 71.462 84.281 -14.016 1.00 9.88 1MCP 2 21 C SER L 14 70.117 84.224 -13.373 1.00 9.74 1MCP 2 22 O SER L 14 70.116 84.396 -12.101 1.00 10.24 1MCP 2 23 CB SER L 14 72.295 85.445 -13.563 1.00 10.28 1MCP 2 24 OG SER L 14 71.717 86.638 -14.055 1.00 11.26 1MCP 2 25 N ALA L 15 69.050 83.855 -14.046 1.00 9.23 1MCP 2 26 CA ALA L 15 67.804 83.640 -13.186 1.00 9.13 1MCP 2 27 C ALA L 15 67.206 85.055 -13.076 1.00 9.03 1MCP 2 28 O ALA L 15 67.976 85.913 -12.707 1.00 9.39 1MCP 2 29 CB ALA L 15 68.318 83.392 -11.726 1.00 8.56 1MCP 2 30 N GLY L 16 65.931 85.164 -13.202 1.00 8.85 1MCP 2 31 CA GLY L 16 65.276 86.463 -13.212 1.00 8.31 1MCP 2 32 C GLY L 16 65.423 86.926 -14.665 1.00 7.97 1MCP 2 33 O GLY L 16 64.694 87.887 -14.948 1.00 8.76 1MCP 2 34 N GLU L 17 66.274 86.291 -15.417 1.00 7.12 1MCP 2 35 CA GLU L 17 66.442 86.554 -16.839 1.00 6.71 1MCP 2 36 C GLU L 17 65.358 85.939 -17.727 1.00 6.61 1MCP 2 37 O GLU L 17 64.603 85.067 -17.287 1.00 6.82 1MCP 2 38 CB GLU L 17 67.691 85.880 -17.404 1.00 6.65 1MCP 2 39 CG GLU L 17 69.004 86.594 -17.226 1.00 6.77 1MCP 2 40 CD GLU L 17 69.742 86.787 -18.494 1.00 7.22 1MCP 2 41 OE1 GLU L 17 69.197 87.268 -19.503 1.00 8.27 1MCP 2 42 OE2 GLU L 17 70.888 86.397 -18.378 1.00 7.27 1MCP 2 43 N ARG L 18 65.426 86.281 -19.005 1.00 6.23 1MCP 2 44 CA ARG L 18 64.444 85.851 -20.030 1.00 5.78 1MCP 2 45 C ARG L 18 65.247 85.160 -21.109 1.00 5.66 1MCP 2 46 O ARG L 18 66.356 85.645 -21.454 1.00 5.84 1MCP 2 47 CB ARG L 18 63.633 87.047 -20.538 1.00 5.76 1MCP 2 48 CG ARG L 18 62.557 86.758 -21.532 1.00 6.14 1MCP 2 49 CD ARG L 18 61.663 87.824 -22.028 1.00 5.97 1MCP 2 50 NE ARG L 18 60.845 88.406 -20.927 1.00 6.00 1MCP 2 51 CZ ARG L 18 59.525 88.414 -21.084 1.00 6.10 1MCP 2 52 NH1 ARG L 18 58.691 88.764 -20.128 1.00 6.15 1MCP 2 53 NH2 ARG L 18 59.067 87.961 -22.263 1.00 6.28 1MCP 2 54 N VAL L 19 64.789 84.013 -21.542 1.00 5.62 1MCP 2 55 CA VAL L 19 65.554 83.083 -22.409 1.00 5.44 1MCP 2 56 C VAL L 19 64.726 82.563 -23.537 1.00 5.38 1MCP 2 57 O VAL L 19 63.506 82.566 -23.420 1.00 5.87 1MCP 2 58 CB VAL L 19 66.205 82.035 -21.460 1.00 5.36 1MCP 2 59 CG1 VAL L 19 65.634 80.657 -21.450 1.00 5.22 1MCP 2 60 CG2 VAL L 19 67.713 81.992 -21.719 1.00 5.21 1MCP 2 61 N THR L 20 65.300 82.124 -24.625 1.00 5.49 1MCP 2 62 CA THR L 20 64.586 81.549 -25.783 1.00 5.41 1MCP 2 63 C THR L 20 65.496 80.518 -26.419 1.00 5.50 1MCP 2 64 O THR L 20 66.622 80.866 -26.746 1.00 5.72 1MCP 2 65 CB THR L 20 64.106 82.660 -26.767 1.00 5.35 1MCP 2 66 OG1 THR L 20 63.422 83.659 -25.926 1.00 5.31 1MCP 2 67 CG2 THR L 20 63.199 82.248 -27.923 1.00 5.42 1MCP 2 68 N MET L 21 65.078 79.275 -26.436 1.00 5.77 1MCP 2 69 CA MET L 21 65.791 78.152 -27.089 1.00 5.50 1MCP 2 70 C MET L 21 65.007 77.995 -28.401 1.00 5.37 1MCP 2 71 O MET L 21 63.841 78.378 -28.281 1.00 5.00 1MCP 2 72 CB MET L 21 65.513 76.852 -26.304 1.00 5.77 1MCP 2 73 CG MET L 21 64.597 77.066 -25.180 1.00 6.07 1MCP 2 74 SD MET L 21 64.983 75.838 -23.897 1.00 7.10 1MCP 2 75 CE MET L 21 65.333 76.990 -22.520 1.00 6.53 1MCP 2 76 N SER L 22 65.570 77.430 -29.414 1.00 5.95 1MCP 2 77 CA SER L 22 64.816 77.236 -30.655 1.00 6.88 1MCP 2 78 C SER L 22 64.850 75.758 -31.009 1.00 7.63 1MCP 2 79 O SER L 22 65.635 75.006 -30.438 1.00 8.41 1MCP 2 80 CB SER L 22 65.312 78.021 -31.842 1.00 7.12 1MCP 2 81 OG SER L 22 66.680 78.337 -31.667 1.00 7.58 1MCP 2 82 N CYS L 23 64.053 75.463 -32.007 1.00 8.15 1MCP 2 83 CA CYS L 23 63.905 74.091 -32.495 1.00 8.37 1MCP 2 84 C CYS L 23 63.278 74.081 -33.887 1.00 8.92 1MCP 2 85 O CYS L 23 62.047 74.222 -33.961 1.00 8.96 1MCP 2 86 CB CYS L 23 62.975 73.421 -31.449 1.00 7.73 1MCP 2 87 SG CYS L 23 62.235 71.926 -32.149 1.00 7.51 1MCP 2 88 N LYS L 24 64.081 73.860 -34.916 1.00 9.67 1MCP 2 89 CA LYS L 24 63.535 73.769 -36.276 1.00 10.90 1MCP 2 90 C LYS L 24 63.346 72.284 -36.633 1.00 11.11 1MCP 2 91 O LYS L 24 64.043 71.443 -36.047 1.00 11.27 1MCP 2 92 CB LYS L 24 64.378 74.351 -37.351 1.00 11.64 1MCP 2 93 CG LYS L 24 65.262 75.534 -37.243 1.00 12.77 1MCP 2 94 CD LYS L 24 65.711 75.922 -38.677 1.00 13.92 1MCP 2 95 CE LYS L 24 67.005 76.746 -38.644 1.00 14.63 1MCP 2 96 NZ LYS L 24 67.662 76.543 -40.018 1.00 15.18 1MCP 2 97 N SER L 25 62.575 72.034 -37.659 1.00 11.60 1MCP 2 98 CA SER L 25 62.428 70.629 -38.139 1.00 12.49 1MCP 2 99 C SER L 25 62.809 70.689 -39.610 1.00 13.41 1MCP 3 00 O SER L 25 62.824 71.841 -40.122 1.00 13.80 1MCP 3 01 CB SER L 25 61.116 69.999 -37.863 1.00 12.29 1MCP 3 02 OG SER L 25 59.995 70.577 -38.484 1.00 12.01 1MCP 3 03 N SER L 26 63.105 69.569 -40.199 1.00 14.27 1MCP 3 04 CA SER L 26 63.472 69.506 -41.622 1.00 15.34 1MCP 3 05 C SER L 26 62.234 69.411 -42.504 1.00 16.33 1MCP 3 06 O SER L 26 62.289 69.571 -43.751 1.00 16.28 1MCP 3 07 CB SER L 26 64.480 68.395 -41.840 1.00 15.12 1MCP 3 08 OG SER L 26 63.900 67.109 -41.849 1.00 15.18 1MCP 3 09 N GLN L 27 61.104 69.177 -41.883 1.00 17.69 1MCP 3 10 CA GLN L 27 59.812 69.027 -42.544 1.00 19.35 1MCP 3 11 C GLN L 27 58.724 69.593 -41.618 1.00 20.03 1MCP 3 12 O GLN L 27 58.744 69.436 -40.401 1.00 20.07 1MCP 3 13 CB GLN L 27 59.426 67.576 -42.865 1.00 20.21 1MCP 3 14 CG GLN L 27 59.717 67.204 -44.289 1.00 21.49 1MCP 3 15 CD GLN L 27 60.156 65.770 -44.419 1.00 22.46 1MCP 3 16 OE1 GLN L 27 61.257 65.510 -44.929 1.00 23.25 1MCP 3 17 NE2 GLN L 27 59.301 64.851 -43.968 1.00 22.74 1MCP 3 18 N SER L 28 57.743 70.120 -42.297 1.00 21.02 1MCP 3 19 CA SER L 28 56.575 70.765 -41.722 1.00 21.76 1MCP 3 20 C SER L 28 55.846 69.811 -40.801 1.00 22.54 1MCP 3 21 O SER L 28 55.718 68.658 -41.237 1.00 22.78 1MCP 3 22 CB SER L 28 55.653 71.209 -42.846 1.00 21.56 1MCP 3 23 OG SER L 28 55.251 72.532 -42.637 1.00 21.60 1MCP 3 24 N LEU L 29 55.408 70.341 -39.676 1.00 23.47 1MCP 3 25 CA LEU L 29 54.661 69.526 -38.691 1.00 24.46 1MCP 3 26 C LEU L 29 53.194 69.961 -38.691 1.00 25.54 1MCP 3 27 O LEU L 29 52.362 69.433 -37.919 1.00 25.99 1MCP 3 28 CB LEU L 29 55.366 69.800 -37.351 1.00 24.09 1MCP 3 29 CG LEU L 29 56.867 69.494 -37.355 1.00 23.95 1MCP 3 30 CD1 LEU L 29 57.452 69.583 -35.965 1.00 23.82 1MCP 3 31 CD2 LEU L 29 57.050 68.071 -37.904 1.00 23.92 1MCP 3 32 N LEU L 30 52.921 70.895 -39.575 1.00 26.39 1MCP 3 33 CA LEU L 30 51.612 71.530 -39.732 1.00 27.41 1MCP 3 34 C LEU L 30 50.713 70.758 -40.682 1.00 28.30 1MCP 3 35 O LEU L 30 51.216 70.486 -41.792 1.00 28.70 1MCP 3 36 CB LEU L 30 51.958 72.919 -40.335 1.00 27.22 1MCP 3 37 CG LEU L 30 50.841 73.894 -40.593 1.00 27.03 1MCP 3 38 CD1 LEU L 30 50.520 74.719 -39.349 1.00 27.01 1MCP 3 39 CD2 LEU L 30 51.310 74.856 -41.686 1.00 27.12 1MCP 3 40 N ASN L 31 49.474 70.506 -40.289 1.00 29.22 1MCP 3 41 CA ASN L 31 48.545 69.793 -41.219 1.00 29.02 1MCP 3 42 C ASN L 31 48.155 70.768 -42.342 1.00 29.69 1MCP 3 43 O ASN L 31 48.395 71.969 -42.137 1.00 30.06 1MCP 3 44 CB ASN L 31 47.287 69.279 -40.487 1.00 28.87 1MCP 3 45 CG ASN L 31 47.260 67.752 -40.551 1.00 28.87 1MCP 3 46 OD1 ASN L 31 48.093 67.168 -41.281 1.00 28.69 1MCP 3 47 ND2 ASN L 31 46.334 67.143 -39.810 1.00 28.81 1MCP 3 48 N SER L 32 47.590 70.248 -43.419 1.00 30.23 1MCP 3 49 CA SER L 32 47.095 71.193 -44.477 1.00 30.91 1MCP 3 50 C SER L 32 45.567 71.243 -44.238 1.00 31.20 1MCP 3 51 O SER L 32 44.813 71.411