ML_AI_training/test_data/pnca_all_params_OLD.csv

310 KiB

1mutationinformationwild_typepositionmutant_typechainligand_idligand_distanceduet_stability_changeduet_outcomeligand_affinity_changeligand_outcomeduet_scaledaffinity_scaledwild_poswild_chain_posddg_foldxcontactselectro_rrelectro_mmelectro_smelectro_ssdisulfide_rrdisulfide_mmdisulfide_smdisulfide_sshbonds_rrhbonds_mmhbonds_smhbonds_sspartcov_rrpartcov_mmpartcov_smpartcov_ssvdwclashes_rrvdwclashes_mmvdwclashes_smvdwclashes_ssvolumetric_rrvolumetric_mmvolumetric_smvolumetric_ssfoldx_scaledfoldx_outcomedeepddgdeepddg_outcomedeepddg_scaledasarsassss_classkd_valuesrd_valueswt_3upperconsurf_scoreconsurf_scaledconsurf_colourconsurf_colour_revconsurf_ci_upperconsurf_ci_lowerconsurf_ci_colourconsurf_msa_dataconsurf_aa_varietysnap2_scoresnap2_scaledsnap2_accuracy_pcsnap2_outcomemutationafbeta_logisticor_logisticpval_logisticse_logisticzval_logisticci_low_logisticci_hi_logisticor_mychisqlog10_or_mychisqor_fisherpval_fisherneglog_pval_fisherci_low_fisherci_hi_fisherest_chisqpval_chisqddg_dynamut2ddg_dynamut2_scaledddg_dynamut2_outcomemut_3upperseq_offset4pdbpdb_file
2M1TM1TAPZA23.9780.109Stabilising0.344Stabilising0.09268707482993190.1542600896860986M1MA10.86777110.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.02.00.00.02.00.00.00.00.00.031606108727481985Destabilising-1.096Destabilising-0.18687127024722933880.3928571428571428-loop0.63333333333333334.12MET-1.048-0.863261943986820499-1.178-0.9939:921/150V:M520.547368421052631675effectpnca_p.met1thr0.000718700589334414.14898097140621395803.748901950.890414731995374102.6929760140080.137779442378573507.71288536892397.38286196707471.98848253379833inf2.1018584548314e-087.6773965339573910.9022485555592inf42.84524907868055.924579267292849e-110.510.2865168539325842StabilisingTHR0pnca_complex.pdb
3M1RM1RAPZA23.9780.6940000000000001Stabilising-0.16Destabilising0.5901360544217688-0.0405268490374873M1MA1-0.00977971-14.00.00.00.0-20.00.00.00.00.0-2.00.0-2.00.00.00.00.00.01.00.0-1.01.00.00.0-2.0-2.0-0.0018802795508728756Stabilising-0.78Destabilising-0.1329923273657289880.3928571428571428-loop0.63333333333333334.12MET-1.048-0.863261943986820499-1.178-0.9939:921/150V:M440.463157894736842171effect1.210.6797752808988764StabilisingARG0pnca_complex.pdb
4M1IM1IAPZA23.978-0.347Destabilising-0.294Destabilising-0.0896640826873385-0.0744680851063829M1MA1-0.05496156.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-3.00.0-3.0-3.00.00.00.00.0-0.010567080673690688Stabilising-0.407Destabilising-0.06939471440750213880.3928571428571428-loop0.63333333333333334.12MET-1.048-0.863261943986820499-1.178-0.9939:921/150V:M70.0736842105263157853effectpnca_p.met1ile0.0001437401178668-9.987521262450564.59700131334276e-050.942832958100734139.277183325397-0.0717096729269464144471.7063148371.21195880622110.08348785866285790.01.00.00.025.83865859621631.0105682238915901e-250.999999999999746-0.79-0.2068062827225131DestabilisingILE0pnca_complex.pdb
5M1KM1KAPZA23.9780.296Stabilising0.215Stabilising0.25170068027210890.0964125560538116M1MA10.0794895-6.0-2.00.00.0-18.00.00.00.00.00.00.00.0-2.00.00.00.00.0-1.00.0-1.0-1.00.00.00.00.00.002895180617574429Destabilising-1.017Destabilising-0.1734015345268542880.3928571428571428-loop0.63333333333333334.12MET-1.048-0.863261943986820499-1.178-0.9939:921/150V:M700.736842105263157985effectpnca_p.met1lys7.18700589334483e-05-8.987408781496420.00012497350770340.940032862253633119.468044435492-0.07522855859877484692673.510813952.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.999999999999997-0.34-0.0890052356020942DestabilisingLYS0pnca_complex.pdb
6R2WR2WAPZA21.092-0.1639999999999999Destabilising-1.147Destabilising-0.0423772609819121-0.2905268490374873R2RA24.385658.030.00.04.026.00.00.00.00.04.00.02.02.00.00.00.00.00.00.0-5.05.06.00.06.04.00.15973491939772289Destabilising-0.74Destabilising-0.12617220801364024550.2007299270072992Estrand-0.26666666666666664.74ARG-0.015-0.01235584843492586555-0.2440.0836:584/150R:K:N:H:T:S:E580.610526315789473775effect-0.16-0.0418848167539267DestabilisingTRP0pnca_complex.pdb
7R2PR2PAPZA21.092-1.031Destabilising-2.244Destabilising-0.2664082687338501-0.56838905775076R2RA24.2037648.028.00.04.024.00.00.00.00.02.00.04.00.00.00.00.00.04.02.01.01.04.00.06.00.00.1531100896713991Destabilising-1.935Destabilising-0.329923273657289550.2007299270072992Estrand-0.26666666666666664.74ARG-0.015-0.01235584843492586555-0.2440.0836:584/150R:K:N:H:T:S:E630.663157894736842180effect-0.43-0.112565445026178DestabilisingPRO0pnca_complex.pdb
8R2LR2LAPZA21.0920.062Stabilising-2.083Destabilising0.0527210884353741-0.5276089159067883R2RA21.7875538.030.00.04.026.00.00.00.00.04.00.02.02.00.00.00.00.01.00.0-2.02.00.00.00.0-2.00.06510646202259632Destabilising-0.708Destabilising-0.1207161125319693550.2007299270072992Estrand-0.26666666666666664.74ARG-0.015-0.01235584843492586555-0.2440.0836:584/150R:K:N:H:T:S:E440.463157894736842171effectpnca_p.arg2leu7.18700589334483e-05-8.98740878149640.00012497350770340.940032862253633119.46804443549-0.07522855859877554692673.510812592.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.999999999999997-0.24-0.06282722513089DestabilisingLEU0pnca_complex.pdb
9A3EA3EAPZA18.028-2.829Destabilising-1.5519999999999998Destabilising-0.7310077519379844-0.3931104356636271A3AA32.75936-30.0-38.00.0-2.0-36.00.00.00.00.00.00.00.00.00.00.00.00.0-13.00.0-3.0-14.0-4.00.0-2.0-9.00.1005018975954079Destabilising-5.34Destabilising-0.910485933503836200.0Estrand0.36666666666666668.38ALA-0.873-0.719110378912685488-0.993-0.8279:8141/150A:G:T:V:C560.589473684210526375effectpnca_p.ala3glu0.000287480235733714.14645145909541392277.507850870.930573112990226162.3718495990860.08712379328082150.01139954433555538.85473684210531.58944397188817inf0.00085282752075193.069138793404423.20302487654751inf13.99098223529590.0001836895199759-1.11-0.2905759162303665DestabilisingGLU0pnca_complex.pdb
10A3PA3PAPZA18.028-1.124Destabilising-2.664Destabilising-0.2904392764857881-0.6747720364741641A3AA3-0.1556970.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-7.02.0-7.0-4.0-2.00.0-2.0-1.0-0.029934822733215412Stabilising-3.837Destabilising-0.654219948849104800.0Estrand0.36666666666666668.38ALA-0.873-0.719110378912685488-0.993-0.8279:8141/150A:G:T:V:C660.694736842105263280effectpnca_p.ala3pro7.18700589334483e-0512.1451538387263188179.9262645990.919026337424228119.4680444362220.1016602715482635.01153666063644e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-0.13-0.0340314136125654DestabilisingPRO0pnca_complex.pdb
11L4SL4SAPZA15.328-3.87Destabilising-1.078Destabilising-1.0-0.2730496453900709L4LA45.5783822.00.00.00.00.00.00.00.00.00.00.0-2.00.00.00.00.00.0-3.00.0-1.0-2.06.00.04.06.00.20317674225482413Destabilising-2.638Destabilising-0.449786871270247200.0Estrand3.36666666666666678.8LEU-1.075-0.885502471169686999-1.152-1.0289:9146/150F:V:L:I630.663157894736842180effectpnca_p.leu4ser0.00244358200373723.3483947982037928.45701770599424.89069202996555e-120.4846625776450816.9087133041573912.007158487331483.715168698310728.45702127659571.454189438585928.43088656078555.6263316435115e-1817.249774671974910.873915709429294.2522723934353107.0579527689284.32340113554558e-25-3.7-0.968586387434555DestabilisingSER0pnca_complex.pdb
12L4WL4WAPZA15.328-2.169Destabilising-2.216Destabilising-0.5604651162790698-0.5612968591691996L4LA41.63111-46.06.00.00.06.00.00.00.00.00.00.00.00.00.00.00.00.0-15.00.0-7.0-8.00.00.0-16.02.00.05940857669417755Destabilising-2.168Destabilising-0.3696504688832054600.0Estrand3.36666666666666678.8LEU-1.075-0.885502471169686999-1.152-1.0289:9146/150F:V:L:I700.736842105263157985effectpnca_p.leu4trp0.00122179100186863.1247927506971422.75517860989649.15103299018708e-070.6365348504516384.909067820057347.4209652753234998.771287657662422.75517970401691.3570802696009222.74636847621837.157958206418241e-098.145210841678756.3414443600848123.17912493130246.62741886144578.58505795592483e-12-1.93-0.5052356020942408DestabilisingTRP0pnca_complex.pdb
13L4VL4VAPZA15.328-1.717Destabilising-2.8280000000000003Destabilising-0.4436692506459948-0.7163120567375887L4LA41.1962422.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-3.00.0-1.0-2.02.00.00.00.00.043569664697440974Destabilising-1.68Destabilising-0.286445012787723800.0Estrand3.36666666666666678.8LEU-1.075-0.885502471169686999-1.152-1.0289:9146/150F:V:L:I220.2315789473684210563effect-1.95-0.5104712041884817DestabilisingVAL0pnca_complex.pdb
14I5TI5TAPZA11.437-3.43Destabilising-0.945Destabilising-0.8863049095607235-0.2393617021276595I5IA53.6777632.00.00.00.00.00.00.00.00.00.00.0-4.00.00.00.00.00.04.00.02.02.00.00.04.00.00.1339520247088047Destabilising-2.709Destabilising-0.461892583120204600.0Estrand4.26666666666666712.6ILE-0.011-0.00906095551894563455-0.2440.0836:5146/150G:F:I:L:V630.663157894736842180effectpnca_p.ile5thr0.00028748023573372.6784896296014114.56308103022780.02026791028213621.153849496483172.32135095414541.86363317860697294.48817794611614.56313131313131.1632547654853914.56310122532360.01741404882020371.759100242332271.16837785201846760.9897595427335.818739942061350.0158563003544608-3.3-0.8638743455497382DestabilisingTHR0pnca_complex.pdb
15I5SI5SAPZA11.437-3.843Destabilising-0.778Destabilising-0.9930232558139536-0.1970618034447821I5IA55.8317630.00.00.00.00.00.00.00.00.00.00.0-4.00.00.00.00.00.04.00.02.02.00.00.04.00.00.21240539339593092Destabilising-3.518Destabilising-0.599829497016197700.0Estrand4.26666666666666712.6ILE-0.011-0.00906095551894563455-0.2440.0836:5146/150G:F:I:L:V630.663157894736842180effectpnca_p.ile5ser7.18700589334483e-0512.1451538387253188179.926264410.919026337424193119.468044436160.1016602715483075.0115366606943e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-3.58-0.93717277486911DestabilisingSER0pnca_complex.pdb
16I6LI6LAPZA9.258-0.5479999999999999Destabilising-3.018Destabilising-0.1416020671834625-0.7644376899696049I6IA60.267883-6.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-7.00.0-2.0-5.02.00.0-2.0-2.00.009756881970294073Destabilising-1.616Destabilising-0.2755328218243819310.0050761421319796Estrand4.411.36ILE-0.6-0.494233937397034677-0.728-0.5538:7146/150M:A:I:L:V50.0526315789473684253effectpnca_p.ile6leu0.0097024579560155-0.9537042701460090.3853110803100260.00375604220969370.329095586242593-2.897955214273170.1890894684620420.6973853898911550.385310257492613-0.4141894293126070.3853266833771450.00173556979727722.760557916154010.1800496439600230.7339807508781488.354145409195460.0038480840706912-0.58-0.1518324607329843DestabilisingLEU0pnca_complex.pdb
17I6VI6VAPZA9.258-1.528Destabilising-2.761Destabilising-0.3948320413436692-0.6993414387031409I6IA61.331470000000000224.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-1.00.0-1.00.02.00.02.00.00.04849503565731103Destabilising-1.511Destabilising-0.2576300085251491710.0050761421319796Estrand4.411.36ILE-0.6-0.494233937397034677-0.728-0.5538:7146/150M:A:I:L:V-86-0.924731182795698993neutral-1.35-0.3534031413612565DestabilisingVAL0pnca_complex.pdb
18I6TI6TAPZA9.258-3.089Destabilising-1.244Destabilising-0.7981912144702842-0.315096251266464I6IA63.7145224.00.00.00.00.00.00.00.00.00.00.0-2.00.00.00.00.00.0-1.00.0-1.00.02.00.00.00.00.1352909039255822Destabilising-3.589Destabilising-0.611935208866155210.0050761421319796Estrand4.411.36ILE-0.6-0.494233937397034677-0.728-0.5538:7146/150M:A:I:L:V620.652631578947368580effectpnca_p.ile6thr0.00064683053040114.1485589414361395214.802172750.896008552350165108.2479010398250.130705157379733226.47453558603687.60759493670891.94254175795031inf1.23317897951184e-076.908973886767319.59561062779463inf38.00996325721427.038428913028e-10-3.14-0.8219895287958116DestabilisingTHR0pnca_complex.pdb
19I6SI6SAPZA9.258-3.585Destabilising-1.047Destabilising-0.9263565891472868-0.2651975683890577I6IA66.0175124.00.00.00.00.00.00.00.00.00.00.0-2.00.00.00.00.00.0-1.00.0-1.00.02.00.04.00.00.21917081272445166Destabilising-4.149Destabilising-0.707416879795396410.0050761421319796Estrand4.411.36ILE-0.6-0.494233937397034677-0.728-0.5538:7146/150M:A:I:L:V640.673684210526315880effectpnca_p.ile6ser0.000143740117866813.1456002256205511754.4635525730.924803768446996139.2771833265620.0943844491369280.000162837134445319.4110222970131.28804840845689inf0.02922358609515971.534266491831630.91081598550184inf4.731220703822740.0296198560706035-3.42-0.8952879581151832DestabilisingSER0pnca_complex.pdb
20I6MI6MAPZA9.258-1.021Destabilising-3.085Destabilising-0.2638242894056847-0.7814083080040527I6IA60.24349-32.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-3.00.00.0-3.0-2.00.0-4.0-2.00.00886843581319794Destabilising-2.364Destabilising-0.403069053708439910.0050761421319796Estrand4.411.36ILE-0.6-0.494233937397034677-0.728-0.5538:7146/150M:A:I:L:V100.1052631578947368459effect0.140.0786516853932584StabilisingMET0pnca_complex.pdb
21V7GV7GAPZA5.336-3.114Destabilising-1.062Destabilising-0.8046511627906976-0.2689969604863222V7VA75.2622612.00.00.00.00.00.00.00.00.00.00.0-2.00.00.00.00.00.03.00.01.02.08.00.011.021.00.1916629637453653Destabilising-4.33Destabilising-0.738277919863597600.0Estrand1.733333333333333411.02VAL-0.66-0.543657331136738177-0.779-0.6158:7146/150V:I:A860.905263157894736991effectpnca_p.val7gly0.0012936610608023.664722033221239.04528136344461.03849290922087e-060.7503217637172714.8842006328928911.103639297077247.09047888786639.04528142192131.5915685573876639.04308044992645.5226464423210094e-1110.25785275925039.16748833639401349.9798225205460.56075620889787.134219647799371e-15-2.58-0.6753926701570682DestabilisingGLY0pnca_complex.pdb
22V7LV7LAPZA5.336-1.137Destabilising-0.589Destabilising-0.2937984496124031-0.1491894630192502V7VA7-0.847275-26.00.00.00.00.00.00.00.00.00.00.0-2.00.00.00.00.00.0-3.00.01.0-4.0-2.00.0-2.02.0-0.16289990771360455Stabilising-2.289Destabilising-0.390281329923273700.0Estrand1.733333333333333411.02VAL-0.66-0.543657331136738177-0.779-0.6158:7146/150V:I:A830.873684210526315891effectpnca_p.val7leu0.00093431076613482.3930772235157610.94712892788416.83262964849249e-050.6009676609105213.982039931882573.5618501226410640.431561328032110.94715189873421.0393011442398210.94404619012094.53835196843674e-054.343101825766573.0511759138694948.696992527100721.40409289935183.71976276752962e-06-0.99-0.2591623036649215DestabilisingLEU0pnca_complex.pdb
23V7AV7AAPZA5.336-2.592Destabilising-0.97Destabilising-0.6697674418604651-0.2456940222897669V7VA73.426682.00.00.00.00.00.00.00.00.00.00.0-2.00.00.00.00.00.05.00.03.02.04.00.06.03.00.12480714457418834Destabilising-3.043Destabilising-0.51884057971014500.0Estrand1.733333333333333411.02VAL-0.66-0.543657331136738177-0.779-0.6158:7146/150V:I:A640.673684210526315880effectpnca_p.val7ala7.18700589334483e-05-8.987408781496410.00012497350770340.940032862253633119.468044435491-0.0752285585987754692673.510811852.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.999999999999997-1.9-0.4973821989528796DestabilisingALA0pnca_complex.pdb
24V7FV7FAPZA5.336-1.877Destabilising0.042Stabilising-0.48501291989664070.0188340807174887V7VA74.86315-54.0-2.00.00.0-2.00.00.00.00.00.00.0-2.00.00.00.00.00.0-3.00.01.0-4.0-8.00.0-6.0-4.00.17712650878867126Destabilising-2.949Destabilising-0.502813299232736500.0Estrand1.733333333333333411.02VAL-0.66-0.543657331136738177-0.779-0.6158:7146/150V:I:A830.873684210526315891effectpnca_p.val7phe0.00021561017680032.272606078088179.704658986530490.063445590226091.224427601584961.85605590330240.929172866365903208.8816030047779.704669751787970.9869807610106799.701949905893830.07768449259424941.109665666564610.504888890842109570.3728424103282.291682450166840.130068862702538-1.55-0.4057591623036649DestabilisingPHE0pnca_complex.pdb
25V7IV7IAPZA5.336-0.898Destabilising-0.635Destabilising-0.2320413436692506-0.1608409321175278V7VA7-1.10338-24.00.00.00.00.00.00.00.00.00.00.0-2.00.00.00.00.00.0-4.00.02.0-7.00.00.02.0-2.0-0.21213950626778436Stabilising-0.738Destabilising-0.125831202046035800.0Estrand1.733333333333333411.02VAL-0.66-0.543657331136738177-0.779-0.6158:7146/150V:I:A460.484210526315789571effect-0.73-0.1910994764397905DestabilisingILE0pnca_complex.pdb
26D8ED8EAPZA3.22-0.7859999999999999Destabilising0.012Stabilising-0.20310077519379840.0053811659192825D8DA81.90122-24.0-28.00.00.0-28.00.00.00.00.0-2.00.0-2.00.00.00.00.00.02.00.02.0-1.0-8.00.0-10.0-6.00.0692465708520604Destabilising-1.417Destabilising-0.2416027280477408350.0259067357512953-loop1.63333333333333359.48ASP-1.187-0.977759472817133599-1.221-1.1789:9146/150D:H900.947368421052631595effectpnca_p.asp8glu0.00028748023573372.6784896296014114.56308103022780.02026791028213611.153849496483172.32135095414541.86363317860697294.48817794581514.56313131313131.1632547654853914.56310122532360.01741404882020371.759100242332271.16837785201846760.9897595427335.818739942061350.0158563003544608-0.4-0.1047120418848167DestabilisingGLU0pnca_complex.pdb
27D8AD8AAPZA3.22-0.511Destabilising-3.268Destabilising-0.1320413436692506-0.8277608915906789D8DA80.54102826.036.00.00.036.00.00.00.00.00.00.00.04.00.00.00.00.0-5.00.0-4.0-1.00.00.06.01.00.01970541743456756Destabilising-1.125Destabilising-0.191815856777493650.0259067357512953-loop1.63333333333333359.48ASP-1.187-0.977759472817133599-1.221-1.1789:9146/150D:H870.915789473684210591effectpnca_p.asp8ala0.000143740117866813.1456002256206511754.4635526230.924803768447001139.2771833265720.0943844491369220.000162837134445119.4110222970131.28804840845689inf0.02922358609515971.534266491831630.91081598550184inf4.731220703822740.02961985607060350.40.2247191011235955StabilisingALA0pnca_complex.pdb
28D8ND8NAPZA3.22-1.182Destabilising-1.655Destabilising-0.3054263565891472-0.4191995947315096D8DA8-1.260570.034.00.00.034.00.00.00.00.0-4.00.0-2.0-2.00.00.00.00.0-7.00.0-5.0-4.00.00.0-4.02.0-0.24236137814350533Stabilising-1.022Destabilising-0.174254049445865350.0259067357512953-loop1.63333333333333359.48ASP-1.187-0.977759472817133599-1.221-1.1789:9146/150D:H920.96842105263157995effectpnca_p.asp8asn0.00050309041253413.3729032940259829.16307324351870.0017890770828181.079957687620313.123180965967464.97876379054103550.89432351925229.16308470290771.4648334592411829.12933259783150.00014852956210033.8281870993483.534437535566361331.5687319993818.67174938085831.55265977742841e-05-1.29-0.3376963350785341DestabilisingASN0pnca_complex.pdb
29D8GD8GAPZA3.22-0.851Destabilising-3.445Destabilising-0.2198966408268733-0.8725937183383992D8DA81.8930534.038.00.00.038.00.00.00.00.00.00.00.00.00.00.00.00.0-8.0-1.0-3.0-5.06.00.09.017.00.0689490016681357Destabilising-1.078Destabilising-0.1838022165387894250.0259067357512953-loop1.63333333333333359.48ASP-1.187-0.977759472817133599-1.221-1.1789:9146/150D:H920.96842105263157995effectpnca_p.asp8gly0.00079057064826793.8854162605398848.68720480414740.00021180758772911.04883671410913.704500622711549.3197738725557893.7833722923748.68720979316171.6874148863521148.67468781626231.95392414212297e-076.709092301055796.917816795682662088.8499422051937.26191685724721.03281930722422e-09-0.82-0.2146596858638743DestabilisingGLY0pnca_complex.pdb
30V9GV9GAPZA6.555-3.236Destabilising-1.063Destabilising-0.8361757105943153-0.2692502532928065V9VA93.709528.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.02.0-2.04.00.03.021.00.13510879304190734Destabilising-3.636Destabilising-0.619948849104859400.0-loop-0.93333333333333329.57VAL-0.711-0.58566721581548688-0.827-0.6158:7146/150I:C:L:V:M830.873684210526315891effectpnca_p.val9gly0.00035935029466722.9665952872801819.42566805717670.00795005031660531.117705282648222.654183829436072.87215213651501380.09715897593819.42568421052631.2883763244419619.41697909836360.00368168890159292.433952911657541.92061868691892951.4031143047039.875613637235080.0016748373055023-3.48-0.9109947643979058DestabilisingGLY0pnca_complex.pdb
31V9AV9AAPZA6.555-2.467Destabilising-1.286Destabilising-0.6374677002583979-0.3257345491388044V9VA92.036890.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.02.00.00.02.06.00.06.05.00.07418796756969384Destabilising-2.068Destabilising-0.352600170502983800.0-loop-0.93333333333333329.57VAL-0.711-0.58566721581548688-0.827-0.6158:7146/150I:C:L:V:M610.642105263157894780effectpnca_p.val9ala0.0002156101768003-9.987607973918194.59660271789382e-050.930014323968985113.719344729607-0.0878268160765962127.9487350989550.807902480033628-0.09264105870473970.01.00.00.011.73697547380050.0003936455651480.984170607395186-2.01-0.5261780104712042DestabilisingALA0pnca_complex.pdb
32Q10PQ10PAPZA6.02-0.631Destabilising-1.771Destabilising-0.1630490956072351-0.4485815602836879Q10QA106.7829938.0-2.00.00.0-2.00.00.00.00.06.02.04.00.00.00.00.00.0-8.02.0-6.0-4.00.00.02.00.00.24705126057153678Destabilising-2.963Destabilising-0.505200341005967600.0Bstrand-0.93333333333333328.14GLN-1.214-1.099-1.229-1.2019:9147/150Q951.095effectpnca_p.gln10pro0.02112979732643385.05135310548255156.2337222332672.4956221564878496e-550.32239532000685715.668196130685587.7376148601903314.979076956589156.2338902147972.19377524680641156.3824727563581.2782291871021599e-207206.89339126998883.6783303393677330.7820288999351333.510934539625.90060424845557e-292-0.11-0.0287958115183246DestabilisingPRO0pnca_complex.pdb
33Q10HQ10HAPZA6.02-1.024Destabilising-0.636Destabilising-0.2645994832041343-0.1610942249240121Q10QA103.946334.00.00.00.00.00.00.00.00.02.00.02.00.00.00.00.00.0-11.00.0-8.0-3.00.00.02.02.00.1437339287145157Destabilising-1.814Destabilising-0.309292412617220800.0Bstrand-0.93333333333333328.14GLN-1.214-1.099-1.229-1.2019:9147/150Q910.957894736842105295effectpnca_p.gln10his0.000790570648267915.14940666797273795803.483360720.925233417916174161.4325428787740.093843573283417624.1993753469043107.1663851351352.03005858162844inf3.5812015819156903e-098.4459712323392112.2081619622864inf47.68479638349565.0055851012886495e-12-0.97-0.2539267015706806DestabilisingHIS0pnca_complex.pdb
34Q10EQ10EAPZA6.02-2.051Destabilising-0.537Destabilising-0.5299741602067184-0.1360182370820668Q10QA103.846920.0-56.00.00.0-56.00.00.00.00.00.00.02.0-2.00.00.00.00.0-4.00.0-6.01.00.00.00.04.00.1401132001252923Destabilising-1.976Destabilising-0.336913895993179900.0Bstrand-0.93333333333333328.14GLN-1.214-1.099-1.229-1.2019:9147/150Q880.926315789473684291effect-0.13-0.0340314136125654DestabilisingGLU0pnca_complex.pdb
35Q10RQ10RAPZA6.02-1.078Destabilising-0.833Destabilising-0.2785529715762274-0.2109929078014184Q10QA108.553410000000001-48.0-32.00.00.0-32.00.00.00.00.02.00.02.00.00.00.00.00.0-5.00.0-5.0-5.00.00.06.0-4.00.31153381070666314Destabilising-2.07Destabilising-0.352941176470588200.0Bstrand-0.93333333333333328.14GLN-1.214-1.099-1.229-1.2019:9147/150Q940.989473684210526395effectpnca_p.gln10arg0.0012936610608024.4189572246902483.00967976657381.61039699449321e-051.024562242499784.3130197867809817.04768573953731496.2422845682983.01354784081291.9191489751756682.98172127761571.31421065040623e-1211.881335017594512.99243243302913402.1529870480270.70346976279244.15161653132659e-17-0.42-0.1099476439790576DestabilisingARG0pnca_complex.pdb
36Q10LQ10LAPZA6.020.6409999999999999Stabilising-1.694Destabilising0.5450680272108843-0.4290780141843971Q10QA100.16927520.00.00.00.00.00.00.00.00.04.00.04.00.00.00.00.00.0-3.00.0-3.0-3.02.00.06.04.00.006165363966812113Destabilising-0.188Destabilising-0.0320545609548167100.0Bstrand-0.93333333333333328.14GLN-1.214-1.099-1.229-1.2019:9147/150Q910.957894736842105295effect0.050.0280898876404494StabilisingLEU0pnca_complex.pdb
37N11SN11SAPZA9.5990.315Stabilising-1.515Destabilising0.2678571428571428-0.3837386018237081N11NA112.585364.00.00.00.00.00.00.00.00.02.00.02.00.00.00.00.00.0-2.00.00.0-2.00.00.0-2.00.00.09416443884352305Destabilising-1.389Destabilising-0.23682864450127877420.2153846153846154Ghelix-3.54.28ASN-0.682-0.561779242174629488-0.827-0.6158:7147/150T:P:L:N:V:I:R:K:Y:E:H:Q690.726315789473684280effectpnca_p.asn11ser7.18700589334483e-05-8.987408781496410.00012497350770340.940032862253633119.46804443549-0.07522855859877554692673.510810152.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.9999999999999970.570.3202247191011235StabilisingSER0pnca_complex.pdb
38D12ED12EAPZA7.825-0.21Destabilising-0.42Destabilising-0.0542635658914728-0.1063829787234042D12DA122.1586-8.00.00.00.00.00.00.00.00.02.00.02.00.00.00.00.00.0-3.00.0-3.0-2.00.00.00.00.00.07862091070010707Destabilising-2.035Destabilising-0.34697357203751067220.1139896373056994Ghelix-1.45.01ASP-1.058-0.871499176276771199-1.124-1.0289:9147/150C:D:T:G690.726315789473684280effectpnca_p.asp12glu0.00057496047146753.5274654208592834.03758723343860.00094827258563471.067169562808543.305440432142596.05331233477717636.46495247774834.03794266441821.5319633023969134.04363653152032.88610345466244e-054.539688105334094.368202269737261521.2918290189623.24093781935511.42922316872435e-06-0.02-0.0052356020942408DestabilisingGLU0pnca_complex.pdb
39D12YD12YAPZA7.825-0.794Destabilising-1.94Destabilising-0.2051679586563307-0.4913880445795339D12DA124.93098-30.016.00.00.016.00.00.00.00.04.00.04.00.00.00.00.00.0-7.00.0-7.0-2.00.00.00.0-6.00.1795970250366043Destabilising-1.092Destabilising-0.18618925831202046220.1139896373056994Ghelix-1.45.01ASP-1.058-0.871499176276771199-1.124-1.0289:9147/150C:D:T:G820.863157894736842191effect-0.59-0.1544502617801047DestabilisingTYR0pnca_complex.pdb
40D12GD12GAPZA7.8250.079Stabilising-3.008Destabilising0.0671768707482993-0.7619047619047619D12DA122.2609520.016.00.00.016.00.00.00.00.04.00.04.00.00.00.00.00.00.00.00.00.06.00.015.017.00.0823487204889313Destabilising-1.546Destabilising-0.26359761295822676220.1139896373056994Ghelix-1.45.01ASP-1.058-0.871499176276771199-1.124-1.0289:9147/150C:D:T:G670.705263157894736880effectpnca_p.asp12gly0.00050309041253413.3729032940259829.16307324351870.0017890770828181.079957687620313.123180965967474.97876379053956550.89432351928629.16308470290771.4648334592411829.12933259783150.00014852956210033.8281870993483.534437535566361331.5687319993818.67174938085831.55265977742841e-050.460.2584269662921348StabilisingGLY0pnca_complex.pdb
41D12AD12AAPZA7.8250.904Stabilising-2.924Destabilising0.7687074829931974-0.7406281661600811D12DA120.89657514.016.00.00.016.00.00.00.00.04.00.04.00.00.00.00.00.00.00.00.00.04.00.06.03.00.03265521310615608Destabilising-1.267Destabilising-0.21602728047740832220.1139896373056994Ghelix-1.45.01ASP-1.058-0.871499176276771199-1.124-1.0289:9147/150C:D:T:G640.673684210526315880effectpnca_p.asp12ala0.00179675147333621.663186974019765.276098868759253.35314758209503e-050.4009560551169944.148053016768782.3902135604284211.74359621317745.27609890109890.7223129278521395.27527864935376.93631068428177e-054.158871462612682.2160154709805612.665152054683619.12760371773281.22263744860911e-051.360.7640449438202248StabilisingALA0pnca_complex.pdb
42D12ND12NAPZA7.8250.018Stabilising-1.928Destabilising0.0153061224489795-0.4883485309017224D12DA121.582770.016.00.00.016.00.00.00.00.02.00.02.00.00.00.00.00.0-7.00.0-5.0-2.00.00.00.00.00.05764792867080908Destabilising-2.236Destabilising-0.3812446717817562220.1139896373056994Ghelix-1.45.01ASP-1.058-0.871499176276771199-1.124-1.0289:9147/150C:D:T:G790.831578947368421185effectpnca_p.asp12asn0.0006468305304012.8342397261407717.01745745291330.00040575657357760.8014678716516483.536311094167794.11022012991606114.2581312740217.01749578414841.2308956516861417.00763322912460.00011054474399143.956461901748963.23648804294829167.75705550669619.3064401149621.11330211002346e-050.090.0505617977528089StabilisingASN0pnca_complex.pdb
43F13CF13CAPZA3.551-2.32Destabilising-0.485Destabilising-0.5994832041343668-0.1228470111448834F13FA132.6973442.04.00.00.04.00.00.00.00.00.00.0-2.00.00.00.00.00.0-7.00.0-5.0-2.0-2.00.0-2.00.00.09824299419430503Destabilising-2.036Destabilising-0.3471440750213129240.1Ghelix0.66.93PHE-1.201-0.989291598023064399-1.229-1.2019:9147/150F790.831578947368421185effectpnca_p.phe13cys0.0001437401178668-9.987521262450584.59700131334268e-050.942832958100734139.277183325397-0.0717096729269463144471.7063148421.21195880622110.08348785866285790.01.00.00.025.83865859621631.0105682238915901e-250.999999999999746-2.68-0.7015706806282723DestabilisingCYS0pnca_complex.pdb
44F13LF13LAPZA3.551-2.033Destabilising-0.427Destabilising-0.5253229974160206-0.1081560283687943F13FA131.09688.06.00.00.06.00.00.00.00.00.00.00.00.00.00.00.00.0-4.00.0-2.0-4.0-4.00.0-2.00.00.03994784344291552Destabilising-1.283Destabilising-0.2187553282182438240.1Ghelix0.66.93PHE-1.201-0.989291598023064399-1.229-1.2019:9147/150F840.884210526315789491effectpnca_p.phe13leu0.00057496047146753.5274654208592834.03758723343880.00094827258563461.067169562808543.30544043214266.05331233477459636.46495247675734.03794266441821.5319633023969134.04363653152032.88610345466244e-054.539688105334094.368202269737261521.2918290189623.24093781935511.42922316872435e-06-2.06-0.5392670157068064DestabilisingLEU0pnca_complex.pdb
45F13IF13IAPZA3.551-1.7619999999999998Destabilising-0.45Destabilising-0.4552971576227389-0.1139817629179331F13FA130.887245000000000112.08.00.00.08.00.00.00.00.00.00.00.00.00.00.00.00.0-7.00.0-3.0-4.04.00.02.04.00.03231539419721881Destabilising-1.241Destabilising-0.21159420289855074240.1Ghelix0.66.93PHE-1.201-0.989291598023064399-1.229-1.2019:9147/150F830.873684210526315891effectpnca_p.phe13ile0.00028748023573372.6784896296014114.56308103022770.02026791028213631.153849496483172.32135095414541.86363317860665294.48817794599614.56313131313131.1632547654853914.56310122532360.01741404882020371.759100242332271.16837785201846760.9897595427335.818739942061350.0158563003544608-2.3-0.6020942408376964DestabilisingILE0pnca_complex.pdb
46F13SF13SAPZA3.551-3.104Destabilising0.218Stabilising-0.80206718346253210.0977578475336322F13FA132.5917444.06.00.00.06.00.00.00.00.00.00.0-2.00.00.00.00.00.0-9.00.0-5.0-4.0-2.00.02.06.00.09439681233109216Destabilising-2.032Destabilising-0.346462063086104240.1Ghelix0.66.93PHE-1.201-0.989291598023064399-1.229-1.2019:9147/150F880.926315789473684291effectpnca_p.phe13ser0.00028748023573370.4802571302871461.616489997296730.6772477868343311.15384934899060.4162216936788830.079938964616049612.63181652845891.616484440706480.2085715287138351.616413627742860.5276936681014430.2776181169752380.030778889119769420.14015940055.751485287704321e-250.999999999999395-3.54-0.9267015706806284DestabilisingSER0pnca_complex.pdb
47F13VF13VAPZA3.551-2.57Destabilising-0.562Destabilising-0.6640826873385013-0.1423505572441742F13FA131.4019344.08.00.00.08.00.00.00.00.02.00.02.00.00.00.00.00.0-1.00.0-1.00.00.00.0-4.00.00.05106134223005703Destabilising-2.51Destabilising-0.42796248934356346240.1Ghelix0.66.93PHE-1.201-0.989291598023064399-1.229-1.2019:9147/150F840.884210526315789491effectpnca_p.phe13val0.0001437401178668-9.987521262450584.59700131334268e-050.942832958100734139.277183325397-0.0717096729269463144471.7063148421.21195880622110.08348785866285790.01.00.00.025.83865859621631.0105682238915901e-250.999999999999746-2.34-0.612565445026178DestabilisingVAL0pnca_complex.pdb
48C14YC14YAPZA8.493-0.931Destabilising-0.604Destabilising-0.2405684754521963-0.1529888551165147C14CA14-0.852908-40.0-2.00.00.0-2.00.00.00.00.00.00.00.00.00.00.00.00.0-5.00.0-3.0-2.00.00.00.0-2.0-0.16398292701684228Stabilising-1.613Destabilising-0.2750213128729752710.0059880239520958Sloop0.65.76CYS0.0130.00416666666666666755-0.2440.2256:4147/150L:V:C:I:M:A:T730.768421052631578985effectpnca_p.cys14tyr0.00014374011786681.579039389124024.850294327177340.2642475663767231.414392862765841.116407916564430.191756076673665122.6837603992454.850294365012620.6857680967922064.849564479041120.3127341543101870.5048246860149950.061763864579114379.5583372042030.08811926218633320.766581879696361-0.51-0.1335078534031413DestabilisingTYR0pnca_complex.pdb
49C14GC14GAPZA8.493-0.534Destabilising-1.214Destabilising-0.137984496124031-0.3074974670719351C14CA141.4010110.00.00.00.00.00.00.00.00.00.00.02.0-2.00.00.00.00.04.00.04.02.04.00.013.015.00.051027833827460865Destabilising-2.618Destabilising-0.4463768115942028410.0059880239520958Sloop0.65.76CYS0.0130.00416666666666666755-0.2440.2256:4147/150L:V:C:I:M:A:T820.863157894736842191effectpnca_p.cys14gly0.00093431076613481.426473194382744.163987689693610.01041029930242260.5568040760106372.561894310478241.3394409133052612.54613799032884.16398771898140.6195094399579814.163394648675280.01428869270953741.845007503539711.1548112221404414.48292862149495.834185691553440.01571768294347941.210.6797752808988764StabilisingGLY0pnca_complex.pdb
50C14RC14RAPZA8.493-0.3329999999999999Destabilising-1.215Destabilising-0.0860465116279069-0.3077507598784195C14CA14-1.79171-58.0-18.00.00.0-18.00.00.00.00.0-4.00.0-2.0-2.00.00.00.00.0-5.00.0-2.0-3.00.00.0-2.0-2.0-0.34448011997231404Stabilising-2.708Destabilising-0.461722080136402410.0059880239520958Sloop0.65.76CYS0.0130.00416666666666666755-0.2440.2256:4147/150L:V:C:I:M:A:T810.852631578947368491effectpnca_p.cys14arg0.00344976282880553.7482744655019742.44777367239182.29709370000913e-150.4730190294164087.9241515296465818.4724160727947122.82872576757842.44777397260271.627854920097942.44229963134375.27268754098056e-2827.277967964160416.8169087404394137.378365631042173.4454223784161.30826250297363e-390.110.0617977528089887StabilisingARG0pnca_complex.pdb
51C14WC14WAPZA8.493-1.426Destabilising-0.421Destabilising-0.3684754521963824-0.1066362715298885C14CA143.5671800000000005-40.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-2.00.0-2.0-4.00.00.00.0-2.00.1299244604054517Destabilising-1.443Destabilising-0.2460358056265984610.0059880239520958Sloop0.65.76CYS0.0130.00416666666666666755-0.2440.2256:4147/150L:V:C:I:M:A:T810.852631578947368491effectpnca_p.cys14trp0.00021561017680032.272606078088179.704658986530510.06344559022608981.224427601584961.85605590330240.929172866365548208.8816030047789.704669751787970.9869807610106799.701949905893830.07768449259424941.109665666564610.504888890842109570.3728424103282.291682450166840.130068862702538-1.01-0.2643979057591623DestabilisingTRP0pnca_complex.pdb
52E15DE15DAPZA11.854-0.135Destabilising0.146Stabilising-0.03488372093023250.0654708520179372E15EA152.3893610.04.00.00.04.00.00.00.00.07.00.07.00.00.00.00.00.04.00.02.02.00.00.02.0-4.00.08702569220346884Destabilising-0.543Destabilising-0.09258312020460359920.4125560538116592Tloop-0.46666666666666663.7GLU-0.898-0.739703459637561888-0.993-0.8279:8146/150H:A:S:E:P:D-31-0.333333333333333366neutral-0.05-0.013089005235602DestabilisingASP0pnca_complex.pdb
53E15GE15GAPZA11.8540.063Stabilising-0.81Destabilising0.0535714285714285-0.2051671732522796E15EA152.8263616.010.00.00.010.00.00.00.00.07.00.07.00.00.00.00.00.04.00.02.02.00.00.011.05.00.10294218343665092Destabilising-0.925Destabilising-0.1577152600170503920.4125560538116592Tloop-0.46666666666666663.7GLU-0.898-0.739703459637561888-0.993-0.8279:8146/150H:A:S:E:P:D660.694736842105263280effectpnca_p.glu15gly0.0003593502946672-10.98779090199951.69068633684896e-050.939691219428539145.22979768191-0.07565796466965860.33890826761290.484657419083649-0.3145651347425670.00.5961118750587110.2246722265665940.05.292243504333850.1777772638998140.6732904245244840.470.2640449438202247StabilisingGLY0pnca_complex.pdb
54G17AG17AAPZA11.288-0.03Destabilising-0.016Destabilising-0.0077519379844961-0.0040526849037487G17GA174.40656-6.00.00.00.00.00.00.00.00.02.00.02.00.00.00.00.00.0-2.00.0-4.02.0-6.00.0-13.0-18.00.1604965071132511Destabilising-1.942Destabilising-0.3311167945439045180.173076923076923Sloop-0.53333333333333333.87GLY-1.147-0.944810543657331299-1.221-1.1249:9147/150R:G660.694736842105263280effectpnca_p.gly17ala7.18700589334483e-0512.1451538387262188179.9262645830.919026337424224119.4680444362150.1016602715482685.01153666064308e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-0.17-0.0445026178010471DestabilisingALA0pnca_complex.pdb
55G17RG17RAPZA11.288-0.0579999999999999Destabilising0.099Stabilising-0.01498708010335910.0443946188340807G17GA1713.8675-74.0-16.00.00.0-16.00.00.00.00.0-2.00.0-2.0-2.00.00.00.00.0-7.00.0-7.0-5.0-10.00.0-13.0-21.00.5050845358722018Destabilising-2.189Destabilising-0.373231031543052180.173076923076923Sloop-0.53333333333333333.87GLY-1.147-0.944810543657331299-1.221-1.1249:9147/150R:G860.905263157894736991effectpnca_p.gly17arg7.18700589334483e-0512.1451538387266188179.9262646630.919026337424239119.4680444362410.101660271548255.0115366606189e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.3821468117582610.010.0056179775280898StabilisingARG0pnca_complex.pdb
56G17DG17DAPZA11.288-0.552Destabilising1.6780000000000002Stabilising-0.14263565891472860.7524663677130046G17GA1715.5901-26.0-26.00.00.0-26.00.00.00.00.0-2.00.0-4.0-2.00.00.00.00.0-6.00.0-6.0-2.0-6.00.0-11.0-21.00.5678253775158618Destabilising-2.984Destabilising-0.5087809036658141180.173076923076923Sloop-0.53333333333333333.87GLY-1.147-0.944810543657331299-1.221-1.1249:9147/150R:G780.821052631578947485effectpnca_p.gly17asp0.00035935029466722.9665952872801819.42566805717670.00795005031660541.117705282648222.654183829436072.87215213651461380.097158975619.42568421052631.2883763244419619.41697909836360.00368168890159292.433952911657541.92061868691892951.4031143047039.875613637235080.0016748373055023-0.05-0.013089005235602DestabilisingASP0pnca_complex.pdb
57G17SG17SAPZA11.288-0.437Destabilising0.598Stabilising-0.11291989664082680.2681614349775785G17GA178.97262-6.00.00.00.00.00.00.00.00.0-2.00.0-2.0-2.00.00.00.00.0-7.00.0-7.00.0-4.00.0-11.0-19.00.32680235141573Destabilising-1.946Destabilising-0.33179880647911336180.173076923076923Sloop-0.53333333333333333.87GLY-1.147-0.944810543657331299-1.221-1.1249:9147/150R:G680.715789473684210580effectpnca_p.gly17ser0.00021561017680030.8858066062472812.42493957425810.4694062168248261.224427532119220.7234455147493620.11266293762039125.3270547471172.424936921783010.3847004460814332.424737369475330.4302589851681560.3662700514636120.041085444410624746.58814728670334.31445715363782e-250.999999999999476-0.26-0.0680628272251308DestabilisingSER0pnca_complex.pdb
58S18PS18PAPZA9.173-0.521Destabilising-1.13Destabilising-0.134625322997416-0.2862208713272542S18SA181.092680.00.00.00.00.00.00.00.00.04.00.04.00.00.00.00.00.0-4.02.0-6.0-2.0-2.00.0-8.00.00.039797784074767445Destabilising0.064Stabilising0.05405405405405406530.3419354838709677Tloop0.86666666666666663.72SER-0.553-0.455518945634266977-0.674-0.4857:7147/150T:S:A:R:K:N:H:E530.557894736842105275effectpnca_p.ser18pro7.18700589334483e-05-8.98740878149640.00012497350770340.940032862253632119.468044435489-0.07522855859877614692673.510811572.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.999999999999997-0.16-0.0418848167539267DestabilisingPRO0pnca_complex.pdb
59L19VL19VAPZA5.113-2.048Destabilising-1.722Destabilising-0.5291989664082687-0.4361702127659574L19LA191.2526526.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-2.00.0-2.0-1.0-2.00.00.0-2.00.04562423968706066Destabilising-1.307Destabilising-0.222847399829497270.1343283582089552Tloop1.64.47LEU-1.173-0.966227347611202799-1.221-1.1529:9147/150L:V70.0736842105263157853effectpnca_p.leu19val7.18700589334483e-05-8.987408781496410.00012497350770340.940032862253633119.46804443549-0.07522855859877594692673.510810352.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.999999999999997-2.23-0.5837696335078534DestabilisingVAL0pnca_complex.pdb
60L19RL19RAPZA5.113-1.418Destabilising-0.665Destabilising-0.3664082687338502-0.1684397163120567L19LA192.62574-54.0-30.00.00.0-30.00.00.00.00.00.00.00.00.00.00.00.00.02.00.0-1.02.0-4.00.00.0-8.00.09563516634008115Destabilising-1.398Destabilising-0.2383631713554987270.1343283582089552Tloop1.64.47LEU-1.173-0.966227347611202799-1.221-1.1529:9147/150L:V810.852631578947368491effectpnca_p.leu19arg0.00021561017680032.272606078088179.704658986530510.06344559022608971.224427601584961.85605590330240.929172866364976208.8816030049819.704669751787970.9869807610106799.701949905893830.07768449259424941.109665666564610.504888890842109570.3728424103282.291682450166840.130068862702538-0.57-0.1492146596858638DestabilisingARG0pnca_complex.pdb
61L19PL19PAPZA5.113-1.791Destabilising-1.723Destabilising-0.4627906976744185-0.4364235055724417L19LA192.9816426.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.07.06.0-1.01.0-4.00.0-2.00.00.10859781904005711Destabilising-1.477Destabilising-0.25183290707587386270.1343283582089552Tloop1.64.47LEU-1.173-0.966227347611202799-1.221-1.1529:9147/150L:V830.873684210526315891effectpnca_p.leu19pro0.00035935029466722.9665952872801819.42566805717670.00795005031660531.117705282648222.654183829436072.87215213651493380.0971589755319.42568421052631.2883763244419619.41697909836360.00368168890159292.433952911657541.92061868691892951.4031143047039.875613637235080.0016748373055023-1.37-0.3586387434554974DestabilisingPRO0pnca_complex.pdb
62A20PA20PAPZA9.104-0.313Destabilising-0.318Destabilising-0.0808785529715762-0.080547112462006A20AA20-1.377980.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-4.02.0-6.00.00.00.00.0-3.0-0.26493501499653926Stabilising-0.07Destabilising-0.011935208866155159520.4031007751937984-loop3.2666666666666673.81ALA-0.39-0.321252059308072566-0.553-0.3327:6147/150P:A:S:Y:E:G:H-76-0.817204301075268987neutral0.060.0337078651685393StabilisingPRO0pnca_complex.pdb
63A20SA20SAPZA9.104-0.846Destabilising0.467Stabilising-0.21860465116279060.2094170403587444A20AA20-0.1279190.00.00.00.00.00.00.00.00.0-4.00.0-4.00.00.00.00.00.0-3.00.0-3.00.00.00.00.0-1.0-0.02459413212335615Stabilising-0.376Destabilising-0.06410912190963342520.4031007751937984-loop3.2666666666666673.81ALA-0.39-0.321252059308072566-0.553-0.3327:6147/150P:A:S:Y:E:G:H-46-0.494623655913978572neutral-0.16-0.0418848167539267DestabilisingSER0pnca_complex.pdb
64V21GV21GAPZA6.521-2.004Destabilising-0.391Destabilising-0.517829457364341-0.0990374873353596V21VA212.372870000000000316.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.02.00.011.015.00.0864250905091092Destabilising-2.469Destabilising-0.420971867007672690.0517241379310344-loop1.76666666666666684.94VAL-1.104-0.909390444810543899-1.178-1.0629:9147/150T:V:C:I700.736842105263157985effectpnca_p.val21gly0.00043122035360063.1901608036187224.292333424160.00359542813005941.095659689549332.911634729329963.91551977432241465.53106322033524.29233361415331.3854692367923224.28330969228970.00074940700078953.125282254143112.715678448283451141.6008949688414.19774426910740.0001645676755807-2.8-0.7329842931937173DestabilisingGLY0pnca_complex.pdb
65V21AV21AAPZA6.521-1.742Destabilising-0.327Destabilising-0.4501291989664082-0.0828267477203647V21VA211.434014.00.00.00.00.00.00.00.00.02.00.00.00.00.00.00.00.0-1.00.0-1.00.02.00.04.01.00.052229765659714884Destabilising-1.866Destabilising-0.3181585677749360690.0517241379310344-loop1.76666666666666684.94VAL-1.104-0.909390444810543899-1.178-1.0629:9147/150T:V:C:I600.63157894736842180effectpnca_p.val21ala0.00014374011786681.579039389124024.850294327177360.2642475663767221.414392862765841.116407916564430.191756076673664122.6837603992334.850294365012620.6857680967922064.849564479041120.3127341543101870.5048246860149950.061763864579114379.5583372042030.08811926218633320.766581879696361-1.79-0.468586387434555DestabilisingALA0pnca_complex.pdb
66V21IV21IAPZA6.521-0.748Destabilising-0.188Destabilising-0.19328165374677-0.0476190476190476V21VA21-0.568333-14.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-2.00.0-2.00.00.00.0-2.0-2.0-0.10926959163270014Stabilising-0.271Destabilising-0.0462063086104006890.0517241379310344-loop1.76666666666666684.94VAL-1.104-0.909390444810543899-1.178-1.0629:9147/150T:V:C:I300.315789473684210566effect-0.56-0.1465968586387434DestabilisingILE0pnca_complex.pdb
67T22PT22PAPZA11.1950.063Stabilising-0.353Destabilising0.0535714285714285-0.0894123606889564T22TA22-1.500270.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-4.0-0.28844689686995306Stabilising0.006Stabilising0.0050675675675675681270.7383720930232558Tloop1.03333333333333343.6THR1.5460.49551282051282053110.8421.7122:1147/150T:A:S:G:P:D:H:E:Q:N:K:I:R-77-0.827956989247311987neutral-0.0-0.0StabilisingPRO0pnca_complex.pdb
68T22AT22AAPZA11.1950.118Stabilising-0.361Destabilising0.1003401360544217-0.0914387031408308T22TA22-0.1932690.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.02.00.04.01.0-0.03715854033684534Stabilising0.057Stabilising0.048141891891891891270.7383720930232558Tloop1.03333333333333343.6THR1.5460.49551282051282053110.8421.7122:1147/150T:A:S:G:P:D:H:E:Q:N:K:I:R-93-1.097neutral-0.37-0.0968586387434555DestabilisingALA0pnca_complex.pdb
69G23VG23VAPZA11.963-0.7809999999999999Destabilising-0.147Destabilising-0.2018087855297157-0.0372340425531914G23GA232.85361-2.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-3.00.0-3.00.0-2.00.0-5.0-13.00.10393468775267886Destabilising-2.833Destabilising-0.4830349531116795280.2692307692307692Tloop-0.53.83GLY0.4920.1576923076923077330.0830.595:3147/150G:D:H:Y:E:Q:N:R:K530.557894736842105275effectpnca_p.gly23val7.18700589334483e-05-8.987408781496410.00012497350770340.940032862253633119.468044435491-0.07522855859877514692673.510813142.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.999999999999997-1.41-0.369109947643979DestabilisingVAL0pnca_complex.pdb
70G24SG24SAPZA10.19-1.524Destabilising-0.034Destabilising-0.3937984496124031-0.008611955420466G24GA24-0.205598-8.00.00.00.00.00.00.00.00.0-2.00.0-2.00.00.00.00.00.0-8.00.0-6.0-4.0-4.00.0-9.0-17.0-0.03952895485657156Stabilising-2.078Destabilising-0.3543052003410059300.0Hhelix0.33333333333333335.96GLY-0.971-0.79983525535420199-1.094-0.9149:8147/150G:S:A410.4315789473684210671effectpnca_p.gly24ser7.18700589334483e-0512.1451538387267188179.9262646870.919026337424243119.4680444362490.1016602715482445.01153666061174e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-1.03-0.2696335078534032DestabilisingSER0pnca_complex.pdb
71G24RG24RAPZA10.19-1.19Destabilising-0.978Destabilising-0.3074935400516795-0.2477203647416413G24GA246.837089999999999-64.0-30.00.00.0-30.00.00.00.00.0-2.00.00.0-2.00.00.00.00.0-9.00.0-3.0-11.0-14.00.0-17.0-29.00.24902170033289867Destabilising-3.44Destabilising-0.586530264279624800.0Hhelix0.33333333333333335.96GLY-0.971-0.79983525535420199-1.094-0.9149:8147/150G:S:A820.863157894736842191effectpnca_p.gly24arg7.18700589334483e-0512.1451538387262188179.9262645950.919026337424226119.4680444362180.1016602715482665.01153666064e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-0.67-0.175392670157068DestabilisingARG0pnca_complex.pdb
72G24DG24DAPZA10.19-2.197Destabilising1.138Stabilising-0.56770025839793280.5103139013452914G24GA244.32448-20.0-28.00.00.0-28.00.00.00.00.00.00.00.00.00.00.00.00.0-10.00.0-6.0-6.0-6.00.0-9.0-23.00.15750697484684476Destabilising-3.803Destabilising-0.648422847399829500.0Hhelix0.33333333333333335.96GLY-0.971-0.79983525535420199-1.094-0.9149:8147/150G:S:A800.842105263157894791effectpnca_p.gly24asp0.00050309041253413.3729032940259829.16307324351890.0017890770828181.079957687620313.123180965967464.97876379054099550.89432351924329.16308470290771.4648334592411829.12933259783150.00014852956210033.8281870993483.534437535566361331.5687319993818.67174938085831.55265977742841e-05-1.77-0.4633507853403141DestabilisingASP0pnca_complex.pdb
73G24VG24VAPZA10.19-0.186Destabilising-1.361Destabilising-0.0480620155038759-0.3447315096251266G24GA242.33197-8.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-9.00.0-7.0-6.0-6.00.0-11.0-23.00.0849354234806489Destabilising-2.591Destabilising-0.441773231031543100.0Hhelix0.33333333333333335.96GLY-0.971-0.79983525535420199-1.094-0.9149:8147/150G:S:A700.736842105263157985effectpnca_p.gly24val7.18700589334483e-05-8.987408781496410.00012497350770340.940032862253632119.46804443549-0.07522855859877614692673.510811732.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.999999999999997-1.1-0.2879581151832461DestabilisingVAL0pnca_complex.pdb
74A25VA25VAPZA12.121-0.514Destabilising-0.995Destabilising-0.1328165374677002-0.2520263424518744A25AA25-0.280715-2.00.00.00.00.00.00.00.00.00.00.02.0-2.00.00.00.00.01.00.03.0-1.00.00.00.03.0-0.053971198954087515Stabilising-0.778Destabilising-0.13265132139812447260.2015503875968992Hhelix1.06666666666666694.5ALA-0.242-0.1993410214168039666-0.411-0.1477:6147/150R:K:N:H:E:Y:D:T:S:G:A-66-0.709677419354838782neutral-0.65-0.1701570680628272DestabilisingVAL0pnca_complex.pdb
75L27PL27PAPZA9.548-1.624Destabilising-1.558Destabilising-0.4196382428940569-0.3946301925025329L27LA274.659922.00.00.00.00.00.00.00.00.02.02.00.00.00.00.00.00.0-2.04.0-4.0-2.02.00.06.02.00.16972370136728854Destabilising-3.919Destabilising-0.6682011935208866110.0547263681592039Hhelix2.4666666666666675.14LEU-0.385-0.317133443163097266-0.553-0.3327:6147/150R:C:I:V:L:T:M710.747368421052631685effectpnca_p.leu27pro0.00071870058933442.9681942143847319.45675312911680.0001734516969410.7904980209177023.754840791301294.8718075812224128.95890798295619.45676929565581.2890707293778619.44800679414432.34381123661905e-054.630077367993463.87828374077737187.77986562768723.66971462585661.14368245582331e-06-1.07-0.2801047120418848DestabilisingPRO0pnca_complex.pdb
76L27RL27RAPZA9.548-0.738Destabilising-1.016Destabilising-0.1906976744186046-0.2573454913880446L27LA272.15593-46.0-20.00.0-2.0-18.00.00.00.00.00.00.0-2.00.00.00.00.00.0-3.00.0-3.0-1.00.00.02.04.00.07852366348822472Destabilising-3.558Destabilising-0.6066496163682864110.0547263681592039Hhelix2.4666666666666675.14LEU-0.385-0.317133443163097266-0.553-0.3327:6147/150R:C:I:V:L:T:M690.726315789473684280effectpnca_p.leu27arg0.00014374011786681.579039389124024.850294327177340.2642475663767231.414392862765841.116407916564430.191756076673649122.6837603992184.850294365012620.6857680967922064.849564479041120.3127341543101870.5048246860149950.061763864579114379.5583372042030.08811926218633320.766581879696361-0.1-0.0261780104712041DestabilisingARG0pnca_complex.pdb
77L27QL27QAPZA9.548-1.081Destabilising0.134Stabilising-0.2793281653746770.0600896860986547L27LA272.24048-8.00.00.00.00.00.00.00.00.0-2.00.0-2.00.00.00.00.00.0-10.00.0-6.0-4.02.00.02.0-2.00.08160315853116645Destabilising-3.309Destabilising-0.5641943734015346110.0547263681592039Hhelix2.4666666666666675.14LEU-0.385-0.317133443163097266-0.553-0.3327:6147/150R:C:I:V:L:T:M450.4736842105263157671effect-0.81-0.2120418848167539DestabilisingGLN0pnca_complex.pdb
78A28TA28TAPZA12.7-1.901Destabilising-0.289Destabilising-0.4912144702842377-0.0732016210739615A28AA28-0.611286-2.00.00.00.00.00.00.00.00.0-2.00.0-2.00.00.00.00.00.0-8.00.0-2.0-6.0-8.00.0-4.0-5.0-0.117527878181958Stabilising-2.577Destabilising-0.43938618925831200.0Hhelix0.36666666666666666.48ALA-0.564-0.464579901153212577-0.728-0.4858:7147/150P:A:I:V:L410.4315789473684210671effect-1.74-0.4554973821989529DestabilisingTHR0pnca_complex.pdb
79A28DA28DAPZA12.7-2.8Destabilising0.5539999999999999Stabilising-0.72351421188630480.2484304932735425A28AA283.01687-8.0-52.00.00.0-52.00.00.00.00.00.00.04.0-4.00.00.00.00.0-7.00.0-3.0-2.0-8.00.0-10.0-5.00.10988097232643011Destabilising-4.44Destabilising-0.757033248081841500.0Hhelix0.36666666666666666.48ALA-0.564-0.464579901153212577-0.728-0.4858:7147/150P:A:I:V:L670.705263157894736880effectpnca_p.ala28asp7.18700589334483e-0512.1451538387266188179.9262646630.91902633742424119.4680444362420.1016602715482495.01153666061778e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-1.38-0.3612565445026178DestabilisingASP0pnca_complex.pdb
80A30VA30VAPZA16.46-0.401Destabilising-0.846Destabilising-0.1036175710594315-0.2142857142857142A30AA30-0.154342-4.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-5.00.0-5.0-4.00.00.00.0-3.0-0.02967430592940091Stabilising-0.442Destabilising-0.07536231884057971370.2868217054263566Hhelix0.63.88ALA1.2070.3868589743589744110.591.1833:1147/150Q:E:Y:K:I:R:V:L:N:P:M:A:G:T:D-76-0.817204301075268987neutralpnca_p.ala30val7.18700589334483e-0512.1451538387263188179.92626460.919026337424228119.4680444362210.1016602715482645.01153666063734e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-0.7-0.1832460732984293DestabilisingVAL0pnca_complex.pdb
81I31TI31TAPZA11.654000000000002-3.12Destabilising-0.358Destabilising-0.8062015503875969-0.0906788247213779I31IA313.0692224.00.00.00.00.00.00.00.00.0-2.00.0-2.00.00.00.00.00.0-5.00.0-5.00.02.00.02.00.00.11178767327850582Destabilising-3.102Destabilising-0.528900255754475600.0Hhelix1.83333333333333336.99ILE-0.562-0.462932454695222577-0.728-0.4858:7147/150I:L:V:T:A620.652631578947368580effectpnca_p.ile31thr7.18700589334483e-05-8.987408781496410.00012497350770340.940032862253633119.46804443549-0.07522855859877584692673.510810662.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.999999999999997-3.05-0.7984293193717278DestabilisingTHR0pnca_complex.pdb
82I31SI31SAPZA11.654000000000002-3.608Destabilising-0.3289999999999999Destabilising-0.9322997416020672-0.0833333333333333I31IA314.8124828.00.00.00.00.00.00.00.00.00.00.0-2.00.00.00.00.00.00.00.00.00.02.00.02.02.00.1752809970935103Destabilising-3.395Destabilising-0.578857630008525100.0Hhelix1.83333333333333336.99ILE-0.562-0.462932454695222577-0.728-0.4858:7147/150I:L:V:T:A600.63157894736842180effectpnca_p.ile31ser0.000431220353600614.14729391912791393450.940220950.915018435774967132.5760606762050.1067107730231954.1789618205029558.33122629582811.7659011066874inf2.48532104922106e-054.604617501941085.71767556863798inf23.5474886354081.21868387173808e-06-3.34-0.8743455497382199DestabilisingSER0pnca_complex.pdb
83S32IS32IAPZA16.7870.018Stabilising-1.207Destabilising0.0153061224489795-0.3057244174265451S32SA320.86851-10.00.00.00.00.00.00.00.00.02.00.04.00.00.00.00.00.00.00.0-2.0-3.00.00.00.00.00.031633024716089135Destabilising-0.677Destabilising-0.115430520034100670.0451612903225806Tloop0.06666666666666664.62SER-0.647-0.532948929159802377-0.779-0.5538:7147/150D:T:S:G:A:V:N:R:Q290.3052631578947368563effectpnca_p.ser32ile7.18700589334483e-0512.1451538387266188179.9262646640.919026337424239119.4680444362410.1016602715482495.01153666061844e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-0.41-0.1073298429319371DestabilisingILE0pnca_complex.pdb
84S32GS32GAPZA16.787-0.875Destabilising-1.334Destabilising-0.2260981912144702-0.3378926038500506S32SA320.04856159999999994.00.00.00.00.00.00.00.00.02.00.04.00.00.00.00.00.03.00.03.00.02.00.05.017.00.0017687191777329345Destabilising-0.992Destabilising-0.169138959931798870.0451612903225806Tloop0.06666666666666664.62SER-0.647-0.532948929159802377-0.779-0.5538:7147/150D:T:S:G:A:V:N:R:Q-32-0.3440860215053763766neutral-0.43-0.112565445026178DestabilisingGLY0pnca_complex.pdb
85D33VD33VAPZA20.3130.276Stabilising-0.795Destabilising0.2346938775510204-0.2013677811550152D33DA331.481144.014.00.02.012.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-2.00.05394634284923404Destabilising-0.022Destabilising-0.0037510656436487637770.3989637305699481Tloop-1.86666666666666653.72ASP1.2130.3887820512820513110.8421.1832:1147/150N:L:V:K:R:H:E:Q:D:T:A:S:G-5-0.05376344086021505553neutralpnca_p.asp33val7.18700589334483e-0512.1451538387263188179.92626460.919026337424228119.4680444362210.1016602715482645.01153666063734e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-0.3-0.0785340314136125DestabilisingVAL0pnca_complex.pdb
86Y34CY34CAPZA18.259-1.829Destabilising-0.635Destabilising-0.472609819121447-0.1608409321175278Y34YA341.9256248.010.00.02.08.00.00.00.00.0-2.00.0-4.02.00.00.00.00.02.00.00.02.06.00.02.06.00.07013527196439369Destabilising-0.861Destabilising-0.14680306905370843260.0988593155893536Tloop-0.33333333333333344.65TYR0.420.1346153846153846330.0830.595:3147/150M:A:W:Y:E:F:H:Q:V:L:R:C:I-2-0.02150537634408602353neutral-1.94-0.5078534031413613DestabilisingCYS0pnca_complex.pdb
87Y34DY34DAPZA18.259-1.857Destabilising0.124Stabilising-0.479844961240310.0556053811659192Y34YA342.088138.0-18.00.00.0-18.00.00.00.00.02.00.00.02.00.00.00.00.03.00.00.03.08.00.02.06.00.07605314724029166Destabilising-1.484Destabilising-0.2530264279624893260.0988593155893536Tloop-0.33333333333333344.65TYR0.420.1346153846153846330.0830.595:3147/150M:A:W:Y:E:F:H:Q:V:L:R:C:I300.315789473684210566effectpnca_p.tyr34asp0.00057496047146752.679666350190414.58022779401170.00102453523771040.8160506321224163.283701089993673.3569796112212599.55386925924114.58027812895071.1637658085304114.58017590340610.00050753514476143.294533879232452.60435121163486147.67632700613615.06634481641440.0001037975122989-1.99-0.5209424083769634DestabilisingASP0pnca_complex.pdb
88Y34SY34SAPZA18.259-3.224Destabilising-0.316Destabilising-0.8330749354005167-0.0800405268490375Y34YA340.3283648.010.00.02.08.00.00.00.00.0-2.00.0-4.02.00.00.00.00.02.00.00.02.010.00.02.010.00.011959585952694876Destabilising-1.692Destabilising-0.28849104859335034260.0988593155893536Tloop-0.33333333333333344.65TYR0.420.1346153846153846330.0830.595:3147/150M:A:W:Y:E:F:H:Q:V:L:R:C:I130.136842105263157959effectpnca_p.tyr34ser0.0001437401178668-9.987521262450624.5970013133425e-050.942832958100734139.277183325398-0.071709672926946144471.7063148781.21195880622110.08348785866285790.01.00.00.025.83865859621631.0105682238915901e-250.999999999999746-3.31-0.8664921465968587DestabilisingSER0pnca_complex.pdb
89L35RL35RAPZA17.42-1.493Destabilising-0.653Destabilising-0.3857881136950905-0.1654002026342452L35LA35-2.11958-30.0-32.00.0-2.0-30.00.00.00.00.0-2.00.0-2.00.00.00.00.00.0-6.00.0-6.0-2.0-2.00.0-8.0-2.0-0.4075174959624702Stabilising-2.016Destabilising-0.34373401534526854350.1741293532338308Tloop1.43333333333333314.69LEU0.1830.05865384615384615444-0.0380.3895:4147/150G:A:S:M:T:Q:V:L:I640.673684210526315880effectpnca_p.leu35arg0.0025873221216041-1.256618543358840.284614813806290.08429969905576670.727940577686249-1.726265277521670.04616510452708160.9347177339734480.284614813531639-0.5457424996571360.2846305092447360.07460878633780381.12721002462750.0331018273828961.111624984969422.625102150044980.105185735611338-0.88-0.2303664921465968DestabilisingARG0pnca_complex.pdb
90L35PL35PAPZA17.42-2.0540000000000003Destabilising-0.954Destabilising-0.530749354005168-0.2416413373860182L35LA358.9199824.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.02.0-5.01.08.00.00.08.00.3248850880324012Destabilising-2.108Destabilising-0.35942028985507246350.1741293532338308Tloop1.43333333333333314.69LEU0.1830.05865384615384615444-0.0380.3895:4147/150G:A:S:M:T:Q:V:L:I820.863157894736842191effectpnca_p.leu35pro0.00057496047146751.580041615936874.855157858976140.02552372297753610.707465706146312.233382625065511.1472685066683320.54668643085974.855157894736840.6862033581776784.854428453388920.0333865346694671.476428655879130.90349568423798826.06271352548664.011391124949250.0451938468216249-1.48-0.387434554973822DestabilisingPRO0pnca_complex.pdb
91L35ML35MAPZA17.42-1.162Destabilising-1.12Destabilising-0.3002583979328165-0.2836879432624113L35LA35-0.61263-10.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-1.00.02.00.0-2.02.0-0.11778628008921019Stabilising-0.928Destabilising-0.15822676896845694350.1741293532338308Tloop1.43333333333333314.69LEU0.1830.05865384615384615444-0.0380.3895:4147/150G:A:S:M:T:Q:V:L:I-4-0.04301075268817204653neutral-0.38-0.0994764397905759DestabilisingMET0pnca_complex.pdb
92E37VE37VAPZA24.08-0.033Destabilising-0.519Destabilising-0.0085271317829457-0.1314589665653495E37EA370.08596412.018.00.02.016.00.00.00.00.02.00.02.00.00.00.00.00.0-1.00.0-2.01.02.00.02.0-2.00.0031309960008449943Destabilising-0.065Destabilising-0.0110826939471440741380.6188340807174888Sloop0.03333333333333333.58GLU2.7360.8769230769230769111.1833.1251:195/150F:E:Q:V:N:L:I:R:T:W:H:Y:M:G:A:S:P:D-32-0.3440860215053763766neutralpnca_p.glu37val7.18700589334483e-05-8.98740878149640.00012497350770340.940032862253632119.468044435489-0.07522855859877614692673.510811572.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.999999999999997-0.26-0.0680628272251308DestabilisingVAL0pnca_complex.pdb
93Y41DY41DAPZA19.063-2.11Destabilising-0.298Destabilising-0.545219638242894-0.0754812563323201Y41YA415.3502436.0-28.00.0-4.0-24.00.00.00.00.00.00.0-2.02.00.00.00.00.02.00.0-2.04.04.00.00.04.00.194867386854508Destabilising-3.198Destabilising-0.5452685421994885350.1330798479087452-loop-2.66666666666666654.97TYR-0.477-0.392915980230642577-0.674-0.4117:7147/150L:N:R:F:H:Y:W:A:G700.736842105263157985effectpnca_p.tyr41asp7.18700589334483e-0512.1451538387252188179.9262644070.919026337424193119.4680444361590.1016602715483085.01153666069528e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-1.85-0.4842931937172775DestabilisingASP0pnca_complex.pdb
94Y41CY41CAPZA19.063-1.057Destabilising-1.07Destabilising-0.2731266149870801-0.2710233029381966Y41YA414.0302746.08.00.00.08.00.00.00.00.02.00.0-2.04.00.00.00.00.02.00.0-2.04.010.00.02.010.00.1467912062296491Destabilising-1.836Destabilising-0.3130434782608696350.1330798479087452-loop-2.66666666666666654.97TYR-0.477-0.392915980230642577-0.674-0.4117:7147/150L:N:R:F:H:Y:W:A:G370.389473684210526366effectpnca_p.tyr41cys7.18700589334483e-05-8.987408781496430.00012497350770340.940032862253634119.468044435493-0.07522855859877394692673.510812872.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.9999999999999970.190.1067415730337078StabilisingCYS0pnca_complex.pdb
95H43DH43DAPZA19.543-1.596Destabilising-0.912Destabilising-0.4124031007751937-0.2310030395136778H43HA433.542226.0-24.00.0-2.0-22.00.00.00.00.00.00.02.00.00.00.00.00.0-2.00.0-2.0-6.00.00.00.00.00.1290153628741468Destabilising-0.971Destabilising-0.16555839727195226400.1785714285714285Estrand-0.73333333333333344.75HIS1.0710.3432692307692307110.591.1833:1147/150Y:F:H:Q:L:N:V:R:I:C:A:M:T:P:D270.2842105263157894763effectpnca_p.his43asp7.18700589334483e-05-8.987408781496410.00012497350770340.940032862253634119.468044435492-0.07522855859877464692673.510813922.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.999999999999997-1.78-0.4659685863874346DestabilisingASP0pnca_complex.pdb
96H43YH43YAPZA19.5430.984Stabilising-1.341Destabilising0.8367346938775512-0.3396656534954407H43HA43-0.653353-22.0-6.00.0-2.0-4.00.00.00.00.00.00.0-2.02.00.00.00.00.0-1.00.0-2.00.04.00.0-2.02.0-0.12561581942628625Stabilising-0.455Destabilising-0.07757885763000852400.1785714285714285Estrand-0.73333333333333344.75HIS1.0710.3432692307692307110.591.1833:1147/150Y:F:H:Q:L:N:V:R:I:C:A:M:T:P:D-33-0.354838709677419466neutral1.370.7696629213483147StabilisingTYR0pnca_complex.pdb
97H43PH43PAPZA19.543-0.892Destabilising-1.878Destabilising-0.2304909560723514-0.4756838905775076H43HA432.1044718.00.00.00.00.00.00.00.00.02.00.00.02.00.00.00.00.0-4.02.0-3.0-4.04.00.04.0-4.00.07664937827344313Destabilising-1.154Destabilising-0.19676044330775785400.1785714285714285Estrand-0.73333333333333344.75HIS1.0710.3432692307692307110.591.1833:1147/150Y:F:H:Q:L:N:V:R:I:C:A:M:T:P:D300.315789473684210566effect0.40.2247191011235955StabilisingPRO0pnca_complex.pdb
98V44AV44AAPZA17.073-2.343Destabilising-1.246Destabilising-0.6054263565891472-0.3156028368794326V44VA443.403952.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.02.01.00.12397926849700246Destabilising-1.839Destabilising-0.3135549872122762130.0747126436781609Estrand1.73333333333333345.57VAL-0.194-0.159802306425041266-0.411-0.0387:5149/150T:A:Q:C:R:I:L:V570.675effectpnca_p.val44ala7.18700589334483e-0512.1451538387265188179.9262646440.919026337424235119.4680444362350.1016602715482545.01153666062486e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-2.01-0.5261780104712042DestabilisingALA0pnca_complex.pdb
99V44GV44GAPZA17.073-2.975Destabilising-1.136Destabilising-0.7687338501291989-0.2877406281661601V44VA445.195278.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-2.00.0-2.00.04.00.05.019.00.1892230421258896Destabilising-3.88Destabilising-0.6615515771526002130.0747126436781609Estrand1.73333333333333345.57VAL-0.194-0.159802306425041266-0.411-0.0387:5149/150T:A:Q:C:R:I:L:V740.778947368421052685effectpnca_p.val44gly0.00050309041253412.496923933731212.14507737940640.00282932188573230.836294959445552.985697696165262.6161083308289384.837127083807812.14511373209771.0844015860815512.14166641515040.00225160059751252.647508644762061.98635523014012127.71994664563611.00192052746070.0009101752788745-2.43-0.6361256544502618DestabilisingGLY0pnca_complex.pdb
100V45EV45EAPZA13.521-3.389Destabilising-1.5930000000000002Destabilising-0.8757105943152454-0.4034954407294833V45VA454.7083900000000005-32.0-34.00.0-2.0-32.00.00.00.00.00.00.00.00.00.00.00.00.02.00.02.0-1.00.00.00.00.00.17148981271716726Destabilising-4.817Destabilising-0.821312872975277100.0Estrand3.48.66VAL-0.375-0.308896210873146666-0.553-0.2447:6149/150F:A:Y:M:I:V:L800.842105263157894791effect-1.92-0.5026178010471204DestabilisingGLU0pnca_complex.pdb
101V45GV45GAPZA13.521-3.523Destabilising-1.938Destabilising-0.9103359173126616-0.4908814589665654V45VA455.1646510.02.00.00.02.00.00.00.00.00.00.00.00.00.00.00.00.04.00.02.01.04.00.05.025.00.1881077950742648Destabilising-3.509Destabilising-0.598294970161977700.0Estrand3.48.66VAL-0.375-0.308896210873146666-0.553-0.2447:6149/150F:A:Y:M:I:V:L800.842105263157894791effectpnca_p.val45gly7.18700589334483e-05-8.987408781496420.00012497350770340.940032862253634119.468044435493-0.07522855859877414692673.510814812.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.999999999999997-3.55-0.9293193717277488DestabilisingGLY0pnca_complex.pdb
102V45AV45AAPZA13.521-2.783Destabilising-2.228Destabilising-0.7191214470284237-0.5643363728470112V45VA453.605766.02.00.00.02.00.00.00.00.00.00.00.00.00.00.00.00.02.00.00.01.02.00.00.07.00.13132962798388684Destabilising-1.973Destabilising-0.336402387041773200.0Estrand3.48.66VAL-0.375-0.308896210873146666-0.553-0.2447:6149/150F:A:Y:M:I:V:L390.410526315789473766effectpnca_p.val45ala7.18700589334483e-05-8.987408781496410.00012497350770340.940032862253633119.46804443549-0.07522855859877584692673.51081222.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.999999999999997-2.23-0.5837696335078534DestabilisingALA0pnca_complex.pdb
103A46EA46EAPZA11.322-1.747Destabilising-1.749Destabilising-0.4514211886304909-0.4430091185410335A46AA462.18089-36.0-32.00.00.0-32.00.00.00.00.00.00.00.00.00.00.00.00.0-4.00.01.0-5.0-8.00.0-8.0-7.00.07943276101952958Destabilising-5.096Destabilising-0.868883205456095400.0Estrand1.76666666666666668.13ALA-0.822-0.677100494233937488-0.914-0.7798:8149/150Q:F:Y:I:V:L:T:A:S:G790.831578947368421185effectpnca_p.ala46glu7.18700589334483e-0512.1451538387253188179.9262644170.919026337424195119.4680444361630.1016602715483055.01153666069207e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-1.21-0.3167539267015707DestabilisingGLU0pnca_complex.pdb
104A46VA46VAPZA11.3221.017Stabilising-2.718Destabilising0.8647959183673471-0.6884498480243161A46AA46-2.38862-2.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-7.00.01.0-8.0-2.00.02.0-7.0-0.4592440206106283Stabilising-1.487Destabilising-0.25353793691389600.0Estrand1.76666666666666668.13ALA-0.822-0.677100494233937488-0.914-0.7798:8149/150Q:F:Y:I:V:L:T:A:S:G590.621052631578947475effectpnca_p.ala46val0.00043122035360062.273361125354029.71198922975610.00865760330289620.8659477538930752.625286704808211.8945083167692570.09127426773049.7120.9873086737311829.709298202332510.00954625270319962.020167073410741.39065774214338107.4359875511857.200653677269820.00728770308105490.440.247191011235955StabilisingVAL0pnca_complex.pdb
105A46PA46PAPZA11.322-0.221Destabilising-2.408Destabilising-0.0571059431524547-0.6099290780141844A46AA462.092340.00.00.00.00.00.00.00.00.02.02.00.00.00.00.00.00.0-10.00.0-8.0-4.0-2.00.00.0-3.00.07620757726964794Destabilising-4.42Destabilising-0.75362318840579700.0Estrand1.76666666666666668.13ALA-0.822-0.677100494233937488-0.914-0.7798:8149/150Q:F:Y:I:V:L:T:A:S:G810.852631578947368491effectpnca_p.ala46pro0.000143740117866813.1456002256206511754.4635526410.924803768447002139.2771833265740.09438444913692090.000162837134445119.4110222970131.28804840845689inf0.02922358609515971.534266491831630.91081598550184inf4.731220703822740.02961985607060350.650.3651685393258427StabilisingPRO0pnca_complex.pdb
106A46TA46TAPZA11.322-1.192Destabilising-1.355Destabilising-0.3080103359173126-0.3432117527862208A46AA46-1.34478-2.00.00.00.00.00.00.00.00.0-2.00.0-2.00.00.00.00.00.0-9.00.0-2.0-7.0-2.00.0-2.0-3.0-0.2585518726447743Stabilising-2.283Destabilising-0.3892583120204603500.0Estrand1.76666666666666668.13ALA-0.822-0.677100494233937488-0.914-0.7798:8149/150Q:F:Y:I:V:L:T:A:S:G-6-0.0645161290322580653neutralpnca_p.ala46thr0.00014374011786681.579039389124024.850294327177330.2642475663767241.414392862765841.116407916564430.191756076673846122.6837603989344.850294365012620.6857680967922064.849564479041120.3127341543101870.5048246860149950.061763864579114379.5583372042030.08811926218633320.766581879696361-0.62-0.1623036649214659DestabilisingTHR0pnca_complex.pdb
107T47NT47NAPZA7.502999999999999-1.831Destabilising-0.208Destabilising-0.4731266149870801-0.0526849037487335T47TA470.956982-26.02.00.00.02.00.00.00.00.0-4.00.0-2.02.00.00.00.00.00.00.01.0-1.0-4.00.0-6.02.00.034855367536185435Destabilising-5.182Destabilising-0.883546462063086200.0Estrand-0.933333333333333210.3THR-0.925-0.761943986820428488-1.028-0.8729:8149/150C:K:I:T:S770.810526315789473785effectpnca_p.thr47asn7.18700589334483e-05-8.987408781496410.00012497350770340.940032862253634119.468044435492-0.07522855859877424692673.510812182.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.999999999999997-1.29-0.3376963350785341DestabilisingASN0pnca_complex.pdb
108T47IT47IAPZA7.502999999999999-0.155Destabilising-2.112Destabilising-0.0400516795865633-0.5349544072948329T47TA47-1.0395-32.02.00.00.02.00.00.00.00.00.00.00.02.00.00.00.00.0-2.00.0-3.0-1.02.00.00.04.0-0.19985772514035224Stabilising-1.52Destabilising-0.259164535379369100.0Estrand-0.933333333333333210.3THR-0.925-0.761943986820428488-1.028-0.8729:8149/150C:K:I:T:S720.757894736842105385effectpnca_p.thr47ile0.00035935029466720.1924857177748771.212259189825150.8632684059787471.117705054157340.1722151269325660.0619550849552318.199056717423411.212258200168210.0835951305279281.2122140741251.00.00.024605377217271312.2606125933547.1929763849897505e-250.999999999999323-0.62-0.1623036649214659DestabilisingILE0pnca_complex.pdb
109T47PT47PAPZA7.502999999999999-1.493Destabilising-1.892Destabilising-0.3857881136950905-0.4792299898682877T47TA471.936134.02.00.00.02.00.00.00.00.02.02.00.02.00.00.00.00.04.00.02.02.08.00.06.00.00.07051806904187821Destabilising-5.056Destabilising-0.862063086104006800.0Estrand-0.933333333333333210.3THR-0.925-0.761943986820428488-1.028-0.8729:8149/150C:K:I:T:S870.915789473684210591effectpnca_p.thr47pro0.0001437401178668-9.987521262450624.5970013133425e-050.942832958100734139.277183325398-0.071709672926946144471.706314861.21195880622110.08348785866285790.01.00.00.025.83865859621631.0105682238915901e-250.999999999999746-1.52-0.3979057591623037DestabilisingPRO0pnca_complex.pdb
110T47AT47AAPZA7.502999999999999-1.71Destabilising-2.172Destabilising-0.441860465116279-0.5501519756838905T47TA472.876174.00.00.00.00.00.00.00.00.00.00.00.02.00.00.00.00.06.00.04.02.012.00.06.09.00.10475637205981979Destabilising-2.276Destabilising-0.388064791133844800.0Estrand-0.933333333333333210.3THR-0.925-0.761943986820428488-1.028-0.8729:8149/150C:K:I:T:S580.610526315789473775effectpnca_p.thr47ala0.00086244070720131.580710615712284.858407045224620.00622313254011720.5777901258580722.735786828071481.5186451396487915.54288877486754.858407079646020.6864939009666724.857677956245580.00897687516574472.046874814162121.2974057699377518.18654717885766.996547901202190.0081667056971109-0.77-0.2015706806282722DestabilisingALA0pnca_complex.pdb
111K48EK48EAPZA7.546-1.833Destabilising-1.91Destabilising-0.4736434108527132-0.483789260385005K48KA482.386228.0-28.00.00.0-28.00.00.00.00.02.00.02.00.00.00.00.00.01.00.00.01.00.00.00.00.00.08691059812498635Destabilising-1.921Destabilising-0.32753623188405795190.0805084745762711Estrand-2.76.78LYS-0.823-0.677924217462932488-0.914-0.7798:8149/150I:K:R:L:Q:A530.557894736842105275effectpnca_p.lys48glu0.0006468305304011.803606307631376.071503740771530.007206189422430.6711936233565442.687162459338921.6053008707495224.54609660159526.071503791069920.7832962705280476.070368435967350.00997945185934292.000893312520281.3055012094131930.61775961744656.878013929724040.0087262477054536-1.95-0.5104712041884817DestabilisingGLU0pnca_complex.pdb
112K48TK48TAPZA7.546-1.92Destabilising-2.085Destabilising-0.4961240310077519-0.5281155015197568K48KA482.814858.024.00.00.024.00.00.00.00.02.00.02.00.00.00.00.00.01.00.0-1.02.00.00.04.0-2.00.10252114307359465Destabilising0.126Stabilising0.10641891891891893190.0805084745762711Estrand-2.76.78LYS-0.823-0.677924217462932488-0.914-0.7798:8149/150I:K:R:L:Q:A630.663157894736842180effectpnca_p.lys48thr0.00114992094293511.329557439024853.779370415543480.00839750400061280.5044504655875112.63565509346171.3495841376003810.15331057928593.779370432827430.5774194611280443.778865212613460.01153720800529071.937899277367611.194697972544911.41557016680036.255311011621140.0123821507399189-1.82-0.4764397905759163DestabilisingTHR0pnca_complex.pdb
113K48QK48QAPZA7.546-1.537Destabilising-1.653Destabilising-0.397157622739018-0.418693009118541K48KA481.389770000000000228.024.00.00.024.00.00.00.00.00.00.02.0-2.00.00.00.00.02.00.01.01.02.00.02.0-4.00.0506184485609598Destabilising-0.028Destabilising-0.004774083546462063190.0805084745762711Estrand-2.76.78LYS-0.823-0.677924217462932488-0.914-0.7798:8149/150I:K:R:L:Q:A-61-0.655913978494623682neutral-1.89-0.4947643979057591DestabilisingGLN0pnca_complex.pdb
114K48NK48NAPZA7.546-2.178Destabilising-1.168Destabilising-0.5627906976744186-0.2958459979736575K48KA482.207846.024.00.00.024.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-2.01.02.00.00.0-2.00.08041288179546763Destabilising-2.869Destabilising-0.48917306052855924190.0805084745762711Estrand-2.76.78LYS-0.823-0.677924217462932488-0.914-0.7798:8149/150I:K:R:L:Q:A670.705263157894736880effectpnca_p.lys48asn0.0001437401178668-9.98752126245064.59700131334259e-050.942832958100734139.277183325398-0.0717096729269463144471.7063148291.21195880622110.08348785866285790.01.00.00.025.83865859621631.0105682238915901e-250.999999999999746-1.86-0.486910994764398DestabilisingASN0pnca_complex.pdb
115D49GD49GAPZA3.452-1.157Destabilising-3.463Destabilising-0.2989664082687338-0.8771529888551165D49DA490.46098328.030.00.00.030.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-1.06.00.09.019.00.016790004297816855Destabilising-2.415Destabilising-0.411764705882352970.0362694300518134Estrand-1.53333333333333327.89ASP-1.188-0.978583196046128599-1.221-1.1789:9149/150T:D830.873684210526315891effectpnca_p.asp49gly0.00050309041253413.3729032940259929.16307324351890.00178907708281821.079957687620323.123180965967444.97876379054023550.89432351862229.16308470290771.4648334592411829.12933259783150.00014852956210033.8281870993483.534437535566361331.5687319993818.67174938085831.55265977742841e-05-1.08-0.2827225130890052DestabilisingGLY0pnca_complex.pdb
116D49ND49NAPZA3.452-1.6840000000000002Destabilising-1.932Destabilising-0.4351421188630491-0.4893617021276595D49DA49-0.3346690.032.00.00.032.00.00.00.00.0-2.00.00.0-2.00.00.00.00.0-6.00.00.0-6.0-2.00.00.00.0-0.064344574329001Stabilising-2.857Destabilising-0.487127024722932770.0362694300518134Estrand-1.53333333333333327.89ASP-1.188-0.978583196046128599-1.221-1.1789:9149/150T:D760.885effectpnca_p.asp49asn0.000574960471467514.1481370894991394626.352234030.901927875940367114.8142370340020.12322633024429882.958602142445777.84057359763811.89120602753485inf7.2326389241213e-076.14070321569598.29603358299821inf33.18027492710128.399830460993881e-09-1.45-0.3795811518324607DestabilisingASN0pnca_complex.pdb
117D49AD49AAPZA3.452-0.451Destabilising-3.3480000000000003Destabilising-0.1165374677002584-0.8480243161094225D49DA49-2.0672420.028.00.00.028.00.00.00.00.00.00.00.00.00.00.00.00.0-5.00.00.0-5.00.00.02.03.0-0.3974544335922479Stabilising-1.72Destabilising-0.293265132139812470.0362694300518134Estrand-1.53333333333333327.89ASP-1.188-0.978583196046128599-1.221-1.1789:9149/150T:D730.768421052631578985effectpnca_p.asp49ala0.000431220353600614.14729391912851393450.94022170.915018435774987132.5760606762410.1067107730231714.1789618204908158.33122629582811.7659011066874inf2.48532104922106e-054.604617501941085.71767556863798inf23.5474886354081.21868387173808e-06-1.56-0.4083769633507854DestabilisingALA0pnca_complex.pdb
118D49ED49EAPZA3.452-0.472Destabilising0.251Stabilising-0.12196382428940560.1125560538116591D49DA49-0.696543-22.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-5.00.0-1.0-6.0-10.00.0-6.0-8.0-0.13391967238329616Stabilising-2.35Destabilising-0.4006820119352088670.0362694300518134Estrand-1.53333333333333327.89ASP-1.188-0.978583196046128599-1.221-1.1789:9149/150T:D750.789473684210526385effectpnca_p.asp49glu0.00021561017680032.272606078088179.704658986530520.06344559022608971.224427601584961.85605590330240.929172866365932208.8816030047829.704669751787970.9869807610106799.701949905893830.07768449259424941.109665666564610.504888890842109570.3728424103282.291682450166840.130068862702538-0.28-0.0732984293193717DestabilisingGLU0pnca_complex.pdb
119D49YD49YAPZA3.452-0.7390000000000001Destabilising-1.855Destabilising-0.1909560723514212-0.4698581560283688D49DA49-2.66914-42.020.00.00.020.00.00.00.00.0-2.00.00.0-4.00.00.00.00.0-14.00.0-4.0-10.0-14.00.0-12.0-12.0-0.5131777282165654Stabilising-0.988Destabilising-0.1684569479965899570.0362694300518134Estrand-1.53333333333333327.89ASP-1.188-0.978583196046128599-1.221-1.1789:9149/150T:D850.894736842105263291effectpnca_p.asp49tyr7.18700589334483e-0512.1451538387266188179.9262646540.919026337424238119.4680444362390.101660271548255.0115366606202e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-1.64-0.4293193717277487DestabilisingTYR0pnca_complex.pdb
120H51PH51PAPZA5.6610000000000005-1.7619999999999998Destabilising-2.624Destabilising-0.4552971576227389-0.6646403242147922H51HA512.8259128.00.00.00.00.00.00.00.00.04.02.02.00.00.00.00.00.00.00.0-2.02.04.00.06.02.00.10292579345712016Destabilising-1.529Destabilising-0.260699062233589110.0044642857142857Bstrand1.36666666666666656.97HIS-1.189-0.979406919275123699-1.221-1.1789:9149/150H:Y820.863157894736842191effectpnca_p.his51pro0.00021561017680030.8858066062472852.424939574258110.4694062168248251.224427532119220.7234455147493640.11266293762038725.32705474711722.424936921783010.3847004460814332.424737369475330.4302589851681560.3662700514636120.041085444410624746.58814728670334.31445715363782e-250.999999999999476-0.98-0.256544502617801DestabilisingPRO0pnca_complex.pdb
121H51NH51NAPZA5.6610000000000005-2.215Destabilising-1.063Destabilising-0.5723514211886305-0.2692502532928065H51HA511.0320814.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-4.00.02.00.00.03759060016462824Destabilising-2.201Destabilising-0.375277067348678610.0044642857142857Bstrand1.36666666666666656.97HIS-1.189-0.979406919275123699-1.221-1.1789:9149/150H:Y700.736842105263157985effect-1.83-0.4790575916230367DestabilisingASN0pnca_complex.pdb
122H51QH51QAPZA5.6610000000000005-1.714Destabilising-1.42Destabilising-0.4428940568475452-0.3596757852077001H51HA51-1.104890.00.00.00.00.00.00.00.00.0-4.00.0-2.0-2.00.00.00.00.02.00.02.00.0-6.00.0-2.0-4.0-0.21242982388679535Stabilising-1.18Destabilising-0.201193520886615510.0044642857142857Bstrand1.36666666666666656.97HIS-1.189-0.979406919275123699-1.221-1.1789:9149/150H:Y650.684210526315789580effectpnca_p.his51gln0.00043122035360063.1901608036187224.292333424160.00359542813005951.095659689549342.911634729329953.91551977432275465.53106322086324.29233361415331.3854692367923224.28330969228970.00074940700078953.125282254143112.715678448283451141.6008949688414.19774426910740.0001645676755807-1.75-0.4581151832460733DestabilisingGLN0pnca_complex.pdb
123H51DH51DAPZA5.6610000000000005-2.198Destabilising-1.821Destabilising-0.5679586563307494-0.4612462006079027H51HA514.3402216.0-28.00.00.0-28.00.00.00.00.02.00.02.00.00.00.00.00.04.00.02.02.02.00.04.04.00.1580802599086532Destabilising-1.814Destabilising-0.309292412617220810.0044642857142857Bstrand1.36666666666666656.97HIS-1.189-0.979406919275123699-1.221-1.1789:9149/150H:Y820.863157894736842191effectpnca_p.his51asp0.003018542475204816.162585612788210454944.81806350.905545449550291136.2102618342630.11865908922819926043.55772506571.23987518604392e+26414.6084724005142.61763817252677inf4.4914140361843e-3332.34761690812153.6831618314533inf198.4366956369114.58127580776551e-45-1.67-0.4371727748691099DestabilisingASP0pnca_complex.pdb
124H51YH51YAPZA5.66100000000000050.122Stabilising-2.046Destabilising0.1037414965986394-0.5182370820668692H51HA51-1.10156-18.0-6.00.00.0-6.00.00.00.00.02.00.02.00.00.00.00.00.0-4.00.02.0-6.0-2.00.04.0-4.0-0.21178958701838038Stabilising-0.891Destabilising-0.1519181585677749410.0044642857142857Bstrand1.36666666666666656.97HIS-1.189-0.979406919275123699-1.221-1.1789:9149/150H:Y600.63157894736842180effectpnca_p.his51tyr0.00021561017680032.272606078088179.704658986530510.06344559022608971.224427601584961.85605590330240.929172866365331208.8816030051689.704669751787970.9869807610106799.701949905893830.07768449259424941.109665666564610.504888890842109570.3728424103282.291682450166840.1300688627025380.410.2303370786516853StabilisingTYR0pnca_complex.pdb
125H51RH51RAPZA5.6610000000000005-1.766Destabilising-0.862Destabilising-0.4563307493540051-0.218338399189463H51HA512.7037-32.0-2.00.00.0-2.00.00.00.00.00.00.02.0-2.00.00.00.00.0-10.00.0-2.0-9.00.00.02.0-2.00.09847463923833943Destabilising-1.252Destabilising-0.213469735720375110.0044642857142857Bstrand1.36666666666666656.97HIS-1.189-0.979406919275123699-1.221-1.1789:9149/150H:Y740.778947368421052685effectpnca_p.his51arg0.0012936610608023.1942085863816724.39086279087244.47975895465189e-070.6328484085478625.047351851150468.04148719104289105.36824872415624.39086294416241.3872271658429724.38174119797251.4579789128422702e-098.836248757295466.89001106760784131.33783584167351.20293779737598.32938806400108e-13-1.48-0.387434554973822DestabilisingARG0pnca_complex.pdb
126I52TI52TAPZA12.353-1.196Destabilising0.529Stabilising-0.30904392764857880.237219730941704I52IA520.9508466.00.00.00.00.00.00.00.00.0-2.00.00.0-2.00.00.00.00.0-1.00.0-3.00.00.00.00.0-2.00.034631881059739654Destabilising-1.262Destabilising-0.21517476555839726820.416243654822335Sloop-0.73333333333333344.09ILE-0.518-0.426688632619439977-0.674-0.4117:7149/150N:L:V:I:S:T:P:D260.273684210526315863effect-1.33-0.3481675392670157DestabilisingTHR0pnca_complex.pdb
127D53ED53EAPZA13.16-0.145Destabilising-0.123Destabilising-0.0374677002583979-0.0311550151975683D53DA530.906346-6.02.00.00.02.00.00.00.00.00.00.00.00.00.00.00.00.0-1.00.0-1.00.0-2.00.0-2.00.00.03301109419503347Destabilising-0.467Destabilising-0.079624893435635131030.533678756476684-loop-0.23.83ASP0.4980.1596153846153846330.2250.594:3148/150D:P:S:G:A:I:R:L:N:V:Q:E:H-39-0.4193548387096774466neutralpnca_p.asp53glu7.18700589334483e-05-8.98740878149640.00012497350770340.940032862253633119.468044435491-0.07522855859877524692673.510812972.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.9999999999999970.140.0786516853932584StabilisingGLU0pnca_complex.pdb
128P54AP54AAPZA9.765-1.416Destabilising-1.785Destabilising-0.365891472868217-0.452127659574468P54PA542.257960.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-1.00.0-1.00.00.00.00.01.00.08223981818049375Destabilising-1.236Destabilising-0.2107416879795396380.050314465408805-loop-1.83333333333333334.91PRO-0.129-0.1062602965403624455-0.332-0.0386:5148/150Q:E:H:K:V:N:P:A:G:S:D250.263157894736842163effectpnca_p.pro54ala7.18700589334483e-05-8.987408781496410.00012497350770340.940032862253633119.468044435491-0.07522855859877554692673.510812662.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.999999999999997-1.58-0.4136125654450262DestabilisingALA0pnca_complex.pdb
129P54LP54LAPZA9.765-0.0969999999999999Destabilising-1.77Destabilising-0.0250645994832041-0.4483282674772036P54PA543.46567-16.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-10.00.0-6.0-4.0-2.00.0-2.0-2.00.12622724524508483Destabilising-0.95Destabilising-0.161977834612105780.050314465408805-loop-1.83333333333333334.91PRO-0.129-0.1062602965403624455-0.332-0.0386:5148/150Q:E:H:K:V:N:P:A:G:S:D330.347368421052631666effectpnca_p.pro54leu0.00237171194480373.0936768420188722.05803295765267.52888191547387e-120.4518137588446466.847239114474639.7371759907790859.159394416024122.05803571428571.3435668355552522.04916211369066.54726814958295e-1615.18393987177098.9077682324348565.365381851377393.22705863452964.6626285706706e-22-0.4-0.1047120418848167DestabilisingLEU0pnca_complex.pdb
130P54SP54SAPZA9.765-1.837Destabilising-0.307Destabilising-0.4746770025839793-0.0777608915906788P54PA541.586830.0-4.00.00.0-4.00.00.00.00.0-6.00.02.0-8.00.00.00.00.0-7.00.0-3.0-2.0-6.00.0-6.0-4.00.057795802708353064Destabilising-1.286Destabilising-0.2192668371696504580.050314465408805-loop-1.83333333333333334.91PRO-0.129-0.1062602965403624455-0.332-0.0386:5148/150Q:E:H:K:V:N:P:A:G:S:D260.273684210526315863effectpnca_p.pro54ser0.00021561017680032.272606078088169.704658986530470.06344559022609041.224427601584961.85605590330240.929172866366028208.881603005169.704669751787970.9869807610106799.701949905893830.07768449259424941.109665666564610.504888890842109570.3728424103282.291682450166840.130068862702538-1.76-0.4607329842931937DestabilisingSER0pnca_complex.pdb
131P54QP54QAPZA9.765-1.251Destabilising-0.084Destabilising-0.3232558139534883-0.0212765957446808P54PA549.94224-16.00.00.00.00.00.00.00.00.0-3.00.0-1.0-2.00.00.00.00.0-8.00.0-8.0-4.0-10.00.0-8.0-6.00.362118022421492Destabilising-1.258Destabilising-0.214492753623188480.050314465408805-loop-1.83333333333333334.91PRO-0.129-0.1062602965403624455-0.332-0.0386:5148/150Q:E:H:K:V:N:P:A:G:S:D80.0842105263157894753effectpnca_p.pro54gln0.00035935029466722.9665952872801819.42566805717680.00795005031660531.117705282648222.654183829436072.872152136516380.09715897559819.42568421052631.2883763244419619.41697909836360.00368168890159292.433952911657541.92061868691892951.4031143047039.875613637235080.0016748373055023-1.64-0.4293193717277487DestabilisingGLN0pnca_complex.pdb
132P54RP54RAPZA9.765-0.884Destabilising-0.957Destabilising-0.2284237726098191-0.2424012158054711P54PA547.062289999999999-40.0-24.00.00.0-24.00.00.00.00.0-4.00.00.0-4.00.00.00.00.0-19.00.0-8.0-16.0-12.00.0-12.0-12.00.257223974533614Destabilising-1.269Destabilising-0.2163682864450127780.050314465408805-loop-1.83333333333333334.91PRO-0.129-0.1062602965403624455-0.332-0.0386:5148/150Q:E:H:K:V:N:P:A:G:S:D330.347368421052631666effectpnca_p.pro54arg0.000143740117866813.14560022562511754.4635523420.924803768446982139.277183326530.09438444913694630.000162837134446119.4110222970131.28804840845689inf0.02922358609515971.534266491831630.91081598550184inf4.731220703822740.0296198560706035-0.35-0.0916230366492146DestabilisingARG0pnca_complex.pdb
133G55SG55SAPZA12.27-0.912Destabilising0.5589999999999999Stabilising-0.23565891472868210.2506726457399102G55GA550.4413130.00.00.00.00.00.00.00.00.0-2.00.0-2.00.00.00.00.00.0-2.00.0-4.00.00.00.0-3.0-7.00.016073580081439987Destabilising-1.035Destabilising-0.1764705882352941360.3461538461538461Ghelix-1.83333333333333333.54GLY-1.036-0.853377265238879899-1.124-0.9939:9148/150T:H:S:A:G50.0526315789473684253effect0.060.0337078651685393StabilisingSER0pnca_complex.pdb
134D56ED56EAPZA11.1330.434Stabilising-0.01Destabilising0.369047619047619-0.0025329280648429D56DA56-0.915918-8.0-4.00.00.0-4.00.00.00.00.0-1.00.0-1.00.00.00.00.00.00.00.00.0-1.00.00.00.00.0-0.17609743905252634Stabilising-0.032Destabilising-0.0054560954816709291480.7668393782383419Ghelix-2.36666666666666673.47ASP2.3660.7583333333333333111.1833.1251:1148/150D:P:S:A:G:T:K:C:R:I:L:V:E:Y-78-0.838709677419354987neutral0.090.0505617977528089StabilisingGLU0pnca_complex.pdb
135H57QH57QAPZA4.561-1.29Destabilising-0.949Destabilising-0.3333333333333333-0.2403748733535967H57HA570.8493200000000001-2.00.00.00.00.00.00.00.00.01.00.0-1.02.00.00.00.00.0-2.00.0-2.02.00.00.0-2.0-2.00.030934083144545054Destabilising-0.454Destabilising-0.07740835464620631160.0714285714285714Ghelix-1.35.63HIS-1.177-0.969522240527182999-1.221-1.1529:9148/150H:S630.663157894736842180effect-0.3-0.0785340314136125DestabilisingGLN0pnca_complex.pdb
136H57LH57LAPZA4.561-0.06Destabilising-1.924Destabilising-0.0155038759689922-0.4873353596757852H57HA57-1.114062.00.00.00.00.00.00.00.00.02.00.00.02.00.00.00.00.00.00.0-2.01.00.00.0-2.00.0-0.21419287856648467Stabilising-0.541Destabilising-0.09224211423699916160.0714285714285714Ghelix-1.35.63HIS-1.177-0.969522240527182999-1.221-1.1529:9148/150H:S680.715789473684210580effect-0.64-0.1675392670157068DestabilisingLEU0pnca_complex.pdb
137H57RH57RAPZA4.561-1.171Destabilising-0.281Destabilising-0.3025839793281654-0.0711752786220871H57HA571.25273-20.0-28.00.00.0-28.00.00.00.00.02.00.00.02.00.00.00.00.00.00.0-2.03.00.00.0-2.00.00.04562715346119945Destabilising-0.843Destabilising-0.14373401534526853160.0714285714285714Ghelix-1.35.63HIS-1.177-0.969522240527182999-1.221-1.1529:9148/150H:S760.885effectpnca_p.his57arg0.001868621532269615.15576127524983820001.125628270.885234541058947105.00277150340.14433677376562515316.77893389482.0462689243807308e+16254.9171270718232.40639901531589inf1.0165082312418301e-2019.992889100283832.1173872780919inf120.5099210374954.89215110948636e-28-0.28-0.0732984293193717DestabilisingARG0pnca_complex.pdb
138H57DH57DAPZA4.561-1.854Destabilising-1.283Destabilising-0.4790697674418605-0.3249746707193516H57HA571.8331512.0-52.00.00.0-52.00.00.00.00.02.00.00.02.00.00.00.00.00.00.00.02.0-2.00.00.00.00.06676731328171097Destabilising-1.011Destabilising-0.17237851662404088160.0714285714285714Ghelix-1.35.63HIS-1.177-0.969522240527182999-1.221-1.1529:9148/150H:S750.789473684210526385effectpnca_p.his57asp0.00733074601121175.11745293904149166.9096985693512.3513585122013e-180.5855864183346248.7390225913969262.7783116073746679.19417378895166.9105263157892.2224837265936166.0661170541342.0766131992924198e-7271.682644389866955.3332327668776812.938834180501457.8277123226761.42764749548143e-101-1.24-0.3246073298429319DestabilisingASP0pnca_complex.pdb
139H57PH57PAPZA4.561-1.226Destabilising-2.115Destabilising-0.3167958656330749-0.5357142857142858H57HA570.1500222.00.00.00.00.00.00.00.00.04.02.00.02.00.00.00.00.03.04.0-3.04.02.00.00.04.00.005464054953780257Destabilising-0.75Destabilising-0.1278772378516624160.0714285714285714Ghelix-1.35.63HIS-1.177-0.969522240527182999-1.221-1.1529:9148/150H:S780.821052631578947485effectpnca_p.his57pro0.000287480235733714.14645145909521392277.507850550.930573112990219162.3718495990670.08712379328083010.011399544335576638.85473684210531.58944397188817inf0.00085282752075193.069138793404423.20302487654751inf13.99098223529590.0001836895199759-0.33-0.0863874345549738DestabilisingPRO0pnca_complex.pdb
140H57YH57YAPZA4.5610.405Stabilising-1.155Destabilising0.3443877551020408-0.2925531914893617H57HA57-0.147464-10.0-6.00.00.0-6.00.00.00.00.00.00.00.00.00.00.00.00.0-4.00.0-2.00.00.00.00.00.0-0.028351918787972007Stabilising-0.488Destabilising-0.08320545609548166160.0714285714285714Ghelix-1.35.63HIS-1.177-0.969522240527182999-1.221-1.1529:9148/150H:S630.663157894736842180effectpnca_p.his57tyr0.000215610176800313.1460210124991511969.8484282960.907969111549563113.7193447318710.1156005694852960.18392693627887429.12878787878791.4643224129316inf0.00499313284561492.30162687909812.00455510251839inf9.28726407271570.00230752540691850.90.5056179775280899StabilisingTYR0pnca_complex.pdb
141F58LF58LAPZA8.072000000000001-1.639Destabilising-2.337Destabilising-0.4235142118863049-0.5919452887537994F58FA580.15513410.02.00.00.02.00.00.00.00.00.00.00.00.00.00.00.00.0-3.00.0-3.01.02.00.06.00.00.0056503179656028964Destabilising-0.746Destabilising-0.12719522591645352430.1791666666666666Bstrand-0.40000000000000014.41PHE-1.108-0.912685337726523999-1.178-1.0629:9148/150W:I:F740.778947368421052685effectpnca_p.phe58leu0.0006468305304011.803606307631376.07150374077150.00720618942243010.6711936233565442.687162459338921.6053008707495224.54609660159536.071503791069920.7832962705280476.070368435967350.00997945185934292.000893312520281.3055012094131930.61775961744656.878013929724040.0087262477054536-1.43-0.3743455497382199DestabilisingLEU0pnca_complex.pdb
142F58SF58SAPZA8.072000000000001-2.784Destabilising-0.8059999999999999Destabilising-0.7193798449612402-0.2041540020263424F58FA582.943528.02.00.00.02.00.00.00.00.00.00.00.0-2.00.00.00.00.00.00.00.02.06.00.010.02.00.10720867721938533Destabilising-1.022Destabilising-0.1742540494458653430.1791666666666666Bstrand-0.40000000000000014.41PHE-1.108-0.912685337726523999-1.178-1.0629:9148/150W:I:F780.821052631578947485effectpnca_p.phe58ser0.00014374011786681.579039389124024.850294327177340.2642475663767231.414392862765841.116407916564430.191756076673649122.6837603992184.850294365012620.6857680967922064.849564479041120.3127341543101870.5048246860149950.061763864579114379.5583372042030.08811926218633320.766581879696361-3.0-0.7853403141361257DestabilisingSER0pnca_complex.pdb
143F58VF58VAPZA8.072000000000001-1.927Destabilising-2.319Destabilising-0.4979328165374676-0.587386018237082F58FA581.5643328.02.00.00.02.00.00.00.00.00.00.02.0-2.00.00.00.00.0-2.00.0-2.02.04.00.08.0-2.00.05697630373181623Destabilising-1.103Destabilising-0.18806479113384483430.1791666666666666Bstrand-0.40000000000000014.41PHE-1.108-0.912685337726523999-1.178-1.0629:9148/150W:I:F710.747368421052631685effectpnca_p.phe58val7.18700589334483e-05-8.987408781496410.00012497350770340.940032862253633119.468044435491-0.07522855859877554692673.510812662.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.999999999999997-1.7-0.4450261780104712DestabilisingVAL0pnca_complex.pdb
144S59PS59PAPZA11.829-0.594Destabilising-1.097Destabilising-0.1534883720930232-0.2778622087132725S59SA593.60580.00.00.00.00.00.00.00.00.04.02.02.00.00.00.00.00.0-6.00.0-4.0-2.0-2.00.0-4.0-6.00.1313310848709562Destabilising-1.13Destabilising-0.19266837169650466380.2451612903225806-loop0.53333333333333333.86SER-0.671-0.552718286655683877-0.779-0.6158:7148/150T:G:A:S:Q:H:E:K:R:L:V620.652631578947368580effectpnca_p.ser59pro0.000431220353600614.14729391913271393450.940227640.915018435775139132.576060676520.1067107730229784.1789618203969358.33122629582811.7659011066874inf2.48532104922106e-054.604617501941085.71767556863798inf23.5474886354081.21868387173808e-06-0.16-0.0418848167539267DestabilisingPRO0pnca_complex.pdb
145S59FS59FAPZA11.829-0.905Destabilising-0.598Destabilising-0.2338501291989664-0.1514690982776089S59SA590.176045-14.0-2.00.00.0-2.00.00.00.00.02.00.02.00.00.00.00.00.0-3.00.0-1.0-2.0-2.00.0-4.0-2.00.006411942103307863Destabilising-1.083Destabilising-0.1846547314578005380.2451612903225806-loop0.53333333333333333.86SER-0.671-0.552718286655683877-0.779-0.6158:7148/150T:G:A:S:Q:H:E:K:R:L:V560.589473684210526375effectpnca_p.ser59phe7.18700589334483e-0512.1451538387252188179.9262644040.919026337424193119.4680444361590.1016602715483075.01153666069521e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-0.74-0.193717277486911DestabilisingPHE0pnca_complex.pdb
146S59YS59YAPZA11.829-0.542Destabilising-0.5529999999999999Destabilising-0.1400516795865633-0.1400709219858155S59SA590.447426-22.0-2.00.00.0-2.00.00.00.00.02.00.02.00.00.00.00.00.0-1.00.0-1.00.00.00.0-2.0-2.00.01629622884782086Destabilising-0.986Destabilising-0.1681159420289855380.2451612903225806-loop0.53333333333333333.86SER-0.671-0.552718286655683877-0.779-0.6158:7148/150T:G:A:S:Q:H:E:K:R:L:V580.610526315789473775effectpnca_p.ser59tyr7.18700589334483e-0512.1451538387264188179.9262646340.919026337424234119.4680444362320.1016602715482565.0115366606273e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-0.66-0.1727748691099476DestabilisingTYR0pnca_complex.pdb
147G60DG60DAPZA14.904000000000002-0.161Destabilising0.52Stabilising-0.04160206718346250.2331838565022421G60GA60-2.082670.0-8.00.00.0-8.00.00.00.00.0-4.00.00.0-4.00.00.00.00.0-1.00.0-1.00.00.00.0-1.0-7.0-0.40042105667922784Stabilising0.187Stabilising0.1579391891891892800.7692307692307693Sloop-0.63333333333333333.26GLY0.720.23076923076923075220.3890.8424:2148/150H:E:Q:N:L:V:K:I:T:A:S:G:P:D-38-0.4086021505376344366neutralpnca_p.gly60asp7.18700589334483e-05-8.987408781496410.00012497350770340.940032862253634119.468044435492-0.07522855859877454692673.510814242.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.999999999999997-0.13-0.0340314136125654DestabilisingASP0pnca_complex.pdb
148T61PT61PAPZA14.618-0.204Destabilising-0.472Destabilising-0.0527131782945736-0.1195542046605876T61TA611.581340.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.02.0-2.00.00.00.00.0-2.00.057595844958078075Destabilising-0.158Destabilising-0.0269394714407502141300.7558139534883721Sloop-0.93.48THR1.3230.42403846153846153110.8421.7122:1124/150R:K:N:L:V:Q:H:E:D:P:T:A:G:S-13-0.1397849462365591357neutralpnca_p.thr61pro7.18700589334483e-05-8.987408781496440.00012497350770340.940032862253633119.468044435491-0.07522855859877524692673.510813452.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.9999999999999970.020.0112359550561797StabilisingPRO0pnca_complex.pdb
149T61RT61RAPZA14.6180.174Stabilising-0.01Destabilising0.1479591836734693-0.0025329280648429T61TA61-0.3629409999999999-8.0-4.00.00.0-4.00.00.00.00.00.00.00.00.00.00.00.00.0-1.00.0-1.0-1.00.00.00.00.0-0.06978024302084132Stabilising-0.011Destabilising-0.00187553282182438181300.7558139534883721Sloop-0.93.48THR1.3230.42403846153846153110.8421.7122:1124/150R:K:N:L:V:Q:H:E:D:P:T:A:G:S-37-0.397849462365591466neutral-0.02-0.0052356020942408DestabilisingARG0pnca_complex.pdb
150P62LP62LAPZA11.121-0.504Destabilising-0.276Destabilising-0.1302325581395348-0.0699088145896656P62PA621.77657999999999980.0-2.00.00.0-2.00.00.00.00.00.00.00.00.00.00.00.00.0-1.0-2.0-7.01.02.00.04.02.00.06470691074381368Destabilising-1.127Destabilising-0.19215686274509802340.2138364779874214-loop-1.93333333333333363.99PRO-0.599-0.4934102141680395477-0.779-0.4858:7125/150I:V:P:A:E540.568421052631578975effectpnca_p.pro62leu0.00079057064826793.8854162605398848.68720480414740.00021180758772921.04883671410913.704500622711549.31977387255173893.78337229227148.68720979316171.6874148863521148.67468781626231.95392414212297e-076.709092301055796.917816795682662088.8499422051937.26191685724721.03281930722422e-09-0.59-0.1544502617801047DestabilisingLEU0pnca_complex.pdb
151P62SP62SAPZA11.121-1.342Destabilising0.534Stabilising-0.34677002583979320.2394618834080717P62PA621.541350.00.00.00.00.00.00.00.00.0-2.00.0-2.00.00.00.00.00.0-3.0-2.0-1.00.0-4.00.0-4.00.00.05613932211044661Destabilising-1.161Destabilising-0.1979539641943734340.2138364779874214-loop-1.93333333333333363.99PRO-0.599-0.4934102141680395477-0.779-0.4858:7125/150I:V:P:A:E500.526315789473684275effectpnca_p.pro62ser0.00035935029466720.1924857177748761.212259189825150.8632684059787481.117705054157340.1722151269325650.06195508495527068.199056717423431.212258200168210.0835951305279281.2122140741251.00.00.024605377217271312.2606125933547.1929763849897505e-250.999999999999323-1.23-0.3219895287958115DestabilisingSER0pnca_complex.pdb
152P62QP62QAPZA11.121-0.763Destabilising0.708Stabilising-0.1971576227390180.3174887892376681P62PA621.97038-6.00.00.00.00.00.00.00.00.0-3.00.0-1.0-2.00.00.00.00.0-7.0-2.0-3.0-3.00.00.00.00.00.07176552859505096Destabilising-0.98Destabilising-0.1670929241261722340.2138364779874214-loop-1.93333333333333363.99PRO-0.599-0.4934102141680395477-0.779-0.4858:7125/150I:V:P:A:E500.526315789473684275effect-0.28-0.0732984293193717DestabilisingGLN0pnca_complex.pdb
153P62TP62TAPZA11.121-1.056Destabilising0.522Stabilising-0.27286821705426350.2340807174887892P62PA622.209080.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-9.0-2.0-5.0-2.0-4.00.0-4.00.00.08045950218168839Destabilising-1.242Destabilising-0.21176470588235294340.2138364779874214-loop-1.93333333333333363.99PRO-0.599-0.4934102141680395477-0.779-0.4858:7125/150I:V:P:A:E550.578947368421052775effectpnca_p.pro62thr0.000215610176800313.1460210125009511969.8484292080.907969111549634113.7193447319750.1156005694852070.18392693627672429.12878787878791.4643224129316inf0.00499313284561492.30162687909812.00455510251839inf9.28726407271570.0023075254069185-0.58-0.1518324607329843DestabilisingTHR0pnca_complex.pdb
154P62RP62RAPZA11.121-0.186Destabilising0.023Stabilising-0.04806201550387590.0103139013452914P62PA622.51854-20.0-14.00.00.0-14.00.00.00.00.00.00.00.00.00.00.00.00.0-7.0-2.0-1.0-5.0-2.00.00.00.00.09173070899409232Destabilising-1.078Destabilising-0.18380221653878942340.2138364779874214-loop-1.93333333333333363.99PRO-0.599-0.4934102141680395477-0.779-0.4858:7125/150I:V:P:A:E610.642105263157894780effect-0.18-0.0471204188481675DestabilisingARG0pnca_complex.pdb
155D63ED63EAPZA10.737-0.2189999999999999Destabilising-0.0139999999999999Destabilising-0.0565891472868217-0.0035460992907801D63DA633.8992-4.06.00.00.06.00.00.00.00.04.00.06.02.00.00.00.00.02.00.02.00.00.00.02.02.00.14201735152499653Destabilising-0.86Destabilising-0.1466325660699062840.4352331606217616-loop-2.13333333333333333.62ASP-0.741-0.610378912685337788-0.872-0.6748:7125/150W:D:M:G:N:F:Y:E320.336842105263157966effect0.020.0112359550561797StabilisingGLU0pnca_complex.pdb
156D63GD63GAPZA10.737-1.153Destabilising-0.799Destabilising-0.2979328165374677-0.2023809523809523D63DA634.6162199999999994.012.00.00.012.00.00.00.00.04.00.04.06.00.00.00.00.03.00.01.00.00.00.07.011.00.16813278068750498Destabilising-0.964Destabilising-0.16436487638533673840.4352331606217616-loop-2.13333333333333333.62ASP-0.741-0.610378912685337788-0.872-0.6748:7125/150W:D:M:G:N:F:Y:E330.347368421052631666effectpnca_p.asp63gly0.00057496047146751.580041615936874.855157858976140.02552372297753610.707465706146312.233382625065511.1472685066683120.54668643085954.855157894736840.6862033581776784.854428453388920.0333865346694671.476428655879130.90349568423798826.06271352548664.011391124949250.0451938468216249-0.66-0.1727748691099476DestabilisingGLY0pnca_complex.pdb
157D63YD63YAPZA10.7370.07Stabilising-0.4379999999999999Destabilising0.0595238095238095-0.1109422492401215D63DA634.37717-6.012.00.00.012.00.00.00.00.04.00.04.06.00.00.00.00.02.00.02.0-2.00.00.02.00.00.15942605933901033Destabilising-0.53Destabilising-0.09036658141517477840.4352331606217616-loop-2.13333333333333333.62ASP-0.741-0.610378912685337788-0.872-0.6748:7125/150W:D:M:G:N:F:Y:E350.368421052631578966effectpnca_p.asp63tyr7.18700589334483e-05-8.987408781496410.00012497350770340.940032862253634119.468044435492-0.07522855859877444692673.510814312.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.9999999999999970.230.1292134831460674StabilisingTYR0pnca_complex.pdb
158D63AD63AAPZA10.737-0.7140000000000001Destabilising-0.769Destabilising-0.1844961240310077-0.1947821681864235D63DA634.44722.012.00.00.012.00.00.00.00.04.00.04.06.00.00.00.00.03.00.03.00.00.00.02.01.00.1619767043757603Destabilising-0.704Destabilising-0.12003410059676044840.4352331606217616-loop-2.13333333333333333.62ASP-0.741-0.610378912685337788-0.872-0.6748:7125/150W:D:M:G:N:F:Y:E400.4210526315789473571effectpnca_p.asp63ala0.00093431076613483.2879148522952426.78695063407031.90630753051068e-050.7689965452610434.2755911877077.18677177005967173.19915101158126.78695101351351.4279232834714526.77080329785171.9896368453757e-076.701226185118915.83859157504838247.44379804845637.21596598919881.0574446237829601e-090.120.0674157303370786StabilisingALA0pnca_complex.pdb
159D63HD63HAPZA10.737-0.085Destabilising-0.456Destabilising-0.0219638242894056-0.1155015197568389D63DA634.0904300000000005-4.06.00.00.06.00.00.00.00.02.00.02.06.00.00.00.00.03.00.03.00.00.00.02.0-2.00.14898236438202495Destabilising-0.703Destabilising-0.11986359761295821840.4352331606217616-loop-2.13333333333333333.62ASP-0.741-0.610378912685337788-0.872-0.6748:7125/150W:D:M:G:N:F:Y:E350.368421052631578966effectpnca_p.asp63his0.00021561017680030.8858066062472842.424939574258110.4694062168248261.224427532119220.7234455147493630.11266293762038625.32705474713052.424936921783010.3847004460814332.424737369475330.4302589851681560.3662700514636120.041085444410624746.58814728670334.31445715363782e-250.9999999999994760.250.1404494382022472StabilisingHIS0pnca_complex.pdb
160D63VD63VAPZA10.7370.0279999999999999Stabilising-0.722Destabilising0.0238095238095238-0.1828774062816616D63DA634.486870.012.00.00.012.00.00.00.00.04.00.04.06.00.00.00.00.01.00.01.00.00.00.00.00.00.16342157212683658Destabilising-0.842Destabilising-0.1435635123614663840.4352331606217616-loop-2.13333333333333333.62ASP-0.741-0.610378912685337788-0.872-0.6748:7125/150W:D:M:G:N:F:Y:E400.4210526315789473571effect-0.12-0.031413612565445DestabilisingVAL0pnca_complex.pdb
161Y64DY64DAPZA8.434-0.392Destabilising0.546Stabilising-0.10129198966408260.2448430493273543Y64YA642.5986632.0-18.00.00.0-18.00.00.00.00.00.00.00.00.00.00.00.00.03.00.0-3.04.06.00.06.04.00.09464885379409815Destabilising-0.33Destabilising-0.056265984654731461350.5133079847908745Sloop-1.86666666666666653.61TYR0.9470.303525641025641110.591.1833:1146/150E:Y:H:F:Q:N:R:K:S:G:A:T:P:W:D690.726315789473684280effectpnca_p.tyr64asp0.00028748023573371.579373295212094.851914140399820.1143422970043041.00025364540071.578972796024540.58188909131151240.45629110752984.851914177534710.6859131102999064.851184435511780.1379549363682950.8602627547777290.35147133141776367.04210604197061.174970908556980.2783822018195610.170.0955056179775281StabilisingASP0pnca_complex.pdb
162S65PS65PAPZA8.267999999999999-0.032Destabilising-0.499Destabilising-0.0082687338501291-0.1263931104356636S65SA653.337530.00.00.00.00.00.00.00.00.04.00.04.00.00.00.00.00.00.04.0-4.0-2.00.00.0-2.0-2.00.12156010751826572Destabilising-0.186Destabilising-0.031713554987212275970.6258064516129033Sloop-0.96666666666666683.79SER-0.697-0.574135090609555188-0.827-0.6158:7147/150L:V:R:K:I:E:Q:D:G:S:A:T210.2210526315789473663effectpnca_p.ser65pro0.0001437401178668-9.987521262450584.59700131334264e-050.942832958100734139.277183325397-0.0717096729269463144471.7063148411.21195880622110.08348785866285790.01.00.00.025.83865859621631.0105682238915901e-250.999999999999746-0.19-0.0497382198952879DestabilisingPRO0pnca_complex.pdb
163S66LS66LAPZA9.0050.201Stabilising-0.6629999999999999Destabilising0.1709183673469388-0.1679331306990881S66SA661.22464-10.00.00.00.00.00.00.00.00.02.00.00.04.00.00.00.00.0-1.00.00.0-5.00.00.00.00.00.044604054516714134Destabilising0.084Stabilising0.07094594594594596710.4580645161290322Sloop-0.80000000000000023.87SER-0.098-0.0807248764415156655-0.332-0.0386:5147/150N:V:I:R:H:F:E:Q:D:T:G:M:S:A320.336842105263157966effectpnca_p.ser66leu0.0005030904125341-10.98796437758281.69039306948873e-050.928667766494711122.741582014466-0.08952112395200971.026435870957930.346123821533658-0.4607685099095710.00.6113803017059260.2136885580833250.03.364429279647070.4896589276114850.484079488471969-0.57-0.1492146596858638DestabilisingLEU0pnca_complex.pdb
164S66PS66PAPZA9.005-0.248Destabilising-0.726Destabilising-0.0640826873385013-0.1838905775075987S66SA661.917960.00.00.00.00.00.00.00.00.04.00.02.04.00.00.00.00.02.04.0-2.0-4.00.00.0-2.00.00.06985627809060381Destabilising-0.165Destabilising-0.02813299232736573710.4580645161290322Sloop-0.80000000000000023.87SER-0.098-0.0807248764415156655-0.332-0.0386:5147/150N:V:I:R:H:F:E:Q:D:T:G:M:S:A460.484210526315789571effectpnca_p.ser66pro7.18700589334483e-0512.1451538387261188179.9262645630.919026337424221119.4680444362090.1016602715482735.01153666064915e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-0.07-0.0183246073298429DestabilisingPRO0pnca_complex.pdb
165S67PS67PAPZA8.658-0.228Destabilising-1.699Destabilising-0.0589147286821705-0.4303444782168186S67SA673.293110.00.00.00.00.00.00.00.00.02.00.02.04.00.00.00.00.0-2.02.0-2.0-4.00.00.00.0-4.00.11994223442769833Destabilising-0.86Destabilising-0.1466325660699062150.0967741935483871-loop-0.83333333333333345.15SER-0.355-0.2924217462932454766-0.553-0.2447:6148/150N:L:V:I:F:Q:W:T:A:M:S:P400.4210526315789473571effectpnca_p.ser67pro0.00093431076613484.0685812110773658.47394153063089.19336449861209e-051.040304983646523.9109504184205511.51666355995361065.6133239763458.47401774397971.7669629351934258.45475747253786.68324361543955e-098.175012707825478.640865298701952465.7464727377246.75148301951678.05839318437163e-12-0.0-0.0StabilisingPRO0pnca_complex.pdb
166S67LS67LAPZA8.6580.61Stabilising-1.544Destabilising0.5187074829931972-0.3910840932117528S67SA670.0243891-8.00.00.00.00.00.00.00.00.02.00.00.04.00.00.00.00.0-5.00.0-2.0-5.00.00.00.0-2.00.0008883041106068664Destabilising-0.207Destabilising-0.03529411764705882150.0967741935483871-loop-0.83333333333333345.15SER-0.355-0.2924217462932454766-0.553-0.2447:6148/150N:L:V:I:F:Q:W:T:A:M:S:P330.347368421052631666effect0.220.1235955056179775StabilisingLEU0pnca_complex.pdb
167S67WS67WAPZA8.658-0.8320000000000001Destabilising-0.833Destabilising-0.2149870801033591-0.2109929078014184S67SA670.2013579999999999-10.0-4.00.00.0-4.00.00.00.00.00.00.00.02.00.00.00.00.0-4.00.0-4.0-4.00.00.00.0-6.00.007333896663000164Destabilising-0.082Destabilising-0.013981244671781756150.0967741935483871-loop-0.83333333333333345.15SER-0.355-0.2924217462932454766-0.553-0.2447:6148/150N:L:V:I:F:Q:W:T:A:M:S:P390.410526315789473766effectpnca_p.ser67trp7.18700589334483e-0512.145153838726188179.9262645410.919026337424218119.4680444362040.1016602715482765.01153666065335e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-0.65-0.1701570680628272DestabilisingTRP0pnca_complex.pdb
168S67TS67TAPZA8.658-0.129Destabilising-1.3019999999999998Destabilising-0.0333333333333333-0.3297872340425531S67SA67-0.2653210.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-8.00.0-6.0-2.00.00.00.0-4.0-0.051011497346766126Stabilising-0.27Destabilising-0.04603580562659847150.0967741935483871-loop-0.83333333333333345.15SER-0.355-0.2924217462932454766-0.553-0.2447:6148/150N:L:V:I:F:Q:W:T:A:M:S:P-47-0.505376344086021572neutral-0.1-0.0261780104712041DestabilisingTHR0pnca_complex.pdb
169W68CW68CAPZA4.974-1.453Destabilising-1.575Destabilising-0.3754521963824289-0.3989361702127659W68WA682.6809146.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.04.00.00.04.02.00.00.04.00.09764457783054946Destabilising-1.561Destabilising-0.26615515771526450.1578947368421052Bstrand-1.15.49TRP-1.146-0.94398682042833699-1.221-1.1249:9150/150F:W780.821052631578947485effectpnca_p.trp68cys0.00043122035360063.1901608036187224.29233342415990.00359542813005951.095659689549342.911634729329953.91551977432164465.53106322052124.29233361415331.3854692367923224.28330969228970.00074940700078953.125282254143112.715678448283451141.6008949688414.19774426910740.0001645676755807-1.46-0.3821989528795811DestabilisingCYS0pnca_complex.pdb
170W68GW68GAPZA4.974-2.572Destabilising-2.125Destabilising-0.6645994832041343-0.5382472137791287W68WA684.0379252.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.04.00.00.04.04.00.05.021.00.14706983588167163Destabilising-1.882Destabilising-0.3208866155157715450.1578947368421052Bstrand-1.15.49TRP-1.146-0.94398682042833699-1.221-1.1249:9150/150F:W860.905263157894736991effectpnca_p.trp68gly0.00136553111973554.4765856924805587.93392608209951.32290566590749e-051.027616235926834.3562815922648818.15652851721871582.5323809053887.93392630241421.9441564650994687.89984003248112.3565519928076e-1312.627722973922413.87020724484973588.3573438711975.51738676024063.62203368500016e-18-3.08-0.8062827225130891DestabilisingGLY0pnca_complex.pdb
171W68RW68RAPZA4.974-1.608Destabilising-0.5760000000000001Destabilising-0.4155038759689922-0.1458966565349544W68WA680.0790982-18.0-32.00.00.0-32.00.00.00.00.0-2.00.0-2.00.00.00.00.00.0-1.00.0-4.03.02.00.00.0-2.00.0028809286198180346Destabilising-1.263Destabilising-0.21534526854219946450.1578947368421052Bstrand-1.15.49TRP-1.146-0.94398682042833699-1.221-1.1249:9150/150F:W890.936842105263157991effectpnca_p.trp68arg0.00201236165013654.88586941655608132.405530867761.59295080619135e-061.018057650997344.7992070112823728.21262252033422362.8544732838132.4056122448982.12190639382976132.6087582252194.03470202806197e-2019.394188533394721.7935654751715246.53379470447119.0233288751821.03505008297772e-27-1.5-0.3926701570680628DestabilisingARG0pnca_complex.pdb
172W68SW68SAPZA4.974-2.673Destabilising-1.036Destabilising-0.6906976744186046-0.2624113475177305W68WA682.6478848.00.00.00.00.00.00.00.00.0-2.00.0-2.00.00.00.00.00.00.00.00.00.04.00.02.04.00.09644155333299338Destabilising-1.343Destabilising-0.22898550724637678450.1578947368421052Bstrand-1.15.49TRP-1.146-0.94398682042833699-1.221-1.1249:9150/150F:W860.905263157894736991effectpnca_p.trp68ser7.18700589334483e-0512.1451538387252188179.9262643990.919026337424192119.4680444361570.1016602715483095.01153666069715e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-3.09-0.8089005235602095DestabilisingSER0pnca_complex.pdb
173W68LW68LAPZA4.974-1.622Destabilising-2.242Destabilising-0.4191214470284237-0.5678824721377913W68WA680.19213230.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-3.00.0-1.0-3.00.00.00.02.00.006997865660443331Destabilising-1.096Destabilising-0.18687127024722933450.1578947368421052Bstrand-1.15.49TRP-1.146-0.94398682042833699-1.221-1.1249:9150/150F:W840.884210526315789491effect-1.35-0.3534031413612565DestabilisingLEU0pnca_complex.pdb
174P69RP69RAPZA7.994-1.258Destabilising-0.966Destabilising-0.3250645994832041-0.2446808510638297P69PA692.33826-46.0-14.00.00.0-14.00.00.00.00.0-2.00.0-2.00.00.00.00.00.0-8.00.0-2.0-7.0-6.00.00.0-2.00.08516451897231186Destabilising-1.319Destabilising-0.2248934356351236230.1446540880503144-loop-1.36666666666666654.65PRO-1.198-0.986820428336079199-1.229-1.1789:9150/150P770.810526315789473785effectpnca_p.pro69arg7.18700589334483e-05-8.987408781496420.00012497350770340.940032862253634119.468044435493-0.07522855859877434692673.510813032.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.999999999999997-1.24-0.3246073298429319DestabilisingARG0pnca_complex.pdb
175P69QP69QAPZA7.994-1.59Destabilising-0.293Destabilising-0.4108527131782946-0.0742147922998986P69PA692.83344-12.00.00.00.00.00.00.00.00.0-2.00.0-2.00.00.00.00.00.0-6.00.0-2.0-5.0-8.00.0-2.0-2.00.1032000524479345Destabilising-1.339Destabilising-0.22830349531116792230.1446540880503144-loop-1.36666666666666654.65PRO-1.198-0.986820428336079199-1.229-1.1789:9150/150P710.747368421052631685effectpnca_p.pro69gln7.18700589334483e-05-8.987408781496410.00012497350770340.940032862253634119.468044435492-0.07522855859877444692673.510814312.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.999999999999997-0.94-0.2460732984293193DestabilisingGLN0pnca_complex.pdb
176P69LP69LAPZA7.9940.046Stabilising-1.774Destabilising0.0391156462585034-0.4493414387031408P69PA692.773-12.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-1.00.0-1.00.0-4.00.0-2.00.00.1009986960860729Destabilising-1.421Destabilising-0.2422847399829497230.1446540880503144-loop-1.36666666666666654.65PRO-1.198-0.986820428336079199-1.229-1.1789:9150/150P710.747368421052631685effectpnca_p.pro69leu0.00043122035360063.1901608036187324.29233342416010.00359542813005941.095659689549342.911634729329963.91551977432241465.53106322033824.29233361415331.3854692367923224.28330969228970.00074940700078953.125282254143112.715678448283451141.6008949688414.19774426910740.0001645676755807-0.28-0.0732984293193717DestabilisingLEU0pnca_complex.pdb
177P69SP69SAPZA7.994-2.477Destabilising-0.353Destabilising-0.6400516795865633-0.0894123606889564P69PA693.288380.00.00.00.00.00.00.00.00.00.00.00.0-2.00.00.00.00.0-1.00.0-1.00.02.00.02.02.00.11976995753174192Destabilising-1.447Destabilising-0.24671781756180733230.1446540880503144-loop-1.36666666666666654.65PRO-1.198-0.986820428336079199-1.229-1.1789:9150/150P730.768421052631578985effectpnca_p.pro69ser0.0001437401178668-9.987521262450594.59700131334263e-050.942832958100734139.277183325398-0.0717096729269462144471.7063148451.21195880622110.08348785866285790.01.00.00.025.83865859621631.0105682238915901e-250.999999999999746-1.93-0.5052356020942408DestabilisingSER0pnca_complex.pdb
178P69TP69TAPZA7.994-1.905Destabilising-0.377Destabilising-0.4922480620155038-0.0954913880445795P69PA692.75187000000000030.00.00.00.00.00.00.00.00.0-2.00.0-2.00.00.00.00.00.0-1.00.0-1.00.00.00.02.00.00.10022909549166298Destabilising-1.735Destabilising-0.2958226768968457230.1446540880503144-loop-1.36666666666666654.65PRO-1.198-0.986820428336079199-1.229-1.1789:9150/150P720.757894736842105385effectpnca_p.pro69thr7.18700589334483e-0512.1451538387252188179.9262644080.919026337424193119.468044436160.1016602715483075.01153666069443e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-1.08-0.2827225130890052DestabilisingTHR0pnca_complex.pdb
179H71YH71YAPZA4.184-0.461Destabilising-1.955Destabilising-0.1191214470284237-0.4951874366767984H71HA71-1.77532-26.0-6.00.00.0-6.00.00.00.00.0-2.00.02.0-4.00.00.00.00.0-8.00.0-3.0-5.0-12.00.0-12.0-6.0-0.34132892409443977Stabilising-0.84Destabilising-0.143222506393861950.0223214285714285-loop-0.76666666666666676.25HIS-1.209-0.995881383855024899-1.229-1.2019:9150/150H610.642105263157894780effectpnca_p.his71tyr0.00179675147333623.2454533305232525.67334593392632.7826871320661e-090.5460113778397365.943929856120779.7635244050387188.0699881164825.67334605597961.4094824747854525.66386232994594.51976315688199e-1312.34488432234668.64707452935555102.9638840283774.42702490196086.2921718497543394e-18-0.23-0.0602094240837696DestabilisingTYR0pnca_complex.pdb
180H71RH71RAPZA4.184-1.93Destabilising-0.831Destabilising-0.4987080103359173-0.2104863221884498H71HA71-1.52387-36.0-2.00.00.0-2.00.00.00.00.00.00.02.0-2.00.00.00.00.0-1.00.0-1.01.0-4.00.0-4.00.0-0.29298431131277397Stabilising-1.26Destabilising-0.2148337595907928450.0223214285714285-loop-0.76666666666666676.25HIS-1.209-0.995881383855024899-1.229-1.2019:9150/150H770.810526315789473785effectpnca_p.his71arg0.00050309041253410.6628253923443091.940266611700370.4280260664779850.8362946538072020.7925739921053180.277764022894949.007532899546531.940260832982750.2878601168944811.940036143338640.3423358951946440.4655475610793440.18463793351318711.86046639662970.09266625551261220.760814539944039-1.58-0.4136125654450262DestabilisingARG0pnca_complex.pdb
181H71PH71PAPZA4.184-2.362Destabilising-2.885Destabilising-0.6103359173126615-0.7307497467071935H71HA713.2621832.08.00.00.08.00.00.00.00.02.00.02.00.00.00.00.00.0-2.00.0-4.02.00.00.00.00.00.11881569650128569Destabilising-1.555Destabilising-0.265132139812446750.0223214285714285-loop-0.76666666666666676.25HIS-1.209-0.995881383855024899-1.229-1.2019:9150/150H840.884210526315789491effectpnca_p.his71pro0.00014374011786681.579039389124024.850294327177340.2642475663767231.414392862765841.116407916564430.191756076673778122.6837603992454.850294365012620.6857680967922064.849564479041120.3127341543101870.5048246860149950.061763864579114379.5583372042030.08811926218633320.766581879696361-2.44-0.6387434554973822DestabilisingPRO0pnca_complex.pdb
182H71DH71DAPZA4.184-2.685Destabilising-2.498Destabilising-0.6937984496124031-0.6327254305977711H71HA715.7452518.0-24.00.00.0-24.00.00.00.00.04.00.02.02.00.00.00.00.0-3.00.0-7.04.00.00.00.00.00.20925451088658864Destabilising-1.66Destabilising-0.283034953111679450.0223214285714285-loop-0.76666666666666676.25HIS-1.209-0.995881383855024899-1.229-1.2019:9150/150H820.863157894736842191effectpnca_p.his71asp7.18700589334483e-0512.1451538387264188179.9262646260.919026337424233119.4680444362310.1016602715482575.01153666062825e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-2.6-0.680628272251309DestabilisingASP0pnca_complex.pdb
183H71QH71QAPZA4.184-2.294Destabilising-1.733Destabilising-0.592764857881137-0.4389564336372847H71HA711.12335-4.06.00.00.06.00.00.00.00.00.00.02.0-2.00.00.00.00.0-5.00.0-5.0-1.00.00.00.02.00.04091485223522899Destabilising-1.091Destabilising-0.1860187553282182450.0223214285714285-loop-0.76666666666666676.25HIS-1.209-0.995881383855024899-1.229-1.2019:9150/150H670.705263157894736880effectpnca_p.his71gln0.000143740117866813.1456002256222511754.4635534720.924803768447052139.2771833266850.09438444913685740.000162837134442519.4110222970131.28804840845689inf0.02922358609515971.534266491831630.91081598550184inf4.731220703822740.0296198560706035-1.86-0.486910994764398DestabilisingGLN0pnca_complex.pdb
184H71NH71NAPZA4.184-2.6710000000000003Destabilising-1.335Destabilising-0.6901808785529716-0.3381458966565349H71HA710.6437816.06.00.00.06.00.00.00.00.0-2.00.02.0-4.00.00.00.00.01.00.0-2.05.00.00.00.00.00.023447868938439236Destabilising-1.764Destabilising-0.3007672634271099750.0223214285714285-loop-0.76666666666666676.25HIS-1.209-0.995881383855024899-1.229-1.2019:9150/150H700.736842105263157985effect-2.6-0.680628272251309DestabilisingASN0pnca_complex.pdb
185C72WC72WAPZA7.053-1.725Destabilising0.265Stabilising-0.44573643410852710.1188340807174888C72CA7227.4558-46.00.00.00.00.00.00.00.00.0-2.00.00.0-2.00.00.00.00.0-12.00.0-12.0-6.0-16.00.0-14.0-8.01.0Destabilising-1.622Destabilising-0.276555839727195200.0Sloop1.16666666666666677.01CYS-1.104-0.909390444810543899-1.178-1.0629:9150/150G:A:C850.894736842105263291effectpnca_p.cys72trp0.000143740117866813.14560022562511754.4635523330.924803768446981139.2771833265280.09438444913694780.000162837134446119.4110222970131.28804840845689inf0.02922358609515971.534266491831630.91081598550184inf4.731220703822740.0296198560706035-1.13-0.2958115183246073DestabilisingTRP0pnca_complex.pdb
186C72RC72RAPZA7.053-1.639Destabilising0.152Stabilising-0.42351421188630490.0681614349775784C72CA727.93343-68.0-32.00.00.0-32.00.00.00.00.0-6.00.0-6.0-2.00.00.00.00.0-16.00.0-5.0-13.0-20.00.0-8.0-12.00.28895278957451614Destabilising-2.368Destabilising-0.403751065643648700.0Sloop1.16666666666666677.01CYS-1.104-0.909390444810543899-1.178-1.0629:9150/150G:A:C870.915789473684210591effectpnca_p.cys72arg0.00021561017680032.272606078088179.704658986530540.06344559022608931.224427601584961.85605590330240.929172866365108208.8816030051619.704669751787970.9869807610106799.701949905893830.07768449259424941.109665666564610.504888890842109570.3728424103282.291682450166840.130068862702538-1.28-0.3350785340314136DestabilisingARG0pnca_complex.pdb
187C72YC72YAPZA7.053-1.564Destabilising0.154Stabilising-0.40413436692506460.0690582959641255C72CA7215.4245-46.0-12.00.00.0-12.00.00.00.00.0-2.00.0-2.00.00.00.00.00.0-15.00.0-4.0-13.0-18.00.0-16.0-14.00.5617938650485508Destabilising-1.249Destabilising-0.2129582267689684700.0Sloop1.16666666666666677.01CYS-1.104-0.909390444810543899-1.178-1.0629:9150/150G:A:C830.873684210526315891effectpnca_p.cys72tyr7.18700589334483e-0512.1451538387253188179.926264410.919026337424193119.468044436160.1016602715483075.0115366606943e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-1.05-0.274869109947644DestabilisingTYR0pnca_complex.pdb
188C72GC72GAPZA7.053-1.759Destabilising-0.725Destabilising-0.4545219638242894-0.1836372847011144C72CA721.332610.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-2.00.00.0-2.00.00.03.017.00.04853619271702154Destabilising-1.459Destabilising-0.2487638533674339200.0Sloop1.16666666666666677.01CYS-1.104-0.909390444810543899-1.178-1.0629:9150/150G:A:C540.568421052631578975effect-1.55-0.4057591623036649DestabilisingGLY0pnca_complex.pdb
189V73DV73DAPZA10.768-1.148Destabilising1.153Stabilising-0.2966408268733850.5170403587443946V73VA731.11169-6.0-50.00.00.0-50.00.00.00.00.00.00.00.00.00.00.00.00.0-2.00.0-4.02.02.00.02.0-2.00.04049016965449923Destabilising-2.613Destabilising-0.4455242966751918460.264367816091954Bstrand1.96666666666666684.66VAL-0.743-0.612026359143327888-0.872-0.6748:7150/150I:R:K:L:V:E:T:M870.915789473684210591effect-1.37-0.3586387434554974DestabilisingASP0pnca_complex.pdb
190T76PT76PAPZA14.032-0.519Destabilising-0.382Destabilising-0.1341085271317829-0.096757852077001T76TA761.151550.00.00.00.00.00.00.00.00.02.00.02.00.00.00.00.00.0-4.02.0-6.0-2.04.00.02.00.00.04194195761915515Destabilising-1.623Destabilising-0.27672634271099744560.3255813953488372Sloop-0.93.94THR-0.548-0.4514003294892916577-0.674-0.4857:7150/150Q:T:S:D780.821052631578947485effectpnca_p.thr76pro0.00172488141440273.1962391671855824.44044072761455.521534264615841e-090.5481798598753245.830639542124969.2391074312634784.086115341674924.44044086477321.3881090355889924.43126936539942.2395302438185697e-1211.64984306823398.1727993994952898.40758001982769.80312771402866.55288933297668e-17-0.09-0.0235602094240837DestabilisingPRO0pnca_complex.pdb
191T76IT76IAPZA14.0320.311Stabilising-0.319Destabilising0.2644557823129251-0.0808004052684903T76TA76-0.781308-10.00.00.00.00.00.00.00.00.02.00.02.00.00.00.00.00.0-6.00.0-6.00.00.00.00.0-4.0-0.15021687302930092Stabilising-0.733Destabilising-0.12497868712702472560.3255813953488372Sloop-0.93.94THR-0.548-0.4514003294892916577-0.674-0.4857:7150/150Q:T:S:D690.726315789473684280effectpnca_p.thr76ile0.000215610176800313.1460210125007511969.8484291010.907969111549626113.7193447319630.1156005694852170.18392693627697229.12878787878791.4643224129316inf0.00499313284561492.30162687909812.00455510251839inf9.28726407271570.0023075254069185-0.73-0.1910994764397905DestabilisingILE0pnca_complex.pdb
192P77LP77LAPZA13.2350.544Stabilising0.067Stabilising0.46258503401360550.0300448430493273P77PA770.65747-10.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-5.0-2.0-3.0-1.00.00.00.0-2.00.023946488537940982Destabilising-0.447Destabilising-0.07621483375959079940.5911949685534591Ghelix-0.93.75PRO3.1130.9977564102564103111.7123.1251:1150/150T:W:Q:E:F:R:L:V:N:P:G:S:A:D:Y:H:K180.1894736842105263259effectpnca_p.pro77leu7.18700589334483e-05-8.987408781496390.00012497350770340.940032862253632119.468044435489-0.0752285585987764692673.510810012.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.999999999999997-0.2-0.0523560209424083DestabilisingLEU0pnca_complex.pdb
193G78AG78AAPZA9.840.335Stabilising-0.912Destabilising0.2848639455782313-0.2310030395136778G78GA781.30582-4.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-2.00.00.0-2.0-2.00.0-7.0-16.00.04756080682405903Destabilising-1.378Destabilising-0.2349531116794543780.0769230769230769Ghelix-0.06666666666666674.83GLY-0.882-0.726523887973640988-0.993-0.8279:8150/150G:E:N:D670.705263157894736880effect-0.01-0.0026178010471204DestabilisingALA0pnca_complex.pdb
194G78CG78CAPZA9.84-1.038Destabilising-0.281Destabilising-0.2682170542635659-0.0711752786220871G78GA782.40156-10.00.00.00.00.00.00.00.00.0-2.00.0-2.00.00.00.00.00.0-5.00.0-1.0-4.0-4.00.0-9.0-19.00.08747004275963548Destabilising-1.186Destabilising-0.202216538789428880.0769230769230769Ghelix-0.06666666666666674.83GLY-0.882-0.726523887973640988-0.993-0.8279:8150/150G:E:N:D700.736842105263157985effectpnca_p.gly78cys0.00021561017680032.272606078088169.704658986530480.06344559022609011.224427601584961.85605590330240.929172866365334208.8816030049819.704669751787970.9869807610106799.701949905893830.07768449259424941.109665666564610.504888890842109570.3728424103282.291682450166840.130068862702538-0.68-0.1780104712041885DestabilisingCYS0pnca_complex.pdb
195G78VG78VAPZA9.840.114Stabilising-0.8420000000000001Destabilising0.096938775510204-0.2132725430597771G78GA782.8237-8.0-2.00.00.0-2.00.00.00.00.02.00.02.00.00.00.00.00.0-17.00.0-11.0-10.0-8.00.0-9.0-21.00.10284530044653589Destabilising-1.939Destabilising-0.3306052855924978680.0769230769230769Ghelix-0.06666666666666674.83GLY-0.882-0.726523887973640988-0.993-0.8279:8150/150G:E:N:D770.810526315789473785effectpnca_p.gly78val0.000143740117866813.1456002256219511754.4635532820.924803768447042139.2771833266620.09438444913687020.000162837134442919.4110222970131.28804840845689inf0.02922358609515971.534266491831630.91081598550184inf4.731220703822740.0296198560706035-0.82-0.2146596858638743DestabilisingVAL0pnca_complex.pdb
196G78RG78RAPZA9.84-0.272Destabilising-0.84Destabilising-0.0702842377260982-0.2127659574468085G78GA781.06499-42.0-20.00.00.0-20.00.00.00.00.00.00.02.0-4.00.00.00.00.0-9.00.0-5.0-7.0-6.00.0-11.0-13.00.03878925400097612Destabilising-1.34Destabilising-0.2284739982949701780.0769230769230769Ghelix-0.06666666666666674.83GLY-0.882-0.726523887973640988-0.993-0.8279:8150/150G:E:N:D840.884210526315789491effect-0.13-0.0340314136125654DestabilisingARG0pnca_complex.pdb
197G78SG78SAPZA9.84-0.8590000000000001Destabilising0.215Stabilising-0.22196382428940570.0964125560538116G78GA780.982763-6.0-2.00.00.0-2.00.00.00.00.00.00.02.0-2.00.00.00.00.0-10.00.0-8.0-2.0-2.00.0-5.0-19.00.035794367674589704Destabilising-1.528Destabilising-0.2605285592497868580.0769230769230769Ghelix-0.06666666666666674.83GLY-0.882-0.726523887973640988-0.993-0.8279:8150/150G:E:N:D650.684210526315789580effectpnca_p.gly78ser0.00021561017680032.272606078088179.70465898653050.06344559022608981.224427601584961.85605590330240.929172866365337208.8816030049819.704669751787970.9869807610106799.701949905893830.07768449259424941.109665666564610.504888890842109570.3728424103282.291682450166840.130068862702538-0.4-0.1047120418848167DestabilisingSER0pnca_complex.pdb
198A79TA79TAPZA10.663-1.881Destabilising-0.176Destabilising-0.4860465116279069-0.044579533941236A79AA79-0.06687070.00.00.00.00.00.00.00.00.0-2.00.0-2.00.00.00.00.00.0-1.00.0-1.00.0-2.00.0-2.0-5.0-0.01285678305006537Stabilising-2.659Destabilising-0.453367433930093710.0077519379844961Ghelix-0.69999999999999985.8ALA-0.886-0.729818780889621288-0.993-0.8279:8150/150Q:G:S:E:A:C:V690.726315789473684280effectpnca_p.ala79thr0.0001437401178668-9.987521262450554.59700131334282e-050.942832958100734139.277183325396-0.0717096729269465144471.706314811.21195880622110.08348785866285790.01.00.00.025.83865859621631.0105682238915901e-250.999999999999746-1.58-0.4136125654450262DestabilisingTHR0pnca_complex.pdb
199A79VA79VAPZA10.663-0.186Destabilising-1.403Destabilising-0.0480620155038759-0.3553698074974671A79AA79-0.8251090.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-1.00.0-1.00.0-2.00.0-2.0-5.0-0.1586381988771822Stabilising-1.839Destabilising-0.313554987212276210.0077519379844961Ghelix-0.69999999999999985.8ALA-0.886-0.729818780889621288-0.993-0.8279:8150/150Q:G:S:E:A:C:V250.263157894736842163effectpnca_p.ala79val0.0003593502946672-10.98779090199961.69068633684892e-050.939691219428539145.229797681911-0.075657964669657660.33890826761720.484657419083649-0.3145651347425670.00.5961118750587110.2246722265665940.05.292243504333850.1777772638998140.673290424524484-0.64-0.1675392670157068DestabilisingVAL0pnca_complex.pdb
200F81SF81SAPZA11.313-2.584Destabilising-0.596Destabilising-0.6677002583979327-0.1509625126646403F81FA812.4438532.04.00.00.04.00.00.00.00.0-2.00.0-2.00.00.00.00.00.06.00.02.04.012.00.010.08.00.08901033661375737Destabilising-1.725Destabilising-0.29411764705882354400.1666666666666666Bstrand-1.34.56PHE-0.082-0.0675453047775947455-0.3320.0836:5150/150F:M:Y:P:V:L:I310.326315789473684266effectpnca_p.phe81ser0.0001437401178668-9.987521262450584.59700131334266e-050.942832958100734139.277183325397-0.0717096729269465144471.706314831.21195880622110.08348785866285790.01.00.00.025.83865859621631.0105682238915901e-250.999999999999746-2.58-0.6753926701570682DestabilisingSER0pnca_complex.pdb
201F81CF81CAPZA11.313-1.592Destabilising-1.003Destabilising-0.4113695090439276-0.2540526849037487F81FA812.5675326.04.00.00.04.00.00.00.00.0-2.00.0-2.00.00.00.00.00.02.00.02.00.010.00.010.06.00.09351503143233852Destabilising-1.315Destabilising-0.22421142369991473400.1666666666666666Bstrand-1.34.56PHE-0.082-0.0675453047775947455-0.3320.0836:5150/150F:M:Y:P:V:L:I550.578947368421052775effectpnca_p.phe81cys7.18700589334483e-0512.1451538387266188179.9262646650.919026337424239119.4680444362410.1016602715482495.01153666061863e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-1.85-0.4842931937172775DestabilisingCYS0pnca_complex.pdb
202F81VF81VAPZA11.313-1.5630000000000002Destabilising-1.967Destabilising-0.4038759689922481-0.4982269503546099F81FA812.0897232.04.00.00.04.00.00.00.00.00.00.00.00.00.00.00.00.04.00.02.02.010.00.08.06.00.07611215116660232Destabilising-1.962Destabilising-0.3345268542199488400.1666666666666666Bstrand-1.34.56PHE-0.082-0.0675453047775947455-0.3320.0836:5150/150F:M:Y:P:V:L:I560.589473684210526375effectpnca_p.phe81val0.00035935029466720.1924857177748761.212259189825150.8632684059787481.117705054157340.1722151269325650.06195508495527118.19905671742331.212258200168210.0835951305279281.2122140741251.00.00.024605377217271312.2606125933547.1929763849897505e-250.999999999999323-1.92-0.5026178010471204DestabilisingVAL0pnca_complex.pdb
203H82RH82RAPZA11.736-0.6629999999999999Destabilising-0.111Destabilising-0.1713178294573643-0.0281155015197568H82HA82-0.0040868-34.0-18.00.00.0-18.00.00.00.00.00.00.02.0-2.00.00.00.00.0-5.00.02.0-5.02.00.02.0-2.0-0.0007857417519034069Stabilising-0.923Destabilising-0.15737425404944586330.1473214285714285-loop-0.66666666666666694.73HIS-0.684-0.563426688632619588-0.827-0.6158:7150/150D:P:S:A:I:R:V:H520.547368421052631675effectpnca_p.his82arg0.00043122035360063.1901608036187324.29233342416010.00359542813005941.095659689549342.911634729329963.915519774324465.53106322023124.29233361415331.3854692367923224.28330969228970.00074940700078953.125282254143112.715678448283451141.6008949688414.19774426910740.0001645676755807-0.05-0.013089005235602DestabilisingARG0pnca_complex.pdb
204H82DH82DAPZA11.736-0.198Destabilising0.013Stabilising-0.05116279069767440.005829596412556H82HA821.7822826.0-20.00.00.0-20.00.00.00.00.0-2.00.0-2.00.00.00.00.00.0-1.00.01.00.04.00.04.0-2.00.06491451715120303Destabilising-1.413Destabilising-0.24092071611253196330.1473214285714285-loop-0.66666666666666694.73HIS-0.684-0.563426688632619588-0.827-0.6158:7150/150D:P:S:A:I:R:V:H630.663157894736842180effectpnca_p.his82asp0.00014374011786681.579039389124024.850294327177350.2642475663767231.414392862765841.116407916564430.191756076673665122.6837603992454.850294365012620.6857680967922064.849564479041120.3127341543101870.5048246860149950.061763864579114379.5583372042030.08811926218633320.7665818796963610.30.1685393258426966StabilisingASP0pnca_complex.pdb
205H82YH82YAPZA11.7360.591Stabilising-0.973Destabilising0.5025510204081632-0.2464539007092198H82HA82-0.6673020000000001-26.0-4.00.00.0-4.00.00.00.00.00.00.00.00.00.00.00.00.0-4.00.00.0-6.0-2.00.0-2.0-4.0-0.1282977005306468Stabilising-0.819Destabilising-0.13964194373401534330.1473214285714285-loop-0.66666666666666694.73HIS-0.684-0.563426688632619588-0.827-0.6158:7150/150D:P:S:A:I:R:V:H620.652631578947368580effect1.230.6910112359550562StabilisingTYR0pnca_complex.pdb
206L85RL85RAPZA12.428-1.371Destabilising-0.8079999999999999Destabilising-0.3542635658914728-0.204660587639311L85LA852.99904-50.0-32.00.00.0-32.00.00.00.00.00.00.00.00.00.00.00.00.0-3.00.01.0-5.0-8.00.0-6.0-6.00.10923156491524559Destabilising-1.503Destabilising-0.2562659846547314490.044776119402985Sloop-0.16666666666666665.61LEU-0.734-0.604612850082372388-0.872-0.6748:7150/150F:V:L:I840.884210526315789491effectpnca_p.leu85arg0.00093431076613483.2879148522952426.78695063407031.90630753051074e-050.7689965452610444.275591187706997.18677177006371173.19915101159526.78695101351351.4279232834714526.77080329785171.9896368453757e-076.701226185118915.83859157504838247.44379804845637.21596598919881.0574446237829601e-09-0.82-0.2146596858638743DestabilisingARG0pnca_complex.pdb
207L85PL85PAPZA12.428-1.891Destabilising-1.426Destabilising-0.4886304909560723-0.3611955420466058L85LA858.8286818.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.01.00.0-1.0-2.04.00.0-2.08.00.3215597432964984Destabilising-1.285Destabilising-0.2190963341858482390.044776119402985Sloop-0.16666666666666665.61LEU-0.734-0.604612850082372388-0.872-0.6748:7150/150F:V:L:I850.894736842105263291effectpnca_p.leu85pro0.00050309041253413.3729032940259829.16307324351890.0017890770828181.079957687620313.123180965967474.97876379054104550.89432351883429.16308470290771.4648334592411829.12933259783150.00014852956210033.8281870993483.534437535566361331.5687319993818.67174938085831.55265977742841e-05-1.32-0.3455497382198953DestabilisingPRO0pnca_complex.pdb
208D86GD86GAPZA17.129-0.094Destabilising-1.107Destabilising-0.0242894056847545-0.2803951367781155D86DA862.195314.014.00.00.014.00.00.00.00.04.00.02.02.00.00.00.00.03.00.01.02.02.00.03.013.00.07995796880804784Destabilising-0.796Destabilising-0.13572037510656437970.5025906735751295-loop-0.13333333333333343.88ASP1.310.4198717948717949110.8421.7122:1150/150D:P:A:G:S:T:K:R:N:L:V:Q:E:F:H150.1578947368421052559effectpnca_p.asp86gly7.18700589334483e-05-8.987408781496420.00012497350770340.940032862253633119.468044435491-0.07522855859877534692673.510811352.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.9999999999999970.240.1348314606741573StabilisingGLY0pnca_complex.pdb
209T87MT87MAPZA17.594-0.4Destabilising-0.6920000000000001Destabilising-0.103359173126615-0.1752786220871327T87TA87-1.95982-22.00.00.00.00.00.00.00.00.02.00.02.00.00.00.00.00.0-5.00.0-1.0-4.0-2.00.0-2.00.0-0.37680150734445894Stabilising-0.061Destabilising-0.010400682011935208860.5-loop-1.66666666666666673.72THR1.0030.32147435897435894110.591.1833:1150/150I:R:L:V:N:Q:F:E:W:T:K:H:Y:D:P:G:M:A:S-47-0.505376344086021572neutralpnca_p.thr87met0.0007905706482679-11.98831490747276.21642915145485e-060.940801856882948161.432542873449-0.07426207067103350.9750802207398540.220184187397302-0.6572138732510970.00.230011039752550.6382513188147890.01.931600313516991.22372520745760.268630815579749-0.37-0.0968586387434555DestabilisingMET0pnca_complex.pdb
210I90TI90TAPZA14.878-1.983Destabilising0.462Stabilising-0.51240310077519380.2071748878923767I90IA902.2826910.00.00.00.00.00.00.00.00.00.00.0-2.00.00.00.00.00.0-1.00.0-1.00.02.00.00.02.00.08314053861114956Destabilising-2.457Destabilising-0.418925831202046240.1218274111675127-loop0.93333333333333324.88ILE0.1510.0483974358974358944-0.1470.2256:4147/150P:S:G:A:W:D:E:F:C:I:L:V:N420.442105263157894771effectpnca_p.ile90thr0.00028748023573372.6784896296014114.56308103022780.02026791028213631.153849496483172.32135095414541.8636331786073294.48817794583314.56313131313131.1632547654853914.56310122532360.01741404882020371.759100242332271.16837785201846760.9897595427335.818739942061350.0158563003544608-1.55-0.4057591623036649DestabilisingTHR0pnca_complex.pdb
211I90SI90SAPZA14.878-2.286Destabilising0.447Stabilising-0.59069767441860470.2004484304932735I90IA904.1157212.00.00.00.00.00.00.00.00.00.00.0-2.00.00.00.00.00.0-1.00.0-1.00.00.00.00.00.00.1499034812316523Destabilising-2.665Destabilising-0.45439045183290705240.1218274111675127-loop0.93333333333333324.88ILE0.1510.0483974358974358944-0.1470.2256:4147/150P:S:G:A:W:D:E:F:C:I:L:V:N380.466effectpnca_p.ile90ser0.00050309041253411.867810401387936.474105176706550.01450430452545350.7640790886338452.444524957131761.4262375473782932.88773538823746.474105263157890.8111797563635856.472819750998980.01927245551078241.715062948196441.0942940373441644.23978054499425.348797055437220.0207365726835135-1.93-0.5052356020942408DestabilisingSER0pnca_complex.pdb
212A92VA92VAPZA15.570.941Stabilising-1.7819999999999998Destabilising0.8001700680272109-0.4513677811550151A92AA92-1.359410.02.00.00.02.00.00.00.00.00.00.00.00.00.00.00.00.0-6.00.00.0-6.0-4.00.0-2.0-3.0-0.2613646850726755Stabilising-0.312Destabilising-0.053196930946291555110.0852713178294573Estrand0.83333333333333344.62ALA0.3180.10192307692307692440.0830.3895:4150/150I:R:V:L:Q:E:F:W:T:K:Y:H:P:M:S:A:G-40-0.4301075268817204466neutral0.550.3089887640449438StabilisingVAL0pnca_complex.pdb
213A92GA92GAPZA15.57-0.574Destabilising-1.692Destabilising-0.1483204134366925-0.4285714285714285A92AA921.406656.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.02.00.00.00.03.012.00.051233254904246094Destabilising-1.618Destabilising-0.2758738277919864110.0852713178294573Estrand0.83333333333333344.62ALA0.3180.10192307692307692440.0830.3895:4150/150I:R:V:L:Q:E:F:W:T:K:Y:H:P:M:S:A:G120.1263157894736842159effect-0.96-0.2513089005235602DestabilisingGLY0pnca_complex.pdb
214A92PA92PAPZA15.570.14Stabilising-1.787Destabilising0.119047619047619-0.4526342451874366A92AA920.2753590.02.00.00.02.00.00.00.00.00.00.00.00.00.00.00.00.0-6.02.0-2.0-6.02.00.00.0-3.00.010029174163564712Destabilising-2.918Destabilising-0.49752770673486785110.0852713178294573Estrand0.83333333333333344.62ALA0.3180.10192307692307692440.0830.3895:4150/150I:R:V:L:Q:E:F:W:T:K:Y:H:P:M:S:A:G90.0947368421052631653effectpnca_p.ala92pro7.18700589334483e-05-8.987408781496410.00012497350770340.940032862253633119.46804443549-0.07522855859877564692673.51081082.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.9999999999999970.760.4269662921348314StabilisingPRO0pnca_complex.pdb
215V93GV93GAPZA13.206-2.333Destabilising-0.958Destabilising-0.602842377260982-0.2426545086119554V93VA933.061074.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.02.00.00.01.04.00.013.015.00.1114908325381158Destabilising-2.536Destabilising-0.43239556692242115270.1551724137931034Estrand2.93333333333333364.76VAL-0.095-0.0782537067545304955-0.332-0.0386:5150/150W:T:A:S:K:I:C:R:L:V:Q:H:Y:E410.4315789473684210671effect-2.72-0.712041884816754DestabilisingGLY0pnca_complex.pdb
216V93LV93LAPZA13.206-0.015Destabilising-1.213Destabilising-0.003875968992248-0.3072441742654508V93VA93-1.8226-14.00.00.00.00.00.00.00.00.0-2.00.00.0-2.00.00.00.00.0-8.00.0-5.0-4.00.00.02.0-2.0-0.3504191340459894Stabilising-0.026Destabilising-0.00443307757885763270.1551724137931034Estrand2.93333333333333364.76VAL-0.095-0.0782537067545304955-0.332-0.0386:5150/150W:T:A:S:K:I:C:R:L:V:Q:H:Y:E-1-0.01075268817204301253neutral-0.52-0.1361256544502617DestabilisingLEU0pnca_complex.pdb
217F94VF94VAPZA10.621-1.995Destabilising-1.681Destabilising-0.5155038759689923-0.4257852077001013F94FA942.5665530.04.00.00.04.00.00.00.00.00.00.00.00.00.00.00.00.0-1.00.0-3.02.04.00.06.02.00.09347933769913824Destabilising-2.927Destabilising-0.499062233589087800.0Estrand1.97.59PHE-0.13-0.107084019769357555-0.332-0.0386:5150/150A:F:Q:V:L:I-5-0.05376344086021505553neutralpnca_p.phe94val7.18700589334483e-05-8.98740878149640.00012497350770340.940032862253633119.46804443549-0.07522855859877574692673.510812312.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.999999999999997-1.82-0.4764397905759163DestabilisingVAL0pnca_complex.pdb
218F94SF94SAPZA10.621-3.027Destabilising-0.449Destabilising-0.7821705426356588-0.1137284701114488F94FA945.8527232.04.00.00.04.00.00.00.00.00.00.0-2.00.00.00.00.00.0-1.00.0-3.00.06.00.010.06.00.21316880222029588Destabilising-3.24Destabilising-0.552429667519181700.0Estrand1.97.59PHE-0.13-0.107084019769357555-0.332-0.0386:5150/150A:F:Q:V:L:I690.726315789473684280effectpnca_p.phe94ser0.000143740117866813.1456002256206511754.4635526220.924803768446999139.2771833265680.09438444913692440.000162837134445219.4110222970131.28804840845689inf0.02922358609515971.534266491831630.91081598550184inf4.731220703822740.0296198560706035-2.74-0.7172774869109948DestabilisingSER0pnca_complex.pdb
219F94CF94CAPZA10.621-1.595Destabilising-1.615Destabilising-0.4121447028423772-0.4090678824721377F94FA944.5281328.04.00.00.04.00.00.00.00.00.00.0-2.00.00.00.00.00.02.00.00.02.08.00.08.06.00.16492435113892145Destabilising-3.58Destabilising-0.610400682011935200.0Estrand1.97.59PHE-0.13-0.107084019769357555-0.332-0.0386:5150/150A:F:Q:V:L:I490.515789473684210671effectpnca_p.phe94cys0.00028748023573372.6784896296014114.56308103022780.02026791028213611.153849496483172.32135095414541.86363317860726294.48817794583314.56313131313131.1632547654853914.56310122532360.01741404882020371.759100242332271.16837785201846760.9897595427335.818739942061350.0158563003544608-1.42-0.3717277486910995DestabilisingCYS0pnca_complex.pdb
220F94LF94LAPZA10.621-1.582Destabilising-1.712Destabilising-0.4087855297157622-0.4336372847011145F94FA941.179616.04.00.00.04.00.00.00.00.00.00.00.00.00.00.00.00.0-3.00.0-1.0-3.02.00.06.02.00.04296359967657107Destabilising-2.563Destabilising-0.43699914748508100.0Estrand1.97.59PHE-0.13-0.107084019769357555-0.332-0.0386:5150/150A:F:Q:V:L:I240.2526315789473684363effectpnca_p.phe94leu0.00050309041253411.867810401387936.474105176706540.01450430452545360.7640790886338452.444524957131761.4262375473777532.88773538823636.474105263157890.8111797563635856.472819750998980.01927245551078241.715062948196441.0942940373441644.23978054499425.348797055437220.0207365726835135-1.99-0.5209424083769634DestabilisingLEU0pnca_complex.pdb
221Y95DY95DAPZA10.528-0.772Destabilising0.071Stabilising-0.19948320413436690.0318385650224215Y95YA954.7810638.0-12.00.00.0-12.00.00.00.00.02.00.00.02.00.00.00.00.01.00.01.01.04.00.02.02.00.17413661230049754Destabilising-2.558Destabilising-0.43614663256606984750.2851711026615969Estrand-0.80000000000000024.15TYR-0.013-0.01070840197693574955-0.2440.0836:5150/150K:Y:H:D:G:S:M:P:L:N:C:R:E:F:Q:T460.484210526315789571effectpnca_p.tyr95asp7.18700589334483e-0512.1451538387253188179.9262644270.919026337424197119.4680444361660.1016602715483035.01153666068889e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-0.4-0.1047120418848167DestabilisingASP0pnca_complex.pdb
222K96MK96MAPZA3.9770.413Stabilising-1.026Destabilising0.3511904761904761-0.2598784194528875K96KA960.27325724.032.00.00.032.00.00.00.00.04.00.00.04.00.00.00.00.0-5.00.0-5.00.0-2.00.0-2.0-4.00.009952614748067804Destabilising-0.457Destabilising-0.0779198635976129680.0338983050847457Estrand-1.86666666666666655.96LYS-1.194-0.983525535420098899-1.229-1.1789:9150/150K:Q840.884210526315789491effectpnca_p.lys96met0.000143740117866813.1456002256221511754.4635533820.924803768447045139.2771833266690.09438444913686670.000162837134442819.4110222970131.28804840845689inf0.02922358609515971.534266491831630.91081598550184inf4.731220703822740.02961985607060351.020.5730337078651685StabilisingMET0pnca_complex.pdb
223K96NK96NAPZA3.977-1.156Destabilising0.325Stabilising-0.29870801033591720.1457399103139013K96KA962.6124552.06.00.00.06.00.00.00.00.04.00.02.00.00.00.00.00.0-3.00.0-1.0-3.06.00.04.0-2.00.09515111561127339Destabilising-3.151Destabilising-0.537254901960784380.0338983050847457Estrand-1.86666666666666655.96LYS-1.194-0.983525535420098899-1.229-1.1789:9150/150K:Q900.947368421052631595effectpnca_p.lys96asn7.18700589334483e-05-8.987408781496410.00012497350770340.940032862253633119.468044435491-0.07522855859877514692673.510813272.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.999999999999997-0.85-0.2225130890052356DestabilisingASN0pnca_complex.pdb
224K96TK96TAPZA3.977-0.86Destabilising-0.57Destabilising-0.2222222222222222-0.1443768996960486K96KA963.5376472.08.00.00.08.00.00.00.00.04.00.00.04.00.00.00.00.00.00.00.00.08.00.06.04.00.12884854930470066Destabilising-0.932Destabilising-0.158908780903665880.0338983050847457Estrand-1.86666666666666655.96LYS-1.194-0.983525535420098899-1.229-1.1789:9150/150K:Q850.894736842105263291effectpnca_p.lys96thr0.00093431076613484.0685812110773658.4739415306319.193364498612e-051.040304983646523.9109504184205611.51666355995391065.6133239774458.47401774397971.7669629351934258.45475747253786.68324361543955e-098.175012707825478.640865298701952465.7464727377246.75148301951678.05839318437163e-12-0.61-0.1596858638743455DestabilisingTHR0pnca_complex.pdb
225K96RK96RAPZA3.977-0.1689999999999999Destabilising0.083Stabilising-0.04366925064599480.037219730941704K96KA96-0.740521-12.0-4.00.00.0-4.00.00.00.00.00.00.0-2.02.00.00.00.00.0-5.00.0-3.0-5.0-8.00.0-6.0-8.0-0.14237502883949857Stabilising-2.045Destabilising-0.348678601875532880.0338983050847457Estrand-1.86666666666666655.96LYS-1.194-0.983525535420098899-1.229-1.1789:9150/150K:Q850.894736842105263291effectpnca_p.lys96arg0.00107805088400172.969795980077319.48794326174144.2195571364394e-060.6455707636502694.600264056700936.1854285292630585.588134824997919.48795944233211.2897663671150519.47913884326511.66262776179573e-076.779204972123535.25121653678864107.84405722203537.5914490013878.72260296739213e-10-0.35-0.0916230366492146DestabilisingARG0pnca_complex.pdb
226K96QK96QAPZA3.977-1.318Destabilising-0.08Destabilising-0.3405684754521964-0.0202634245187436K96KA961.0440926.08.00.00.08.00.00.00.00.00.00.0-2.00.00.00.00.00.0-2.00.0-2.0-1.02.00.02.0-2.00.03802803050721523Destabilising-1.359Destabilising-0.2317135549872122780.0338983050847457Estrand-1.86666666666666655.96LYS-1.194-0.983525535420098899-1.229-1.1789:9150/150K:Q780.821052631578947485effectpnca_p.lys96gln0.00028748023573371.579373295212094.851914140399810.1143422970043041.00025364540071.578972796024540.5818890913115340.45629110752984.851914177534710.6859131102999064.851184435511780.1379549363682950.8602627547777290.35147133141776367.04210604197061.174970908556980.278382201819561-0.86-0.225130890052356DestabilisingGLN0pnca_complex.pdb
227K96EK96EAPZA3.977-2.119Destabilising-0.6729999999999999Destabilising-0.547545219638243-0.1704660587639311K96KA966.92486999999999926.0-2.00.00.0-2.00.00.00.00.04.00.0-4.04.00.00.00.00.00.00.0-2.01.0-2.00.00.0-2.00.2522188390066944Destabilising-2.7Destabilising-0.460358056265984780.0338983050847457Estrand-1.86666666666666655.96LYS-1.194-0.983525535420098899-1.229-1.1789:9150/150K:Q890.936842105263157991effectpnca_p.lys96glu0.000790570648267915.14940666798063795803.483390790.925233417916433161.432542879420.093843573283091124.1993753459371107.1663851351352.03005858162844inf3.5812015819156903e-098.4459712323392112.2081619622864inf47.68479638349565.0055851012886495e-12-1.84-0.4816753926701571DestabilisingGLU0pnca_complex.pdb
228G97DG97DAPZA8.236-2.974Destabilising-0.248Destabilising-0.7684754521963824-0.0628166160081053G97GA9712.1049-16.0-66.00.00.0-66.00.00.00.00.0-6.00.00.0-6.00.00.00.00.0-13.00.0-9.0-13.0-8.00.0-15.0-23.00.4408868071591431Destabilising-2.263Destabilising-0.38584825234441670.0673076923076923-loop-0.83333333333333314.92GLY-1.026-0.845140032948929399-1.124-0.9939:9150/150A:G830.873684210526315891effectpnca_p.gly97asp0.00251545206267063.3827217081194529.45081866312222.5998520960761497e-120.4833968526548226.997814920683712.465621481238786.494604852328629.45083014048531.4690975409007429.41775448719821.1100950551901799e-1817.954639831864611.294020686118497.32420575844111.746780269524.05989172191837e-26-1.49-0.3900523560209424DestabilisingASP0pnca_complex.pdb
229G97CG97CAPZA8.236-1.635Destabilising-1.158Destabilising-0.4224806201550387-0.2933130699088145G97GA974.47159-10.0-2.00.00.0-2.00.00.00.00.00.00.02.0-2.00.00.00.00.0-9.00.0-3.0-11.0-8.00.0-7.0-21.00.16286504126632623Destabilising-1.484Destabilising-0.253026427962489370.0673076923076923-loop-0.83333333333333314.92GLY-1.026-0.845140032948929399-1.124-0.9939:9150/150A:G690.726315789473684280effectpnca_p.gly97cys0.000718700589334414.14898097140571395803.748901150.890414731995348102.6929760139790.137779442378606507.71288536976597.38286196707471.98848253379833inf2.1018584548314e-087.6773965339573910.9022485555592inf42.84524907868055.924579267292849e-11-0.7-0.1832460732984293DestabilisingCYS0pnca_complex.pdb
230G97SG97SAPZA8.236-1.999Destabilising-0.309Destabilising-0.5165374677002584-0.0782674772036474G97GA975.99386-6.00.00.00.00.00.00.00.00.0-4.00.0-2.0-2.00.00.00.00.0-7.00.0-3.0-4.0-4.00.0-7.0-19.00.21830942824466962Destabilising-2.075Destabilising-0.353793691389599370.0673076923076923-loop-0.83333333333333314.92GLY-1.026-0.845140032948929399-1.124-0.9939:9150/150A:G720.757894736842105385effectpnca_p.gly97ser0.00064683053040114.14855894144121395214.802179920.896008552350388108.2479010400980.130705157379451226.47453558221487.60759493670891.94254175795031inf1.23317897951184e-076.908973886767319.59561062779463inf38.00996325721427.038428913028e-10-1.28-0.3350785340314136DestabilisingSER0pnca_complex.pdb
231G97RG97RAPZA8.236-1.252Destabilising-0.89Destabilising-0.3235142118863049-0.2254305977710233G97GA974.89479-78.0-34.00.00.0-34.00.00.00.00.0-4.00.00.0-6.00.00.00.00.0-16.00.0-10.0-15.0-16.00.0-13.0-27.00.1782789064605657Destabilising-2.091Destabilising-0.356521739130434870.0673076923076923-loop-0.83333333333333314.92GLY-1.026-0.845140032948929399-1.124-0.9939:9150/150A:G820.863157894736842191effectpnca_p.gly97arg0.000143740117866813.1456002256219511754.4635533230.924803768447043139.2771833266640.09438444913686910.000162837134442919.4110222970131.28804840845689inf0.02922358609515971.534266491831630.91081598550184inf4.731220703822740.0296198560706035-0.79-0.2068062827225131DestabilisingARG0pnca_complex.pdb
232G97AG97AAPZA8.236-1.126Destabilising-1.721Destabilising-0.2909560723514211-0.4359169199594731G97GA973.72826-6.00.00.00.00.00.00.00.00.00.00.02.0-2.00.00.00.00.0-4.00.00.0-4.0-2.00.0-1.0-16.00.1357913446339207Destabilising-1.921Destabilising-0.3275362318840579570.0673076923076923-loop-0.83333333333333314.92GLY-1.026-0.845140032948929399-1.124-0.9939:9150/150A:G660.694736842105263280effect-0.73-0.1910994764397905DestabilisingALA0pnca_complex.pdb
233G97VG97VAPZA8.236-0.588Destabilising-1.664Destabilising-0.151937984496124-0.4214792299898683G97GA976.12241-8.0-2.00.00.0-2.00.00.00.00.0-2.00.00.0-2.00.00.00.00.0-14.00.0-8.0-9.0-12.00.0-11.0-23.00.22299149906395008Destabilising-2.616Destabilising-0.4460358056265984570.0673076923076923-loop-0.83333333333333314.92GLY-1.026-0.845140032948929399-1.124-0.9939:9150/150A:G770.810526315789473785effectpnca_p.gly97val7.18700589334483e-0512.1451538387264188179.9262646250.919026337424232119.4680444362290.1016602715482585.01153666063045e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-1.24-0.3246073298429319DestabilisingVAL0pnca_complex.pdb
234T100AT100AAPZA8.272-0.5429999999999999Destabilising-1.759Destabilising-0.1403100775193798-0.4455420466058764T100TA1000.4083160.00.00.00.00.00.00.00.00.02.00.02.00.00.00.00.00.00.00.00.00.02.00.02.05.00.01487175751571617Destabilising0.129Stabilising0.10895270270270271810.4709302325581395Sloop-0.80000000000000024.18THR1.3470.4317307692307692110.8421.7122:1150/150K:Y:D:P:A:G:S:R:I:V:L:N:Q:F:E:T-36-0.387096774193548466neutralpnca_p.thr100ala0.00028748023573371.579373295212094.851914140399820.1143422970043041.00025364540071.578972796024540.58188909131207640.4562911075574.851914177534710.6859131102999064.851184435511780.1379549363682950.8602627547777290.35147133141776367.04210604197061.174970908556980.278382201819561-0.1-0.0261780104712041DestabilisingALA0pnca_complex.pdb
235T100IT100IAPZA8.2720.379Stabilising-1.537Destabilising0.3222789115646258-0.3893110435663627T100TA1000.8080149999999999-6.02.00.00.02.00.00.00.00.02.00.02.00.00.00.00.00.0-1.00.0-3.00.00.00.00.0-2.00.029429665134507097Destabilising-0.042Destabilising-0.007161125319693095810.4709302325581395Sloop-0.80000000000000024.18THR1.3470.4317307692307692110.8421.7122:1150/150K:Y:D:P:A:G:S:R:I:V:L:N:Q:F:E:T140.1473684210526315759effectpnca_p.thr100ile0.0006468305304013.6614289282921438.91691263678160.00055782750781081.060874245253493.451331715020817.13685172054609722.16507375735438.91691269506541.5901383800886338.91452962991575.5228318480997e-065.257838179400655.210749591492541710.7556573630427.87381456646131.29490403629991e-07-0.36-0.094240837696335DestabilisingILE0pnca_complex.pdb
236T100PT100PAPZA8.272-0.488Destabilising-1.685Destabilising-0.1260981912144702-0.4267983789260385T100TA1001.65140999999999980.00.00.00.00.00.00.00.00.02.00.02.00.00.00.00.00.00.02.00.0-2.00.00.0-2.0-4.00.060147946881897445Destabilising-0.412Destabilising-0.07024722932651321810.4709302325581395Sloop-0.80000000000000024.18THR1.3470.4317307692307692110.8421.7122:1150/150K:Y:D:P:A:G:S:R:I:V:L:N:Q:F:E:T180.1894736842105263259effectpnca_p.thr100pro0.000503090412534114.14771541545131394038.398466070.908235680148122.7415820194020.11526424201714222.957814350172568.08178752107921.83303094984313inf4.24048522418865e-065.372584445734967.00237574052121inf28.358283615631.00814491180914e-070.030.0168539325842696StabilisingPRO0pnca_complex.pdb
237A102TA102TAPZA3.5-0.7190000000000001Destabilising0.8809999999999999Stabilising-0.18578811369509040.395067264573991A102AA102-2.02927-2.00.00.00.00.00.00.00.00.0-2.00.00.0-2.00.00.00.00.0-5.00.0-3.0-3.0-4.00.0-2.0-5.0-0.39015419518572636Stabilising-1.769Destabilising-0.301619778346121100.0775193798449612-loop0.03333333333333325.51ALA-0.862-0.710049423393739788-0.955-0.8279:8150/150M:E:S:G:A:H:Q710.747368421052631685effectpnca_p.ala102thr0.000143740117866813.1456002256202511754.4635524190.924803768446987139.2771833265420.09438444913693950.000162837134445819.4110222970131.28804840845689inf0.02922358609515971.534266491831630.91081598550184inf4.731220703822740.0296198560706035-0.2-0.0523560209424083DestabilisingTHR0pnca_complex.pdb
238A102PA102PAPZA3.5-1.249Destabilising-0.23Destabilising-0.3227390180878553-0.058257345491388A102AA102-0.61678199999999990.00.00.00.00.00.00.00.00.00.00.02.0-2.00.00.00.00.0-8.00.0-2.0-6.0-6.00.0-2.0-5.0-0.11858455740982848Stabilising-2.115Destabilising-0.360613810741688100.0775193798449612-loop0.03333333333333325.51ALA-0.862-0.710049423393739788-0.955-0.8279:8150/150M:E:S:G:A:H:Q830.873684210526315891effectpnca_p.ala102pro0.00057496047146752.679666350190414.58022779401160.00102453523771030.8160506321224143.283701089993683.3569796112212699.553869259231714.58027812895071.1637658085304114.58017590340610.00050753514476143.294533879232452.60435121163486147.67632700613615.06634481641440.00010379751229890.130.0730337078651685StabilisingPRO0pnca_complex.pdb
239A102VA102VAPZA3.5-0.251Destabilising-0.162Destabilising-0.0648578811369509-0.0410334346504559A102AA102-1.90987-2.0-26.00.00.0-26.00.00.00.00.00.00.00.00.00.00.00.00.0-5.00.0-3.0-2.0-4.00.0-4.0-3.0-0.36719795431823427Stabilising-1.389Destabilising-0.23682864450127877100.0775193798449612-loop0.03333333333333325.51ALA-0.862-0.710049423393739788-0.955-0.8279:8150/150M:E:S:G:A:H:Q730.768421052631578985effectpnca_p.ala102val0.0006468305304010.8863011122401742.426139017951580.2100894525099770.7071629446556211.253319505692980.5117012099363569.202627133999422.426136363636360.3849152072108742.425936601872490.1884170821300560.7248797260732940.39229928870579411.36628903680220.7246847015004290.394611528192705-0.73-0.1910994764397905DestabilisingVAL0pnca_complex.pdb
240A102RA102RAPZA3.5-0.696Destabilising0.174Stabilising-0.179844961240310.0780269058295964A102AA1024.1344-76.0-30.00.00.0-30.00.00.00.00.0-2.00.00.0-2.00.00.00.00.0-12.00.0-4.0-10.0-16.00.0-12.0-7.00.15058384749306158Destabilising-2.095Destabilising-0.35720375106564367100.0775193798449612-loop0.03333333333333325.51ALA-0.862-0.710049423393739788-0.955-0.8279:8150/150M:E:S:G:A:H:Q810.852631578947368491effectpnca_p.ala102arg7.18700589334483e-05-8.987408781496420.00012497350770340.940032862253633119.468044435492-0.07522855859877494692673.510813672.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.999999999999997-0.28-0.0732984293193717DestabilisingARG0pnca_complex.pdb
241Y103DY103DAPZA5.4161.176Stabilising0.851Stabilising1.00.3816143497757847Y103YA1031.1845834.0-24.00.00.0-24.00.00.00.00.00.00.00.00.00.00.00.00.02.00.0-2.04.0-2.00.0-2.0-2.00.04314498211671122Destabilising-0.578Destabilising-0.098550724637681151380.5247148288973384-loop-0.13.94TYR-1.175-0.967874794069192999-1.221-1.1529:9150/150Y:K880.926315789473684291effectpnca_p.tyr103asp0.00215610176800344.95817835126683142.3342765376581.0743991920355e-061.016541332778454.8774980331738730.46209176013882537.05252258235142.3344680851062.1533100827021142.747838705051.2391666921776101e-2120.906870268584823.55569232189635610.51758528632128.7209038872037.80576752108032e-301.510.848314606741573StabilisingASP0pnca_complex.pdb
242Y103CY103CAPZA5.4160.606Stabilising-0.48Destabilising0.5153061224489796-0.121580547112462Y103YA1031.0292442.04.00.00.04.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-2.02.00.00.0-2.00.00.03748716118270092Destabilising-0.498Destabilising-0.084910485933503841380.5247148288973384-loop-0.13.94TYR-1.175-0.967874794069192999-1.221-1.1529:9150/150Y:K680.715789473684210580effectpnca_p.tyr103cys0.00071870058933441.174403102439183.236210680952080.06900227415215240.645842474358761.81840487280620.82680487895996911.33775303756193.236210526315790.5100367661674453.235834717554840.07540313207620531.122610614141340.67107896469421613.66171561356142.26262605721010.1325291575726481.430.8033707865168539StabilisingCYS0pnca_complex.pdb
243Y103SY103SAPZA5.4160.233Stabilising-0.062Destabilising0.1981292517006803-0.0157041540020263Y103YA1031.1617544.04.00.00.04.00.00.00.00.00.00.00.00.00.00.00.00.04.00.00.04.02.00.00.02.00.04231346382185185Destabilising-0.796Destabilising-0.135720375106564371380.5247148288973384-loop-0.13.94TYR-1.175-0.967874794069192999-1.221-1.1529:9150/150Y:K850.894736842105263291effectpnca_p.tyr103ser7.18700589334483e-0512.1451538387267188179.9262646730.919026337424241119.4680444362440.1016602715482475.01153666061564e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.3821468117582610.420.2359550561797752StabilisingSER0pnca_complex.pdb
244Y103HY103HAPZA5.4160.779Stabilising-0.046Destabilising0.6624149659863946-0.0116514690982776Y103YA1030.90950122.0-22.00.00.0-22.00.00.00.00.0-2.00.0-2.00.00.00.00.00.03.00.0-1.04.00.00.00.00.00.0331260061626323Destabilising-0.683Destabilising-0.11645353793691391380.5247148288973384-loop-0.13.94TYR-1.175-0.967874794069192999-1.221-1.1529:9150/150Y:K810.852631578947368491effectpnca_p.tyr103his0.000143740117866813.1456002256202511754.4635524190.924803768446986139.277183326540.09438444913694050.000162837134445819.4110222970131.28804840845689inf0.02922358609515971.534266491831630.91081598550184inf4.731220703822740.02961985607060351.210.6797752808988764StabilisingHIS0pnca_complex.pdb
245S104RS104RAPZA6.519-0.525Destabilising-0.4379999999999999Destabilising-0.1356589147286821-0.1109422492401215S104SA104-0.736092-68.0-30.00.00.0-30.00.00.00.00.04.00.00.04.00.00.00.00.0-8.00.0-4.0-9.0-2.00.0-4.0-2.0-0.14152349457817426Stabilising-2.325Destabilising-0.3964194373401534510.0064516129032258-loop-0.83333333333333345.37SER-1.214-1.099-1.229-1.2019:9150/150S850.894736842105263291effectpnca_p.ser104arg0.00057496047146752.679666350190414.58022779401170.00102453523771030.8160506321224163.283701089993673.3569796112212699.553869259261114.58027812895071.1637658085304114.58017590340610.00050753514476143.294533879232452.60435121163486147.67632700613615.06634481641440.0001037975122989-0.47-0.1230366492146596DestabilisingARG0pnca_complex.pdb
246S104GS104GAPZA6.519-0.6709999999999999Destabilising-0.7Destabilising-0.1733850129198966-0.177304964539007S104SA1043.326954.00.00.00.00.00.00.00.00.04.00.02.02.00.00.00.00.01.00.01.00.02.00.05.015.00.12117476088840974Destabilising-2.163Destabilising-0.3687979539641943510.0064516129032258-loop-0.83333333333333345.37SER-1.214-1.099-1.229-1.2019:9150/150S810.852631578947368491effectpnca_p.ser104gly0.00021561017680030.8858066062472832.424939574258110.4694062168248251.224427532119220.7234455147493630.11266293762039125.3270547471042.424936921783010.3847004460814332.424737369475330.4302589851681560.3662700514636120.041085444410624746.58814728670334.31445715363782e-250.999999999999476-0.68-0.1780104712041885DestabilisingGLY0pnca_complex.pdb
247S104IS104IAPZA6.5190.284Stabilising-0.295Destabilising0.2414965986394557-0.0747213779128672S104SA1040.982352-18.02.00.00.02.00.00.00.00.02.00.00.02.00.00.00.00.0-7.00.0-11.00.0-10.00.0-6.0-6.00.03577939815995163Destabilising-1.713Destabilising-0.292071611253196910.0064516129032258-loop-0.83333333333333345.37SER-1.214-1.099-1.229-1.2019:9150/150S820.863157894736842191effect-0.39-0.1020942408376963DestabilisingILE0pnca_complex.pdb
248G105RG105RAPZA7.858-0.974Destabilising-0.634Destabilising-0.2516795865633075-0.1605876393110435G105GA1055.20362-98.0-50.00.0-2.0-48.00.00.00.00.0-4.00.00.0-4.00.00.00.00.0-23.00.0-8.0-21.0-22.00.0-27.0-39.00.1895271673016266Destabilising-1.727Destabilising-0.29445865302642800.0Ghelix0.53333333333333327.04GLY-0.506-0.416803953871499277-0.674-0.4117:7150/150A:S:M:G:I:V:L810.852631578947368491effectpnca_p.gly105arg7.18700589334483e-0512.1451538387267188179.9262646850.919026337424243119.4680444362480.1016602715482455.01153666061226e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-0.66-0.1727748691099476DestabilisingARG0pnca_complex.pdb
249G105VG105VAPZA7.8580.1169999999999999Stabilising-0.85Destabilising0.0994897959183673-0.2152988855116514G105GA105-2.03856-2.00.00.00.00.00.00.00.00.0-2.00.0-2.02.00.00.00.00.0-9.00.0-1.0-10.0-8.00.0-9.0-21.0-0.39194032146427743Stabilising-1.183Destabilising-0.2017050298380221600.0Ghelix0.53333333333333327.04GLY-0.506-0.416803953871499277-0.674-0.4117:7150/150A:S:M:G:I:V:L680.715789473684210580effectpnca_p.gly105val7.18700589334483e-0512.1451538387264188179.9262646310.919026337424233119.4680444362310.1016602715482565.01153666062796e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-0.86-0.225130890052356DestabilisingVAL0pnca_complex.pdb
250G105DG105DAPZA7.858-1.651Destabilising0.7090000000000001Stabilising-0.42661498708010330.3179372197309417G105GA1052.15123-20.0-32.00.00.0-32.00.00.00.00.0-2.00.02.0-2.00.00.00.00.0-5.00.00.0-5.0-18.00.0-15.0-25.00.07835247925757034Destabilising-2.29Destabilising-0.3904518329070758600.0Ghelix0.53333333333333327.04GLY-0.506-0.416803953871499277-0.674-0.4117:7150/150A:S:M:G:I:V:L790.831578947368421185effectpnca_p.gly105asp0.000143740117866813.1456002256223511754.4635534890.924803768447052139.2771833266850.09438444913685730.000162837134442519.4110222970131.28804840845689inf0.02922358609515971.534266491831630.91081598550184inf4.731220703822740.0296198560706035-1.54-0.4031413612565445DestabilisingASP0pnca_complex.pdb
251F106SF106SAPZA10.466-2.455Destabilising-0.439Destabilising-0.6343669250645995-0.1111955420466058F106FA1064.86398000000000132.02.00.00.02.00.00.00.00.0-2.00.0-2.0-4.00.00.00.00.08.00.04.05.06.00.0-2.06.00.1771567391953613Destabilising-1.914Destabilising-0.32634271099744244290.1208333333333333Ghelix-0.36666666666666675.05PHE-1.174-0.967051070840197799-1.221-1.1529:9150/150F:L730.768421052631578985effectpnca_p.phe106ser7.18700589334483e-0512.1451538387255188179.9262644470.9190263374242119.4680444361720.1016602715482995.01153666068353e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-2.08-0.5445026178010471DestabilisingSER0pnca_complex.pdb
252F106CF106CAPZA10.466-1.594Destabilising-1.068Destabilising-0.4118863049095607-0.270516717325228F106FA1063.97730.0-2.00.00.0-2.00.00.00.00.00.00.0-2.0-2.00.00.00.00.08.00.07.02.010.00.02.012.00.14485099687497724Destabilising-1.577Destabilising-0.26888320545609545290.1208333333333333Ghelix-0.36666666666666675.05PHE-1.174-0.967051070840197799-1.221-1.1529:9150/150F:L590.621052631578947475effectpnca_p.phe106cys7.18700589334483e-05-8.987408781496410.00012497350770340.940032862253633119.468044435491-0.07522855859877494692673.510811932.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.999999999999997-2.12-0.5549738219895288DestabilisingCYS0pnca_complex.pdb
253F106VF106VAPZA10.466-1.933Destabilising-1.625Destabilising-0.4994832041343669-0.4116008105369808F106FA1063.7376730.04.00.00.04.00.00.00.00.00.00.0-2.00.00.00.00.00.06.00.04.03.010.00.02.08.00.13613407731699678Destabilising-2.02Destabilising-0.3444160272804774290.1208333333333333Ghelix-0.36666666666666675.05PHE-1.174-0.967051070840197799-1.221-1.1529:9150/150F:L690.726315789473684280effectpnca_p.phe106val7.18700589334483e-0512.1451538387261188179.9262645740.919026337424223119.4680444362130.1016602715482695.01153666064512e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-2.1-0.549738219895288DestabilisingVAL0pnca_complex.pdb
254F106LF106LAPZA10.466-1.425Destabilising-1.7080000000000002Destabilising-0.3682170542635659-0.4326241134751774F106FA1061.9285810.04.00.00.04.00.00.00.00.00.00.00.00.00.00.00.00.02.00.00.02.06.00.02.04.00.07024308160752919Destabilising-0.947Destabilising-0.16146632566069904290.1208333333333333Ghelix-0.36666666666666675.05PHE-1.174-0.967051070840197799-1.221-1.1529:9150/150F:L660.694736842105263280effectpnca_p.phe106leu0.00021561017680030.8858066062472832.424939574258110.4694062168248261.224427532119220.7234455147493630.11266293762038725.32705474710382.424936921783010.3847004460814332.424737369475330.4302589851681560.3662700514636120.041085444410624746.58814728670334.31445715363782e-250.999999999999476-1.96-0.5130890052356021DestabilisingLEU0pnca_complex.pdb
255E107DE107DAPZA8.13-0.2239999999999999Destabilising-0.6559999999999999Destabilising-0.0578811369509043-0.166160081053698E107EA1070.96566814.00.00.00.00.00.00.00.00.0-2.00.0-2.00.00.00.00.00.03.00.0-1.04.0-6.00.0-4.0-4.00.03517173056330539Destabilising-0.917Destabilising-0.15635123614663257880.3946188340807174Ghelix-0.36666666666666673.69GLU-0.068-0.0560131795716639355-0.2440.0836:5150/150T:S:G:A:M:D:Q:F:H:Y:E:R:V:L70.0736842105263157853effect-0.02-0.0052356020942408DestabilisingASP0pnca_complex.pdb
256G108RG108RAPZA10.939-0.972Destabilising-1.199Destabilising-0.2511627906976744-0.3036980749746707G108GA1088.65723-90.0-46.00.00.0-46.00.00.00.00.0-4.00.0-2.00.00.00.00.00.0-22.00.0-10.0-18.0-18.00.0-17.0-31.00.31531516109528773Destabilising-2.025Destabilising-0.3452685421994884400.0-loop0.15.18GLY-0.947-0.780065897858319699-1.062-0.8729:8136/150N:V:D:G:E:A:P530.557894736842105275effectpnca_p.gly108arg0.00028748023573371.579373295212094.851914140399830.1143422970043031.00025364540071.578972796024540.58188909131207140.4562911075794.851914177534710.6859131102999064.851184435511780.1379549363682950.8602627547777290.35147133141776367.04210604197061.174970908556980.278382201819561-0.81-0.2120418848167539DestabilisingARG0pnca_complex.pdb
257G108EG108EAPZA10.939-1.423Destabilising0.303Stabilising-0.36770025839793280.1358744394618834G108GA1083.72313-44.0-66.00.00.0-66.00.00.00.00.0-2.00.0-2.00.00.00.00.00.0-13.00.0-8.0-9.0-12.00.0-15.0-23.00.1356044988672703Destabilising-3.566Destabilising-0.608013640238704100.0-loop0.15.18GLY-0.947-0.780065897858319699-1.062-0.8729:8136/150N:V:D:G:E:A:P390.410526315789473766effect-0.78-0.2041884816753927DestabilisingGLU0pnca_complex.pdb
258D110HD110HAPZA16.281-0.7609999999999999Destabilising-1.3Destabilising-0.196640826873385-0.3292806484295846D110DA1103.05477-10.020.00.00.020.00.00.00.00.0-2.00.00.00.00.00.00.00.0-3.00.0-3.0-1.00.00.02.00.00.1112613728246855Destabilising-0.614Destabilising-0.10468883205456095170.0880829015544041-loop-0.93333333333333324.81ASP0.5260.1685897435897436330.2250.594:3128/150Q:H:E:K:R:L:N:T:A:G:S:D-18-0.193548387096774257neutral-0.26-0.0680628272251308DestabilisingHIS0pnca_complex.pdb
259E111DE111DAPZA18.3820.156Stabilising0.103Stabilising0.13265306122448980.0461883408071748E111EA1110.18319610.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.01.00.01.01.00.00.00.00.00.006672397089139635Destabilising-0.053Destabilising-0.0090366581415174761670.7488789237668162Sloop-3.53.55GLU1.6160.517948717948718111.1831.7121:1132/150T:M:S:G:A:P:D:F:E:Q:L:V:N:R:K-55-0.591397849462365678neutralpnca_p.glu111asp7.18700589334483e-05-8.987408781496410.00012497350770340.940032862253633119.46804443549-0.07522855859877594692673.510810352.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.999999999999997-0.32-0.0837696335078534DestabilisingASP0pnca_complex.pdb
260N112YN112YAPZA19.93-0.3779999999999999Destabilising-0.261Destabilising-0.0976744186046511-0.0661094224924012N112NA1124.97901-10.02.00.00.02.00.00.00.00.02.00.02.04.00.00.00.00.00.00.02.01.04.00.00.04.00.1813463821851849Destabilising-0.297Destabilising-0.0506393861892583051090.558974358974359Sloop-2.4666666666666673.54ASN0.770.24679487179487178220.3890.8424:2131/150K:R:N:V:Q:E:H:D:P:S:M:G:A:T260.273684210526315863effect-0.25-0.0654450261780104DestabilisingTYR0pnca_complex.pdb
261T114MT114MAPZA17.4910.246Stabilising-1.152Destabilising0.2091836734693878-0.2917933130699088T114TA114-0.0405939-8.00.00.00.00.00.00.00.00.0-2.00.0-2.02.00.00.00.00.0-6.00.00.0-6.00.00.00.02.0-0.007804718141967239Stabilising-0.077Destabilising-0.013128729752770673290.1686046511627907-loop-0.94.57THR-0.224-0.1845140032948929366-0.411-0.1477:6148/150S:A:P:D:H:K:T:W:E:Q:V:N:L:I:R:C250.263157894736842163effectpnca_p.thr114met7.18700589334483e-05-8.987408781496410.00012497350770340.940032862253633119.468044435491-0.07522855859877514692673.510813272.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.9999999999999970.380.2134831460674157StabilisingMET0pnca_complex.pdb
262T114PT114PAPZA17.491-0.6509999999999999Destabilising-1.3219999999999998Destabilising-0.1682170542635658-0.3348530901722391T114TA1145.391584.00.00.00.00.00.00.00.00.00.00.00.04.00.00.00.00.0-2.02.0-4.00.04.00.0-2.06.00.19637307964073167Destabilising-2.268Destabilising-0.38670076726342706290.1686046511627907-loop-0.94.57THR-0.224-0.1845140032948929366-0.411-0.1477:6148/150S:A:P:D:H:K:T:W:E:Q:V:N:L:I:R:C340.3578947368421052766effectpnca_p.thr114pro7.18700589334483e-0512.1451538387266188179.9262646670.91902633742424119.4680444362420.1016602715482485.01153666061746e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-0.1-0.0261780104712041DestabilisingPRO0pnca_complex.pdb
263P115LP115LAPZA16.985-0.4479999999999999Destabilising-0.972Destabilising-0.1157622739018087-0.2462006079027355P115PA1150.979724-14.00.00.00.00.00.00.00.00.0-2.00.0-2.00.00.00.00.00.0-8.00.0-4.0-5.0-2.00.0-2.00.00.03568368067949213Destabilising-0.8Destabilising-0.13640238704177324500.3144654088050314Bstrand0.49999999999999984.3PRO0.7740.24807692307692308220.3890.8424:2147/150T:G:A:S:P:D:E:Q:L:N:K:R80.0842105263157894753effectpnca_p.pro115leu7.18700589334483e-05-8.987408781496410.00012497350770340.940032862253632119.46804443549-0.07522855859877614692673.510810152.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.999999999999997-0.55-0.143979057591623DestabilisingLEU0pnca_complex.pdb
264L116VL116VAPZA13.071-1.084Destabilising-1.648Destabilising-0.2801033591731266-0.4174265450861196L116LA1161.8749120.00.00.00.00.00.00.00.00.00.00.0-2.00.00.00.00.00.02.00.02.00.02.00.00.02.00.06828830338216334Destabilising-1.706Destabilising-0.290878090366581400.0Hhelix2.06.86LEU-0.924-0.761120263591433488-1.028-0.8729:8147/150I:V:L:M:A:T:F480.505263157894736971effectpnca_p.leu116val7.18700589334483e-05-8.987408781496410.00012497350770340.940032862253634119.468044435492-0.07522855859877464692673.5108142.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.9999999999999970.620.348314606741573StabilisingVAL0pnca_complex.pdb
265L116RL116RAPZA13.071-1.733Destabilising-0.78Destabilising-0.4478036175710594-0.1975683890577507L116LA1164.65552-54.0-52.00.0-2.0-50.00.00.00.00.0-2.00.0-2.0-2.00.00.00.00.0-6.00.01.0-7.0-4.00.0-12.00.00.16956417223318934Destabilising-4.189Destabilising-0.714236999147485100.0Hhelix2.06.86LEU-0.924-0.761120263591433488-1.028-0.8729:8147/150I:V:L:M:A:T:F850.894736842105263291effectpnca_p.leu116arg7.18700589334483e-0512.1451538387266188179.9262646680.91902633742424119.4680444362430.1016602715482485.01153666061721e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-1.89-0.4947643979057591DestabilisingARG0pnca_complex.pdb
266L116PL116PAPZA13.071-1.386Destabilising-1.504Destabilising-0.3581395348837209-0.3809523809523809L116LA1163.7437218.00.00.00.00.00.00.00.00.02.02.0-2.00.00.00.00.00.0-3.02.0-3.0-2.08.00.00.08.00.13635443148624335Destabilising-2.595Destabilising-0.442455242966751900.0Hhelix2.06.86LEU-0.924-0.761120263591433488-1.028-0.8729:8147/150I:V:L:M:A:T:F890.936842105263157991effectpnca_p.leu116pro0.00021561017680032.272606078088169.704658986530470.06344559022609041.224427601584961.85605590330240.929172866365899208.8816030049669.704669751787970.9869807610106799.701949905893830.07768449259424941.109665666564610.504888890842109570.3728424103282.291682450166840.1300688627025380.060.0337078651685393StabilisingPRO0pnca_complex.pdb
267L117RL117RAPZA17.11-0.6779999999999999Destabilising-0.585Destabilising-0.1751937984496124-0.148176291793313L117LA1170.0947913-28.0-26.00.0-2.0-24.00.00.00.00.0-2.00.0-2.0-2.00.00.00.00.04.00.01.04.02.00.02.00.00.0034525054815375982Destabilising-1.884Destabilising-0.3212276214833759500.2487562189054726Hhelix1.36666666666666654.46LEU0.4470.14326923076923076330.0830.595:3147/150D:P:G:S:A:T:K:V:L:E:H90.0947368421052631653effectpnca_p.leu117arg7.18700589334483e-05-8.987408781496420.00012497350770340.940032862253633119.468044435491-0.07522855859877534692673.510813082.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.999999999999997-0.23-0.0602094240837696DestabilisingARG0pnca_complex.pdb
268N118EN118EAPZA19.7380.78Stabilising-0.713Destabilising0.663265306122449-0.1805977710233029N118NA118-2.32726-6.0-14.00.00.0-14.00.00.00.00.0-2.00.00.0-4.00.00.00.00.00.00.00.0-2.0-2.00.00.00.0-0.447446743059294Stabilising0.371Stabilising0.3133445945945946800.4102564102564102Hhelix-0.24.06ASN0.6920.22179487179487178220.3890.8424:2146/150N:R:K:E:Y:Q:D:A:M:S:G:T-29-0.311827956989247361neutral-0.19-0.0497382198952879DestabilisingGLU0pnca_complex.pdb
269W119CW119CAPZA19.722-1.743Destabilising-1.4980000000000002Destabilising-0.4503875968992248-0.3794326241134752W119WA1194.066542.00.00.00.00.00.00.00.00.0-2.00.0-2.00.00.00.00.00.03.00.0-1.04.012.00.010.010.00.14811078169275707Destabilising-2.343Destabilising-0.39948849104859335140.0491228070175438Hhelix-0.25.7TRP0.2240.0717948717948717944-0.0380.3895:4146/150T:G:S:M:A:W:Q:F:E:Y:I:R:L:V480.505263157894736971effectpnca_p.trp119cys7.18700589334483e-0512.1451538387261188179.9262645780.919026337424224119.4680444362140.1016602715482695.01153666064432e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-1.91-0.5DestabilisingCYS0pnca_complex.pdb
270W119RW119RAPZA19.722-1.874Destabilising-0.807Destabilising-0.4842377260981912-0.2044072948328267W119WA1193.612130000000001-4.0-30.00.0-2.0-28.00.00.00.00.0-2.00.00.0-2.00.00.00.00.0-2.00.0-5.0-1.00.00.02.00.00.1315616372496886Destabilising-2.916Destabilising-0.4971867007672634140.0491228070175438Hhelix-0.25.7TRP0.2240.0717948717948717944-0.0380.3895:4146/150T:G:S:M:A:W:Q:F:E:Y:I:R:L:V700.736842105263157985effectpnca_p.trp119arg0.00050309041253411.867810401387936.474105176706540.01450430452545360.7640790886338462.444524957131761.426237547378832.88773538824176.474105263157890.8111797563635856.472819750998980.01927245551078241.715062948196441.0942940373441644.23978054499425.348797055437220.0207365726835135-1.89-0.4947643979057591DestabilisingARG0pnca_complex.pdb
271W119GW119GAPZA19.722-2.983Destabilising-1.84Destabilising-0.7708010335917312-0.4660587639311044W119WA1195.8816852.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.05.00.0-3.06.018.00.015.031.00.21422358845854064Destabilising-3.318Destabilising-0.5657289002557545140.0491228070175438Hhelix-0.25.7TRP0.2240.0717948717948717944-0.0380.3895:4146/150T:G:S:M:A:W:Q:F:E:Y:I:R:L:V700.736842105263157985effectpnca_p.trp119gly0.000143740117866813.1456002256201511754.4635523910.924803768446985139.2771833265380.09438444913694190.000162837134445919.4110222970131.28804840845689inf0.02922358609515971.534266491831630.91081598550184inf4.731220703822740.0296198560706035-3.39-0.8874345549738221DestabilisingGLY0pnca_complex.pdb
272W119SW119SAPZA19.722-3.136Destabilising-0.995Destabilising-0.8103359173126615-0.2520263424518744W119WA1194.638544.00.00.00.00.00.00.00.00.0-2.00.0-2.00.00.00.00.00.06.00.00.06.014.00.010.012.00.16894426678516014Destabilising-2.258Destabilising-0.38499573742540494140.0491228070175438Hhelix-0.25.7TRP0.2240.0717948717948717944-0.0380.3895:4146/150T:G:S:M:A:W:Q:F:E:Y:I:R:L:V660.694736842105263280effectpnca_p.trp119ser0.000143740117866813.1456002256241511754.4635544490.924803768447112139.2771833268150.09438444913678260.000162837134439519.4110222970131.28804840845689inf0.02922358609515971.534266491831630.91081598550184inf4.731220703822740.0296198560706035-3.44-0.9005235602094241DestabilisingSER0pnca_complex.pdb
273W119LW119LAPZA19.722-1.981Destabilising-2.11Destabilising-0.5118863049095607-0.5344478216818642W119WA1192.3922722.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.01.00.01.01.012.00.06.08.00.08713168073776761Destabilising-1.186Destabilising-0.2022165387894288140.0491228070175438Hhelix-0.25.7TRP0.2240.0717948717948717944-0.0380.3895:4146/150T:G:S:M:A:W:Q:F:E:Y:I:R:L:V320.336842105263157966effect-1.92-0.5026178010471204DestabilisingLEU0pnca_complex.pdb
274L120PL120PAPZA17.55-2.181Destabilising-1.644Destabilising-0.5635658914728682-0.4164133738601824L120LA1207.5969816.016.00.00.016.00.00.00.00.02.02.02.0-2.00.00.00.00.00.04.0-4.0-2.08.00.02.04.00.2766985482120354Destabilising-4.748Destabilising-0.809548167092924100.0Hhelix-0.53333333333333358.07LEU-1.142-0.940691927512355899-1.201-1.1249:9147/150F:V:L790.831578947368421185effectpnca_p.leu120pro0.001868621532269615.15576127524583820001.125612860.885234541058746105.0027715031860.1443367737658815316.77893400452.0462689242793896e+16254.9171270718232.40639901531589inf1.0165082312418301e-2019.992889100283832.1173872780919inf120.5099210374954.89215110948636e-28-1.51-0.3952879581151832DestabilisingPRO0pnca_complex.pdb
275L120RL120RAPZA17.55-2.51Destabilising-0.772Destabilising-0.648578811369509-0.1955420466058764L120LA1205.6624-44.0-32.00.0-2.0-30.00.00.00.00.00.00.00.00.00.00.00.00.0-8.00.00.0-13.0-8.00.0-12.0-4.00.20623693354409633Destabilising-4.716Destabilising-0.804092071611253200.0Hhelix-0.53333333333333358.07LEU-1.142-0.940691927512355899-1.201-1.1249:9147/150F:V:L740.778947368421052685effectpnca_p.leu120arg0.00050309041253412.496923933731212.14507737940650.00282932188573230.836294959445552.985697696165262.6161083308303884.837127083925912.14511373209771.0844015860815512.14166641515040.00225160059751252.647508644762061.98635523014012127.71994664563611.00192052746070.0009101752788745-1.93-0.5052356020942408DestabilisingARG0pnca_complex.pdb
276R121WR121WAPZA22.533-0.5379999999999999Destabilising-0.426Destabilising-0.1390180878552971-0.10790273556231R121RA1211.959756.018.00.02.016.00.00.00.00.02.00.02.00.00.00.00.00.00.00.00.00.0-4.00.0-6.0-2.00.07137836085635822Destabilising-0.442Destabilising-0.075362318840579711250.4562043795620438Hhelix-1.43.76ARG0.5060.1621794871794872330.2250.594:3147/150D:T:A:S:G:L:N:C:R:K:I:H:E:Q700.736842105263157985effect-0.5-0.1308900523560209DestabilisingTRP0pnca_complex.pdb
277R121QR121QAPZA22.533-0.1689999999999999Destabilising-0.674Destabilising-0.0436692506459948-0.1707193515704154R121RA1211.4172222.018.00.02.016.00.00.00.00.00.00.00.00.00.00.00.00.0-1.00.00.0-1.0-2.00.0-2.02.00.05161823731233473Destabilising-0.286Destabilising-0.0487638533674339261250.4562043795620438Hhelix-1.43.76ARG0.5060.1621794871794872330.2250.594:3147/150D:T:A:S:G:L:N:C:R:K:I:H:E:Q10.01052631578947368453effectpnca_p.arg121gln7.18700589334483e-05-8.987408781496410.00012497350770340.940032862253633119.46804443549-0.07522855859877584692673.510809882.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.999999999999997-0.53-0.1387434554973822DestabilisingGLN0pnca_complex.pdb
278R121PR121PAPZA22.533-0.46Destabilising-1.047Destabilising-0.1188630490956072-0.2651975683890577R121RA1214.9015540.020.00.02.018.00.00.00.00.04.02.02.00.00.00.00.00.00.04.0-3.0-2.04.00.04.00.00.1785251203752941Destabilising-1.076Destabilising-0.1834612105711851250.4562043795620438Hhelix-1.43.76ARG0.5060.1621794871794872330.2250.594:3147/150D:T:A:S:G:L:N:C:R:K:I:H:E:Q770.810526315789473785effectpnca_p.arg121pro7.18700589334483e-0512.1451538387264188179.9262646170.919026337424231119.4680444362270.1016602715482595.01153666063191e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-0.11-0.0287958115183246DestabilisingPRO0pnca_complex.pdb
279Q122RQ122RAPZA24.6830000000000030.113Stabilising-0.114Destabilising0.0960884353741496-0.0288753799392097Q122QA122-1.69455-24.0-1.00.00.0-1.00.00.00.00.02.00.0-2.00.00.00.00.00.02.00.03.0-1.02.00.00.02.0-0.3257998154272091Stabilising-0.152Destabilising-0.0259164535379369131320.5866666666666667Tloop-4.1666666666666673.49GLN1.3340.4275641025641026110.8421.7122:1147/150D:T:S:M:A:G:K:R:N:Q:H:E:Y-41-0.4408602150537634472neutral-0.16-0.0418848167539267DestabilisingARG0pnca_complex.pdb
280R123PR123PAPZA23.59-0.348Destabilising-0.955Destabilising-0.089922480620155-0.2418946301925025R123RA1233.533530000000000342.016.00.02.014.00.00.00.00.03.00.01.02.00.00.00.00.04.02.0-2.00.06.00.02.04.00.12869885415831994Destabilising-1.065Destabilising-0.1815856777493606980.3576642335766423Tloop-2.80000000000000033.81ARG0.6590.21121794871794872330.3890.8424:2147/150Q:H:F:Y:E:K:I:C:R:N:V:L:T:A:M540.568421052631578975effectpnca_p.arg123pro0.000143740117866813.1456002256242511754.4635544850.924803768447114139.277183326820.09438444913677960.000162837134439319.4110222970131.28804840845689inf0.02922358609515971.534266491831630.91081598550184inf4.731220703822740.0296198560706035-0.23-0.0602094240837696DestabilisingPRO0pnca_complex.pdb
281R123GR123GAPZA23.59-1.212Destabilising-1.129Destabilising-0.3131782945736434-0.28596757852077R123RA1232.7707850.016.00.02.014.00.00.00.00.02.00.00.02.00.00.00.00.01.00.03.0-3.06.00.011.017.00.10091783885372124Destabilising-1.005Destabilising-0.1713554987212276980.3576642335766423Tloop-2.80000000000000033.81ARG0.6590.21121794871794872330.3890.8424:2147/150Q:H:F:Y:E:K:I:C:R:N:V:L:T:A:M510.536842105263157975effect-0.9-0.2356020942408377DestabilisingGLY0pnca_complex.pdb
282G124RG124RAPZA26.025-0.757Destabilising-0.075Destabilising-0.1956072351421188-0.0189969604863221G124GA124-0.489243-20.0-14.00.0-2.0-12.00.00.00.00.0-2.00.00.0-2.00.00.00.00.0-2.00.0-5.0-2.04.00.0-1.01.0-0.09406348534953472Stabilising-0.439Destabilising-0.07485080988917306360.3461538461538461Tloop-0.23333333333333323.58GLY1.0710.3432692307692307110.591.1833:1147/150A:S:G:D:Q:E:R:K:N280.2947368421052631363effect-0.47-0.1230366492146596DestabilisingARG0pnca_complex.pdb
283G124SG124SAPZA26.025-1.24Destabilising0.612Stabilising-0.32041343669250640.274439461883408G124GA1241.11330.00.00.00.00.00.00.00.00.0-2.00.0-2.00.00.00.00.00.0-1.00.0-3.00.00.00.0-3.0-9.00.04054880935904253Destabilising-0.85Destabilising-0.14492753623188404360.3461538461538461Tloop-0.23333333333333323.58GLY1.0710.3432692307692307110.591.1833:1147/150A:S:G:D:Q:E:R:K:N-22-0.2365591397849462561neutralpnca_p.gly124ser7.18700589334483e-05-8.987408781496410.00012497350770340.940032862253633119.46804443549-0.07522855859877594692673.510812152.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.999999999999997-0.39-0.1020942408376963DestabilisingSER0pnca_complex.pdb
284V125GV125GAPZA21.367-3.005Destabilising-1.814Destabilising-0.7764857881136951-0.4594731509625127V125VA1253.834048.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-2.00.0-1.00.08.00.013.021.00.13964408248894586Destabilising-3.24Destabilising-0.552429667519181700.0-loop0.16.12VAL-0.095-0.0782537067545304955-0.332-0.0386:5147/150I:L:V:Q:F:A:E700.736842105263157985effectpnca_p.val125gly0.00316228259307174.2107838808564967.40936001190111.83664466117051e-120.5975832175003067.0463556497958924.5112444006964278.63689309737867.4097519247221.8287227288904267.38551711025932.05851007546474e-2827.686447002988621.4729050424094338.090551978209174.9183031800596.238026108181269e-40-2.63-0.6884816753926701DestabilisingGLY0pnca_complex.pdb
285V125DV125DAPZA21.367-3.013Destabilising-0.358Destabilising-0.7785529715762274-0.0906788247213779V125VA1253.9883-8.0-32.00.0-2.0-30.00.00.00.00.0-2.00.0-2.00.00.00.00.00.0-8.00.0-6.0-1.02.00.02.0-2.00.1452625674720824Destabilising-4.507Destabilising-0.768456947996589800.0-loop0.16.12VAL-0.095-0.0782537067545304955-0.332-0.0386:5147/150I:L:V:Q:F:A:E740.778947368421052685effectpnca_p.val125asp0.0002156101768003-9.987607973918184.5966027178939e-050.930014323968984113.719344729606-0.0878268160765965127.9487350989410.807902480033628-0.09264105870473970.01.00.00.011.73697547380050.0003936455651480.984170607395186-2.67-0.6989528795811518DestabilisingASP0pnca_complex.pdb
286V125FV125FAPZA21.367-1.739Destabilising-1.707Destabilising-0.4493540051679586-0.432370820668693V125VA1254.56-20.0-4.00.0-2.0-2.00.00.00.00.00.00.00.00.00.00.00.00.0-11.00.0-6.0-10.0-2.00.0-6.0-2.00.16608512591146496Destabilising-1.65Destabilising-0.2813299232736572500.0-loop0.16.12VAL-0.095-0.0782537067545304955-0.332-0.0386:5147/150I:L:V:Q:F:A:E480.505263157894736971effectpnca_p.val125phe0.0001437401178668-9.987521262450594.59700131334263e-050.942832958100734139.277183325398-0.0717096729269461144471.7063148481.21195880622110.08348785866285790.01.00.00.025.83865859621631.0105682238915901e-250.999999999999746-1.72-0.4502617801047121DestabilisingPHE0pnca_complex.pdb
287V125AV125AAPZA21.367-2.449Destabilising-1.941Destabilising-0.6328165374677002-0.4916413373860182V125VA1252.081144.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-1.02.04.00.04.05.00.07579964889021627Destabilising-2.189Destabilising-0.37323103154305200.0-loop0.16.12VAL-0.095-0.0782537067545304955-0.332-0.0386:5147/150I:L:V:Q:F:A:E490.515789473684210671effect-1.89-0.4947643979057591DestabilisingALA0pnca_complex.pdb
288D126ED126EAPZA23.083-0.157Destabilising0.035Stabilising-0.04056847545219630.0156950672645739D126DA126-0.5659569999999999-2.02.00.00.02.00.00.00.00.00.00.00.00.00.00.00.00.0-1.00.00.0-1.00.00.00.0-2.0-0.10881277397523648Stabilising-0.068Destabilising-0.011594202898550725660.3419689119170984-loop-0.93333333333333324.35ASP3.121.0111.7123.1251:1147/150D:T:M:S:A:G:L:N:V:K:R:H:E:Y:Q-71-0.763440860215053887neutral-0.55-0.143979057591623DestabilisingGLU0pnca_complex.pdb
289E127DE127DAPZA20.54-1.341Destabilising-1.005Destabilising-0.3465116279069767-0.2545592705167173E127EA1272.778416.0-2.00.00.0-2.00.00.00.00.02.00.00.02.00.00.00.00.0-3.00.0-2.0-3.00.00.00.00.00.10119574006220908Destabilising-0.674Destabilising-0.11491901108269395550.2466367713004484Estrand-0.93333333333333325.17GLU0.9160.2935897435897436220.591.1833:1147/150D:T:S:G:A:R:K:N:L:Q:H:E-42-0.4516129032258064472neutral-1.29-0.3376963350785341DestabilisingASP0pnca_complex.pdb
290E127VE127VAPZA20.540.4539999999999999Stabilising-2.247Destabilising0.3860544217687074-0.5691489361702128E127EA127-0.867960000000000114.024.00.04.020.00.00.00.00.02.00.00.02.00.00.00.00.0-3.00.0-3.00.0-2.00.0-2.0-2.0-0.16687687456740755Stabilising-0.221Destabilising-0.03768115942028986550.2466367713004484Estrand-0.93333333333333325.17GLU0.9160.2935897435897436220.591.1833:1147/150D:T:S:G:A:R:K:N:L:Q:H:E120.1263157894736842159effect-0.33-0.0863874345549738DestabilisingVAL0pnca_complex.pdb
291V128FV128FAPZA16.575-1.849Destabilising-2.082Destabilising-0.4777777777777777-0.5273556231003039V128VA1282.63855-34.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-11.00.0-3.0-10.0-4.00.0-2.0-8.00.09610173442405612Destabilising-1.167Destabilising-0.198976982097186700.0Estrand-0.93333333333333328.31VAL-0.394-0.324546952224052766-0.553-0.3327:6147/150V:L:I:A580.610526315789473775effectpnca_p.val128phe7.18700589334483e-0512.1451538387252188179.9262643970.919026337424191119.4680444361570.1016602715483095.01153666069775e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-1.73-0.4528795811518324DestabilisingPHE0pnca_complex.pdb
292V128GV128GAPZA16.575-3.564Destabilising-1.823Destabilising-0.9209302325581394-0.4617527862208714V128VA1284.6656216.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.06.00.07.023.00.16993203621821254Destabilising-4.952Destabilising-0.844330775788576300.0Estrand-0.93333333333333328.31VAL-0.394-0.324546952224052766-0.553-0.3327:6147/150V:L:I:A750.789473684210526385effectpnca_p.val128gly0.00100618082506823.3753482379412829.23446255786969.91219225447489e-060.7638124194927754.419080067044157.9656644717311187.95956381587829.2344740177441.4658952844826529.2008822516313.94377277607243e-087.404088115267516.49943487243223267.20621130359441.82968832767339.95798685333635e-11-3.82-1.0DestabilisingGLY0pnca_complex.pdb
293D129ND129NAPZA14.781-0.735Destabilising-3.245Destabilising-0.189922480620155-0.8219351570415401D129DA1291.83782-2.038.00.04.034.00.00.00.00.0-2.00.0-2.00.00.00.00.00.00.00.0-1.00.00.00.02.00.00.06693740484706329Destabilising-2.127Destabilising-0.3626598465473145300.0Estrand1.63333333333333357.77ASP0.0740.02371794871794871755-0.1470.2256:4147/150I:V:L:E:Y:H:F:D:W:S:A:T720.757894736842105385effectpnca_p.asp129asn7.18700589334483e-05-8.987408781496410.00012497350770340.940032862253634119.468044435493-0.07522855859877414692673.510812312.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.999999999999997-0.87-0.2277486910994764DestabilisingASN0pnca_complex.pdb
294D129GD129GAPZA14.781-0.65Destabilising-3.948Destabilising-0.1679586563307493-1.0D129DA1294.6835634.036.00.04.032.00.00.00.00.04.00.00.04.00.00.00.00.04.00.00.04.04.00.011.019.00.1705854500688379Destabilising-2.685Destabilising-0.457800511508951400.0Estrand1.63333333333333357.77ASP0.0740.02371794871794871755-0.1470.2256:4147/150I:V:L:E:Y:H:F:D:W:S:A:T770.810526315789473785effectpnca_p.asp129gly7.18700589334483e-05-8.987408781496410.00012497350770340.940032862253633119.468044435492-0.07522855859877494692673.510811212.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.999999999999997-0.43-0.112565445026178DestabilisingGLY0pnca_complex.pdb
295D129YD129YAPZA14.7810.187Stabilising-2.832Destabilising0.1590136054421768-0.7173252279635258D129DA1293.80937-40.034.00.04.030.00.00.00.00.04.00.00.02.00.00.00.00.0-8.00.0-3.0-5.08.00.04.02.00.13874554738889414Destabilising0.436Stabilising0.3682432432432432600.0Estrand1.63333333333333357.77ASP0.0740.02371794871794871755-0.1470.2256:4147/150I:V:L:E:Y:H:F:D:W:S:A:T420.442105263157894771effectpnca_p.asp129tyr7.18700589334483e-0512.1451538387262188179.9262645890.919026337424226119.4680444362170.1016602715482665.0115366606409e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.3821468117582610.120.0674157303370786StabilisingTYR0pnca_complex.pdb
296V130AV130AAPZA10.402-2.827Destabilising-1.3769999999999998Destabilising-0.7304909560723514-0.3487841945288753V130VA1303.709392.00.00.00.00.00.00.00.00.00.00.0-2.00.00.00.00.00.03.00.03.00.04.00.04.03.00.1351040581589318Destabilising-2.959Destabilising-0.504518329070758800.0Estrand1.633333333333333511.27VAL0.0640.02051282051282051355-0.1470.2256:4147/150M:F:D:C:I:L:V510.536842105263157975effectpnca_p.val130ala7.18700589334483e-05-8.987408781496410.00012497350770340.940032862253633119.468044435491-0.07522855859877514692673.510813272.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.999999999999997-2.32-0.6073298429319371DestabilisingALA0pnca_complex.pdb
297V130MV130MAPZA10.402-1.539Destabilising-2.265Destabilising-0.3976744186046512-0.5737082066869301V130VA130-0.7073020000000001-58.00.00.00.00.00.00.00.00.00.00.0-2.00.00.00.00.00.0-2.00.03.0-5.0-4.00.02.0-6.0-0.1359882334845805Stabilising-2.385Destabilising-0.406649616368286400.0Estrand1.633333333333333511.27VAL0.0640.02051282051282051355-0.1470.2256:4147/150M:F:D:C:I:L:V340.3578947368421052766effectpnca_p.val130met7.18700589334483e-05-8.987408781496420.00012497350770340.940032862253634119.468044435493-0.07522855859877414692673.51081322.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.999999999999997-1.31-0.3429319371727748DestabilisingMET0pnca_complex.pdb
298V130GV130GAPZA10.402-3.429Destabilising-1.126Destabilising-0.8860465116279069-0.2852077001013171V130VA1305.7761220.00.00.00.00.00.00.00.00.00.00.0-2.00.00.00.00.00.03.00.03.00.08.00.09.023.00.21037886348239715Destabilising-4.805Destabilising-0.819266837169650400.0Estrand1.633333333333333511.27VAL0.0640.02051282051282051355-0.1470.2256:4147/150M:F:D:C:I:L:V730.768421052631578985effectpnca_p.val130gly0.000143740117866813.1456002256202511754.4635524240.924803768446987139.2771833265420.09438444913693940.000162837134445819.4110222970131.28804840845689inf0.02922358609515971.534266491831630.91081598550184inf4.731220703822740.0296198560706035-3.46-0.9057591623036648DestabilisingGLY0pnca_complex.pdb
299V130EV130EAPZA10.402-3.207Destabilising-0.292Destabilising-0.8286821705426356-0.0739614994934143V130VA1305.05456-46.0-56.00.0-4.0-52.00.00.00.00.00.00.00.00.00.00.00.00.0-5.00.00.0-5.0-2.00.02.0-4.00.18409807763751193Destabilising-5.67Destabilising-0.966751918158567800.0Estrand1.633333333333333511.27VAL0.0640.02051282051282051355-0.1470.2256:4147/150M:F:D:C:I:L:V750.789473684210526385effectpnca_p.val130glu0.000143740117866813.1456002256204511754.463552540.924803768446994139.2771833265570.09438444913693090.000162837134445419.4110222970131.28804840845689inf0.02922358609515971.534266491831630.91081598550184inf4.731220703822740.0296198560706035-1.74-0.4554973821989529DestabilisingGLU0pnca_complex.pdb
300V131GV131GAPZA9.063-3.182Destabilising-1.774Destabilising-0.8222222222222222-0.4493414387031408V131VA1315.353456.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.02.00.03.019.00.1949843020418272Destabilising-3.989Destabilising-0.680136402387041810.0057471264367816Estrand2.666666666666666510.36VAL0.2040.0653846153846153744-0.0380.3895:4147/150D:M:S:A:G:T:C:V:L540.568421052631578975effectpnca_p.val131gly0.000143740117866813.145600225622511754.4635533380.924803768447044139.2771833266670.09438444913686760.000162837134442919.4110222970131.28804840845689inf0.02922358609515971.534266491831630.91081598550184inf4.731220703822740.0296198560706035-2.53-0.662303664921466DestabilisingGLY0pnca_complex.pdb
301V131FV131FAPZA9.063-1.59Destabilising-2.323Destabilising-0.4108527131782946-0.5883991894630193V131VA1311.54666-44.0-4.00.00.0-4.00.00.00.00.00.00.00.00.00.00.00.00.0-15.00.0-7.0-8.0-6.00.0-8.0-8.00.0563327238689093Destabilising-1.786Destabilising-0.304518329070758710.0057471264367816Estrand2.666666666666666510.36VAL0.2040.0653846153846153744-0.0380.3895:4147/150D:M:S:A:G:T:C:V:L720.757894736842105385effectpnca_p.val131phe0.000143740117866813.1456002256219511754.4635533150.924803768447041139.2771833266610.09438444913687130.00016283713444319.4110222970131.28804840845689inf0.02922358609515971.534266491831630.91081598550184inf4.731220703822740.0296198560706035-1.52-0.3979057591623037DestabilisingPHE0pnca_complex.pdb
302G132DG132DAPZA6.912000000000001-2.518Destabilising-0.8220000000000001Destabilising-0.6506459948320414-0.2082066869300912G132GA13218.6426-22.0-42.00.0-2.0-40.00.00.00.00.00.00.00.00.00.00.00.00.0-11.00.0-9.0-6.0-4.00.0-9.0-23.00.6790040719993591Destabilising-3.507Destabilising-0.597953964194373400.0Estrand2.7666666666666668.75GLY-1.191-0.981054365733113899-1.229-1.1789:9147/150G920.96842105263157995effectpnca_p.gly132asp0.000431220353600614.14729391913341393450.940228590.915018435775164132.5760606765640.1067107730229484.1789618203820458.33122629582811.7659011066874inf2.48532104922106e-054.604617501941085.71767556863798inf23.5474886354081.21868387173808e-06-1.46-0.3821989528795811DestabilisingASP0pnca_complex.pdb
303G132AG132AAPZA6.912000000000001-0.8290000000000001Destabilising-1.92Destabilising-0.2142118863049095-0.486322188449848G132GA1325.5504-4.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-6.00.0-6.0-2.00.00.0-7.0-18.00.20215764974977965Destabilising-2.927Destabilising-0.499062233589087800.0Estrand2.7666666666666668.75GLY-1.191-0.981054365733113899-1.229-1.1789:9147/150G800.842105263157894791effectpnca_p.gly132ala0.00057496047146752.679666350190414.58022779401170.00102453523771040.8160506321224173.283701089993673.3569796112201699.553869259154914.58027812895071.1637658085304114.58017590340610.00050753514476143.294533879232452.60435121163486147.67632700613615.06634481641440.0001037975122989-0.28-0.0732984293193717DestabilisingALA0pnca_complex.pdb
304G132SG132SAPZA6.912000000000001-2.061Destabilising-0.312Destabilising-0.5325581395348837-0.0790273556231003G132GA13210.5344-4.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-8.00.0-8.0-4.00.00.0-7.0-19.00.38368577859687203Destabilising-3.165Destabilising-0.539641943734015300.0Estrand2.7666666666666668.75GLY-1.191-0.981054365733113899-1.229-1.1789:9147/150G850.894736842105263291effectpnca_p.gly132ser0.000574960471467514.14813708950881394626.352247660.901927875940771114.8142370345560.12322633024378982.958602139360477.84057359763811.89120602753485inf7.2326389241213e-076.14070321569598.29603358299821inf33.18027492710128.399830460993881e-09-1.17-0.306282722513089DestabilisingSER0pnca_complex.pdb
305I133TI133TAPZA3.05-2.7880000000000003Destabilising0.703Stabilising-0.72041343669250650.3152466367713004I133IA1331.5784434.00.00.00.00.00.00.00.00.0-2.00.0-2.00.00.00.00.00.00.00.00.00.04.00.04.00.00.05749022064554666Destabilising-1.862Destabilising-0.317476555839727230.015228426395939Estrand1.96666666666666687.9ILE-0.739-0.608731466227347688-0.872-0.6748:7147/150V:L:I:M:F680.715789473684210580effectpnca_p.ile133thr0.00316228259307171.862058200592016.436971725678211.0518317723875602e-090.3051884226465076.101339573909063.5522227107020811.85555834892316.436971783749940.8086816054178376.435697211258832.90039620895666e-098.537542671201013.3973925116016912.387504516872746.35889970452389.845927533322829e-12-2.56-0.6701570680628273DestabilisingTHR0pnca_complex.pdb
306I133SI133SAPZA3.05-3.219Destabilising0.578Stabilising-0.83178294573643410.2591928251121076I133IA1333.3019634.00.00.00.00.00.00.00.00.0-2.00.0-2.00.00.00.00.00.00.00.00.00.06.00.08.00.00.12026457069180281Destabilising-2.461Destabilising-0.4196078431372548530.015228426395939Estrand1.96666666666666687.9ILE-0.739-0.608731466227347688-0.872-0.6748:7147/150V:L:I:M:F700.736842105263157985effectpnca_p.ile133ser7.18700589334483e-0512.1451538387262188179.9262645890.919026337424226119.4680444362180.1016602715482665.01153666064073e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-3.47-0.9083769633507854DestabilisingSER0pnca_complex.pdb
307A134VA134VAPZA3.047-0.414Destabilising0.118Stabilising-0.10697674418604650.052914798206278A134AA134-1.46184-6.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-2.00.0-2.0-6.0-2.00.0-2.0-3.0-0.2810582173344613Stabilising-1.64Destabilising-0.27962489343563507100.0775193798449612-loop1.86666666666666656.77ALA-1.111-0.915156507413509199-1.178-1.0949:9147/150V:T:S:A740.778947368421052685effectpnca_p.ala134val0.00035935029466722.9665952872801819.42566805717670.00795005031660531.117705282648222.654183829436072.87215213651462380.09715897558819.42568421052631.2883763244419619.41697909836360.00368168890159292.433952911657541.92061868691892951.4031143047039.875613637235080.0016748373055023-0.88-0.2303664921465968DestabilisingVAL0pnca_complex.pdb
308A134TA134TAPZA3.047-1.925Destabilising0.875Stabilising-0.49741602067183460.3923766816143498A134AA134-0.943073-6.00.00.00.00.00.00.00.00.0-2.00.0-2.00.00.00.00.00.0-2.00.00.0-4.0-2.00.0-2.0-3.0-0.1813183496116281Stabilising-1.723Destabilising-0.2937766410912191100.0775193798449612-loop1.86666666666666656.77ALA-1.111-0.915156507413509199-1.178-1.0949:9147/150V:T:S:A610.642105263157894780effect-1.44-0.3769633507853403DestabilisingTHR0pnca_complex.pdb
309A134GA134GAPZA3.047-1.618Destabilising-0.3779999999999999Destabilising-0.4180878552971576-0.0957446808510638A134AA134-1.285362.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.01.00.00.00.03.014.0-0.24712758594170578Stabilising-2.508Destabilising-0.42762148337595907100.0775193798449612-loop1.86666666666666656.77ALA-1.111-0.915156507413509199-1.178-1.0949:9147/150V:T:S:A790.831578947368421185effect-1.88-0.4921465968586387DestabilisingGLY0pnca_complex.pdb
310A134PA134PAPZA3.047-1.426Destabilising0.077Stabilising-0.36847545219638240.0345291479820627A134AA134-5.20120.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.01.01.0-1.0-2.0-2.00.00.0-9.0-1.0Stabilising-2.503Destabilising-0.426768968456948100.0775193798449612-loop1.86666666666666656.77ALA-1.111-0.915156507413509199-1.178-1.0949:9147/150V:T:S:A880.926315789473684291effectpnca_p.ala134pro7.18700589334483e-0512.1451538387265188179.926264650.919026337424237119.4680444362370.1016602715482525.01153666062244e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-0.19-0.0497382198952879DestabilisingPRO0pnca_complex.pdb
311A134DA134DAPZA3.047-2.98Destabilising0.5820000000000001Stabilising-0.77002583979328170.2609865470852018A134AA1341.03055-24.0-34.00.00.0-34.00.00.00.00.0-2.00.0-2.00.00.00.00.00.00.00.00.0-2.0-4.00.0-2.0-3.00.03753487423422374Destabilising-3.856Destabilising-0.6574595055413469100.0775193798449612-loop1.86666666666666656.77ALA-1.111-0.915156507413509199-1.178-1.0949:9147/150V:T:S:A850.894736842105263291effectpnca_p.ala134asp7.18700589334483e-05-8.987408781496430.00012497350770340.940032862253634119.468044435494-0.07522855859877364692673.5108142.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.999999999999997-1.13-0.2958115183246073DestabilisingASP0pnca_complex.pdb
312T135IT135IAPZA6.0210.442Stabilising-1.039Destabilising0.3758503401360544-0.2631712259371834T135TA135-0.624872-10.00.00.00.00.00.00.00.00.04.00.0-2.04.00.00.00.00.0-3.00.0-1.00.02.00.02.0-4.0-0.12013996769976158Stabilising-0.279Destabilising-0.0475703324808184230.0174418604651162Tloop-0.79999999999999995.97THR-0.612-0.504118616144975377-0.728-0.5538:7147/150G:S:M:A:T:L:R:E:Y:F:Q860.905263157894736991effectpnca_p.thr135ile7.18700589334483e-05-8.98740878149640.00012497350770340.940032862253633119.46804443549-0.07522855859877554692673.51081092.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.9999999999999970.660.3707865168539326StabilisingILE0pnca_complex.pdb
313T135PT135PAPZA6.021-0.141Destabilising-1.103Destabilising-0.0364341085271317-0.2793819655521783T135TA1354.229944.00.00.00.00.00.00.00.00.06.02.0-2.04.00.00.00.00.00.02.00.00.04.00.04.0-2.00.15406362225832065Destabilising-2.513Destabilising-0.428473998294970130.0174418604651162Tloop-0.79999999999999995.97THR-0.612-0.504118616144975377-0.728-0.5538:7147/150G:S:M:A:T:L:R:E:Y:F:Q930.978947368421052795effectpnca_p.thr135pro0.00194049159120314.84770422501703127.4474630303911.95563371409724e-061.018862826520614.7579557314617127.08950536111362275.86435679243127.4475138121552.10533136786968127.5479773114812.29679039420522e-1918.63887863684420.91035397255025063.91643152716114.1776926099731.1913921230384099e-260.50.2808988764044944StabilisingPRO0pnca_complex.pdb
314T135AT135AAPZA6.021-0.347Destabilising-1.324Destabilising-0.0896640826873385-0.3353596757852077T135TA1350.9399714.00.00.00.00.00.00.00.00.04.00.0-2.04.00.00.00.00.04.00.04.02.06.00.06.03.00.03423578988774685Destabilising-1.151Destabilising-0.1962489343563512430.0174418604651162Tloop-0.79999999999999995.97THR-0.612-0.504118616144975377-0.728-0.5538:7147/150G:S:M:A:T:L:R:E:Y:F:Q720.757894736842105385effect-0.32-0.0837696335078534DestabilisingALA0pnca_complex.pdb
315T135ST135SAPZA6.021-1.605Destabilising-0.7090000000000001Destabilising-0.4147286821705426-0.1795845997973657T135TA1350.778890.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.03.00.01.02.02.00.02.02.00.028368869237101087Destabilising-1.567Destabilising-0.267178175618073330.0174418604651162Tloop-0.79999999999999995.97THR-0.612-0.504118616144975377-0.728-0.5538:7147/150G:S:M:A:T:L:R:E:Y:F:Q650.684210526315789580effectpnca_p.thr135ser7.18700589334483e-05-8.987408781496410.00012497350770340.940032862253632119.46804443549-0.0752285585987764692673.510811842.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.999999999999997-0.71-0.1858638743455497DestabilisingSER0pnca_complex.pdb
316D136YD136YAPZA6.178999999999999-0.96Destabilising-1.662Destabilising-0.2480620155038759-0.4209726443768997D136DA1366.12929-32.025.00.00.025.00.00.00.00.06.00.02.04.00.00.00.00.0-6.00.0-4.0-4.0-2.00.02.0-2.00.22324208363988665Destabilising-1.07Destabilising-0.182438192668371760.0310880829015544Tloop-2.4666666666666675.37ASP-1.076-0.886326194398682199-1.152-1.0289:9147/150S:E:D860.905263157894736991effectpnca_p.asp136tyr0.000215610176800313.1460210125005511969.8484290020.907969111549614113.7193447319470.1156005694852320.18392693627731729.12878787878791.4643224129316inf0.00499313284561492.30162687909812.00455510251839inf9.28726407271570.0023075254069185-0.23-0.0602094240837696DestabilisingTYR0pnca_complex.pdb
317D136AD136AAPZA6.1789999999999990.66Stabilising-2.506Destabilising0.5612244897959184-0.6347517730496454D136DA1361.501124.029.00.00.029.00.00.00.00.08.00.02.02.00.00.00.00.04.00.00.04.06.00.010.0-3.00.05467405794039875Destabilising-0.993Destabilising-0.16930946291560160.0310880829015544Tloop-2.4666666666666675.37ASP-1.076-0.886326194398682199-1.152-1.0289:9147/150S:E:D730.768421052631578985effectpnca_p.asp136ala7.18700589334483e-0512.1451538387252188179.9262644030.919026337424193119.4680444361590.1016602715483085.01153666069587e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.3821468117582611.781.0StabilisingALA0pnca_complex.pdb
318D136ND136NAPZA6.1789999999999990.216Stabilising-1.58Destabilising0.1836734693877551-0.4002026342451875D136DA1360.9610880.029.00.00.029.00.00.00.00.04.00.00.02.00.00.00.00.0-5.00.03.0-9.04.00.02.0-4.00.03500491699385922Destabilising-1.377Destabilising-0.2347826086956521860.0310880829015544Tloop-2.4666666666666675.37ASP-1.076-0.886326194398682199-1.152-1.0289:9147/150S:E:D790.831578947368421185effectpnca_p.asp136asn0.00050309041253411.291938585315423.639835853048290.09086654325627080.7640789771254491.690844302739280.71651909963243316.52227109308873.639835858585860.5610817992211073.639363653987780.1018837765797330.991894965187220.53273875669343821.525946479471.712378964787860.1906770026903950.480.2696629213483146StabilisingASN0pnca_complex.pdb
319D136GD136GAPZA6.1789999999999990.314Stabilising-2.5780000000000003Destabilising0.2670068027210884-0.6529888551165147D136DA1362.049916.029.00.00.029.00.00.00.00.08.00.02.02.00.00.00.00.05.00.05.02.08.00.013.015.00.07466218431078316Destabilising-1.455Destabilising-0.2480818414322250660.0310880829015544Tloop-2.4666666666666675.37ASP-1.076-0.886326194398682199-1.152-1.0289:9147/150S:E:D790.831578947368421185effectpnca_p.asp136gly0.00086244070720131.243730335422543.468528135126990.03378892238208850.5859516990766822.122581669073341.0257838075822110.87586951453593.468528102058010.5401452175091223.468097036263280.04008255650264721.397044586552370.86717745533264312.70729948992863.52694116055840.06037908323508620.520.2921348314606741StabilisingGLY0pnca_complex.pdb
320H137NH137NAPZA3.4190.1889999999999999Stabilising-0.124Destabilising0.1607142857142857-0.0314083080040526H137HA1370.4014414.03.00.00.03.00.00.00.00.00.00.00.00.00.00.00.00.0-1.00.01.0-1.04.00.02.02.00.014621318628486514Destabilising-0.475Destabilising-0.08098891730605284840.375Tloop-1.44.6HIS-0.415-0.341845140032948977-0.615-0.3327:6147/150Q:H:F:E:Y:I:V:W650.684210526315789580effectpnca_p.his137asn7.18700589334483e-05-8.987408781496420.00012497350770340.940032862253634119.468044435493-0.0752285585987744692673.510812542.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.9999999999999970.60.3370786516853932StabilisingASN0pnca_complex.pdb
321H137RH137RAPZA3.419-0.272Destabilising0.466Stabilising-0.07028423772609820.2089686098654708H137HA1370.4886649999999999-52.0-2.00.00.0-2.00.00.00.00.00.00.00.00.00.00.00.00.01.00.04.0-1.0-2.00.0-2.0-4.00.017798242994194302Destabilising-0.317Destabilising-0.054049445865302644840.375Tloop-1.44.6HIS-0.415-0.341845140032948977-0.615-0.3327:6147/150Q:H:F:E:Y:I:V:W760.885effectpnca_p.his137arg0.00028748023573371.579373295212094.851914140399810.1143422970043041.00025364540071.578972796024540.58188909131281940.45629110753244.851914177534710.6859131102999064.851184435511780.1379549363682950.8602627547777290.35147133141776367.04210604197061.174970908556980.2783822018195610.210.1179775280898876StabilisingARG0pnca_complex.pdb
322H137YH137YAPZA3.4190.8590000000000001Stabilising-0.005Destabilising0.7304421768707484-0.0012664640324214H137HA1370.344473-42.03.00.00.03.00.00.00.00.02.00.02.00.00.00.00.00.0-1.00.01.0-4.0-2.00.0-2.00.00.012546456486425453Destabilising-0.394Destabilising-0.06717817561807332840.375Tloop-1.44.6HIS-0.415-0.341845140032948977-0.615-0.3327:6147/150Q:H:F:E:Y:I:V:W-7-0.0752688172043010853neutralpnca_p.his137tyr7.18700589334483e-05-8.987408781496420.00012497350770340.940032862253633119.468044435491-0.07522855859877554692673.510812852.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.9999999999999971.720.9662921348314606StabilisingTYR0pnca_complex.pdb
323H137PH137PAPZA3.4190.366Stabilising-0.765Destabilising0.3112244897959184-0.1937689969604863H137HA1372.1904534.03.00.00.03.00.00.00.00.02.00.02.00.00.00.00.00.00.04.0-2.0-4.02.00.0-4.00.00.07978095702911588Destabilising-0.882Destabilising-0.15038363171355498840.375Tloop-1.44.6HIS-0.415-0.341845140032948977-0.615-0.3327:6147/150Q:H:F:E:Y:I:V:W860.905263157894736991effect1.030.5786516853932584StabilisingPRO0pnca_complex.pdb
324C138RC138RAPZA3.2820.099Stabilising0.35Stabilising0.08418367346938770.1569506726457399C138CA138-2.11829-86.0-32.00.00.0-32.00.00.00.00.0-2.00.0-2.0-2.00.00.00.00.0-5.00.0-1.0-6.0-14.00.0-6.0-12.0-0.40726947627470583Stabilising-2.383Destabilising-0.406308610400682120.0718562874251497Hhelix1.16666666666666676.7CYS-1.148-0.945634266886326199-1.221-1.1249:9147/150C:S910.957894736842105295effectpnca_p.cys138arg0.000862440707201315.14982905447783797407.118181150.921917088417709154.5598927651080.098019148327837560.4370486597206116.9581749049432.06803058263964inf6.09960824712391e-109.2146980570508413.5248372165465inf52.52771454992254.2421933164431297e-130.530.297752808988764StabilisingARG0pnca_complex.pdb
325C138YC138YAPZA3.282-0.518Destabilising0.914Stabilising-0.13385012919896640.4098654708520179C138CA138-0.565013-72.0-40.00.00.0-40.00.00.00.00.00.00.0-2.00.00.00.00.00.01.00.00.01.0-12.00.0-2.0-14.0-0.10863127739752365Stabilising-1.271Destabilising-0.2167092924126172120.0718562874251497Hhelix1.16666666666666676.7CYS-1.148-0.945634266886326199-1.221-1.1249:9147/150C:S900.947368421052631595effect-0.44-0.1151832460732984DestabilisingTYR0pnca_complex.pdb
326C138GC138GAPZA3.282-0.015Destabilising-0.012Destabilising-0.003875968992248-0.0030395136778115C138CA1381.1206316.00.00.00.00.00.00.00.00.02.00.00.00.00.00.00.00.03.00.03.00.06.00.09.019.00.040815783914509865Destabilising-2.578Destabilising-0.4395566922421142120.0718562874251497Hhelix1.16666666666666676.7CYS-1.148-0.945634266886326199-1.221-1.1249:9147/150C:S900.947368421052631595effect1.060.5955056179775281StabilisingGLY0pnca_complex.pdb
327C138SC138SAPZA3.282-0.002Destabilising0.8140000000000001Stabilising-0.0005167958656330.3650224215246637C138CA138-0.2292894.00.00.00.00.00.00.00.00.00.00.0-2.00.00.00.00.00.03.00.03.00.02.00.00.02.0-0.04408386526186264Stabilising-1.639Destabilising-0.2794543904518329120.0718562874251497Hhelix1.16666666666666676.7CYS-1.148-0.945634266886326199-1.221-1.1249:9147/150C:S870.915789473684210591effect1.020.5730337078651685StabilisingSER0pnca_complex.pdb
328C138WC138WAPZA3.282-1.048Destabilising0.943Stabilising-0.27080103359173120.4228699551569506C138CA138-1.71951-72.00.00.00.00.00.00.00.00.00.00.0-2.00.00.00.00.00.0-2.00.00.0-3.0-12.00.0-2.0-16.0-0.33059870799046376Stabilising-1.165Destabilising-0.19863597612958225120.0718562874251497Hhelix1.16666666666666676.7CYS-1.148-0.945634266886326199-1.221-1.1249:9147/150C:S910.957894736842105295effect-0.99-0.2591623036649215DestabilisingTRP0pnca_complex.pdb
329V139LV139LAPZA5.113-0.462Destabilising-0.504Destabilising-0.1193798449612403-0.1276595744680851V139VA139-1.24107-28.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-4.00.0-1.0-3.0-2.00.00.00.0-0.23861224332846265Stabilising-0.518Destabilising-0.0883205456095481600.0Hhelix0.73333333333333349.18VAL-1.171-0.964579901153212699-1.221-1.1529:9147/150I:V:A790.831578947368421185effectpnca_p.val139leu0.00079057064826793.0863998055033521.89809847666867.90481988040462e-050.7819079284112573.94726756611175.63934469685405143.70073278585121.89810126582281.3404064597933321.88943470890254.86279858821822e-065.313113718060224.52710002121826207.73620449987828.12276453291981.13858693465794e-07-0.59-0.1544502617801047DestabilisingLEU0pnca_complex.pdb
330V139GV139GAPZA5.113-2.377Destabilising-0.4Destabilising-0.6142118863049095-0.1013171225937183V139VA1394.0300812.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.01.00.01.00.06.00.017.025.00.14678428601606947Destabilising-4.222Destabilising-0.719863597612958300.0Hhelix0.73333333333333349.18VAL-1.171-0.964579901153212699-1.221-1.1529:9147/150I:V:A840.884210526315789491effectpnca_p.val139gly0.0006468305304013.6614289282921438.91691263678170.00055782750781081.060874245253493.451331715020817.13685172053903722.16507375829438.91691269506541.5901383800886338.91452962991575.5228318480997e-065.257838179400655.210749591492541710.7556573630427.87381456646131.29490403629991e-07-2.37-0.6204188481675393DestabilisingGLY0pnca_complex.pdb
331V139AV139AAPZA5.113-1.598Destabilising-0.537Destabilising-0.4129198966408269-0.1360182370820668V139VA1392.242462.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.01.00.01.00.02.00.04.07.00.08167527444110169Destabilising-2.438Destabilising-0.4156862745098039400.0Hhelix0.73333333333333349.18VAL-1.171-0.964579901153212699-1.221-1.1529:9147/150I:V:A520.547368421052631675effectpnca_p.val139ala0.00186862153226961.583057479593064.869822455204425.59300498642966e-050.3928810923015414.029355218698192.2334095189887210.61838509845244.86982248520710.6875131305985964.869094614728960.00011707002555883.931554286829842.0766116785512411.419582284053317.63654036045292.67400952353788e-05-1.84-0.4816753926701571DestabilisingALA0pnca_complex.pdb
332V139MV139MAPZA5.113-0.944Destabilising-1.067Destabilising-0.2439276485788113-0.2702634245187436V139VA139-0.8750100000000001-44.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-6.00.0-1.0-5.0-2.00.00.00.0-0.16823233100053836Stabilising-1.235Destabilising-0.2105711849957374300.0Hhelix0.73333333333333349.18VAL-1.171-0.964579901153212699-1.221-1.1529:9147/150I:V:A690.726315789473684280effectpnca_p.val139met0.0006468305304013.6614289282921438.91691263678160.00055782750781081.060874245253493.45133171502087.13685172054607722.16507375655938.91691269506541.5901383800886338.91452962991575.5228318480997e-065.257838179400655.210749591492541710.7556573630427.87381456646131.29490403629991e-07-1.0-0.2617801047120419DestabilisingMET0pnca_complex.pdb
333R140PR140PAPZA7.347-0.818Destabilising-1.466Destabilising-0.2113695090439276-0.3713272543059777R140RA1406.54200999999999966.036.00.00.036.00.00.00.00.06.02.02.04.00.00.00.00.0-3.02.0-8.0-1.06.00.06.0-2.00.23827424442194362Destabilising-1.939Destabilising-0.33060528559249786580.2116788321167883Hhelix-1.26666666666666665.39ARG-0.185-0.1523887973640856766-0.411-0.0387:5147/150G:A:T:N:L:V:K:R:E:Y:H:F:Q860.905263157894736991effectpnca_p.arg140pro0.000215610176800313.1460210125008511969.8484291560.90796911154963113.7193447319690.1156005694852120.18392693627683429.12878787878791.4643224129316inf0.00499313284561492.30162687909812.00455510251839inf9.28726407271570.0023075254069185-0.18-0.0471204188481675DestabilisingPRO0pnca_complex.pdb
334R140SR140SAPZA7.347-1.705Destabilising-1.646Destabilising-0.4405684754521964-0.4169199594731509R140RA1404.3718664.036.00.00.036.00.00.00.00.02.00.00.04.00.00.00.00.01.00.0-3.02.06.00.06.06.00.15923265758054764Destabilising-0.933Destabilising-0.15907928388746803580.2116788321167883Hhelix-1.26666666666666665.39ARG-0.185-0.1523887973640856766-0.411-0.0387:5147/150G:A:T:N:L:V:K:R:E:Y:H:F:Q530.557894736842105275effectpnca_p.arg140ser7.18700589334483e-05-8.987408781496410.00012497350770340.940032862253634119.468044435492-0.07522855859877454692673.510814242.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.999999999999997-1.49-0.3900523560209424DestabilisingSER0pnca_complex.pdb
335R140GR140GAPZA7.347-1.398Destabilising-1.735Destabilising-0.3612403100775194-0.4394630192502533R140RA1405.0241370.036.00.00.036.00.00.00.00.04.00.02.04.00.00.00.00.01.00.00.01.06.00.015.017.00.1829897507994668Destabilising-1.666Destabilising-0.2840579710144927580.2116788321167883Hhelix-1.26666666666666665.39ARG-0.185-0.1523887973640856766-0.411-0.0387:5147/150G:A:T:N:L:V:K:R:E:Y:H:F:Q710.747368421052631685effect-1.21-0.3167539267015707DestabilisingGLY0pnca_complex.pdb
336R140HR140HAPZA7.347-1.041Destabilising-1.013Destabilising-0.2689922480620155-0.2565856129685916R140RA1402.2976738.06.00.00.06.00.00.00.00.02.00.00.02.00.00.00.00.0-4.00.0-4.0-4.0-2.00.0-2.04.00.08368614281863941Destabilising-1.276Destabilising-0.2175618073316283580.2116788321167883Hhelix-1.26666666666666665.39ARG-0.185-0.1523887973640856766-0.411-0.0387:5147/150G:A:T:N:L:V:K:R:E:Y:H:F:Q530.557894736842105275effect-1.42-0.3717277486910995DestabilisingHIS0pnca_complex.pdb
337Q141PQ141PAPZA8.1079999999999990.901Stabilising-1.656Destabilising0.766156462585034-0.4194528875379939Q141QA1415.0246130.0-31.00.00.0-31.00.00.00.00.04.02.00.04.00.00.00.00.03.04.0-1.0-2.0-8.00.0-10.0-6.00.18300723344429956Destabilising-1.835Destabilising-0.3128729752770673410.1822222222222222Hhelix-2.95.08GLN-0.137-0.1128500823723229166-0.332-0.0386:5147/150N:C:R:F:H:E:Y:Q:W:D:A:S790.831578947368421185effectpnca_p.gln141pro0.00194049159120313.3372735592779628.14229371710737.45865029764653e-100.5421137105030276.1560397654973710.814916025945196.046415766938328.14229626485571.4493595307131328.11768680932081.80101596312758e-1413.7444824378379.60105095933572112.150850080883.72983183120425.67227891121513e-201.140.6404494382022471StabilisingPRO0pnca_complex.pdb
338Q141RQ141RAPZA8.1079999999999990.765Stabilising-1.581Destabilising0.6505102040816327-0.4004559270516717Q141QA1411.88305-58.0-30.00.00.0-30.00.00.00.00.04.00.00.04.00.00.00.00.0-3.00.01.0-5.00.00.00.00.00.06858477990078599Destabilising-0.131Destabilising-0.02233589087809037410.1822222222222222Hhelix-2.95.08GLN-0.137-0.1128500823723229166-0.332-0.0386:5147/150N:C:R:F:H:E:Y:Q:W:D:A:S360.3789473684210526466effectpnca_p.gln141arg0.0001437401178668-9.987521262450584.59700131334267e-050.942832958100734139.277183325398-0.0717096729269461144471.7063148471.21195880622110.08348785866285790.01.00.00.025.83865859621631.0105682238915901e-250.9999999999997460.130.0730337078651685StabilisingARG0pnca_complex.pdb
339T142KT142KAPZA8.097999999999999-0.83Destabilising-1.238Destabilising-0.214470284237726-0.3135764944275582T142TA1423.49705-82.0-48.00.0-2.0-46.00.00.00.00.02.00.02.00.00.00.00.00.01.00.03.0-2.0-6.00.0-4.0-6.00.1273701731510282Destabilising-5.128Destabilising-0.874339300937766400.0Hhelix-0.79999999999999998.33THR-0.892-0.734761120263591488-0.993-0.8279:8147/150S:E:T910.957894736842105295effectpnca_p.thr142lys0.000215610176800313.1460210125009511969.8484292320.907969111549634113.7193447319750.1156005694852070.18392693627672629.12878787878791.4643224129316inf0.00499313284561492.30162687909812.00455510251839inf9.28726407271570.0023075254069185-0.82-0.2146596858638743DestabilisingLYS0pnca_complex.pdb
340T142AT142AAPZA8.097999999999999-0.5720000000000001Destabilising-1.983Destabilising-0.1478036175710594-0.5022796352583587T142TA1422.859154.00.00.00.00.00.00.00.00.02.00.02.00.00.00.00.00.04.00.04.00.06.00.02.09.00.10413646661179059Destabilising-2.289Destabilising-0.390281329923273700.0Hhelix-0.79999999999999998.33THR-0.892-0.734761120263591488-0.993-0.8279:8147/150S:E:T800.842105263157894791effectpnca_p.thr142ala0.00057496047146752.679666350190414.58022779401170.00102453523771030.8160506321224113.283701089993693.3569796112218999.553869259240414.58027812895071.1637658085304114.58017590340610.00050753514476143.294533879232452.60435121163486147.67632700613615.06634481641440.0001037975122989-0.73-0.1910994764397905DestabilisingALA0pnca_complex.pdb
341T142RT142RAPZA8.097999999999999-0.733Destabilising-1.267Destabilising-0.1894056847545219-0.3209219858156029T142TA1425.15889-106.0-34.00.00.0-34.00.00.00.00.0-2.00.04.0-4.00.00.00.00.0-9.00.00.0-9.0-10.00.0-14.0-4.00.1878980033362714Destabilising-4.739Destabilising-0.808013640238704100.0Hhelix-0.79999999999999998.33THR-0.892-0.734761120263591488-0.993-0.8279:8147/150S:E:T910.957894736842105295effect-0.89-0.2329842931937173DestabilisingARG0pnca_complex.pdb
342T142PT142PAPZA8.097999999999999-0.706Destabilising-1.638Destabilising-0.1824289405684754-0.4148936170212766T142TA1426.725364.0-25.00.00.0-25.00.00.00.00.04.02.02.00.00.00.00.00.04.04.00.0-2.06.00.0-2.04.00.24495225052630046Destabilising-4.677Destabilising-0.797442455242966600.0Hhelix-0.79999999999999998.33THR-0.892-0.734761120263591488-0.993-0.8279:8147/150S:E:T920.96842105263157995effectpnca_p.thr142pro0.000143740117866813.1456002256242511754.4635544920.924803768447115139.2771833268220.09438444913677870.000162837134439219.4110222970131.28804840845689inf0.02922358609515971.534266491831630.91081598550184inf4.731220703822740.0296198560706035-0.54-0.1413612565445026DestabilisingPRO0pnca_complex.pdb
343T142MT142MAPZA8.0979999999999990.175Stabilising-1.836Destabilising0.1488095238095238-0.4650455927051671T142TA142-0.8869389999999999-56.00.00.00.00.00.00.00.00.02.00.02.00.00.00.00.00.0-3.00.01.0-4.00.00.00.00.0-0.1705258401907252Stabilising-1.977Destabilising-0.337084398976982100.0Hhelix-0.79999999999999998.33THR-0.892-0.734761120263591488-0.993-0.8279:8147/150S:E:T850.894736842105263291effectpnca_p.thr142met0.00021561017680032.272606078088179.704658986530510.06344559022608991.224427601584961.85605590330240.929172866365547208.8816030047789.704669751787970.9869807610106799.701949905893830.07768449259424941.109665666564610.504888890842109570.3728424103282.291682450166840.130068862702538-0.23-0.0602094240837696DestabilisingMET0pnca_complex.pdb
344A143VA143VAPZA10.807-0.622Destabilising-1.168Destabilising-0.1607235142118863-0.2958459979736575A143AA1430.113853-8.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-12.00.0-6.0-6.0-2.00.0-2.0-7.00.004146774087806584Destabilising-1.998Destabilising-0.3406649616368286300.0Hhelix-0.80000000000000028.82ALA-0.834-0.686985172981878188-0.955-0.7799:8147/150I:C:V:S:A:T-16-0.1720430107526881957neutralpnca_p.ala143val0.0003593502946672-10.98779090199961.69068633684891e-050.939691219428539145.229797681912-0.075657964669657560.33890826761240.484657419083649-0.3145651347425670.00.5961118750587110.2246722265665940.05.292243504333850.1777772638998140.673290424524484-0.56-0.1465968586387434DestabilisingVAL0pnca_complex.pdb
345A143DA143DAPZA10.807-3.46Destabilising0.346Stabilising-0.89405684754521960.1551569506726457A143AA1435.46827-14.0-46.00.0-2.0-44.00.00.00.00.00.00.00.00.00.00.00.00.0-9.00.0-1.0-8.0-6.00.0-4.0-3.00.19916629637453653Destabilising-5.865Destabilising-1.000.0Hhelix-0.80000000000000028.82ALA-0.834-0.686985172981878188-0.955-0.7799:8147/150I:C:V:S:A:T840.884210526315789491effectpnca_p.ala143asp0.00014374011786681.579039389124024.850294327177340.2642475663767231.414392862765841.116407916564430.191756076673654122.6837603990964.850294365012620.6857680967922064.849564479041120.3127341543101870.5048246860149950.061763864579114379.5583372042030.08811926218633320.766581879696361-1.17-0.306282722513089DestabilisingASP0pnca_complex.pdb
346A143GA143GAPZA10.807-2.08Destabilising-0.868Destabilising-0.537467700258398-0.2198581560283688A143AA1432.315332.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.02.00.05.018.00.08432935845977899Destabilising-3.708Destabilising-0.632225063938618900.0Hhelix-0.80000000000000028.82ALA-0.834-0.686985172981878188-0.955-0.7799:8147/150I:C:V:S:A:T720.757894736842105385effectpnca_p.ala143gly0.000359350294667214.14687260040371392863.976906570.922400595820385145.2297976852520.09741026170857420.39027815638153748.58887952822241.68653688423854inf0.00014561217554173.836802309435584.44801917882778inf18.75418886963591.4869638142509e-05-2.04-0.5340314136125655DestabilisingGLY0pnca_complex.pdb
347A143TA143TAPZA10.807-2.359Destabilising0.07Stabilising-0.60956072351421190.0313901345291479A143AA1430.4067679999999999-8.00.00.00.00.00.00.00.00.00.00.0-2.00.00.00.00.00.0-10.00.0-4.0-8.0-6.00.0-6.0-5.00.014815375986130431Destabilising-2.811Destabilising-0.479283887468030700.0Hhelix-0.80000000000000028.82ALA-0.834-0.686985172981878188-0.955-0.7799:8147/150I:C:V:S:A:T470.4947368421052631471effectpnca_p.ala143thr0.00014374011786681.579039389124014.850294327177320.2642475663767241.414392862765841.116407916564430.191756076673653122.6837603990954.850294365012620.6857680967922064.849564479041120.3127341543101870.5048246860149950.061763864579114379.5583372042030.08811926218633320.766581879696361-1.46-0.3821989528795811DestabilisingTHR0pnca_complex.pdb
348A143PA143PAPZA10.807-1.416Destabilising-0.732Destabilising-0.365891472868217-0.1854103343465045A143AA1432.350820.00.00.00.00.00.00.00.00.02.02.0-2.00.00.00.00.00.03.04.01.0-2.0-2.00.0-2.0-5.00.0856219815121031Destabilising-3.997Destabilising-0.681500426257459400.0Hhelix-0.80000000000000028.82ALA-0.834-0.686985172981878188-0.955-0.7799:8147/150I:C:V:S:A:T850.894736842105263291effect-0.21-0.0549738219895288DestabilisingPRO0pnca_complex.pdb
349D145ED145EAPZA11.649-0.148Destabilising-1.031Destabilising-0.0382428940568475-0.261144883485309D145DA145-0.4769-10.04.00.00.04.00.00.00.00.02.00.0-2.04.00.00.00.00.0-3.00.0-2.0-1.00.00.02.0-2.0-0.09169037914327463Stabilising-0.323Destabilising-0.05507246376811594330.1709844559585492Hhelix-1.73333333333333344.71ASP-1.092-0.89950576606260399-1.152-1.0629:9147/150S:E:A:D:K700.736842105263157985effectpnca_p.asp145glu7.18700589334483e-0512.145153838726188179.9262645570.919026337424219119.4680444362060.1016602715482745.01153666065157e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-0.78-0.2041884816753927DestabilisingGLU0pnca_complex.pdb
350D145YD145YAPZA11.649-0.409Destabilising-1.689Destabilising-0.1056847545219638-0.4278115501519757D145DA145-0.814413-38.028.00.00.028.00.00.00.00.00.00.0-4.06.00.00.00.00.0-1.00.00.0-2.0-2.00.0-2.0-2.0-0.15658175036530034Stabilising-0.858Destabilising-0.1462915601023018330.1709844559585492Hhelix-1.73333333333333344.71ASP-1.092-0.89950576606260399-1.152-1.0629:9147/150S:E:A:D:K820.863157894736842191effectpnca_p.asp145tyr7.18700589334483e-0512.1451538387265188179.9262646440.919026337424236119.4680444362350.1016602715482545.01153666062444e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-1.05-0.274869109947644DestabilisingTYR0pnca_complex.pdb
351A146VA146VAPZA14.858-0.425Destabilising-1.712Destabilising-0.1098191214470284-0.4336372847011145A146AA1460.4639090.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-9.00.0-3.0-8.0-4.00.0-2.0-5.00.01689657558694338Destabilising-2.215Destabilising-0.377664109121909600.0Hhelix0.83333333333333347.08ALA-0.895-0.737232289950576788-0.993-0.8279:8147/150G:S:A630.663157894736842180effectpnca_p.ala146val0.00100618082506824.1490444289425963.37341355546186.28168511875833e-051.036750103927834.001971558260312.61889699632581151.61786218663.37362637362641.801908559089863.35155407240661.2241629245587202e-098.912160777837489.504730929441642653.7155438433251.52110067321077.08317026236427e-13-0.75-0.1963350785340314DestabilisingVAL0pnca_complex.pdb
352A146EA146EAPZA14.858-2.184Destabilising0.284Stabilising-0.56434108527131790.1273542600896861A146AA1463.30206-36.0-46.00.0-2.0-44.00.00.00.00.00.00.0-2.00.00.00.00.00.0-6.00.0-2.0-7.0-10.00.0-8.0-9.00.12026821290947633Destabilising-5.327Destabilising-0.908269394714407500.0Hhelix0.83333333333333347.08ALA-0.895-0.737232289950576788-0.993-0.8279:8147/150G:S:A750.789473684210526385effectpnca_p.ala146glu0.000143740117866813.1456002256226511754.4635536490.924803768447062139.2771833267070.09438444913684470.000162837134441919.4110222970131.28804840845689inf0.02922358609515971.534266491831630.91081598550184inf4.731220703822740.0296198560706035-0.93-0.243455497382199DestabilisingGLU0pnca_complex.pdb
353A146TA146TAPZA14.858-2.074Destabilising-0.252Destabilising-0.5359173126614987-0.0638297872340425A146AA1461.480940.00.00.00.00.00.00.00.00.0-2.00.0-4.00.00.00.00.00.0-5.00.0-1.0-4.0-6.00.0-2.0-7.00.05393905841388705Destabilising-2.71Destabilising-0.462063086104006800.0Hhelix0.83333333333333347.08ALA-0.895-0.737232289950576788-0.993-0.8279:8147/150G:S:A530.557894736842105275effectpnca_p.ala146thr0.00071870058933441.98634912920747.288874388340920.00210084701647880.6458427385425183.075592571792352.0805121980996828.52952725098047.288874841972190.8626604929769057.287280681258850.00278309953907822.555471260608331.7265907653101735.174177453848710.14217361869980.0014491518456837-1.44-0.3769633507853403DestabilisingTHR0pnca_complex.pdb
354A146PA146PAPZA14.858-1.233Destabilising-1.497Destabilising-0.3186046511627906-0.3791793313069908A146AA1463.109640.00.00.00.00.00.00.00.00.02.02.0-2.00.00.00.00.00.0-1.04.0-5.0-4.0-4.00.0-2.0-5.00.11325985766213333Destabilising-3.961Destabilising-0.675362318840579600.0Hhelix0.83333333333333347.08ALA-0.895-0.737232289950576788-0.993-0.8279:8147/150G:S:A790.831578947368421185effectpnca_p.ala146pro7.18700589334483e-0512.1451538387267188179.9262646810.919026337424242119.4680444362460.1016602715482465.01153666061373e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.3821468117582610.020.0112359550561797StabilisingPRO0pnca_complex.pdb
355R148CR148CAPZA14.673-0.2769999999999999Destabilising-0.94Destabilising-0.0715762273901808-0.238095238095238R148RA1481.8029938.022.00.00.022.00.00.00.00.00.00.00.02.00.00.00.00.0-3.00.0-7.03.06.00.06.04.00.06566882043138426Destabilising-0.806Destabilising-0.137425404944586521560.5693430656934306Hhelix-1.26666666666666663.5ARG1.3060.4185897435897436110.8421.7122:1146/150I:R:K:N:L:Q:E:H:W:D:M:S:A:G:T390.410526315789473766effect0.840.4719101123595505StabilisingCYS0pnca_complex.pdb
356N149VN149VAPZA16.469-0.064Destabilising-0.706Destabilising-0.0165374677002583-0.1788247213779128N149NA1490.44680916.00.00.00.00.00.00.00.00.00.00.02.00.00.00.00.00.0-3.00.0-3.00.00.00.00.0-2.00.016273756364775384Destabilising-0.317Destabilising-0.054049445865302644710.3641025641025641Tloop-2.80000000000000033.68ASN0.970.3108974358974359110.591.1833:1146/150Q:E:Y:H:F:C:R:K:L:N:G:M:S:A:D-28-0.301075268817204361neutralpnca_p.asn149val7.18700589334483e-0512.1451538387265188179.9262646490.919026337424236119.4680444362370.1016602715482535.01153666062283e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-0.26-0.0680628272251308DestabilisingVAL0pnca_complex.pdb
357N149SN149SAPZA16.469-0.42Destabilising-0.233Destabilising-0.1085271317829457-0.0590172239108409N149NA1490.88915618.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.03238499697695933Destabilising-0.206Destabilising-0.03512361466325661710.3641025641025641Tloop-2.80000000000000033.68ASN0.970.3108974358974359110.591.1833:1146/150Q:E:Y:H:F:C:R:K:L:N:G:M:S:A:D-76-0.817204301075268987neutral0.470.2640449438202247StabilisingSER0pnca_complex.pdb
358N149DN149DAPZA16.4690.469Stabilising-0.043Destabilising0.3988095238095238-0.0108915906788247N149NA1491.849510.0-5.00.00.0-5.00.00.00.00.00.00.02.00.00.00.00.00.00.00.00.00.00.00.00.02.00.06736318009309508Destabilising-0.656Destabilising-0.11184995737425404710.3641025641025641Tloop-2.80000000000000033.68ASN0.970.3108974358974359110.591.1833:1146/150Q:E:Y:H:F:C:R:K:L:N:G:M:S:A:D-34-0.365591397849462466neutral0.160.0898876404494382StabilisingASP0pnca_complex.pdb
359G150DG150DAPZA21.16-0.785Destabilising1.269Stabilising-0.20284237726098190.5690582959641256G150GA1503.5588800000000003-12.0-18.00.0-2.0-16.00.00.00.00.00.00.00.00.00.00.00.00.0-1.00.0-3.00.0-2.00.0-3.0-9.00.12962215633855143Destabilising-0.949Destabilising-0.1618073316283035630.6057692307692307Tloop-0.03333333333333343.34GLY-0.715-0.588962108731466388-0.872-0.6158:7146/150G:E:H:Q:L:D:R510.536842105263157975effectpnca_p.gly150asp7.18700589334483e-0512.1451538387254188179.9262644460.9190263374242119.4680444361720.1016602715482985.01153666068333e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-0.34-0.0890052356020942DestabilisingASP0pnca_complex.pdb
360L151SL151SAPZA18.507-2.523Destabilising0.079Stabilising-0.65193798449612410.0354260089686098L151LA1513.8650518.00.00.00.00.00.00.00.00.00.00.00.0-2.00.00.00.00.0-3.00.0-3.00.010.00.04.08.00.1407735341894973Destabilising-2.175Destabilising-0.3708439897698209100.0497512437810945-loop1.73333333333333325.31LEU-0.04-0.03294892915980230555-0.2440.0836:5145/150Q:F:Y:I:R:L:V:M:W570.675effectpnca_p.leu151ser0.00100618082506822.169848553080988.75695772604260.00010105609828540.5580825755913273.8880421069983.0225242648863828.5230600955488.756962025316460.9423534663879018.754840332251510.00010772448192363.967685585874922.6321145838655533.291128333324818.80861425626311.44512946670157e-05-2.07-0.5418848167539266DestabilisingSER0pnca_complex.pdb
361L151WL151WAPZA18.507-1.831Destabilising-0.7140000000000001Destabilising-0.4731266149870801-0.1808510638297872L151LA1512.01402-22.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-11.00.0-3.0-10.0-10.00.0-16.0-2.00.07335499238776506Destabilising-0.33Destabilising-0.05626598465473146100.0497512437810945-loop1.73333333333333325.31LEU-0.04-0.03294892915980230555-0.2440.0836:5145/150Q:F:Y:I:R:L:V:M:W200.2105263157894736763effectpnca_p.leu151trp7.18700589334483e-0512.1451538387255188179.9262644530.919026337424201119.4680444361740.1016602715482975.01153666068148e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-2.26-0.5916230366492147DestabilisingTRP0pnca_complex.pdb
362L151VL151VAPZA18.507-1.74Destabilising-1.269Destabilising-0.4496124031007751-0.3214285714285714L151LA1511.0930518.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-5.00.0-1.0-4.0-2.00.0-2.02.00.03981126028015938Destabilising-1.108Destabilising-0.18891730605285592100.0497512437810945-loop1.73333333333333325.31LEU-0.04-0.03294892915980230555-0.2440.0836:5145/150Q:F:Y:I:R:L:V:M:W310.326315789473684266effect-1.93-0.5052356020942408DestabilisingVAL0pnca_complex.pdb
363T153IT153IAPZA15.5440.532Stabilising-2.111Destabilising0.4523809523809524-0.5347011144883485T153TA153-0.698929-20.00.00.00.00.00.00.00.00.02.00.02.00.00.00.00.00.0-11.00.0-5.0-8.0-2.00.0-4.0-2.0-0.1343784126739983Stabilising-1.456Destabilising-0.24825234441602725120.0697674418604651Estrand-1.13333333333333355.38THR-0.188-0.1548599670510708666-0.411-0.0387:5144/150V:C:A:S:T430.4526315789473684471effect-0.46-0.1204188481675392DestabilisingILE0pnca_complex.pdb
364T153PT153PAPZA15.544-0.926Destabilising-2.212Destabilising-0.2392764857881136-0.5602836879432623T153TA1533.609380.00.00.00.00.00.00.00.00.02.00.02.00.00.00.00.00.0-6.00.0-6.0-2.06.00.08.00.00.13146147626366742Destabilising-4.405Destabilising-0.7510656436487638120.0697674418604651Estrand-1.13333333333333355.38THR-0.188-0.1548599670510708666-0.411-0.0387:5144/150V:C:A:S:T700.736842105263157985effectpnca_p.thr153pro7.18700589334483e-0512.1451538387264188179.9262646340.919026337424234119.4680444362320.1016602715482565.0115366606273e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-0.6-0.1570680628272251DestabilisingPRO0pnca_complex.pdb
365R154GR154GAPZA15.259-1.337Destabilising-2.707Destabilising-0.3454780361757106-0.6856636271529888R154RA1544.3163966.028.00.04.024.00.00.00.00.02.00.00.02.00.00.00.00.00.00.0-1.01.010.00.011.021.00.15721231943705885Destabilising-1.992Destabilising-0.33964194373401535600.218978102189781Estrand-0.33333333333333335.21ARG1.5420.49423076923076925110.8421.7122:1144/150T:W:E:F:Q:V:N:L:R:I:C:S:A:D:Y:H730.768421052631578985effectpnca_p.arg154gly0.00114992094293513.53033417717834.13537297155292.90603701922833e-060.7547720290379024.67735162586529.53076902254824217.50726629940834.13572938689221.5332091869685134.14170781589541.5011843627935802e-098.823565968098447.82937374234326309.27501152170751.15008086644098.55671558873616e-13-1.71-0.4476439790575916DestabilisingGLY0pnca_complex.pdb
366R154WR154WAPZA15.259-0.436Destabilising-1.381Destabilising-0.1126614987080103-0.3497973657548126R154RA1542.746310.028.00.04.024.00.00.00.00.02.00.00.02.00.00.00.00.0-4.00.0-3.0-1.010.00.04.06.00.10002622396724918Destabilising-0.368Destabilising-0.06274509803921569600.218978102189781Estrand-0.33333333333333335.21ARG1.5420.49423076923076925110.8421.7122:1144/150T:W:E:F:Q:V:N:L:R:I:C:S:A:D:Y:H560.589473684210526375effect-0.6-0.1570680628272251DestabilisingTRP0pnca_complex.pdb
367R154SR154SAPZA15.259-2.044Destabilising-2.614Destabilising-0.5281653746770025-0.6621073961499493R154RA1542.3715160.028.00.04.024.00.00.00.00.00.00.00.00.00.00.00.00.03.00.00.03.010.00.04.06.00.08637555634874962Destabilising-1.076Destabilising-0.183461210571185600.218978102189781Estrand-0.33333333333333335.21ARG1.5420.49423076923076925110.8421.7122:1144/150T:W:E:F:Q:V:N:L:R:I:C:S:A:D:Y:H550.578947368421052775effect-1.74-0.4554973821989529DestabilisingSER0pnca_complex.pdb
368V155LV155LAPZA12.302-1.141Destabilising-2.349Destabilising-0.2948320413436692-0.594984802431611V155VA155-0.756754-34.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-6.00.0-2.0-4.0-8.00.0-8.0-2.0-0.14549603937552874Stabilising-1.463Destabilising-0.249445865302642800.0Estrand1.16666666666666677.97VAL-0.482-0.397034596375617877-0.615-0.4117:7144/150F:Y:I:L:V-14-0.1505376344086021657neutralpnca_p.val155leu7.18700589334483e-0512.1451538387262188179.9262645860.919026337424224119.4680444362150.1016602715482685.01153666064309e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-1.05-0.274869109947644DestabilisingLEU0pnca_complex.pdb
369V155AV155AAPZA12.302-3.049Destabilising-1.886Destabilising-0.7878552971576227-0.4777102330293819V155VA1553.65272.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.02.03.00.13303928495982634Destabilising-2.972Destabilising-0.506734867860187500.0Estrand1.16666666666666677.97VAL-0.482-0.397034596375617877-0.615-0.4117:7144/150F:Y:I:L:V540.568421052631578975effectpnca_p.val155ala7.18700589334483e-0512.1451538387262188179.9262645890.919026337424226119.4680444362170.1016602715482665.0115366606409e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-2.61-0.6832460732984293DestabilisingALA0pnca_complex.pdb
370V155MV155MAPZA12.302-1.505Destabilising-2.486Destabilising-0.3888888888888888-0.6296859169199595V155VA155-0.575554-48.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-8.00.00.0-8.0-4.00.0-4.00.0-0.11065792509420903Stabilising-2.196Destabilising-0.3744245524296675500.0Estrand1.16666666666666677.97VAL-0.482-0.397034596375617877-0.615-0.4117:7144/150F:Y:I:L:V510.536842105263157975effectpnca_p.val155met0.000431220353600614.14729391912731393450.940220090.915018435774946132.5760606761670.1067107730232224.178961820515758.33122629582811.7659011066874inf2.48532104922106e-054.604617501941085.71767556863798inf23.5474886354081.21868387173808e-06-1.23-0.3219895287958115DestabilisingMET0pnca_complex.pdb
371V155GV155GAPZA12.302-3.675Destabilising-1.655Destabilising-0.9496124031007752-0.4191995947315096V155VA1555.876834.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.06.00.03.025.00.21404694090137602Destabilising-4.368Destabilising-0.744757033248081800.0Estrand1.16666666666666677.97VAL-0.482-0.397034596375617877-0.615-0.4117:7144/150F:Y:I:L:V720.757894736842105385effectpnca_p.val155gly0.00043122035360063.1901608036187324.29233342416010.00359542813005941.095659689549342.911634729329963.91551977432402465.53106322022824.29233361415331.3854692367923224.28330969228970.00074940700078953.125282254143112.715678448283451141.6008949688414.19774426910740.0001645676755807-3.48-0.9109947643979058DestabilisingGLY0pnca_complex.pdb
372L156PL156PAPZA13.994000000000002-2.813Destabilising-1.81Destabilising-0.7268733850129199-0.4584599797365755L156LA1562.7495518.00.00.00.00.00.00.00.00.02.02.00.00.00.00.00.00.04.02.00.02.00.00.0-2.0-2.00.10014459604163783Destabilising-3.96Destabilising-0.675191815856777500.0Estrand4.0666666666666666.53LEU0.1220.039102564102564155-0.1470.2256:4144/150L:V:N:R:I:K:F:H:P630.663157894736842180effectpnca_p.leu156pro0.000143740117866813.1456002256219511754.4635533130.924803768447042139.2771833266620.09438444913687030.00016283713444319.4110222970131.28804840845689inf0.02922358609515971.534266491831630.91081598550184inf4.731220703822740.0296198560706035-1.74-0.4554973821989529DestabilisingPRO0pnca_complex.pdb
373L156QL156QAPZA13.994000000000002-2.863Destabilising-0.36Destabilising-0.7397932816537467-0.0911854103343465L156LA1562.4113900000000004-14.00.00.00.00.00.00.00.00.0-2.00.00.0-2.00.00.00.00.03.00.0-2.05.00.00.00.00.00.08782807275694025Destabilising-4.191Destabilising-0.714578005115089500.0Estrand4.0666666666666666.53LEU0.1220.039102564102564155-0.1470.2256:4144/150L:V:N:R:I:K:F:H:P410.4315789473684210671effectpnca_p.leu156gln7.18700589334483e-0512.1451538387267188179.926264690.919026337424244119.468044436250.1016602715482435.01153666061033e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-2.69-0.7041884816753927DestabilisingGLN0pnca_complex.pdb
374V157GV157GAPZA13.632-1.896Destabilising-0.926Destabilising-0.489922480620155-0.2345491388044579V157VA1571.97999-2.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.03.00.03.00.02.00.03.017.00.07211554571347402Destabilising-1.919Destabilising-0.32719522591645356450.2586206896551724Estrand1.54.12VAL0.5790.18557692307692306330.2250.8424:2144/150Q:F:E:I:R:L:V:T:W:K:P:S:M:G:A:D-7-0.0752688172043010853neutralpnca_p.val157gly7.18700589334483e-0512.1451538387252188179.9262644010.919026337424192119.4680444361580.1016602715483095.01153666069661e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-2.35-0.6151832460732984DestabilisingGLY0pnca_complex.pdb
375V157LV157LAPZA13.632-0.484Destabilising-0.972Destabilising-0.1250645994832041-0.2462006079027355V157VA157-2.04339-18.00.00.00.00.00.00.00.00.02.00.0-2.02.00.00.00.00.0-3.00.01.0-4.0-4.00.0-2.0-2.0-0.392868953318465Stabilising1.184Stabilising1.0450.2586206896551724Estrand1.54.12VAL0.5790.18557692307692306330.2250.8424:2144/150Q:F:E:I:R:L:V:T:W:K:P:S:M:G:A:D-43-0.4623655913978494472neutral-0.57-0.1492146596858638DestabilisingLEU0pnca_complex.pdb
376V157AV157AAPZA13.632-1.625Destabilising-0.931Destabilising-0.4198966408268734-0.2358156028368794V157VA1570.8589590.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.03.00.03.00.02.00.00.05.00.03128515650609343Destabilising-1.03Destabilising-0.17561807331628304450.2586206896551724Estrand1.54.12VAL0.5790.18557692307692306330.2250.8424:2144/150Q:F:E:I:R:L:V:T:W:K:P:S:M:G:A:D-36-0.387096774193548466neutralpnca_p.val157ala7.18700589334483e-0512.1451538387253188179.9262644270.919026337424197119.4680444361660.1016602715483035.01153666068889e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-1.74-0.4554973821989529DestabilisingALA0pnca_complex.pdb
377L159PL159PAPZA11.435-1.412Destabilising-1.7519999999999998Destabilising-0.3648578811369509-0.4437689969604863L159LA1596.0841224.04.00.00.04.00.00.00.00.02.02.02.00.00.00.00.00.02.04.0-4.00.0-4.00.0-2.0-2.00.22159689391676807Destabilising-4.496Destabilising-0.766581415174765660.0298507462686567Estrand-0.13333333333333345.42LEU-0.599-0.4934102141680395477-0.728-0.4858:7141/150G:A:M:H:F:Y:L:V920.96842105263157995effect-0.94-0.2460732984293193DestabilisingPRO0pnca_complex.pdb
378L159RL159RAPZA11.435-0.753Destabilising-1.154Destabilising-0.1945736434108527-0.2922998986828774L159LA1590.0571381999999999-56.0-26.00.0-2.0-24.00.00.00.00.0-4.00.0-2.0-2.00.00.00.00.0-3.00.00.0-5.0-4.00.0-4.00.00.0020810976187180816Destabilising-4.133Destabilising-0.704688832054560960.0298507462686567Estrand-0.13333333333333345.42LEU-0.599-0.4934102141680395477-0.728-0.4858:7141/150G:A:M:H:F:Y:L:V890.936842105263157991effectpnca_p.leu159arg0.000503090412534114.14771541545131394038.398466060.908235680147999122.7415820194010.11526424201714322.957814350175368.08178752107921.83303094984313inf4.24048522418865e-065.372584445734967.00237574052121inf28.358283615631.00814491180914e-07-0.41-0.1073298429319371DestabilisingARG0pnca_complex.pdb
379L159VL159VAPZA11.435-1.126Destabilising-1.82Destabilising-0.2909560723514211-0.4609929078014184L159LA1592.8408322.04.00.00.04.00.00.00.00.00.00.00.00.00.00.00.00.0-8.00.0-2.0-6.010.00.0-2.08.00.10346921233400592Destabilising-2.332Destabilising-0.3976129582267689560.0298507462686567Estrand-0.13333333333333345.42LEU-0.599-0.4934102141680395477-0.728-0.4858:7141/150G:A:M:H:F:Y:L:V600.63157894736842180effectpnca_p.leu159val0.00014374011786681.579039389124024.850294327177350.2642475663767231.414392862765841.116407916564430.191756076673846122.6837603991794.850294365012620.6857680967922064.849564479041120.3127341543101870.5048246860149950.061763864579114379.5583372042030.08811926218633320.766581879696361-1.09-0.2853403141361257DestabilisingVAL0pnca_complex.pdb
380T160PT160PAPZA9.847-0.79Destabilising-2.375Destabilising-0.2041343669250646-0.6015704154002026T160TA1603.371946.00.00.00.00.00.00.00.00.02.00.02.00.00.00.00.00.0-4.02.0-6.00.00.00.00.0-4.00.12281339461971605Destabilising-3.753Destabilising-0.6398976982097186220.127906976744186Estrand1.6333333333333334.98THR-0.228-0.1878088962108731666-0.411-0.1477:6141/150V:C:I:M:S:T910.957894736842105295effectpnca_p.thr160pro0.000215610176800313.1460210124992511969.8484283590.907969111549571113.7193447318830.1156005694852860.18392693627863429.12878787878791.4643224129316inf0.00499313284561492.30162687909812.00455510251839inf9.28726407271570.0023075254069185-0.23-0.0602094240837696DestabilisingPRO0pnca_complex.pdb
381T160RT160RAPZA9.847-0.456Destabilising-2.007Destabilising-0.117829457364341-0.5083586626139817T160TA1602.8141-80.0-36.00.0-2.0-34.00.00.00.00.00.00.0-2.00.00.00.00.00.0-5.00.0-2.0-3.0-8.00.0-2.0-4.00.10249564754988016Destabilising-2.869Destabilising-0.48917306052855924220.127906976744186Estrand1.6333333333333334.98THR-0.228-0.1878088962108731666-0.411-0.1477:6141/150V:C:I:M:S:T830.873684210526315891effectpnca_p.thr160arg0.000143740117866813.14560022562511754.4635523510.924803768446983139.2771833265320.09438444913694540.00016283713444619.4110222970131.28804840845689inf0.02922358609515971.534266491831630.91081598550184inf4.731220703822740.0296198560706035-0.29-0.0759162303664921DestabilisingARG0pnca_complex.pdb
382T160AT160AAPZA9.847-0.8420000000000001Destabilising-2.509Destabilising-0.2175710594315245-0.6355116514690983T160TA1602.10458.00.00.00.00.00.00.00.00.02.00.02.00.00.00.00.00.00.00.00.00.02.00.04.03.00.07665047093874518Destabilising-1.519Destabilising-0.2589940323955669220.127906976744186Estrand1.6333333333333334.98THR-0.228-0.1878088962108731666-0.411-0.1477:6141/150V:C:I:M:S:T570.675effectpnca_p.thr160ala0.000574960471467514.14813708950811394626.352246640.901927875940744114.8142370345190.12322633024382282.958602139558977.84057359763811.89120602753485inf7.2326389241213e-076.14070321569598.29603358299821inf33.18027492710128.399830460993881e-09-0.73-0.1910994764397905DestabilisingALA0pnca_complex.pdb
383A161VA161VAPZA7.0330.043Stabilising-0.846Destabilising0.0365646258503401-0.2142857142857142A161AA161-2.66025-2.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-5.00.0-1.0-4.0-2.00.0-4.0-3.0-0.5114685072675537Stabilising0.125Stabilising0.10557432432432433110.0852713178294573Estrand0.23333333333333334.53ALA-0.773-0.636738056013179688-0.872-0.7288:8141/150E:Q:V:I:R:K:S:A210.2210526315789473663effect-0.2-0.0523560209424083DestabilisingVAL0pnca_complex.pdb
384A161GA161GAPZA7.033-0.745Destabilising-0.925Destabilising-0.1925064599483204-0.2342958459979736A161AA1612.3505310.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.02.00.011.010.00.08561141908084995Destabilising-1.432Destabilising-0.24416027280477406110.0852713178294573Estrand0.23333333333333334.53ALA-0.773-0.636738056013179688-0.872-0.7288:8141/150E:Q:V:I:R:K:S:A500.526315789473684275effect-1.02-0.2670157068062827DestabilisingGLY0pnca_complex.pdb
385G162SG162SAPZA8.315-0.866Destabilising0.821Stabilising-0.22377260981912140.3681614349775785G162GA1620.905309-6.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-6.00.0-2.0-4.00.00.0-3.0-13.00.03297332439775931Destabilising-1.14Destabilising-0.19437340153452684260.25-loop1.86666666666666653.93GLY-0.02-0.01647446457990115355-0.2440.0836:5141/150F:S:G:A:P210.2210526315789473663effect-0.55-0.143979057591623DestabilisingSER0pnca_complex.pdb
386G162VG162VAPZA8.315-0.386Destabilising-0.162Destabilising-0.0997416020671834-0.0410334346504559G162GA1622.07181-6.0-2.00.00.0-2.00.00.00.00.06.00.02.02.00.00.00.00.0-10.00.0-2.0-8.04.00.03.0-19.00.07545982998127901Destabilising-1.467Destabilising-0.2501278772378517260.25-loop1.86666666666666653.93GLY-0.02-0.01647446457990115355-0.2440.0836:5141/150F:S:G:A:P660.694736842105263280effect-1.39-0.3638743455497382DestabilisingVAL0pnca_complex.pdb
387G162AG162AAPZA8.315-0.551Destabilising-0.1639999999999999Destabilising-0.1423772609819121-0.0415400202634245G162GA1620.560964-6.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-4.00.0-2.0-2.00.00.0-1.0-12.00.02043152994995593Destabilising-1.074Destabilising-0.18312020460358056260.25-loop1.86666666666666653.93GLY-0.02-0.01647446457990115355-0.2440.0836:5141/150F:S:G:A:P100.1052631578947368459effect-0.09-0.0235602094240837DestabilisingALA0pnca_complex.pdb
388G162RG162RAPZA8.315-0.44Destabilising-0.04Destabilising-0.1136950904392764-0.0101317122593718G162GA1623.4246300000000005-68.0-22.00.00.0-22.00.00.00.00.00.00.00.00.00.00.00.00.0-7.00.0-3.0-5.0-2.00.0-5.0-17.00.12473247911188166Destabilising-0.961Destabilising-0.16385336743393009260.25-loop1.86666666666666653.93GLY-0.02-0.01647446457990115355-0.2440.0836:5141/150F:S:G:A:P870.915789473684210591effect-0.15-0.0392670157068062DestabilisingARG0pnca_complex.pdb
389G162DG162DAPZA8.315-1.037Destabilising2.23Stabilising-0.26795865633074931.0G162GA1623.4317800000000003-20.0-24.00.00.0-24.00.00.00.00.00.00.00.00.00.00.00.00.0-6.00.00.0-4.0-4.00.0-5.0-19.00.12499289767553669Destabilising-1.558Destabilising-0.2656436487638534260.25-loop1.86666666666666653.93GLY-0.02-0.01647446457990115355-0.2440.0836:5141/150F:S:G:A:P790.831578947368421185effectpnca_p.gly162asp0.000287480235733714.1464514590951392277.50785030.930573112990214162.3718495990530.08712379328083640.011399544335592938.85473684210531.58944397188817inf0.00085282752075193.069138793404423.20302487654751inf13.99098223529590.0001836895199759-0.94-0.2460732984293193DestabilisingASP0pnca_complex.pdb
390V163AV163AAPZA6.662999999999999-0.478Destabilising0.052Stabilising-0.12351421188630490.0233183856502242V163VA1630.4714062.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.02.00.06.01.00.01716963264592545Destabilising-0.834Destabilising-0.14219948849104858870.5Sloop1.04.02VAL-1.017-0.837726523887973599-1.094-0.9939:9141/150V:L:I:M650.684210526315789580effectpnca_p.val163ala0.0002156101768003-9.987607973918224.5966027178937e-050.930014323968985113.719344729607-0.087826816076596127.948735098960.807902480033628-0.09264105870473970.01.00.00.011.73697547380050.0003936455651480.984170607395186-0.36-0.094240837696335DestabilisingALA0pnca_complex.pdb
391V163GV163GAPZA6.662999999999999-0.815Destabilising0.031Stabilising-0.2105943152454780.0139013452914798V163VA1631.149862.00.00.00.00.00.00.00.00.02.00.00.00.00.00.00.00.00.0-1.0-1.02.06.00.011.013.00.04188040414047305Destabilising-1.019Destabilising-0.17374254049445864870.5Sloop1.04.02VAL-1.017-0.837726523887973599-1.094-0.9939:9141/150V:L:I:M750.789473684210526385effectpnca_p.val163gly0.0001437401178668-9.987521262450614.59700131334254e-050.942832958100734139.277183325398-0.0717096729269461144471.7063148571.21195880622110.08348785866285790.01.00.00.025.83865859621631.0105682238915901e-250.999999999999746-0.88-0.2303664921465968DestabilisingGLY0pnca_complex.pdb
392V163LV163LAPZA6.662999999999999-0.098Destabilising0.072Stabilising-0.02532299741602060.032286995515695V163VA163-0.813595-20.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-4.00.00.0-4.0-6.00.00.0-4.0-0.15642447896639236Stabilising-0.458Destabilising-0.07809036658141517870.5Sloop1.04.02VAL-1.017-0.837726523887973599-1.094-0.9939:9141/150V:L:I:M670.705263157894736880effectpnca_p.val163leu7.18700589334483e-05-8.987408781496420.00012497350770340.940032862253634119.468044435493-0.07522855859877414692673.51081242.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.999999999999997-0.37-0.0968586387434555DestabilisingLEU0pnca_complex.pdb
393S164PS164PAPZA10.588-0.304Destabilising-0.348Destabilising-0.0785529715762273-0.0881458966565349S164SA1644.824190.00.00.00.00.00.00.00.00.04.00.04.00.00.00.00.00.0-4.02.0-2.0-6.0-2.00.00.0-2.00.1757075007830768Destabilising-1.323Destabilising-0.22557544757033246460.2967741935483871-loop1.73333333333333343.92SER-0.033-0.02718286655683690655-0.2440.0836:5140/150N:V:Q:H:F:E:D:T:G:A:S-23-0.2473118279569892561neutralpnca_p.ser164pro0.000431220353600614.14729391912921393450.94022270.915018435775013132.5760606762880.1067107730231384.1789618204749958.33122629582811.7659011066874inf2.48532104922106e-054.604617501941085.71767556863798inf23.5474886354081.21868387173808e-06-0.03-0.0078534031413612DestabilisingPRO0pnca_complex.pdb
394T167IT167IAPZA10.6630.627Stabilising-0.489Destabilising0.5331632653061225-0.1238601823708206T167TA1670.429573-6.00.00.00.00.00.00.00.00.02.00.00.02.00.00.00.00.0-3.00.01.0-2.00.00.00.0-2.00.015645983726571434Destabilising-0.058Destabilising-0.009889173060528559570.3313953488372093Hhelix-1.63333333333333354.06THR0.3030.097115384615384644-0.0380.3895:4129/150L:N:R:E:Q:D:G:A:S:T:P190.259effectpnca_p.thr167ile0.00014374011786681.579039389124024.850294327177360.2642475663767221.414392862765841.116407916564430.191756076673841122.6837603992374.850294365012620.6857680967922064.849564479041120.3127341543101870.5048246860149950.061763864579114379.5583372042030.08811926218633320.766581879696361-0.04-0.0104712041884816DestabilisingILE0pnca_complex.pdb
395T168NT168NAPZA10.468-0.505Destabilising-0.341Destabilising-0.1304909560723514-0.0863728470111449T168TA1680.148032-10.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-1.00.01.0-2.0-2.00.00.02.00.005391647666431136Destabilising-1.149Destabilising-0.1959079283887468240.1395348837209302Hhelix0.93333333333333324.77THR0.7030.2253205128205128220.3890.8424:2124/150L:N:V:C:R:Y:H:F:W:G:S:A:T:P30.03157894736842105453effect-0.45-0.1178010471204188DestabilisingASN0pnca_complex.pdb
396T168IT168IAPZA10.4680.963Stabilising-1.2009999999999998Destabilising0.8188775510204082-0.3042046605876393T168TA168-0.7812-12.00.00.00.00.00.00.00.00.02.00.00.02.00.00.00.00.0-3.00.0-3.0-2.00.00.00.00.0-0.1501961085903253Stabilising-0.018Destabilising-0.0030690537084398974240.1395348837209302Hhelix0.93333333333333324.77THR0.7030.2253205128205128220.3890.8424:2124/150L:N:V:C:R:Y:H:F:W:G:S:A:T:P110.1157894736842105359effectpnca_p.thr168ile0.0002874802357337-10.98770417549131.69083297052993e-050.946048325624975162.371849597271-0.06767000685613892065.089971774580.605874316939891-0.2176174568906470.01.00.00.07.346605408059750.05967513478283630.8070101418062730.690.3876404494382022StabilisingILE0pnca_complex.pdb
397T168ST168SAPZA10.468-0.382Destabilising-0.83Destabilising-0.0987080103359173-0.2102330293819655T168TA1680.47423999999999990.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.02.00.02.00.02.00.02.04.00.017272853094792352Destabilising-0.28Destabilising-0.047740835464620636240.1395348837209302Hhelix0.93333333333333324.77THR0.7030.2253205128205128220.3890.8424:2124/150L:N:V:C:R:Y:H:F:W:G:S:A:T:P-71-0.763440860215053887neutralpnca_p.thr168ser0.00028748023573370.4802571302871451.616489997296730.6772477868343321.15384934899060.4162216936788820.079938964616287912.63181652844391.616484440706480.2085715287138351.616413627742860.5276936681014430.2776181169752380.030778889119769420.14015940055.751485287704321e-250.9999999999993950.090.0505617977528089StabilisingSER0pnca_complex.pdb
398T168PT168PAPZA10.4680.151Stabilising-1.31Destabilising0.1284013605442177-0.3318135764944275T168TA1683.223650.0-2.00.00.0-2.00.00.00.00.04.02.00.02.00.00.00.00.00.04.00.0-4.02.00.02.0-2.00.1174123500316873Destabilising-1.21Destabilising-0.206308610400682240.1395348837209302Hhelix0.93333333333333324.77THR0.7030.2253205128205128220.3890.8424:2124/150L:N:V:C:R:Y:H:F:W:G:S:A:T:P490.515789473684210671effect0.610.3426966292134831StabilisingPRO0pnca_complex.pdb
399A171TA171TAPZA10.476-1.816Destabilising0.043Stabilising-0.46925064599483190.0192825112107623A171AA1710.486585-2.00.00.00.00.00.00.00.00.00.00.0-2.00.00.00.00.00.0-3.00.0-1.0-2.00.00.00.0-5.00.017722484866585567Destabilising-1.914Destabilising-0.3263427109974424450.0387596899224806Hhelix2.46666666666666635.33ALA-0.872-0.718286655683690388-0.993-0.8279:8122/150R:C:V:T:E:A250.263157894736842163effectpnca_p.ala171thr0.0003593502946672-10.98779090199961.69068633684891e-050.93969121942854145.229797681913-0.07565796466965760.33890826761850.484657419083649-0.3145651347425670.00.5961118750587110.2246722265665940.05.292243504333850.1777772638998140.673290424524484-1.47-0.3848167539267015DestabilisingTHR0pnca_complex.pdb
400A171VA171VAPZA10.476-0.659Destabilising-1.298Destabilising-0.1702842377260982-0.328774062816616A171AA1710.499158-2.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-7.00.0-5.0-6.02.00.02.0-1.00.018180420894674348Destabilising-1.528Destabilising-0.2605285592497868550.0387596899224806Hhelix2.46666666666666635.33ALA-0.872-0.718286655683690388-0.993-0.8279:8122/150R:C:V:T:E:A380.466effectpnca_p.ala171val0.00014374011786681.579039389124024.850294327177360.2642475663767221.414392862765841.116407916564430.191756076673654122.6837603990964.850294365012620.6857680967922064.849564479041120.3127341543101870.5048246860149950.061763864579114379.5583372042030.08811926218633320.766581879696361-0.62-0.1623036649214659DestabilisingVAL0pnca_complex.pdb
401A171EA171EAPZA10.476-2.6710000000000003Destabilising1.116Stabilising-0.69018087855297160.5004484304932735A171AA1713.52921-36.0-26.00.00.0-26.00.00.00.00.00.00.00.00.00.00.00.00.0-1.00.0-3.0-3.00.00.00.0-5.00.12854151035482483Destabilising-3.951Destabilising-0.673657289002557550.0387596899224806Hhelix2.46666666666666635.33ALA-0.872-0.718286655683690388-0.993-0.8279:8122/150R:C:V:T:E:A750.789473684210526385effectpnca_p.ala171glu0.0001437401178668-9.987521262450584.59700131334266e-050.942832958100734139.277183325398-0.0717096729269461144471.7063148491.21195880622110.08348785866285790.01.00.00.025.83865859621631.0105682238915901e-250.999999999999746-0.69-0.1806282722513089DestabilisingGLU0pnca_complex.pdb
402A171PA171PAPZA10.476-1.241Destabilising-1.239Destabilising-0.3206718346253229-0.3138297872340426A171AA1714.26761-2.00.00.00.00.00.00.00.00.04.02.00.00.00.00.00.00.0-3.04.0-5.0-4.04.00.02.01.00.155435645655927Destabilising-3.012Destabilising-0.513554987212276250.0387596899224806Hhelix2.46666666666666635.33ALA-0.872-0.718286655683690388-0.993-0.8279:8122/150R:C:V:T:E:A800.842105263157894791effect-0.05-0.013089005235602DestabilisingPRO0pnca_complex.pdb
403L172PL172PAPZA13.187-1.821Destabilising-1.3530000000000002Destabilising-0.4705426356589147-0.3427051671732523L172LA1724.711714.00.00.00.00.00.00.00.00.02.02.00.00.00.00.00.00.03.04.01.0-1.02.00.0-2.04.00.17161037012216Destabilising-2.793Destabilising-0.4762148337595908510.2537313432835821Hhelix0.69999999999999984.4LEU1.1920.382051282051282110.591.1833:1122/150H:F:E:L:V:K:R:C:I:T:A:M:D:W790.831578947368421185effectpnca_p.leu172pro0.00071870058933443.7796338004036243.79999925632940.0003368840921161.05424694876513.585150333924068.22614212186537807.95098371754943.81.641474110504143.7918825101851.04401171857701e-065.981294626539926.061191691542481899.9461813683832.55148267156011.16076545932747e-08-1.44-0.3769633507853403DestabilisingPRO0pnca_complex.pdb
404L172RL172RAPZA13.187-0.848Destabilising-0.7040000000000001Destabilising-0.2191214470284237-0.1783181357649443L172LA172-0.385063-32.0-36.00.0-2.0-34.00.00.00.00.0-2.00.00.0-4.00.00.00.00.0-8.00.0-1.0-6.0-8.00.0-8.00.0-0.07403349227101438Stabilising-1.797Destabilising-0.3063938618925831510.2537313432835821Hhelix0.69999999999999984.4LEU1.1920.382051282051282110.591.1833:1122/150H:F:E:L:V:K:R:C:I:T:A:M:D:W330.347368421052631666effectpnca_p.leu172arg0.000143740117866813.1456002256205511754.4635525650.924803768446996139.2771833265610.09438444913692830.000162837134445319.4110222970131.28804840845689inf0.02922358609515971.534266491831630.91081598550184inf4.731220703822740.0296198560706035-0.43-0.112565445026178DestabilisingARG0pnca_complex.pdb
405E173GE173GAPZA15.936-1.172Destabilising-0.78Destabilising-0.3028423772609819-0.1975683890577507E173EA1730.7696676.018.00.00.018.00.00.00.00.00.00.00.00.00.00.00.00.03.00.03.01.00.00.03.013.00.028032947501074455Destabilising-0.869Destabilising-0.148167092924126161140.5112107623318386Hhelix-1.06666666666666693.82GLU1.5160.4858974358974359110.8421.7122:1122/150Q:E:F:H:K:R:L:V:S:M:G:A:T:D-5-0.05376344086021505553neutral-1.04-0.2722513089005235DestabilisingGLY0pnca_complex.pdb
406E174DE174DAPZA14.835-0.698Destabilising-0.016Destabilising-0.1803617571059431-0.0040526849037487E174EA1740.55764914.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.02.00.02.00.00.00.00.00.00.0203107904340795Destabilising-0.445Destabilising-0.075873827791986361040.4663677130044843Hhelix-1.73.93GLU-0.292-0.2405271828665568366-0.485-0.1477:6122/150D:T:A:G:S:K:R:Q:E-14-0.1505376344086021657neutralpnca_p.glu174asp7.18700589334483e-0512.1451538387268188179.9262646910.919026337424243119.4680444362490.1016602715482445.01153666061119e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-0.43-0.112565445026178DestabilisingASP0pnca_complex.pdb
407E174GE174GAPZA14.835-0.868Destabilising-1.181Destabilising-0.2242894056847545-0.2991388044579534E174EA1740.834042000000000122.022.00.00.022.00.00.00.00.00.00.00.00.00.00.00.00.02.00.02.00.00.00.03.015.00.030377625128388177Destabilising-0.968Destabilising-0.16504688832054561040.4663677130044843Hhelix-1.73.93GLU-0.292-0.2405271828665568366-0.485-0.1477:6122/150D:T:A:G:S:K:R:Q:E540.568421052631578975effectpnca_p.glu174gly0.0001437401178668-9.987521262450534.59700131334288e-050.942832958100734139.277183325396-0.0717096729269466144471.7063148381.21195880622110.08348785866285790.01.00.00.025.83865859621631.0105682238915901e-250.999999999999746-0.01-0.0026178010471204DestabilisingGLY0pnca_complex.pdb
408E174KE174KAPZA14.8350.204Stabilising-0.8190000000000001Destabilising0.173469387755102-0.2074468085106383E174EA174-0.813418-6.04.00.00.04.00.00.00.00.00.00.02.0-2.00.00.00.00.00.00.00.0-1.00.00.00.00.0-0.1563904483580712Stabilising-0.452Destabilising-0.077067348678601881040.4663677130044843Hhelix-1.73.93GLU-0.292-0.2405271828665568366-0.485-0.1477:6122/150D:T:A:G:S:K:R:Q:E260.273684210526315863effect-0.16-0.0418848167539267DestabilisingLYS0pnca_complex.pdb
409M175KM175KAPZA11.015999999999998-1.311Destabilising-0.207Destabilising-0.3387596899224806-0.0524316109422492M175MA1752.59826-16.0-36.00.00.0-36.00.00.00.00.0-2.00.0-2.00.00.00.00.00.0-5.00.0-4.0-1.0-2.00.02.0-2.00.09463428492340416Destabilising-4.252Destabilising-0.724978687127024600.0Hhelix-2.0333333333333336.81MET-0.521-0.429159802306425177-0.674-0.4117:7120/150F:M:I:W:C:L:V780.821052631578947485effectpnca_p.met175lys7.18700589334483e-0512.1451538387265188179.9262646370.919026337424235119.4680444362340.1016602715482555.01153666062558e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-0.95-0.2486910994764398DestabilisingLYS0pnca_complex.pdb
410M175RM175RAPZA11.015999999999998-1.175Destabilising-0.698Destabilising-0.3036175710594315-0.1767983789260385M175MA1752.37207-36.0-40.00.0-2.0-38.00.00.00.00.0-2.00.0-2.00.00.00.00.00.0-9.00.0-4.0-5.0-4.00.0-6.00.00.0863959527677212Destabilising-3.407Destabilising-0.580903665814151800.0Hhelix-2.0333333333333336.81MET-0.521-0.429159802306425177-0.674-0.4117:7120/150F:M:I:W:C:L:V740.778947368421052685effectpnca_p.met175arg7.18700589334483e-0512.1451538387266188179.926264660.919026337424239119.468044436240.101660271548255.01153666061918e-069.701429772918420.986835744238421inf0.1709788702026740.7670575569843650.124324963210678inf0.7637843399283860.382146811758261-0.8-0.2094240837696335DestabilisingARG0pnca_complex.pdb
411M175TM175TAPZA11.015999999999998-2.131Destabilising0.1159999999999999Stabilising-0.55064599483204120.0520179372197309M175MA1752.8361224.00.00.00.00.00.00.00.00.0-2.00.0-2.00.00.00.00.00.0-4.00.0-4.00.010.00.010.08.00.10329766388158422Destabilising-3.057Destabilising-0.52122762148337600.0Hhelix-2.0333333333333336.81MET-0.521-0.429159802306425177-0.674-0.4117:7120/150F:M:I:W:C:L:V720.757894736842105385effectpnca_p.met175thr0.000215610176800313.1460210124993511969.8484283830.907969111549572113.7193447318840.1156005694852850.18392693627860229.12878787878791.4643224129316inf0.00499313284561492.30162687909812.00455510251839inf9.28726407271570.0023075254069185-1.73-0.4528795811518324DestabilisingTHR0pnca_complex.pdb
412M175IM175IAPZA11.015999999999998-0.6759999999999999Destabilising-1.143Destabilising-0.1746770025839793-0.2895136778115502M175MA1751.677970000000000214.02.00.00.02.00.00.00.00.00.00.00.00.00.00.00.00.0-5.00.0-1.0-4.06.00.04.04.00.06111531989597827Destabilising-1.272Destabilising-0.2168797953964194400.0Hhelix-2.0333333333333336.81MET-0.521-0.429159802306425177-0.674-0.4117:7120/150F:M:I:W:C:L:V190.259effectpnca_p.met175ile0.00028748023573370.4802571302871431.616489997296730.6772477868343331.15384934899060.4162216936788810.079938964616278712.63181652844261.616484440706480.2085715287138351.616413627742860.5276936681014430.2776181169752380.030778889119769420.14015940055.751485287704321e-250.999999999999395-0.65-0.1701570680628272DestabilisingILE0pnca_complex.pdb
413M175VM175VAPZA11.015999999999998-1.251Destabilising-1.081Destabilising-0.3232558139534883-0.2738095238095238M175MA1752.746000000000000424.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-2.00.0-4.00.08.00.08.08.00.1000152973142287Destabilising-2.087Destabilising-0.3558397271952259400.0Hhelix-2.0333333333333336.81MET-0.521-0.429159802306425177-0.674-0.4117:7120/150F:M:I:W:C:L:V520.547368421052631675effectpnca_p.met175val0.00071870058933442.4286877333533811.34398597387420.00043143272589420.6899543620357463.520070119112533.1512921199993852.667254151518811.34401349072511.0547667343185411.34080609619820.0003137935511173.503355985997782.5867470161719967.908692755022616.19994494156985.69957727561539e-05-1.13-0.2958115183246073DestabilisingVAL0pnca_complex.pdb
414R176CR176CAPZA17.132-0.417Destabilising-0.8809999999999999Destabilising-0.1077519379844961-0.2231509625126646R176RA1761.5367632.022.00.00.022.00.00.00.00.00.00.02.00.00.00.00.00.00.00.0-3.03.02.00.02.04.00.05597214431923309Destabilising-0.701Destabilising-0.119522591645353781880.6861313868613139Hhelix-1.13.67ARG1.1850.3798076923076923110.591.1833:1116/150S:M:A:G:T:D:E:Q:N:L:V:K:I:R550.578947368421052775effect0.750.4213483146067415StabilisingCYS0pnca_complex.pdb
415T177PT177PAPZA19.207-0.045Destabilising-0.36Destabilising-0.0116279069767441-0.0911854103343465T177TA1770.7909670.013.00.0-2.015.00.00.00.00.02.02.02.00.00.00.00.00.04.04.0-1.00.0-2.00.0-4.0-2.00.02880873986552932Destabilising-0.444Destabilising-0.075703324808184151260.7325581395348837Hhelix-1.13333333333333353.45THR1.870.5993589743589743111.1831.7121:1114/150N:L:R:K:H:E:Q:D:T:S:M:G:A210.2210526315789473663effectpnca_p.thr177pro0.00028748023573371.579373295212094.851914140399820.1143422970043041.00025364540071.578972796024540.58188909131267640.4562911075324.851914177534710.6859131102999064.851184435511780.1379549363682950.8602627547777290.35147133141776367.04210604197061.174970908556980.278382201819561-0.19-0.0497382198952879DestabilisingPRO0pnca_complex.pdb
416A178PA178PAPZA17.128-0.485Destabilising-0.05Destabilising-0.1253229974160206-0.0126646403242147A178AA1782.019490.0-2.00.00.0-2.00.00.00.00.02.02.02.00.00.00.00.00.0-6.02.0-8.0-2.00.00.0-2.0-5.00.07355422169450535Destabilising-1.803Destabilising-0.3074168797953964320.2480620155038759Tloop0.13.71ALA-0.496-0.408566721581548677-0.674-0.4117:7110/150G:M:A:S:C:K:V:Q:H:E600.63157894736842180effect-0.09-0.0235602094240837DestabilisingPRO0pnca_complex.pdb
417S179IS179IAPZA19.4490.381Stabilising-0.451Destabilising0.3239795918367347-0.1142350557244174S179SA1791.25588-8.00.00.00.00.00.00.00.00.02.00.02.00.00.00.00.00.00.00.00.00.00.00.00.02.00.045741883317914615Destabilising0.395Stabilising0.3336148648648649870.5612903225806452Tloop1.73333333333333343.5SER-0.876-0.721581548599670588-1.028-0.7799:8107/150W:R:D:Q:S:G350.368421052631578966effectpnca_p.ser179ile7.18700589334483e-05-8.987408781496410.00012497350770340.940032862253634119.468044435492-0.07522855859877464692673.5108142.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.999999999999997-0.66-0.1727748691099476DestabilisingILE0pnca_complex.pdb
418V180AV180AAPZA15.436-2.048Destabilising-1.661Destabilising-0.5291989664082687-0.4207193515704154V180VA1802.80492.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-2.00.0-4.00.02.00.02.05.00.10216056352391845Destabilising-2.408Destabilising-0.410571184995737460.0344827586206896-loop-0.03333333333333325.26VAL-0.509-0.4192751235584843477-0.674-0.4117:7102/150I:L:V:S:A:G-8-0.0860215053763440953neutralpnca_p.val180ala0.000143740117866813.14560022562511754.4635523120.92480376844698139.2771833265250.0943844491369490.000162837134446119.4110222970131.28804840845689inf0.02922358609515971.534266491831630.91081598550184inf4.731220703822740.0296198560706035-1.98-0.518324607329843DestabilisingALA0pnca_complex.pdb
419V180GV180GAPZA15.436-2.785Destabilising-1.577Destabilising-0.7196382428940569-0.3994427558257345V180VA1804.9317912.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-4.00.0-6.00.06.00.013.023.00.17962652699975962Destabilising-3.447Destabilising-0.587723785166240460.0344827586206896-loop-0.03333333333333325.26VAL-0.509-0.4192751235584843477-0.674-0.4117:7102/150I:L:V:S:A:G610.642105263157894780effectpnca_p.val180gly0.000790570648267915.14940666798093795803.483391750.92523341791644161.4325428794380.093843573283082324.1993753459118107.1663851351352.03005858162844inf3.5812015819156903e-098.4459712323392112.2081619622864inf47.68479638349565.0055851012886495e-12-2.32-0.6073298429319371DestabilisingGLY0pnca_complex.pdb
420V180FV180FAPZA15.436-1.808Destabilising-1.073Destabilising-0.4671834625322997-0.2717831813576494V180VA18010.5926-22.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-10.00.0-6.0-8.0-12.00.0-12.0-4.00.3858055492828473Destabilising-3.033Destabilising-0.517135549872122760.0344827586206896-loop-0.03333333333333325.26VAL-0.509-0.4192751235584843477-0.674-0.4117:7102/150I:L:V:S:A:G570.675effectpnca_p.val180phe0.00057496047146752.679666350190414.58022779401170.00102453523771030.8160506321224153.283701089993673.3569796112220899.553869259232514.58027812895071.1637658085304114.58017590340610.00050753514476143.294533879232452.60435121163486147.67632700613615.06634481641440.0001037975122989-1.23-0.3219895287958115DestabilisingPHE0pnca_complex.pdb
421V180LV180LAPZA15.436-0.877Destabilising-1.664Destabilising-0.2266149870801033-0.4214792299898683V180VA180-0.0108685-16.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-9.00.0-2.0-9.0-10.00.0-10.0-2.0-0.0020896139352457126Stabilising-2.269Destabilising-0.3868712702472293460.0344827586206896-loop-0.03333333333333325.26VAL-0.509-0.4192751235584843477-0.674-0.4117:7102/150I:L:V:S:A:G560.589473684210526375effect-0.8-0.2094240837696335DestabilisingLEU0pnca_complex.pdb
422L182WL182WAPZA15.184-1.318Destabilising-0.228Destabilising-0.3405684754521964-0.0577507598784194L182LA1824.86413-20.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-1.00.0-1.00.04.00.04.02.00.17716220252187154Destabilising-1.198Destabilising-0.2042625745950554500.2487562189054726Estrand1.54.17LEU0.2810.0900641025641025644-0.0380.3895:487/150F:Q:L:V:R:I750.789473684210526385effect-1.15-0.3010471204188482DestabilisingTRP0pnca_complex.pdb
423L182FL182FAPZA15.184-1.168Destabilising-0.294Destabilising-0.3018087855297157-0.0744680851063829L182LA1824.99445-6.0-2.00.00.0-2.00.00.00.00.00.00.00.00.00.00.00.00.01.00.01.01.02.00.04.00.00.18190874059397286Destabilising-0.804Destabilising-0.1370843989769821500.2487562189054726Estrand1.54.17LEU0.2810.0900641025641025644-0.0380.3895:487/150F:Q:L:V:R:I470.4947368421052631471effectpnca_p.leu182phe7.18700589334483e-05-8.987408781496420.00012497350770340.940032862253634119.468044435493-0.07522855859877414692673.51081322.424127784783520.3845555093736310.01.00.00.0188.5442222312681.0341007080334399e-290.999999999999997-1.0-0.2617801047120419DestabilisingPHE0pnca_complex.pdb
424L182SL182SAPZA15.184-2.349Destabilising0.38Stabilising-0.60697674418604650.1704035874439461L182LA1825.3767622.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-1.00.0-1.00.04.00.04.02.00.19583330298151938Destabilising-1.864Destabilising-0.3178175618073316500.2487562189054726Estrand1.54.17LEU0.2810.0900641025641025644-0.0380.3895:487/150F:Q:L:V:R:I710.747368421052631685effectpnca_p.leu182ser0.00071870058933441.580376030869224.856781767777670.01251751696503790.6328569433250422.497208962527771.3497741822852817.47576771486714.856781802864360.6863485926761274.856052518316480.01717580417960761.765082919910921.1165895034506621.11734402463825.496400657246540.0190556572462216-1.98-0.518324607329843DestabilisingSER0pnca_complex.pdb
425V183LV183LAPZA17.921-0.423Destabilising-0.108Destabilising-0.1093023255813953-0.0273556231003039V183VA183-0.102908-10.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.00.0-3.00.0-1.0-2.0-2.00.00.0-4.0-0.01978543413058525Stabilising-0.776Destabilising-0.13231031543052002340.1954022988505747Estrand3.54.1VAL0.40.12820512820512822440.0830.595:359/150L:V:I:R:C:T:A:G-6-0.0645161290322580653neutralpnca_p.val183leu0.0001437401178668-9.987521262450634.59700131334244e-050.942832958100734139.277183325399-0.0717096729269459144471.7063148651.21195880622110.08348785866285790.01.00.00.025.83865859621631.0105682238915901e-250.999999999999746-0.67-0.175392670157068DestabilisingLEU0pnca_complex.pdb