A0A5K4F250_SCHMA Loading...

GAR domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F250, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,572 aa.

>A0A5K4F250_SCHMA|A0A5K4F250
MSKRRRQDLDLSSSSGSSDCIYDSLLWKFVDENYEFLINDDFLEHCKHAVCDEKSTTPADSSFESCIVLLEDLSELLRNLRQRVELEGHGNFQKYLETTLTNEIQHYERRKHGIINSILSTLDKSQSPLPSSELRNFSVASDLISNELDKKSSNLLLILGELQQEWDETIRKITPISPFTNQISFLEDIDSDLKKIDAWLNTLASNLPNTSAWMTFLMSLSNVQKFSTAKYYQVCLKQIEQYSKTLSTIKELVDHVELNTLADIQFQNNLHNLSRSVCELEAKFHTLWLRLLELSIYIDQNIKTDVNQRVTTDICHDACSNKTRHDVLHQNYGNSYLSEFNTKEIGIHHLSHQNGHESGFESEQSPPLKSYYSYSCNNTITGSDTLVVKDELRLRKDNSRSLPDDFNEIIGKLDNALLNDELKIYPEVINIDESVKCLSSQSDLFFKNEDKCKMNKYGKNLFSSSEQQDIKRNYRLEMTESGDFLWNNTGNGLIDATIQDNGSQSSNSKNAAGSTSCHEDAGVLRKKFSSESCNLNKVQNYETIHKCLSLPNAKSFVTGINKSKSIDLPFISNCRQVNDRSCSMHVNIVNNNNNILRKVISGRKSLTTKYNNLHNFYYLKRIGNSRLMRHLLEFKVKHTNTKLRNKKNFKSRLKRTSKNRNCMSSISLNLYNQISNEMLSHTKSVVSQYSSVDTQMFHVDSGSNSDCEVTSNHSYYCKSIPDNTSELEQRQWRMQVRTYLNAAEKAEELIRNRYSPNRFESWLAGLEVSNLKLGEDNDNNNNNNLVDLTNKQLLVKKNQNNNAYDSCSLFMNDLDGKDEKRTCQDDNDLSPLEDSHEPLLNFWDDYQASLYSNSSDSQAYEPPSMYAEEFPWDDVGSPFFTDIERELNSPPLYSHKEPKKFMKSNSSSIIEENDCSKNQGQDTNDILSTSTSGLFNRKSSLDASFEIFNNTSINNTHGTESWSAEHTDNLLSPESSVRGLRTCPDGGSQHLPSIDTMDVISNQHEIQDIKNHLYPMSSFNEHFNSSNYTYYTRHHSKLHSKLYERKYQTIPRIINRKRKAQINSFQSEKQSVKREFLSLDASLNRLDDRYFSDIHKGILEHSGTRLMHAETYLQHLINLVKRNSSVQRRNLSKQVNSSNWRHRTDLLLQTAEAHVKLLSNLLDDLKSYCSSNVSELSDNRLSASFIQDLTPCEDDNNYVKTDNTDDGHHHSPYRLIILNALKLKSQWINFSSTVRLIYQQSNQYEAWKKQLYILQLRMHDLSRLTRQIGLSMYTSKEVNSANPSNVDTQHISDSIIFDENQSDKITCGFKRCFLEVDSLNFALEEIQSELNKENCQISVNNNNSSATICNTISLDGKLLHEIDRLSSQLAINRSILQRLIRLFESSHSNNSLPHHQLDNEYLTDSIENQLETSIVNPDKSTLEQQINEVYTNEHLFERKSVENHDHQQHPVGVSTSTTEKTPSIYSSICNLLHRILPSTNSQNYFILLISGFIFLAYLSCYILGRLLACNNYSRRPPSSNTVSSLRCFFSLNNNNSDDNNDNVQGATTFGRCPLERDRLSNIIDYTNGAQPY
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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M35.2Very low32Very low216 Ų216179.4 Ų179.4100%1.06484%0.841SS**  0128.40-73.7-171.7174.400112.1
2S29.7Very low31.9Very low116 Ų116173.3 Ų173.381%0.81183%0.833SS**  trans-156133.4154.4-176.60000108.6R4S2-R4 PolarHBondContact O-N 3.13Å
3K32.7Very low32Very low206 Ų206169 Ų16990%0.89683%0.832SS**  trans-75.184.5-170.8-68.6-180177.3178.90111.8R5K3-R5 PolarHBondContact O-N 3.04Å
4R33.7Very low32Very low246 Ų246165.3 Ų165.393%0.92883%0.831SS**  trans-76.579.2163.4-83.4-165.4171.1-164-2.2110.7S2S2-R4 PolarHBondContact O-N 3.13Å
5R32.5Very low32.1Very low196 Ų196162.5 Ų162.574%0.7483%0.834SS**  trans22.2109.2154.2-59.2-170.8-173.3179.91.8117.1K3 Q7K3-R5 PolarHBondContact O-N 3.04Å; R5-Q7 HydrophobicContact CB-CG 4.26Å; R5-Q7 VanDerWaalsContact CD-OE1 3.28Å; R5-Q7 VanDerWaalsContact NH1-OE1 3.14Å; R5-Q7 PolarHBondContact O-N 3.22Å
6R29.6Very low31.8Very low239 Ų239156.7 Ų156.790%0.90283%0.826SS**  trans-56.2125.1137.7-65.2176.7176.9172.7-3.1107.4
7Q33.3Very low32Very low119 Ų119152.1 Ų152.156%0.55681%0.81SS**  trans-142.8105161-80.5-162.1-109.100108.4R5R5-Q7 HydrophobicContact CB-CG 4.26Å; R5-Q7 VanDerWaalsContact CD-OE1 3.28Å; R5-Q7 VanDerWaalsContact NH1-OE1 3.14Å; R5-Q7 PolarHBondContact O-N 3.22Å
8D29.1Very low32.2Very low130 Ų130148.8 Ų148.870%0.69580%0.801SS**  trans63.157.8131.2-34.7-34.6000116.9
9L33.3Very low32.7Very low175 Ų175144.6 Ų144.692%0.91678%0.778SS**  trans-90.683.3149-98.7166000108.2
10D32.2Very low33.2Very low155 Ų155141.9 Ų141.983%0.82977%0.769SS**  trans-70139175-103.7-37.3000111.1
11L30.5Very low33.7Very low175 Ų175139.9 Ų139.992%0.91676%0.757SS**  trans-88.2111.1-169.3-76.1158.6000112.7
12S31.5Very low34.2Very low106 Ų106134.6 Ų134.674%0.74173%0.726SS**  trans-153.7124.5157.144.50000112.6
13S32.5Very low35.3Very low118 Ų118133.6 Ų133.683%0.82571%0.712SS**  trans25.6127.7153.455.30000119.7
14S32.2Very low36.3Very low117 Ų117127.4 Ų127.482%0.81869%0.694SS**  cis-167.3-179.85.972.60000109.3
15S33.6Very low37.4Very low124 Ų124120 Ų12087%0.86767%0.672SS**  cis-139.6-71.96.451.10000112.7
16G27.6Very low38.3Very low69 Ų69112.2 Ų112.271%0.71165%0.645SS**  trans-167.6121.9175.400000115.6
17S34.5Very low39.7Very low79 Ų79107.4 Ų107.455%0.55263%0.628SS**  trans-108.9166.1148.2860000109D19S17-D19 WeakPolarHBondContact CB-OD2 3.36Å; S17-D19 PolarHBondContact O-N 3.21Å; S17-D19 PolarHBondContact OG-OD2 3.49Å
18S36.5Very low41.2Very low92 Ų92107.1 Ų107.164%0.64362%0.624SS**THydrogen-bonded Turntrans-76.1-0.6-176.243.80000115.2
19D41.8Very low42.6Very low70 Ų70101.6 Ų101.637%0.37459%0.594SS.*THydrogen-bonded Turntrans-87.7-12.2-160.8-52.6-70.1000114.2S17 I21 R81S17-D19 WeakPolarHBondContact CB-OD2 3.36Å; S17-D19 PolarHBondContact O-N 3.21Å; S17-D19 PolarHBondContact OG-OD2 3.49Å; D19-I21 PolarHBondContact O-N 3.12Å; D19-R81 IonicContact OD1-NH1 3.62Å; D19-R81 PolarHBondContact OD1-NH1 3.24Å
20C42.9Very low43.7Very low89 Ų8994.5 Ų94.560%0.60156%0.558SS**Hα-helixtrans-64.5-10.9179.5-51.60000114.6Y22 S24C20-Y22 VanDerWaalsContact C-N 3.35Å; C20-Y22 PolarHBondContact O-N 3.18Å; C20-S24 WeakPolarHBondContact O-CB 3.21Å; C20-S24 PolarHBondContact O-N 3.4Å
21I42.3Very low44.9Very low100 Ų10092.3 Ų92.351%0.51355%0.547SS..Hα-helixtrans-67.1-35.3-175.3-59.7174.8000111.6D19 S24 L25D19-I21 PolarHBondContact O-N 3.12Å; I21-S24 CarbonylContact O-C 3.48Å; I21-S24 PolarHBondContact O-N 3.4Å; I21-L25 HydrophobicContact CG2-CD1 4.02Å; I21-L25 HydrophobicContact CG2-CG 4.43Å; I21-L25 WeakPolarHBondContact O-CG 3.04Å; I21-L25 PolarHBondContact O-N 3.31Å
22Y46.4Very low46.3Very low105 Ų10590.2 Ų90.241%0.41253%0.532SS..Hα-helixtrans-72.5-45.2-175.8-66.3-88.4000112.2C20 S24 L25 L26 E165C20-Y22 VanDerWaalsContact C-N 3.35Å; C20-Y22 PolarHBondContact O-N 3.18Å; Y22-S24 VanDerWaalsContact C-N 3.32Å; Y22-L25 PolarHBondContact O-N 2.79Å; Y22-L26 WeakPolarHBondContact O-CB 3.44Å; Y22-L26 PolarHBondContact O-N 3.46Å; Y22-E165 WeakPolarHBondContact CE1-OE2 3.49Å; Y22-E165 PolarHBondContact OH-OE2 3.21Å; Y22-E165 VanDerWaalsContact OH-OE2 3.11Å
23D53.2Low47.3Very low96 Ų9686.1 Ų86.151%0.51350%0.502SS..Hα-helixtrans-55.5-49.7166-85.9-54.4000109.8L25 L26 W27D23-L25 VanDerWaalsContact C-N 3.26Å; D23-L25 PolarHBondContact O-N 2.83Å; D23-L26 PolarHBondContact O-N 2.85Å; D23-W27 VanDerWaalsContact O-CB 3.29Å; D23-W27 WeakPolarHBondContact O-CB 2.79Å; D23-W27 PolarHBondContact O-N 3.4Å; D23-W27 PolarHBondContact OD1-NE1 3.12Å
24S53.5Low48Very low75 Ų7586.1 Ų86.152%0.52448%0.484SS..Hα-helixtrans-60.3-29.7-178.7-173.90000114.4C20 I21 Y22 K28C20-S24 WeakPolarHBondContact O-CB 3.21Å; C20-S24 PolarHBondContact O-N 3.4Å; I21-S24 CarbonylContact O-C 3.48Å; I21-S24 PolarHBondContact O-N 3.4Å; Y22-S24 VanDerWaalsContact C-N 3.32Å; S24-K28 WeakPolarHBondContact O-CB 3.28Å; S24-K28 PolarHBondContact O-N 3.38Å
25L55.4Low48.6Very low90 Ų9088.5 Ų88.547%0.47148%0.483SS..Hα-helixtrans-82.4-42.6177-75.2170.5000111.9I21 Y22 D23 K28 F29I21-L25 HydrophobicContact CG2-CD1 4.02Å; I21-L25 HydrophobicContact CG2-CG 4.43Å; I21-L25 WeakPolarHBondContact O-CG 3.04Å; I21-L25 PolarHBondContact O-N 3.31Å; Y22-L25 PolarHBondContact O-N 2.79Å; D23-L25 VanDerWaalsContact C-N 3.26Å; D23-L25 PolarHBondContact O-N 2.83Å; L25-K28 PolarHBondContact O-N 3.17Å; L25-F29 PolarHBondContact O-N 3.03Å
26L53.4Low49.1Very low33 Ų3389.8 Ų89.817%0.17347%0.473CS..Hα-helixtrans-67.5-46.4178.6-163.375.4000111.2Y22 D23 K28 F29 V30 E71Y22-L26 WeakPolarHBondContact O-CB 3.44Å; Y22-L26 PolarHBondContact O-N 3.46Å; D23-L26 PolarHBondContact O-N 2.85Å; L26-K28 VanDerWaalsContact C-N 3.34Å; L26-K28 PolarHBondContact O-N 3.11Å; L26-F29 PolarHBondContact O-N 3.19Å; L26-V30 WeakPolarHBondContact O-CG2 3.46Å; L26-V30 PolarHBondContact O-N 3.21Å; L26-E71 HydrophobicContact CD2-CG 4.02Å
27W58.2Low49.6Very low139 Ų13990.7 Ų90.753%0.52746%0.461SS..Hα-helixtrans-65.2-35.6175.2-71.7110.8000112.3D23 V30 D31D23-W27 VanDerWaalsContact O-CB 3.29Å; D23-W27 WeakPolarHBondContact O-CB 2.79Å; D23-W27 PolarHBondContact O-N 3.4Å; D23-W27 PolarHBondContact OD1-NE1 3.12Å; W27-V30 HydrophobicContact CE3-CB 4.43Å; W27-V30 HydrophobicContact CE3-CG1 4.38Å; W27-V30 HydrophobicContact CZ3-CG1 4.44Å; W27-V30 PolarHBondContact O-N 2.99Å; W27-D31 WeakPolarHBondContact O-CB 3.42Å; W27-D31 PolarHBondContact O-N 3.46Å
28K64.6Low50Low112 Ų11290.4 Ų90.449%0.48745%0.453SS..Hα-helixtrans-64.4-41172.7179.3175.7174.7-176.20112.2S24 L25 L26 V30 D31 E32S24-K28 WeakPolarHBondContact O-CB 3.28Å; S24-K28 PolarHBondContact O-N 3.38Å; L25-K28 PolarHBondContact O-N 3.17Å; L26-K28 VanDerWaalsContact C-N 3.34Å; L26-K28 PolarHBondContact O-N 3.11Å; K28-V30 VanDerWaalsContact C-N 3.32Å; K28-V30 PolarHBondContact O-N 3.14Å; K28-D31 PolarHBondContact O-N 3.4Å; K28-E32 WeakPolarHBondContact CE-OE1 3.45Å; K28-E32 HydrophobicContact CG-CG 4.2Å; K28-E32 IonicContact NZ-OE1 2.79Å; K28-E32 VanDerWaalsContact O-CB 3.26Å; K28-E32 WeakPolarHBondContact O-CB 3.42Å; K28-E32 VanDerWaalsContact O-CG 3.28Å; K28-E32 WeakPolarHBondContact O-CG 3.49Å; K28-E32 PolarHBondContact O-N 3.3Å
29F58.7Low50.1Low15 Ų1591.2 Ų91.27%0.06645%0.45CS..Hα-helixtrans-63.1-38.5173.4175.3-101.5000112.2L25 L26 N33 F63 N154 I158L25-F29 PolarHBondContact O-N 3.03Å; L26-F29 PolarHBondContact O-N 3.19Å; F29-N33 PolarHBondContact O-N 3.18Å; F29-N33 PolarHBondContact O-ND2 2.89Å; F29-F63 AromaticContact CE1-CZ 3.92Å; F29-F63 HydrophobicContact CE1-CZ 3.92Å; F29-F63 HydrophobicContact CZ-CE2 4.3Å; F29-F63 AromaticContact CZ-CZ 3.74Å; F29-F63 HydrophobicContact CZ-CZ 3.74Å; F29-N154 HydrophobicContact CD2-CB 4.34Å; F29-N154 HydrophobicContact CE2-CB 3.72Å; F29-I158 HydrophobicContact CB-CD1 4.47Å; F29-I158 HydrophobicContact CD1-CD1 4.41Å; F29-I158 HydrophobicContact CD2-CD1 4.1Å; F29-I158 HydrophobicContact CE2-CD1 4.43Å; F29-I158 HydrophobicContact CG-CD1 4.07Å
30V57.1Low50.1Low26 Ų2693.5 Ų93.516%0.15846%0.462CS..Hα-helixtrans-65.3-51.3174.2171.30000111.1L26 W27 K28 N33 Y34L26-V30 WeakPolarHBondContact O-CG2 3.46Å; L26-V30 PolarHBondContact O-N 3.21Å; W27-V30 HydrophobicContact CE3-CB 4.43Å; W27-V30 HydrophobicContact CE3-CG1 4.38Å; W27-V30 HydrophobicContact CZ3-CG1 4.44Å; W27-V30 PolarHBondContact O-N 2.99Å; K28-V30 VanDerWaalsContact C-N 3.32Å; K28-V30 PolarHBondContact O-N 3.14Å; V30-N33 CarbonylContact O-C 3.43Å; V30-N33 PolarHBondContact O-N 3.44Å; V30-N33 VanDerWaalsContact O-N 3.14Å; V30-Y34 HydrophobicContact CG1-CD2 4.35Å; V30-Y34 WeakPolarHBondContact O-CB 3.26Å; V30-Y34 PolarHBondContact O-N 2.87Å
31D57Low50Low109 Ų10995.2 Ų95.258%0.58347%0.465SS*.Hα-helixtrans-61.7-45.4179.9-82.1-15.3000112.2W27 K28 N33 Y34W27-D31 WeakPolarHBondContact O-CB 3.42Å; W27-D31 PolarHBondContact O-N 3.46Å; K28-D31 PolarHBondContact O-N 3.4Å; D31-N33 PolarHBondContact O-N 3.47Å; D31-N33 VanDerWaalsContact O-N 3.11Å; D31-Y34 WeakPolarHBondContact O-CB 3.37Å; D31-Y34 PolarHBondContact O-N 3.15Å
32E58.4Low49.7Very low130 Ų13099.1 Ų99.161%0.60748%0.479SS*.Hα-helixtrans-63.3-15.7176.8-74.2-179.7173.400113.4K28K28-E32 WeakPolarHBondContact CE-OE1 3.45Å; K28-E32 HydrophobicContact CG-CG 4.2Å; K28-E32 IonicContact NZ-OE1 2.79Å; K28-E32 VanDerWaalsContact O-CB 3.26Å; K28-E32 WeakPolarHBondContact O-CB 3.42Å; K28-E32 VanDerWaalsContact O-CG 3.28Å; K28-E32 WeakPolarHBondContact O-CG 3.49Å; K28-E32 PolarHBondContact O-N 3.3Å
33N53.3Low49.3Very low21 Ų21100.2 Ų100.211%0.11249%0.491CS..Hα-helixtrans-110-3.2173.9-72.7-92.3000113.6F29 V30 D31 F36 L37 K151F29-N33 PolarHBondContact O-N 3.18Å; F29-N33 PolarHBondContact O-ND2 2.89Å; V30-N33 CarbonylContact O-C 3.43Å; V30-N33 PolarHBondContact O-N 3.44Å; V30-N33 VanDerWaalsContact O-N 3.14Å; D31-N33 PolarHBondContact O-N 3.47Å; D31-N33 VanDerWaalsContact O-N 3.11Å; N33-F36 PolarHBondContact O-N 3.11Å; N33-L37 HydrophobicContact CB-CD1 4.46Å; N33-L37 WeakPolarHBondContact O-CG 3.46Å; N33-L37 PolarHBondContact O-N 2.86Å; N33-K151 WeakPolarHBondContact OD1-CE 3.3Å
34Y47Very low48.6Very low117 Ų117101.8 Ų101.846%0.45950%0.495SS..Hα-helixtrans-68.2-41.8-165.9-164.7-105.2000113.5V30 D31 F36 L37 I38V30-Y34 HydrophobicContact CG1-CD2 4.35Å; V30-Y34 WeakPolarHBondContact O-CB 3.26Å; V30-Y34 PolarHBondContact O-N 2.87Å; D31-Y34 WeakPolarHBondContact O-CB 3.37Å; D31-Y34 PolarHBondContact O-N 3.15Å; Y34-F36 VanDerWaalsContact C-N 3.3Å; Y34-F36 PolarHBondContact O-N 3.2Å; Y34-L37 PolarHBondContact O-N 2.87Å; Y34-I38 HydrophobicContact CD1-CD1 3.68Å; Y34-I38 HydrophobicContact CD2-CD1 4.48Å; Y34-I38 HydrophobicContact CE1-CD1 3.27Å; Y34-I38 HydrophobicContact CE2-CD1 4.14Å; Y34-I38 HydrophobicContact CG-CD1 4.27Å; Y34-I38 WeakPolarHBondContact O-CG1 3.34Å
35E44.5Very low47.9Very low167 Ų167106.5 Ų106.578%0.7851%0.509SS*.G310 helixtrans-63.9-37175-66.4-167.4139.100111.7L37 I38 N39E35-L37 PolarHBondContact O-N 3.31Å; E35-I38 PolarHBondContact O-N 3.23Å; E35-I38 VanDerWaalsContact O-N 3.15Å; E35-N39 PolarHBondContact O-N 3.27Å
36F44.6Very low47Very low152 Ų152107.3 Ų107.367%0.66752%0.521SS*.G310 helixtrans-68.9-21.4177.8-146.2-77.5000112.6N33 Y34N33-F36 PolarHBondContact O-N 3.11Å; Y34-F36 VanDerWaalsContact C-N 3.3Å; Y34-F36 PolarHBondContact O-N 3.2Å
37L38.3Very low46.2Very low88 Ų88111.9 Ų111.946%0.46154%0.539SS..G310 helixtrans-86-3.3175.8-70.2164.7000113.4N33 Y34 E35 F63N33-L37 HydrophobicContact CB-CD1 4.46Å; N33-L37 WeakPolarHBondContact O-CG 3.46Å; N33-L37 PolarHBondContact O-N 2.86Å; Y34-L37 PolarHBondContact O-N 2.87Å; E35-L37 PolarHBondContact O-N 3.31Å; L37-F63 HydrophobicContact CD2-CD1 4.48Å
38I43.1Very low45.2Very low73 Ų73114.3 Ų114.337%0.37456%0.556SS.*THydrogen-bonded Turntrans-124.6-6-168.8-71.7178.8000114.1Y34 E35 D40Y34-I38 HydrophobicContact CD1-CD1 3.68Å; Y34-I38 HydrophobicContact CD2-CD1 4.48Å; Y34-I38 HydrophobicContact CE1-CD1 3.27Å; Y34-I38 HydrophobicContact CE2-CD1 4.14Å; Y34-I38 HydrophobicContact CG-CD1 4.27Å; Y34-I38 WeakPolarHBondContact O-CG1 3.34Å; E35-I38 PolarHBondContact O-N 3.23Å; E35-I38 VanDerWaalsContact O-N 3.15Å; I38-D40 PolarHBondContact O-N 3.35Å
39N39.2Very low43.7Very low108 Ų108113.3 Ų113.358%0.57857%0.569SS**  trans-65.396.2-179.8-83.7-25.3000113.8E35 D41E35-N39 PolarHBondContact O-N 3.27Å; N39-D41 PolarHBondContact O-N 2.86Å; N39-D41 VanDerWaalsContact O-N 3.11Å
40D40.8Very low42.5Very low118 Ų118119.1 Ų119.163%0.63161%0.605SS**THydrogen-bonded Turntrans-57.8-19.3177.4-80.7-49.1000114.4I38 F42 L43I38-D40 PolarHBondContact O-N 3.35Å; D40-F42 PolarHBondContact O-N 2.93Å; D40-F42 VanDerWaalsContact O-N 3.12Å; D40-L43 WeakPolarHBondContact O-CB 3.41Å; D40-L43 PolarHBondContact O-N 3.06Å
41D40.6Very low41.3Very low125 Ų125123.3 Ų123.367%0.66863%0.634SS**Hα-helixtrans-58.2-27-177.6-75.4-20.5000114N39 L43N39-D41 PolarHBondContact O-N 2.86Å; N39-D41 VanDerWaalsContact O-N 3.11Å; D41-L43 PolarHBondContact O-N 3.24Å
42F37.4Very low40.3Very low183 Ų183126 Ų12680%0.80365%0.649SS**Hα-helixtrans-69.9-19.1174.2-114.9-87.7000113.1D40D40-F42 PolarHBondContact O-N 2.93Å; D40-F42 VanDerWaalsContact O-N 3.12Å
43L36.6Very low39.1Very low127 Ų127127.5 Ų127.567%0.66566%0.655SS**Hα-helixtrans-87.9-20.2-175.9-143.879.1000113.4D40 D41D40-L43 WeakPolarHBondContact O-CB 3.41Å; D40-L43 PolarHBondContact O-N 3.06Å; D41-L43 PolarHBondContact O-N 3.24Å
44E38.9Very low38.2Very low130 Ų130135.2 Ų135.261%0.60769%0.688SS**Hα-helixtrans-87.7-39-177.8-167.3112-84.600112.4C46 K47E44-C46 PolarHBondContact O-N 2.97Å; E44-K47 PolarHBondContact O-N 2.9Å; E44-K47 IonicContact OE1-NZ 2.69Å; E44-K47 PolarHBondContact OE1-NZ 3.02Å
45H38.3Very low37.7Very low174 Ų174135.4 Ų135.481%0.80671%0.706SS**G310 helixtrans-64.1-22.1-177.8-83.881.6000114.2K47H45-K47 VanDerWaalsContact C-N 3.32Å; H45-K47 PolarHBondContact O-N 3.32Å
46C36.1Very low37.5Very low107 Ų107134 Ų13472%0.72371%0.71SS**G310 helixtrans-80.4-1.2-179.3-65.90000115.1E44E44-C46 PolarHBondContact O-N 2.97Å
47K37.9Very low37.3Very low129 Ų129132 Ų13256%0.56171%0.71SS**G310 helixtrans-84.6-6.9-172.1-69.1174.9-170.2161.20116.1E44 H45E44-K47 PolarHBondContact O-N 2.9Å; E44-K47 IonicContact OE1-NZ 2.69Å; E44-K47 PolarHBondContact OE1-NZ 3.02Å; H45-K47 VanDerWaalsContact C-N 3.32Å; H45-K47 PolarHBondContact O-N 3.32Å
48H37.4Very low37.5Very low189 Ų189132.8 Ų132.888%0.87572%0.72SS**SBendtrans-129.744.7-170.4-77.6-55.3000115.7
49A32.5Very low37.6Very low92 Ų92132.1 Ų132.176%0.7673%0.725SS**SBendtrans-142.199.6167.100000113.2
50V33.9Very low38Very low136 Ų136132.6 Ų132.682%0.82473%0.728SS**  trans19.3109.2155.8-170.90000118.9
51C31.9Very low38.8Very low114 Ų114130.1 Ų130.177%0.7772%0.72SS**  trans21.3105.5143.9-510000119.9
52D35.7Very low39.8Very low166 Ų166125.3 Ų125.389%0.88870%0.696SS**  -164.1167.2108.8-108.3-16.9000111.4
53E32.9Very low41Very low161 Ų161118.2 Ų118.275%0.75267%0.665SS**  trans-77.6148.5-174.2-61-173146.100114.5
54K34.9Very low42.5Very low184 Ų184118.8 Ų118.880%0.867%0.665SS**  trans81.585.9167.4-51.1147.7-172.3154.70117.1
55S37.2Very low44Very low120 Ų120115.4 Ų115.484%0.83966%0.655SS**  -175.9120.7124.234.10000112.1
56T38.8Very low45.6Very low139 Ų139107.3 Ų107.385%0.85362%0.618SS**  trans-82.8133.1155.146.40000108
57T40Very low47.4Very low108 Ų108103.7 Ų103.766%0.66359%0.591SS**  trans-60.9131.2-17434.20000112.4A59T57-A59 VanDerWaalsContact C-N 3.28Å; T57-A59 PolarHBondContact O-N 3.24Å
58P42.9Very low49.2Very low105 Ų105101.1 Ų101.168%0.68259%0.586SS**SBendtrans-837.3-170.734-37.9000114.9
59A46.4Very low51.2Low59 Ų5993.6 Ų93.649%0.48855%0.552SS.*Hα-helixtrans-71.7-51.4-173.800000112.4T57 S61 S62 F63T57-A59 VanDerWaalsContact C-N 3.28Å; T57-A59 PolarHBondContact O-N 3.24Å; A59-S61 PolarHBondContact O-N 2.84Å; A59-S62 WeakPolarHBondContact O-CB 3.37Å; A59-S62 PolarHBondContact O-N 2.63Å; A59-S62 VanDerWaalsContact O-N 3.09Å; A59-S62 PolarHBondContact O-OG 3.26Å; A59-F63 PolarHBondContact O-N 3.09Å
60D46.3Very low53.3Low118 Ų11889.4 Ų89.463%0.63152%0.517SS*.Hα-helixtrans-68.6-39.6-167.6-48.4-56.7000112.3S62 F63 E64D60-S62 PolarHBondContact O-N 3.44Å; D60-F63 PolarHBondContact O-N 2.87Å; D60-E64 PolarHBondContact O-N 3.45Å; D60-E64 VanDerWaalsContact O-N 3.12Å
61S58.9Low55.4Low66 Ų6686.9 Ų86.946%0.46250%0.496SS..Hα-helixtrans-67.7-21.7175.658.60000113.4A59 S65A59-S61 PolarHBondContact O-N 2.84Å; S61-S65 WeakPolarHBondContact O-CB 3.03Å; S61-S65 PolarHBondContact O-N 3.48Å; S61-S65 PolarHBondContact O-OG 3.42Å
62S61.7Low57.7Low25 Ų2585.4 Ų85.418%0.17548%0.481CS..Hα-helixtrans-72-39.6173.980.50000111.5A59 D60 S65 C66 T121A59-S62 WeakPolarHBondContact O-CB 3.37Å; A59-S62 PolarHBondContact O-N 2.63Å; A59-S62 VanDerWaalsContact O-N 3.09Å; A59-S62 PolarHBondContact O-OG 3.26Å; D60-S62 PolarHBondContact O-N 3.44Å; S62-S65 PolarHBondContact O-N 3.47Å; S62-C66 PolarHBondContact O-N 2.8Å; S62-C66 VanDerWaalsContact O-N 3.08Å; S62-C66 PolarHBondContact O-SG 2.99Å; S62-C66 VanDerWaalsContact O-SG 3.35Å; S62-T121 VanDerWaalsContact O-CG2 3.31Å; S62-T121 WeakPolarHBondContact O-CG2 3.36Å
63F61.9Low59.7Low33 Ų3377.8 Ų77.815%0.14544%0.44CS..Hα-helixtrans-75.2-41.8-179.7-166.9-106000112F29 L37 A59 D60 S65 C66 I67 K151 L155F29-F63 AromaticContact CE1-CZ 3.92Å; F29-F63 HydrophobicContact CE1-CZ 3.92Å; F29-F63 HydrophobicContact CZ-CE2 4.3Å; F29-F63 AromaticContact CZ-CZ 3.74Å; F29-F63 HydrophobicContact CZ-CZ 3.74Å; L37-F63 HydrophobicContact CD2-CD1 4.48Å; A59-F63 PolarHBondContact O-N 3.09Å; D60-F63 PolarHBondContact O-N 2.87Å; F63-S65 VanDerWaalsContact C-N 3.27Å; F63-S65 PolarHBondContact O-N 3.27Å; F63-C66 PolarHBondContact O-N 3.26Å; F63-C66 VanDerWaalsContact O-N 3.1Å; F63-I67 HydrophobicContact CD1-CD1 3.95Å; F63-I67 HydrophobicContact CE1-CD1 3.78Å; F63-I67 HydrophobicContact CE1-CG1 4.42Å; F63-I67 PolarHBondContact O-N 3.29Å; F63-K151 HydrophobicContact CE2-CB 4.38Å; F63-L155 HydrophobicContact CE2-CD1 4.33Å
64E67.6Low61.9Low140 Ų14072.2 Ų72.265%0.65442%0.418SS*.Hα-helixtrans-58.5-40.3171.9-168.8175-154.900111.1D60 C66 I67 V68D60-E64 PolarHBondContact O-N 3.45Å; D60-E64 VanDerWaalsContact O-N 3.12Å; E64-C66 PolarHBondContact O-N 2.93Å; E64-I67 PolarHBondContact O-N 2.83Å; E64-V68 WeakPolarHBondContact O-CG2 3.39Å; E64-V68 PolarHBondContact O-N 3.41Å
65S71.6Confident64.2Low59 Ų5966.9 Ų66.941%0.41340%0.397SS..Hα-helixtrans-63.4-39173.7-60.80000113S61 S62 F63 L69S61-S65 WeakPolarHBondContact O-CB 3.03Å; S61-S65 PolarHBondContact O-N 3.48Å; S61-S65 PolarHBondContact O-OG 3.42Å; S62-S65 PolarHBondContact O-N 3.47Å; F63-S65 VanDerWaalsContact C-N 3.27Å; F63-S65 PolarHBondContact O-N 3.27Å; S65-L69 WeakPolarHBondContact O-CB 3.42Å; S65-L69 WeakPolarHBondContact O-CD1 3.36Å; S65-L69 VanDerWaalsContact O-CG 3.26Å; S65-L69 WeakPolarHBondContact O-CG 3.45Å; S65-L69 PolarHBondContact O-N 2.82Å; S65-L69 VanDerWaalsContact O-N 3.09Å
66C71.3Confident66.4Low3 Ų361.8 Ų61.82%0.0236%0.36CS..Hα-helixtrans-69.2-34.3177.3-71.80000113.1S62 F63 E64 L69 L70 T121 L155S62-C66 PolarHBondContact O-N 2.8Å; S62-C66 VanDerWaalsContact O-N 3.08Å; S62-C66 PolarHBondContact O-SG 2.99Å; S62-C66 VanDerWaalsContact O-SG 3.35Å; F63-C66 PolarHBondContact O-N 3.26Å; F63-C66 VanDerWaalsContact O-N 3.1Å; E64-C66 PolarHBondContact O-N 2.93Å; C66-L69 PolarHBondContact O-N 2.84Å; C66-L70 WeakPolarHBondContact O-CG 3.46Å; C66-L70 PolarHBondContact O-N 3.43Å; C66-T121 VanDerWaalsContact SG-CG2 3.6Å; C66-L155 HydrophobicContact CB-CD1 3.9Å
67I72.7Confident68.3Low32 Ų3255.6 Ų55.616%0.16432%0.321CS..Hα-helixtrans-64.1-49.7174.8-67.1170.9000110.2F63 E64 L69 L70 E71F63-I67 HydrophobicContact CD1-CD1 3.95Å; F63-I67 HydrophobicContact CE1-CD1 3.78Å; F63-I67 HydrophobicContact CE1-CG1 4.42Å; F63-I67 PolarHBondContact O-N 3.29Å; E64-I67 PolarHBondContact O-N 2.83Å; I67-L69 VanDerWaalsContact C-N 3.25Å; I67-L69 PolarHBondContact O-N 2.95Å; I67-L70 WeakPolarHBondContact O-CA 3.3Å; I67-L70 WeakPolarHBondContact O-CB 3.43Å; I67-L70 PolarHBondContact O-N 2.98Å; I67-E71 PolarHBondContact O-N 3Å
68V77.6Confident70.3Confident75 Ų7556.9 Ų56.946%0.45531%0.314SS..Hα-helixtrans-59.5-37177.6175.10000111.7E64 E71 D72E64-V68 WeakPolarHBondContact O-CG2 3.39Å; E64-V68 PolarHBondContact O-N 3.41Å; V68-E71 PolarHBondContact O-N 3.38Å; V68-D72 PolarHBondContact O-N 2.94Å
69L78.8Confident72.1Confident31 Ų3154.7 Ų54.716%0.16230%0.297CS..Hα-helixtrans-71.1-26.7175.2-72167.8000113.4S65 C66 I67 L73 I114 I118S65-L69 WeakPolarHBondContact O-CB 3.42Å; S65-L69 WeakPolarHBondContact O-CD1 3.36Å; S65-L69 VanDerWaalsContact O-CG 3.26Å; S65-L69 WeakPolarHBondContact O-CG 3.45Å; S65-L69 PolarHBondContact O-N 2.82Å; S65-L69 VanDerWaalsContact O-N 3.09Å; C66-L69 PolarHBondContact O-N 2.84Å; I67-L69 VanDerWaalsContact C-N 3.25Å; I67-L69 PolarHBondContact O-N 2.95Å; L69-L73 WeakPolarHBondContact O-CB 3.33Å; L69-L73 PolarHBondContact O-N 3.3Å; L69-I114 HydrophobicContact CB-CG2 4.19Å; L69-I114 HydrophobicContact CD2-CG2 4.28Å; L69-I114 WeakPolarHBondContact O-CG2 3.43Å; L69-I118 HydrophobicContact CB-CD1 3.87Å; L69-I118 HydrophobicContact CB-CG1 3.49Å; L69-I118 VanDerWaalsContact CB-CG1 3.49Å; L69-I118 HydrophobicContact CD1-CG1 3.86Å; L69-I118 HydrophobicContact CG-CG1 4.29Å
70L75.7Confident73.6Confident3 Ų352 Ų522%0.01627%0.274CS..Hα-helixtrans-75.5-37.6171.5-75.2170.6000111.8C66 I67 L73 S74 I118 L155 I158 L159 L162C66-L70 WeakPolarHBondContact O-CG 3.46Å; C66-L70 PolarHBondContact O-N 3.43Å; I67-L70 WeakPolarHBondContact O-CA 3.3Å; I67-L70 WeakPolarHBondContact O-CB 3.43Å; I67-L70 PolarHBondContact O-N 2.98Å; L70-L73 PolarHBondContact O-N 3.02Å; L70-S74 PolarHBondContact O-N 3.46Å; L70-S74 PolarHBondContact O-OG 3.01Å; L70-I118 HydrophobicContact CD2-CD1 4.07Å; L70-I118 HydrophobicContact CG-CD1 4.25Å; L70-L155 HydrophobicContact CD1-CD2 3.91Å; L70-L155 HydrophobicContact CD1-CG 4.02Å; L70-L155 HydrophobicContact CD2-CD2 4.49Å; L70-L155 HydrophobicContact CG-CD2 4.46Å; L70-I158 HydrophobicContact CD1-CG2 4.48Å; L70-I158 HydrophobicContact CD2-CG2 4.18Å; L70-L159 HydrophobicContact CD2-CD2 3.93Å; L70-L159 HydrophobicContact CD2-CG 4.24Å; L70-L162 HydrophobicContact CD2-CD1 4.1Å
71E77.6Confident75Confident84 Ų8449.5 Ų49.539%0.39326%0.256SS..Hα-helixtrans-60.9-46170.6-69.2175.1178.800111.3L26 I67 V68 L73 S74 E75L26-E71 HydrophobicContact CD2-CG 4.02Å; I67-E71 PolarHBondContact O-N 3Å; V68-E71 PolarHBondContact O-N 3.38Å; E71-L73 PolarHBondContact O-N 3.15Å; E71-S74 PolarHBondContact O-N 3.07Å; E71-S74 PolarHBondContact O-OG 2.8Å; E71-S74 VanDerWaalsContact O-OG 3.12Å; E71-E75 VanDerWaalsContact O-CB 3.28Å; E71-E75 WeakPolarHBondContact O-CB 3.44Å; E71-E75 PolarHBondContact O-N 3.41Å
72D80.3Confident75.8Confident83 Ų8350.6 Ų50.644%0.44425%0.253SS..Hα-helixtrans-59.7-33.2173.3-94.3-16.9000112.3V68 L76 I114V68-D72 PolarHBondContact O-N 2.94Å; D72-L76 VanDerWaalsContact O-CB 3.25Å; D72-L76 WeakPolarHBondContact O-CB 3.41Å; D72-L76 PolarHBondContact O-N 2.97Å; D72-L76 VanDerWaalsContact O-N 3.1Å; D72-I114 HydrophobicContact CB-CD1 4.3Å
73L79.3Confident76.3Confident6 Ų653 Ų533%0.03126%0.259CS..Hα-helixtrans-76.7-43.2179.3-172.557.5000112.6L69 L70 E71 L76 L77 K111 I114 I115 L159 L162L69-L73 WeakPolarHBondContact O-CB 3.33Å; L69-L73 PolarHBondContact O-N 3.3Å; L70-L73 PolarHBondContact O-N 3.02Å; E71-L73 PolarHBondContact O-N 3.15Å; L73-L76 PolarHBondContact O-N 2.94Å; L73-L77 PolarHBondContact O-N 2.91Å; L73-K111 HydrophobicContact CD1-CB 4.49Å; L73-K111 HydrophobicContact CD1-CG 4.25Å; L73-I114 HydrophobicContact CB-CG2 4.04Å; L73-I114 HydrophobicContact CD1-CD1 4.38Å; L73-I115 HydrophobicContact CD2-CG1 4.34Å; L73-L159 HydrophobicContact CD2-CD2 4.07Å; L73-L162 HydrophobicContact CD2-CB 4.43Å; L73-L162 HydrophobicContact CD2-CD1 3.98Å; L73-L162 HydrophobicContact CG-CD1 4.32Å
74S78.9Confident76.6Confident43 Ų4353.7 Ų53.730%0.30127%0.266SS..Hα-helixtrans-67.8-39.2176.9670000111L70 E71 L76 L77 R78L70-S74 PolarHBondContact O-N 3.46Å; L70-S74 PolarHBondContact O-OG 3.01Å; E71-S74 PolarHBondContact O-N 3.07Å; E71-S74 PolarHBondContact O-OG 2.8Å; E71-S74 VanDerWaalsContact O-OG 3.12Å; S74-L76 PolarHBondContact O-N 2.96Å; S74-L77 PolarHBondContact O-N 3.32Å; S74-R78 WeakPolarHBondContact O-CB 3.4Å; S74-R78 PolarHBondContact O-N 3.13Å
75E82.8Confident76.6Confident73 Ų7352.4 Ų52.434%0.34126%0.259SS..Hα-helixtrans-64.8-38.9173.7-177.959.4-170.600111.8E71 L77 R78 N79E71-E75 VanDerWaalsContact O-CB 3.28Å; E71-E75 WeakPolarHBondContact O-CB 3.44Å; E71-E75 PolarHBondContact O-N 3.41Å; E75-L77 VanDerWaalsContact C-N 3.33Å; E75-L77 PolarHBondContact O-N 3.18Å; E75-R78 PolarHBondContact O-N 3.26Å; E75-R78 IonicContact OE1-CZ 2.83Å; E75-R78 IonicContact OE1-NE 3.06Å; E75-R78 IonicContact OE1-NH2 2.69Å; E75-R78 PolarHBondContact OE1-NH2 2.76Å; E75-R78 VanDerWaalsContact OE1-NH2 3.08Å; E75-R78 IonicContact OE2-CZ 3.21Å; E75-R78 IonicContact OE2-NE 2.69Å; E75-R78 PolarHBondContact OE2-NE 3.28Å; E75-R78 IonicContact OE2-NH2 2.66Å; E75-R78 PolarHBondContact OE2-NH2 3.35Å; E75-N79 WeakPolarHBondContact O-CB 3.28Å; E75-N79 PolarHBondContact O-N 3.43Å; E75-N79 PolarHBondContact O-ND2 3.49Å; E75-N79 PolarHBondContact OE1-ND2 3.37Å
76L82.7Confident76Confident12 Ų1256.2 Ų56.26%0.06328%0.275CS..Hα-helixtrans-62.1-39.9174.4-176.269.4000112.1D72 L73 S74 L80 Y107 R110 I114 W166D72-L76 VanDerWaalsContact O-CB 3.25Å; D72-L76 WeakPolarHBondContact O-CB 3.41Å; D72-L76 PolarHBondContact O-N 2.97Å; D72-L76 VanDerWaalsContact O-N 3.1Å; L73-L76 PolarHBondContact O-N 2.94Å; S74-L76 PolarHBondContact O-N 2.96Å; L76-L80 PolarHBondContact O-N 3.03Å; L76-L80 VanDerWaalsContact O-N 3.09Å; L76-Y107 HydrophobicContact CD1-CD1 3.63Å; L76-Y107 HydrophobicContact CD1-CE1 3.76Å; L76-Y107 HydrophobicContact CG-CD1 4.08Å; L76-Y107 HydrophobicContact CG-CE1 4.46Å; L76-R110 HydrophobicContact CD1-CB 4.21Å; L76-R110 HydrophobicContact CD2-CB 3.57Å; L76-I114 HydrophobicContact CD2-CD1 3.98Å; L76-W166 HydrophobicContact CD2-CH2 3.68Å; L76-W166 HydrophobicContact CD2-CZ3 3.72Å; L76-W166 HydrophobicContact CG-CH2 4Å; L76-W166 HydrophobicContact CG-CZ3 3.87Å
77L80.4Confident75.3Confident9 Ų958.8 Ų58.85%0.04729%0.286CS..Hα-helixtrans-70.1-41.5176.5-176.659.9000111.8L73 S74 E75 L80 R81 L162 E165 W166L73-L77 PolarHBondContact O-N 2.91Å; S74-L77 PolarHBondContact O-N 3.32Å; E75-L77 VanDerWaalsContact C-N 3.33Å; E75-L77 PolarHBondContact O-N 3.18Å; L77-L80 WeakPolarHBondContact O-CB 3.43Å; L77-L80 PolarHBondContact O-N 3.1Å; L77-L80 VanDerWaalsContact O-N 3.12Å; L77-R81 PolarHBondContact O-N 3.38Å; L77-L162 HydrophobicContact CD2-CD2 3.96Å; L77-E165 HydrophobicContact CD2-CB 4.18Å; L77-E165 HydrophobicContact CD2-CG 4.2Å; L77-W166 HydrophobicContact CB-CE3 4.49Å; L77-W166 HydrophobicContact CD1-CB 4.41Å; L77-W166 HydrophobicContact CD1-CE3 4Å
78R81.1Confident74.4Confident135 Ų13558.8 Ų58.851%0.50930%0.295SS..Hα-helixtrans-60.5-45.8174.2-170.5174.171.6146.74.7112S74 E75 L80 R81 Q82S74-R78 WeakPolarHBondContact O-CB 3.4Å; S74-R78 PolarHBondContact O-N 3.13Å; E75-R78 PolarHBondContact O-N 3.26Å; E75-R78 IonicContact OE1-CZ 2.83Å; E75-R78 IonicContact OE1-NE 3.06Å; E75-R78 IonicContact OE1-NH2 2.69Å; E75-R78 PolarHBondContact OE1-NH2 2.76Å; E75-R78 VanDerWaalsContact OE1-NH2 3.08Å; E75-R78 IonicContact OE2-CZ 3.21Å; E75-R78 IonicContact OE2-NE 2.69Å; E75-R78 PolarHBondContact OE2-NE 3.28Å; E75-R78 IonicContact OE2-NH2 2.66Å; E75-R78 PolarHBondContact OE2-NH2 3.35Å; R78-L80 VanDerWaalsContact C-N 3.26Å; R78-L80 PolarHBondContact O-N 3.01Å; R78-R81 PolarHBondContact O-N 3.48Å; R78-Q82 WeakPolarHBondContact O-CG 3.32Å; R78-Q82 PolarHBondContact O-N 2.67Å
79N80.6Confident73.6Confident60 Ų6062.8 Ų62.832%0.32131%0.308SS..Hα-helixtrans-64.8-28.8174.5-83-94.7000112.7E75 R83E75-N79 WeakPolarHBondContact O-CB 3.28Å; E75-N79 PolarHBondContact O-N 3.43Å; E75-N79 PolarHBondContact O-ND2 3.49Å; E75-N79 PolarHBondContact OE1-ND2 3.37Å; N79-R83 WeakPolarHBondContact O-CG 3.32Å; N79-R83 PolarHBondContact O-N 3.03Å
80L77.3Confident72.9Confident1 Ų162.2 Ų62.21%0.00531%0.31CS..Hα-helixtrans-71.4-49.6173.2-174.861.4000110.4L76 L77 R78 Q82 R83 V84 L100 Y107 W166 T169 I173L76-L80 PolarHBondContact O-N 3.03Å; L76-L80 VanDerWaalsContact O-N 3.09Å; L77-L80 WeakPolarHBondContact O-CB 3.43Å; L77-L80 PolarHBondContact O-N 3.1Å; L77-L80 VanDerWaalsContact O-N 3.12Å; R78-L80 VanDerWaalsContact C-N 3.26Å; R78-L80 PolarHBondContact O-N 3.01Å; L80-Q82 PolarHBondContact O-N 3.08Å; L80-R83 PolarHBondContact O-N 3.49Å; L80-R83 VanDerWaalsContact O-N 3.11Å; L80-V84 WeakPolarHBondContact O-CG2 3.29Å; L80-V84 PolarHBondContact O-N 2.74Å; L80-V84 VanDerWaalsContact O-N 3.14Å; L80-L100 HydrophobicContact CD1-CD1 3.97Å; L80-L100 HydrophobicContact CD1-CD2 4.21Å; L80-L100 HydrophobicContact CD1-CG 4.27Å; L80-Y107 HydrophobicContact CB-CD1 4.18Å; L80-Y107 HydrophobicContact CB-CE1 4.03Å; L80-Y107 HydrophobicContact CD1-CD1 4Å; L80-Y107 HydrophobicContact CD1-CD2 4.14Å; L80-Y107 HydrophobicContact CD1-CE1 4.11Å; L80-Y107 HydrophobicContact CD1-CE2 4.27Å; L80-Y107 HydrophobicContact CD1-CG 4.03Å; L80-Y107 HydrophobicContact CG-CD1 4.48Å; L80-W166 HydrophobicContact CD2-CH2 4.37Å; L80-W166 HydrophobicContact CD2-CZ2 4.4Å; L80-T169 HydrophobicContact CD2-CG2 3.73Å; L80-T169 HydrophobicContact CG-CG2 3.86Å; L80-I173 HydrophobicContact CD1-CD1 3.79Å; L80-I173 HydrophobicContact CD2-CD1 4.31Å; L80-I173 HydrophobicContact CG-CD1 4.09Å
81R77.1Confident72.9Confident66 Ų6664.2 Ų64.225%0.24932%0.32CS..Hα-helixtrans-56.6-49.2179-167.3-165.8-76.6-168.10.9111.9D19 L77 R78 R83 V84 E85 E165D19-R81 IonicContact OD1-NH1 3.62Å; D19-R81 PolarHBondContact OD1-NH1 3.24Å; L77-R81 PolarHBondContact O-N 3.38Å; R78-R81 PolarHBondContact O-N 3.48Å; R81-R83 PolarHBondContact O-N 3.17Å; R81-V84 WeakPolarHBondContact O-CB 3.38Å; R81-V84 PolarHBondContact O-N 2.92Å; R81-E85 WeakPolarHBondContact CD-OE1 3.12Å; R81-E85 WeakPolarHBondContact CG-OE1 3.42Å; R81-E85 PolarHBondContact O-N 3.12Å; R81-E85 VanDerWaalsContact O-N 3.11Å; R81-E165 IonicContact CZ-OE1 2.59Å; R81-E165 IonicContact NE-OE1 2.7Å; R81-E165 IonicContact NH2-OE1 3.14Å; R81-E165 PolarHBondContact NH2-OE1 3.31Å
82Q75.5Confident72.7Confident89 Ų8960.6 Ų60.642%0.41630%0.303SS..Hα-helixtrans-58.7-33.4177.4-72.6177.7-10.200113.1R78 L80 L86R78-Q82 WeakPolarHBondContact O-CG 3.32Å; R78-Q82 PolarHBondContact O-N 2.67Å; L80-Q82 PolarHBondContact O-N 3.08Å; Q82-L86 WeakPolarHBondContact O-CB 3.31Å; Q82-L86 WeakPolarHBondContact O-CD1 3.49Å; Q82-L86 VanDerWaalsContact O-CG 3.24Å; Q82-L86 WeakPolarHBondContact O-CG 3.47Å; Q82-L86 PolarHBondContact O-N 3.14Å
83R70.9Confident72.3Confident77 Ų7758.7 Ų58.729%0.29129%0.292SS..Hα-helixtrans-72.2-32.5174.3-76-174.3178.6-148-8.7113.2N79 L80 R81 E85 E87 L100 E103 Y107N79-R83 WeakPolarHBondContact O-CG 3.32Å; N79-R83 PolarHBondContact O-N 3.03Å; L80-R83 PolarHBondContact O-N 3.49Å; L80-R83 VanDerWaalsContact O-N 3.11Å; R81-R83 PolarHBondContact O-N 3.17Å; R83-E85 VanDerWaalsContact C-N 3.35Å; R83-E87 PolarHBondContact O-N 2.83Å; R83-L100 HydrophobicContact CB-CD1 3.89Å; R83-L100 HydrophobicContact CB-CD2 4.13Å; R83-E103 IonicContact CZ-OE2 3.65Å; R83-E103 IonicContact NH1-OE1 3.92Å; R83-E103 PolarHBondContact NH1-OE1 3.43Å; R83-E103 IonicContact NH1-OE2 2.72Å; R83-E103 PolarHBondContact NH1-OE2 3.09Å; R83-Y107 WeakPolarHBondContact CD-OH 3.15Å; R83-Y107 PolarHBondContact NE-OH 3.18Å
84V68.5Low72.1Confident47 Ų4762.4 Ų62.429%0.28531%0.307SS..Hα-helixtrans-64-43.1172.7-177.20000110.7L80 R81 L100 T169 I173L80-V84 WeakPolarHBondContact O-CG2 3.29Å; L80-V84 PolarHBondContact O-N 2.74Å; L80-V84 VanDerWaalsContact O-N 3.14Å; R81-V84 WeakPolarHBondContact O-CB 3.38Å; R81-V84 PolarHBondContact O-N 2.92Å; V84-L100 HydrophobicContact CG2-CD2 3.73Å; V84-T169 HydrophobicContact CG2-CG2 4.45Å; V84-I173 HydrophobicContact CG2-CD1 3.7Å; V84-I173 HydrophobicContact CG2-CG1 3.58Å
85E67.1Low71.9Confident112 Ų11260.9 Ų60.952%0.52330%0.295SS..Hα-helixtrans-68.7-35.5179.5-69.3158-175.300112.4R81 R83R81-E85 WeakPolarHBondContact CD-OE1 3.12Å; R81-E85 WeakPolarHBondContact CG-OE1 3.42Å; R81-E85 PolarHBondContact O-N 3.12Å; R81-E85 VanDerWaalsContact O-N 3.11Å; R83-E85 VanDerWaalsContact C-N 3.35Å
86L59.4Low71.2Confident140 Ų14059.7 Ų59.773%0.73329%0.291SS*.Hα-helixtrans-78.6-30.2179.1-76.1168.6000114.9Q82 G88Q82-L86 WeakPolarHBondContact O-CB 3.31Å; Q82-L86 WeakPolarHBondContact O-CD1 3.49Å; Q82-L86 VanDerWaalsContact O-CG 3.24Å; Q82-L86 WeakPolarHBondContact O-CG 3.47Å; Q82-L86 PolarHBondContact O-N 3.14Å; L86-G88 VanDerWaalsContact C-N 3.3Å; L86-G88 PolarHBondContact O-N 3.17Å
87E56.5Low70.2Confident56 Ų5666.6 Ų66.626%0.26232%0.323SS..Hα-helixtrans-70.7-20.4-173.2-84.9-162160.700113.9R83 Q93 T98 T99 L100R83-E87 PolarHBondContact O-N 2.83Å; E87-Q93 PolarHBondContact O-NE2 3.03Å; E87-Q93 PolarHBondContact O-OE1 2.85Å; E87-T98 WeakPolarHBondContact OE2-CB 3.45Å; E87-T98 PolarHBondContact OE2-OG1 3.27Å; E87-T99 VanDerWaalsContact OE1-CB 3.28Å; E87-T99 WeakPolarHBondContact OE1-CB 3.22Å; E87-T99 PolarHBondContact OE1-OG1 3.38Å; E87-L100 PolarHBondContact OE1-N 3.19Å; E87-L100 VanDerWaalsContact OE1-N 3.13Å; E87-L100 VanDerWaalsContact OE2-CB 3.25Å; E87-L100 WeakPolarHBondContact OE2-CB 3.48Å; E87-L100 PolarHBondContact OE2-N 3.39Å
88G55Low69.4Low33 Ų3367.2 Ų67.234%0.3433%0.327SS..  trans158.2171.4160.700000117.6L86L86-G88 VanDerWaalsContact C-N 3.3Å; L86-G88 PolarHBondContact O-N 3.17Å
89H59.8Low68.4Low159 Ų15965.7 Ų65.774%0.73633%0.333SS*.SBendtrans-111.813.3-168.9-53.4-17.4000113.8
90G65Low67.6Low19 Ų1963 Ų6320%0.19632%0.318CS..  trans-97.5138.6-179.400000112.9F92 Q93 D192G90-F92 VanDerWaalsContact C-N 3.26Å; G90-F92 PolarHBondContact O-N 3.01Å; G90-Q93 VanDerWaalsContact O-CB 3.31Å; G90-Q93 WeakPolarHBondContact O-CB 3.32Å; G90-Q93 PolarHBondContact O-N 2.95Å; G90-D192 WeakPolarHBondContact CA-OD2 3.37Å
91N75.5Confident67.1Low44 Ų4464 Ų6424%0.23533%0.325CS..G310 helixtrans-57.9-37.4169.7-84.7-39.1000112.6Q93 K94 D188 D192 K195N91-Q93 PolarHBondContact O-N 2.85Å; N91-Q93 VanDerWaalsContact O-N 3.12Å; N91-K94 WeakPolarHBondContact O-CD 3.16Å; N91-K94 WeakPolarHBondContact O-CE 3.47Å; N91-K94 VanDerWaalsContact O-CG 3.31Å; N91-K94 WeakPolarHBondContact O-CG 3.47Å; N91-K94 PolarHBondContact O-N 3.29Å; N91-K94 PolarHBondContact OD1-NZ 2.92Å; N91-D188 HydrophobicContact CB-CB 3.78Å; N91-D188 VanDerWaalsContact CB-OD1 3.3Å; N91-D188 WeakPolarHBondContact CB-OD1 3.44Å; N91-D192 WeakPolarHBondContact CA-OD2 3.36Å; N91-D192 WeakPolarHBondContact CB-OD2 3.4Å; N91-D192 VanDerWaalsContact N-CG 3.33Å; N91-D192 PolarHBondContact N-OD1 2.89Å; N91-D192 VanDerWaalsContact N-OD1 3.16Å; N91-D192 PolarHBondContact N-OD2 3.36Å; N91-K195 PolarHBondContact ND2-NZ 3.17Å
92F73.1Confident66.5Low9 Ų964.7 Ų64.74%0.03933%0.333CS..G310 helixtrans-59.3-20.8178.582.9-69.3000114.2G90 K94 Y95 L96 I189 D192 T245 T248 I249 L252G90-F92 VanDerWaalsContact C-N 3.26Å; G90-F92 PolarHBondContact O-N 3.01Å; F92-K94 PolarHBondContact O-N 3.29Å; F92-Y95 WeakPolarHBondContact O-CD2 3.4Å; F92-Y95 PolarHBondContact O-N 3.32Å; F92-Y95 VanDerWaalsContact O-N 3.09Å; F92-L96 HydrophobicContact CD2-CD1 4.03Å; F92-L96 HydrophobicContact CE2-CD1 3.59Å; F92-L96 HydrophobicContact CZ-CD1 4.43Å; F92-I189 HydrophobicContact CB-CG1 3.79Å; F92-D192 WeakPolarHBondContact CD1-OD2 3.45Å; F92-D192 PolarHBondContact N-OD2 2.88Å; F92-T245 HydrophobicContact CD1-CG2 4.49Å; F92-T245 HydrophobicContact CE1-CG2 3.6Å; F92-T245 HydrophobicContact CZ-CG2 3.83Å; F92-T248 WeakPolarHBondContact CE2-OG1 3.48Å; F92-I249 HydrophobicContact CB-CG1 4.26Å; F92-I249 HydrophobicContact CD1-CD1 4.21Å; F92-I249 HydrophobicContact CD1-CG1 4.12Å; F92-I249 HydrophobicContact CD2-CD1 4.44Å; F92-I249 HydrophobicContact CD2-CG1 3.49Å; F92-I249 VanDerWaalsContact CD2-CG1 3.49Å; F92-I249 HydrophobicContact CE1-CG1 4.39Å; F92-I249 HydrophobicContact CE2-CG1 3.76Å; F92-I249 HydrophobicContact CG-CD1 4.19Å; F92-I249 HydrophobicContact CG-CG1 3.68Å; F92-I249 HydrophobicContact CZ-CG1 4.22Å; F92-L252 HydrophobicContact CD2-CD2 4.27Å
93Q72.1Confident66.4Low43 Ų4362.2 Ų62.220%0.20132%0.322CS..G310 helixtrans-65.5-24.1-175.5-170.3147.2-0.300113.1E87 G90 N91 Y95 L96 T98E87-Q93 PolarHBondContact O-NE2 3.03Å; E87-Q93 PolarHBondContact O-OE1 2.85Å; G90-Q93 VanDerWaalsContact O-CB 3.31Å; G90-Q93 WeakPolarHBondContact O-CB 3.32Å; G90-Q93 PolarHBondContact O-N 2.95Å; N91-Q93 PolarHBondContact O-N 2.85Å; N91-Q93 VanDerWaalsContact O-N 3.12Å; Q93-Y95 PolarHBondContact O-N 2.94Å; Q93-L96 PolarHBondContact O-N 3.4Å; Q93-L96 VanDerWaalsContact O-N 3.13Å; Q93-T98 HydrophobicContact CG-CG2 4.01Å
94K74.7Confident66.6Low83 Ų8359.6 Ų59.636%0.36131%0.313SS..G310 helixtrans-57.2-18.9173-56.5164.1-157159.40113.2N91 F92 P175 I176 D188N91-K94 WeakPolarHBondContact O-CD 3.16Å; N91-K94 WeakPolarHBondContact O-CE 3.47Å; N91-K94 VanDerWaalsContact O-CG 3.31Å; N91-K94 WeakPolarHBondContact O-CG 3.47Å; N91-K94 PolarHBondContact O-N 3.29Å; N91-K94 PolarHBondContact OD1-NZ 2.92Å; F92-K94 PolarHBondContact O-N 3.29Å; K94-P175 WeakPolarHBondContact O-CA 3.4Å; K94-I176 HydrophobicContact CB-CD1 4.19Å; K94-I176 PolarHBondContact O-N 3.06Å; K94-D188 IonicContact NZ-OD1 2.75Å; K94-D188 PolarHBondContact NZ-OD1 3.38Å; K94-D188 IonicContact NZ-OD2 3.15Å
95Y74.4Confident66.9Low12 Ų1262.9 Ų62.95%0.04733%0.325CS..G310 helixtrans-104.90.2-177.3-53.2-85000113.8F92 Q93 I176 P178 S184 F185 D188F92-Y95 WeakPolarHBondContact O-CD2 3.4Å; F92-Y95 PolarHBondContact O-N 3.32Å; F92-Y95 VanDerWaalsContact O-N 3.09Å; Q93-Y95 PolarHBondContact O-N 2.94Å; Y95-I176 HydrophobicContact CD1-CB 3.94Å; Y95-I176 HydrophobicContact CD1-CG2 3.99Å; Y95-I176 WeakPolarHBondContact CD1-O 3.14Å; Y95-I176 HydrophobicContact CE1-CB 3.93Å; Y95-I176 HydrophobicContact CE1-CG2 3.6Å; Y95-P178 HydrophobicContact CD1-CB 4.21Å; Y95-S184 VanDerWaalsContact OH-C 3.23Å; Y95-S184 PolarHBondContact OH-O 3.24Å; Y95-S184 PolarHBondContact OH-OG 3.43Å; Y95-F185 HydrophobicContact CD1-CB 4.39Å; Y95-F185 AromaticContact CD1-CD2 3.79Å; Y95-F185 HydrophobicContact CD1-CD2 3.79Å; Y95-F185 AromaticContact CD2-CD2 3.93Å; Y95-F185 HydrophobicContact CD2-CD2 3.93Å; Y95-F185 HydrophobicContact CE1-CB 3.91Å; Y95-F185 HydrophobicContact CE1-CD2 4.12Å; Y95-F185 HydrophobicContact CE2-CD2 4.27Å; Y95-F185 AromaticContact CG-CD2 3.71Å; Y95-F185 HydrophobicContact CG-CD2 3.71Å; Y95-F185 HydrophobicContact CG-CE2 4.3Å; Y95-F185 PolarHBondContact OH-N 3.45Å; Y95-D188 HydrophobicContact CE2-CB 3.84Å; Y95-D188 WeakPolarHBondContact CE2-OD2 3.29Å; Y95-D188 VanDerWaalsContact CZ-OD2 3.3Å; Y95-D188 PolarHBondContact OH-OD2 3.4Å
96L67.9Low67.5Low48 Ų4860 Ų6025%0.25131%0.312SS..SBendtrans-101.3138.8-179.5-72.2176.5000112.2F92 Q93 T98 L252F92-L96 HydrophobicContact CD2-CD1 4.03Å; F92-L96 HydrophobicContact CE2-CD1 3.59Å; F92-L96 HydrophobicContact CZ-CD1 4.43Å; Q93-L96 PolarHBondContact O-N 3.4Å; Q93-L96 VanDerWaalsContact O-N 3.13Å; L96-T98 VanDerWaalsContact C-N 3.28Å; L96-T98 HydrophobicContact CB-CG2 4.44Å; L96-T98 PolarHBondContact O-N 2.87Å; L96-L252 HydrophobicContact CD2-CB 4.44Å; L96-L252 HydrophobicContact CD2-CD1 4.09Å; L96-L252 HydrophobicContact CD2-CD2 4.09Å; L96-L252 HydrophobicContact CD2-CG 4.44Å; L96-L252 HydrophobicContact CG-CD2 4.27Å
97E62.9Low68.5Low157 Ų15753.9 Ų53.973%0.73428%0.279SS*.  trans-72.282.5164-72.9-176.6-178.600109.5P175E97-P175 HydrophobicContact CG-CG 4.17Å
98T63.7Low69.7Low22 Ų2254.6 Ų54.614%0.13528%0.283CS..  trans-66.9169.3-179.681.70000112E87 Q93 L96 L100 T101 N102E87-T98 WeakPolarHBondContact OE2-CB 3.45Å; E87-T98 PolarHBondContact OE2-OG1 3.27Å; Q93-T98 HydrophobicContact CG-CG2 4.01Å; L96-T98 VanDerWaalsContact C-N 3.28Å; L96-T98 HydrophobicContact CB-CG2 4.44Å; L96-T98 PolarHBondContact O-N 2.87Å; T98-L100 PolarHBondContact O-N 2.76Å; T98-L100 PolarHBondContact OG1-N 3.11Å; T98-T101 PolarHBondContact N-OG1 3.06Å; T98-T101 PolarHBondContact O-N 2.92Å; T98-T101 VanDerWaalsContact O-N 3.12Å; T98-T101 PolarHBondContact O-OG1 3.47Å; T98-T101 PolarHBondContact OG1-N 2.9Å; T98-N102 PolarHBondContact O-ND2 3.04Å
99T60.3Low71Confident103 Ų10360.9 Ų60.963%0.63230%0.296SS*.Hα-helixtrans-55-40.3171.611.90000112.1E87 T101 N102 E103E87-T99 VanDerWaalsContact OE1-CB 3.28Å; E87-T99 WeakPolarHBondContact OE1-CB 3.22Å; E87-T99 PolarHBondContact OE1-OG1 3.38Å; T99-T101 VanDerWaalsContact C-N 3.32Å; T99-T101 PolarHBondContact O-N 3.18Å; T99-N102 PolarHBondContact O-N 3.42Å; T99-E103 PolarHBondContact O-N 2.94Å
100L63.3Low72Confident2 Ų256.5 Ų56.51%0.0127%0.273CS..Hα-helixtrans-61.6-35.1177.1-159.662.9000113.1L80 R83 V84 E87 T98 N102 E103 I104 Y107 I173L80-L100 HydrophobicContact CD1-CD1 3.97Å; L80-L100 HydrophobicContact CD1-CD2 4.21Å; L80-L100 HydrophobicContact CD1-CG 4.27Å; R83-L100 HydrophobicContact CB-CD1 3.89Å; R83-L100 HydrophobicContact CB-CD2 4.13Å; V84-L100 HydrophobicContact CG2-CD2 3.73Å; E87-L100 PolarHBondContact OE1-N 3.19Å; E87-L100 VanDerWaalsContact OE1-N 3.13Å; E87-L100 VanDerWaalsContact OE2-CB 3.25Å; E87-L100 WeakPolarHBondContact OE2-CB 3.48Å; E87-L100 PolarHBondContact OE2-N 3.39Å; T98-L100 PolarHBondContact O-N 2.76Å; T98-L100 PolarHBondContact OG1-N 3.11Å; L100-N102 VanDerWaalsContact C-N 3.26Å; L100-N102 PolarHBondContact O-N 2.98Å; L100-E103 CarbonylContact O-C 3.59Å; L100-E103 WeakPolarHBondContact O-CA 3.12Å; L100-E103 PolarHBondContact O-N 3.01Å; L100-I104 WeakPolarHBondContact O-CG1 3.48Å; L100-I104 PolarHBondContact O-N 3.21Å; L100-Y107 HydrophobicContact CD1-CE2 4.2Å; L100-I173 HydrophobicContact CB-CG2 4.1Å; L100-I173 HydrophobicContact CD2-CD1 3.7Å; L100-I173 HydrophobicContact CD2-CG1 3.95Å; L100-I173 HydrophobicContact CD2-CG2 3.93Å; L100-I173 HydrophobicContact CG-CD1 4.25Å; L100-I173 HydrophobicContact CG-CG2 4Å
101T65.9Low72.9Confident23 Ų2356 Ų5614%0.14127%0.266CS..Hα-helixtrans-58.7-36.7176.269.30000112.8T98 T99 E103 I173 P175T98-T101 PolarHBondContact N-OG1 3.06Å; T98-T101 PolarHBondContact O-N 2.92Å; T98-T101 VanDerWaalsContact O-N 3.12Å; T98-T101 PolarHBondContact O-OG1 3.47Å; T98-T101 PolarHBondContact OG1-N 2.9Å; T99-T101 VanDerWaalsContact C-N 3.32Å; T99-T101 PolarHBondContact O-N 3.18Å; T101-E103 VanDerWaalsContact C-N 3.35Å; T101-I173 HydrophobicContact CG2-CG2 4.2Å; T101-P175 HydrophobicContact CG2-CG 4.28Å
102N65.6Low73.2Confident81 Ų8159 Ų5943%0.43328%0.278SS..Hα-helixtrans-74.8-27.9175.6-75.9-93.5000111.6T98 T99 L100T98-N102 PolarHBondContact O-ND2 3.04Å; T99-N102 PolarHBondContact O-N 3.42Å; L100-N102 VanDerWaalsContact C-N 3.26Å; L100-N102 PolarHBondContact O-N 2.98Å
103E73.3Confident73.6Confident37 Ų3760.2 Ų60.217%0.17329%0.293CS..Hα-helixtrans-81.7-18.9174.6-68.2-170.3151.500114.1R83 T99 L100 T101 Q105 H106 Y107R83-E103 IonicContact CZ-OE2 3.65Å; R83-E103 IonicContact NH1-OE1 3.92Å; R83-E103 PolarHBondContact NH1-OE1 3.43Å; R83-E103 IonicContact NH1-OE2 2.72Å; R83-E103 PolarHBondContact NH1-OE2 3.09Å; T99-E103 PolarHBondContact O-N 2.94Å; L100-E103 CarbonylContact O-C 3.59Å; L100-E103 WeakPolarHBondContact O-CA 3.12Å; L100-E103 PolarHBondContact O-N 3.01Å; T101-E103 VanDerWaalsContact C-N 3.35Å; E103-Q105 PolarHBondContact O-N 3.34Å; E103-Q105 VanDerWaalsContact O-N 3.16Å; E103-H106 WeakPolarHBondContact O-CA 3.42Å; E103-H106 WeakPolarHBondContact O-CB 3.47Å; E103-H106 PolarHBondContact O-N 3.41Å; E103-Y107 HydrophobicContact CB-CD2 4.03Å; E103-Y107 HydrophobicContact CB-CE2 4.1Å; E103-Y107 WeakPolarHBondContact O-CD2 3.47Å; E103-Y107 PolarHBondContact O-N 3.28Å
104I74Confident74Confident21 Ų2159 Ų5911%0.10829%0.288CS..Hα-helixtrans-48.1-48.1178.2-70.7173.2000110.4L100 H106 Y107 E108 I170 I173L100-I104 WeakPolarHBondContact O-CG1 3.48Å; L100-I104 PolarHBondContact O-N 3.21Å; I104-H106 PolarHBondContact O-N 2.95Å; I104-H106 VanDerWaalsContact O-N 3.14Å; I104-Y107 PolarHBondContact O-N 3.28Å; I104-Y107 VanDerWaalsContact O-N 3.13Å; I104-E108 HydrophobicContact CG2-CG 3.98Å; I104-E108 WeakPolarHBondContact O-CB 3.34Å; I104-E108 WeakPolarHBondContact O-CG 3.42Å; I104-E108 PolarHBondContact O-N 3.14Å; I104-I170 HydrophobicContact CG2-CD1 3.79Å; I104-I170 HydrophobicContact CG2-CG1 4.29Å; I104-I173 HydrophobicContact CD1-CB 4.05Å; I104-I173 HydrophobicContact CD1-CG2 3.77Å; I104-I173 HydrophobicContact CG1-CG2 4.14Å
105Q75.5Confident74.2Confident116 Ų11656.8 Ų56.854%0.54228%0.28SS..Hα-helixtrans-61.8-24.8179.9-64.2-168.518.700113.8E103 R109E103-Q105 PolarHBondContact O-N 3.34Å; E103-Q105 VanDerWaalsContact O-N 3.16Å; Q105-R109 WeakPolarHBondContact O-CB 3.43Å; Q105-R109 WeakPolarHBondContact O-CD 3.5Å; Q105-R109 WeakPolarHBondContact O-CG 3.26Å; Q105-R109 PolarHBondContact O-N 2.78Å; Q105-R109 PolarHBondContact O-NE 2.93Å; Q105-R109 VanDerWaalsContact O-NE 3.13Å
106H79.4Confident74.4Confident53 Ų5360.8 Ų60.825%0.24530%0.302CS..Hα-helixtrans-82.3-42.9174.9162.9-107.8000110.9E103 I104 R109 R110E103-H106 WeakPolarHBondContact O-CA 3.42Å; E103-H106 WeakPolarHBondContact O-CB 3.47Å; E103-H106 PolarHBondContact O-N 3.41Å; I104-H106 PolarHBondContact O-N 2.95Å; I104-H106 VanDerWaalsContact O-N 3.14Å; H106-R109 PolarHBondContact O-N 3.01Å; H106-R110 PolarHBondContact CE1-NE 2.59Å; H106-R110 PolarHBondContact CE1-NH2 2.84Å; H106-R110 VanDerWaalsContact CE1-NH2 3.31Å; H106-R110 PolarHBondContact NE2-NE 3.21Å; H106-R110 PolarHBondContact NE2-NH2 3.3Å; H106-R110 WeakPolarHBondContact O-CG 3.25Å; H106-R110 PolarHBondContact O-N 2.89Å
107Y80.2Confident74.9Confident11 Ų1160.8 Ų60.84%0.04331%0.306CS..Hα-helixtrans-59.3-46.5171.4-83.4-88.3000111.7L76 L80 R83 L100 E103 I104 R109 R110 K111 W166L76-Y107 HydrophobicContact CD1-CD1 3.63Å; L76-Y107 HydrophobicContact CD1-CE1 3.76Å; L76-Y107 HydrophobicContact CG-CD1 4.08Å; L76-Y107 HydrophobicContact CG-CE1 4.46Å; L80-Y107 HydrophobicContact CB-CD1 4.18Å; L80-Y107 HydrophobicContact CB-CE1 4.03Å; L80-Y107 HydrophobicContact CD1-CD1 4Å; L80-Y107 HydrophobicContact CD1-CD2 4.14Å; L80-Y107 HydrophobicContact CD1-CE1 4.11Å; L80-Y107 HydrophobicContact CD1-CE2 4.27Å; L80-Y107 HydrophobicContact CD1-CG 4.03Å; L80-Y107 HydrophobicContact CG-CD1 4.48Å; R83-Y107 WeakPolarHBondContact CD-OH 3.15Å; R83-Y107 PolarHBondContact NE-OH 3.18Å; L100-Y107 HydrophobicContact CD1-CE2 4.2Å; E103-Y107 HydrophobicContact CB-CD2 4.03Å; E103-Y107 HydrophobicContact CB-CE2 4.1Å; E103-Y107 WeakPolarHBondContact O-CD2 3.47Å; E103-Y107 PolarHBondContact O-N 3.28Å; I104-Y107 PolarHBondContact O-N 3.28Å; I104-Y107 VanDerWaalsContact O-N 3.13Å; Y107-R109 PolarHBondContact O-N 2.81Å; Y107-R110 WeakPolarHBondContact O-CB 3.35Å; Y107-R110 PolarHBondContact O-N 3.25Å; Y107-R110 VanDerWaalsContact O-N 3.13Å; Y107-K111 PolarHBondContact O-N 3.39Å; Y107-W166 VanDerWaalsContact C-CZ2 3.49Å; Y107-W166 HydrophobicContact CD1-CH2 4.17Å; Y107-W166 WeakPolarHBondContact O-CH2 3.39Å; Y107-W166 WeakPolarHBondContact O-CZ2 3.38Å
108E81.3Confident75.5Confident71 Ų7153.3 Ų53.333%0.33227%0.271SS..Hα-helixtrans-59.9-42.6174.6-74.4-173.7140.500112.4I104 R110 K111 H112 I170I104-E108 HydrophobicContact CG2-CG 3.98Å; I104-E108 WeakPolarHBondContact O-CB 3.34Å; I104-E108 WeakPolarHBondContact O-CG 3.42Å; I104-E108 PolarHBondContact O-N 3.14Å; E108-R110 VanDerWaalsContact C-N 3.27Å; E108-R110 PolarHBondContact O-N 3.48Å; E108-K111 PolarHBondContact O-N 2.87Å; E108-H112 PolarHBondContact O-N 3.37Å; E108-H112 PolarHBondContact O-ND1 3.21Å; E108-I170 HydrophobicContact CG-CD1 3.73Å
109R82.2Confident76Confident165 Ų16553.9 Ų53.962%0.62327%0.273SS*.Hα-helixtrans-63.7-34.6176.2-75.2165.9-153.4171.68.8111.7Q105 H106 Y107 G113Q105-R109 WeakPolarHBondContact O-CB 3.43Å; Q105-R109 WeakPolarHBondContact O-CD 3.5Å; Q105-R109 WeakPolarHBondContact O-CG 3.26Å; Q105-R109 PolarHBondContact O-N 2.78Å; Q105-R109 PolarHBondContact O-NE 2.93Å; Q105-R109 VanDerWaalsContact O-NE 3.13Å; H106-R109 PolarHBondContact O-N 3.01Å; Y107-R109 PolarHBondContact O-N 2.81Å; R109-G113 PolarHBondContact O-N 2.92Å
110R81.9Confident76.7Confident66 Ų6651.3 Ų51.325%0.24926%0.259CS..Hα-helixtrans-67-50.7171.9-70.8-175.1177.7-166.1-4.3111.5L76 H106 Y107 E108 H112 G113 I114 Y1512L76-R110 HydrophobicContact CD1-CB 4.21Å; L76-R110 HydrophobicContact CD2-CB 3.57Å; H106-R110 PolarHBondContact CE1-NE 2.59Å; H106-R110 PolarHBondContact CE1-NH2 2.84Å; H106-R110 VanDerWaalsContact CE1-NH2 3.31Å; H106-R110 PolarHBondContact NE2-NE 3.21Å; H106-R110 PolarHBondContact NE2-NH2 3.3Å; H106-R110 WeakPolarHBondContact O-CG 3.25Å; H106-R110 PolarHBondContact O-N 2.89Å; Y107-R110 WeakPolarHBondContact O-CB 3.35Å; Y107-R110 PolarHBondContact O-N 3.25Å; Y107-R110 VanDerWaalsContact O-N 3.13Å; E108-R110 VanDerWaalsContact C-N 3.27Å; E108-R110 PolarHBondContact O-N 3.48Å; R110-H112 PolarHBondContact O-N 2.8Å; R110-G113 WeakPolarHBondContact O-CA 3.28Å; R110-G113 PolarHBondContact O-N 3.33Å; R110-I114 WeakPolarHBondContact O-CG1 3.43Å; R110-I114 PolarHBondContact O-N 2.98Å; R110-Y1512 HydrophobicContact CG-CD1 3.8Å; R110-Y1512 HydrophobicContact CG-CE1 3.7Å; R110-Y1512 VanDerWaalsContact NE-CD1 3.27Å
111K83.9Confident77Confident10 Ų1052 Ų524%0.04326%0.264CS..Hα-helixtrans-50.4-54.2173.8174.3173.870.4169.20111.2L73 Y107 E108 G113 I114 I115 W166 D167L73-K111 HydrophobicContact CD1-CB 4.49Å; L73-K111 HydrophobicContact CD1-CG 4.25Å; Y107-K111 PolarHBondContact O-N 3.39Å; E108-K111 PolarHBondContact O-N 2.87Å; K111-G113 VanDerWaalsContact C-N 3.28Å; K111-G113 PolarHBondContact O-N 3.01Å; K111-I114 PolarHBondContact O-N 2.7Å; K111-I115 HydrophobicContact CD-CD1 3.9Å; K111-I115 HydrophobicContact CG-CD1 3.52Å; K111-I115 HydrophobicContact CG-CG1 4.15Å; K111-I115 WeakPolarHBondContact O-CB 3.47Å; K111-I115 WeakPolarHBondContact O-CG1 3.43Å; K111-I115 PolarHBondContact O-N 3.46Å; K111-W166 HydrophobicContact CB-CD2 4.41Å; K111-W166 HydrophobicContact CB-CE3 4.42Å; K111-W166 HydrophobicContact CB-CH2 3.88Å; K111-W166 HydrophobicContact CB-CZ2 3.84Å; K111-W166 HydrophobicContact CB-CZ3 4.18Å; K111-W166 HydrophobicContact CD-CB 4.39Å; K111-W166 HydrophobicContact CD-CD2 3.6Å; K111-W166 HydrophobicContact CD-CE3 4.1Å; K111-W166 HydrophobicContact CD-CG 3.7Å; K111-W166 HydrophobicContact CD-CZ2 4.43Å; K111-W166 HydrophobicContact CG-CD2 4.46Å; K111-D167 IonicContact NZ-OD1 3.95Å; K111-D167 PolarHBondContact NZ-OD1 3.14Å; K111-D167 VanDerWaalsContact NZ-OD1 3.14Å
112H82Confident77Confident105 Ų10552.2 Ų52.249%0.48626%0.264SS..Hα-helixtrans-63.6-32.3179.6-71.990.2000112.4E108 R110 N116E108-H112 PolarHBondContact O-N 3.37Å; E108-H112 PolarHBondContact O-ND1 3.21Å; R110-H112 PolarHBondContact O-N 2.8Å; H112-N116 WeakPolarHBondContact O-CB 3.38Å; H112-N116 PolarHBondContact O-N 2.79Å; H112-N116 PolarHBondContact O-ND2 2.85Å
113G80.8Confident76.9Confident35 Ų3552.7 Ų52.736%0.36127%0.266SS..Hα-helixtrans-62.9-47.817200000113R109 R110 K111 S117R109-G113 PolarHBondContact O-N 2.92Å; R110-G113 WeakPolarHBondContact O-CA 3.28Å; R110-G113 PolarHBondContact O-N 3.33Å; K111-G113 VanDerWaalsContact C-N 3.28Å; K111-G113 PolarHBondContact O-N 3.01Å; G113-S117 WeakPolarHBondContact O-CB 3.37Å; G113-S117 PolarHBondContact O-N 3.37Å; G113-S117 PolarHBondContact O-OG 2.65Å
114I80.1Confident76Confident18 Ų1858.4 Ų58.49%0.09229%0.291CS..Hα-helixtrans-67.3-50.8179.5-62.3164.4000110.8L69 D72 L73 L76 R110 K111 N116 S117 I118L69-I114 HydrophobicContact CB-CG2 4.19Å; L69-I114 HydrophobicContact CD2-CG2 4.28Å; L69-I114 WeakPolarHBondContact O-CG2 3.43Å; D72-I114 HydrophobicContact CB-CD1 4.3Å; L73-I114 HydrophobicContact CB-CG2 4.04Å; L73-I114 HydrophobicContact CD1-CD1 4.38Å; L76-I114 HydrophobicContact CD2-CD1 3.98Å; R110-I114 WeakPolarHBondContact O-CG1 3.43Å; R110-I114 PolarHBondContact O-N 2.98Å; K111-I114 PolarHBondContact O-N 2.7Å; I114-N116 PolarHBondContact O-N 2.69Å; I114-S117 WeakPolarHBondContact O-CA 3.47Å; I114-S117 WeakPolarHBondContact O-CB 3.38Å; I114-S117 PolarHBondContact O-N 3.06Å; I114-I118 HydrophobicContact CG2-CD1 4.02Å; I114-I118 WeakPolarHBondContact O-CG1 3.43Å; I114-I118 PolarHBondContact O-N 3.26Å
115I78.8Confident74.8Confident37 Ų3760.9 Ų60.919%0.1931%0.309CS..Hα-helixtrans-59-45.1177.9-67.2179.5000111.1L73 K111 S117 I118 L119 L159L73-I115 HydrophobicContact CD2-CG1 4.34Å; K111-I115 HydrophobicContact CD-CD1 3.9Å; K111-I115 HydrophobicContact CG-CD1 3.52Å; K111-I115 HydrophobicContact CG-CG1 4.15Å; K111-I115 WeakPolarHBondContact O-CB 3.47Å; K111-I115 WeakPolarHBondContact O-CG1 3.43Å; K111-I115 PolarHBondContact O-N 3.46Å; I115-S117 PolarHBondContact O-N 3.06Å; I115-I118 PolarHBondContact O-N 2.86Å; I115-L119 HydrophobicContact CG2-CD1 3.87Å; I115-L119 HydrophobicContact CG2-CG 4.25Å; I115-L119 WeakPolarHBondContact O-CB 3.37Å; I115-L119 WeakPolarHBondContact O-CG 3.45Å; I115-L119 PolarHBondContact O-N 3.49Å; I115-L159 HydrophobicContact CG1-CD2 4.42Å
116N78.7Confident73.1Confident96 Ų9658.7 Ų58.751%0.51330%0.299SS..Hα-helixtrans-64.1-28175-73.5-37.3000112.4H112 I114 S120H112-N116 WeakPolarHBondContact O-CB 3.38Å; H112-N116 PolarHBondContact O-N 2.79Å; H112-N116 PolarHBondContact O-ND2 2.85Å; I114-N116 PolarHBondContact O-N 2.69Å; N116-S120 WeakPolarHBondContact O-CB 3.35Å; N116-S120 PolarHBondContact O-N 3.12Å; N116-S120 PolarHBondContact O-OG 3.42Å
117S78.5Confident71.2Confident48 Ų4860.9 Ų60.934%0.33632%0.32SS..Hα-helixtrans-72.9-43.5176.7-58.50000110.8G113 I114 I115 S120 T121G113-S117 WeakPolarHBondContact O-CB 3.37Å; G113-S117 PolarHBondContact O-N 3.37Å; G113-S117 PolarHBondContact O-OG 2.65Å; I114-S117 WeakPolarHBondContact O-CA 3.47Å; I114-S117 WeakPolarHBondContact O-CB 3.38Å; I114-S117 PolarHBondContact O-N 3.06Å; I115-S117 PolarHBondContact O-N 3.06Å; S117-S120 PolarHBondContact O-N 2.96Å; S117-S120 PolarHBondContact O-OG 3.31Å; S117-T121 WeakPolarHBondContact O-CB 3.34Å; S117-T121 PolarHBondContact O-N 3.31Å; S117-T121 VanDerWaalsContact O-N 3.13Å; S117-T121 PolarHBondContact O-OG1 3.1Å
118I76.2Confident69.1Low0 Ų065.8 Ų65.80%035%0.354CS..Hα-helixtrans-62.2-50.6173.5-61.6168000110.1L69 L70 I114 I115 S120 T121 L122 L155 L159L69-I118 HydrophobicContact CB-CD1 3.87Å; L69-I118 HydrophobicContact CB-CG1 3.49Å; L69-I118 VanDerWaalsContact CB-CG1 3.49Å; L69-I118 HydrophobicContact CD1-CG1 3.86Å; L69-I118 HydrophobicContact CG-CG1 4.29Å; L70-I118 HydrophobicContact CD2-CD1 4.07Å; L70-I118 HydrophobicContact CG-CD1 4.25Å; I114-I118 HydrophobicContact CG2-CD1 4.02Å; I114-I118 WeakPolarHBondContact O-CG1 3.43Å; I114-I118 PolarHBondContact O-N 3.26Å; I115-I118 PolarHBondContact O-N 2.86Å; I118-S120 PolarHBondContact O-N 3.27Å; I118-T121 WeakPolarHBondContact O-CA 3.4Å; I118-T121 WeakPolarHBondContact O-CB 3.44Å; I118-T121 PolarHBondContact O-N 3.1Å; I118-L122 HydrophobicContact CG2-CD1 4.02Å; I118-L122 PolarHBondContact O-N 3.36Å; I118-L155 HydrophobicContact CG2-CD2 3.8Å; I118-L159 HydrophobicContact CD1-CD2 3.96Å; I118-L159 HydrophobicContact CG2-CD1 4.07Å
119L74.6Confident67.1Low33 Ų3367.4 Ų67.417%0.17336%0.364CS..Hα-helixtrans-57.8-45.4175.4-70.1174.4000111.7I115 T121 L122 D123I115-L119 HydrophobicContact CG2-CD1 3.87Å; I115-L119 HydrophobicContact CG2-CG 4.25Å; I115-L119 WeakPolarHBondContact O-CB 3.37Å; I115-L119 WeakPolarHBondContact O-CG 3.45Å; I115-L119 PolarHBondContact O-N 3.49Å; L119-T121 PolarHBondContact O-N 3.11Å; L119-L122 PolarHBondContact O-N 3.32Å; L119-L122 VanDerWaalsContact O-N 3.15Å; L119-D123 WeakPolarHBondContact O-CB 3.42Å; L119-D123 PolarHBondContact O-N 2.94Å
120S74.4Confident65.2Low50 Ų5063 Ų6335%0.3536%0.357SS..Hα-helixtrans-67.4-7.717681.10000114.5N116 S117 I118 K124N116-S120 WeakPolarHBondContact O-CB 3.35Å; N116-S120 PolarHBondContact O-N 3.12Å; N116-S120 PolarHBondContact O-OG 3.42Å; S117-S120 PolarHBondContact O-N 2.96Å; S117-S120 PolarHBondContact O-OG 3.31Å; I118-S120 PolarHBondContact O-N 3.27Å; S120-K124 WeakPolarHBondContact O-CD 3.42Å; S120-K124 VanDerWaalsContact O-CE 3.28Å; S120-K124 WeakPolarHBondContact O-CE 3.41Å; S120-K124 WeakPolarHBondContact O-CG 3.48Å; S120-K124 PolarHBondContact O-NZ 2.75Å
121T70.7Confident63.2Low17 Ų1765 Ų6510%0.10438%0.381CS..Hα-helixtrans-99.4-32176-56.10000110.4S62 C66 S117 I118 L119 K124S62-T121 VanDerWaalsContact O-CG2 3.31Å; S62-T121 WeakPolarHBondContact O-CG2 3.36Å; C66-T121 VanDerWaalsContact SG-CG2 3.6Å; S117-T121 WeakPolarHBondContact O-CB 3.34Å; S117-T121 PolarHBondContact O-N 3.31Å; S117-T121 VanDerWaalsContact O-N 3.13Å; S117-T121 PolarHBondContact O-OG1 3.1Å; I118-T121 WeakPolarHBondContact O-CA 3.4Å; I118-T121 WeakPolarHBondContact O-CB 3.44Å; I118-T121 PolarHBondContact O-N 3.1Å; L119-T121 PolarHBondContact O-N 3.11Å; T121-K124 PolarHBondContact O-N 3.43Å
122L65.1Low61.2Low27 Ų2768.9 Ų68.914%0.14141%0.409CS..Hα-helixtrans-71.2-41.4167.3-66.6166.4000112.6I118 L119 K124 S125 Q126I118-L122 HydrophobicContact CG2-CD1 4.02Å; I118-L122 PolarHBondContact O-N 3.36Å; L119-L122 PolarHBondContact O-N 3.32Å; L119-L122 VanDerWaalsContact O-N 3.15Å; L122-K124 PolarHBondContact O-N 2.78Å; L122-S125 PolarHBondContact O-N 3.29Å; L122-S125 PolarHBondContact O-OG 3.29Å; L122-Q126 PolarHBondContact O-N 3.34Å
123D62.5Low59.4Low91 Ų9170.6 Ų70.649%0.48742%0.418SS..THydrogen-bonded Turntrans-63.7-10.5173.3-83.7-25.7000113.3L119L119-D123 WeakPolarHBondContact O-CB 3.42Å; L119-D123 PolarHBondContact O-N 2.94Å
124K56Low57.7Low157 Ų15772.3 Ų72.368%0.68342%0.418SS*.THydrogen-bonded Turntrans-90.8-15.6171.1-69.4175.9-169.4112.10113S120 T121 L122S120-K124 WeakPolarHBondContact O-CD 3.42Å; S120-K124 VanDerWaalsContact O-CE 3.28Å; S120-K124 WeakPolarHBondContact O-CE 3.41Å; S120-K124 WeakPolarHBondContact O-CG 3.48Å; S120-K124 PolarHBondContact O-NZ 2.75Å; T121-K124 PolarHBondContact O-N 3.43Å; L122-K124 PolarHBondContact O-N 2.78Å
125S48.5Very low56.2Low72 Ų7282.4 Ų82.450%0.50346%0.455SS..THydrogen-bonded Turntrans-109-16.4177.961.50000113.6L122L122-S125 PolarHBondContact O-N 3.29Å; L122-S125 PolarHBondContact O-OG 3.29Å
126Q40.3Very low54.4Low70 Ų7087.1 Ų87.133%0.32748%0.481SS..SBendtrans-124.9147.8173.4-61.4-162-31.700112.1L122 D149L122-Q126 PolarHBondContact O-N 3.34Å; Q126-D149 PolarHBondContact NE2-OD1 3.23Å
127S37.8Very low52.5Low99 Ų9987.7 Ų87.769%0.69248%0.479SS*.PPolyproline II helixtrans-63141175.152.80000111L129S127-L129 PolarHBondContact O-N 3.43Å
128P37.3Very low50.5Low115 Ų11589.6 Ų89.675%0.74749%0.492SS*.PPolyproline II helixtrans-61.5118-16123.5-35.4000113.2
129L39.7Very low48.5Very low104 Ų10496.3 Ų96.355%0.54553%0.533SS..PPolyproline II helixtrans-71.5147.6169.5-95.872.7000110.6S127 S131S127-L129 PolarHBondContact O-N 3.43Å; L129-S131 PolarHBondContact O-N 3.12Å
130P41.4Very low46.5Very low74 Ų7499 Ų9948%0.48156%0.56SS.*PPolyproline II helixtrans-67.6121.8179.527.7-33.8000111.2S132 E133P130-S132 PolarHBondContact O-N 3.25Å; P130-E133 PolarHBondContact O-N 3.43Å
131S39Very low44.8Very low107 Ų107101.3 Ų101.375%0.74858%0.576SS**THydrogen-bonded Turntrans-65.36.7-175.254.70000116L129L129-S131 PolarHBondContact O-N 3.12Å
132S43.2Very low43.2Very low91 Ų91107.9 Ų107.964%0.63661%0.61SS**THydrogen-bonded Turntrans-79-26.9172.644.90000114.2P130P130-S132 PolarHBondContact O-N 3.25Å
133E44.6Very low42Very low142 Ų142113.7 Ų113.766%0.66464%0.641SS**SBendtrans-92.9-23.4-170.6-63.2-176.1154.900113.3P130 R135 N136P130-E133 PolarHBondContact O-N 3.43Å; E133-R135 PolarHBondContact O-N 3.22Å; E133-N136 PolarHBondContact O-N 2.88Å
134L44.9Very low40.8Very low71 Ų71116.7 Ų116.737%0.37266%0.655SS.*THydrogen-bonded Turntrans-61.64-178.6-63.7172.7000116.1F137L134-F137 HydrophobicContact CB-CE2 4.24Å; L134-F137 HydrophobicContact CD2-CE2 3.75Å; L134-F137 HydrophobicContact CD2-CZ 3.56Å
135R48Very low39.7Very low229 Ų229113.9 Ų113.986%0.86466%0.656SS**THydrogen-bonded Turntrans-88.7-18.9178.8-81.6-169.3172.6-147.3-3.4114.8E133E133-R135 PolarHBondContact O-N 3.22Å
136N40.4Very low39.6Very low136 Ų136115.4 Ų115.473%0.72766%0.658SS**  trans-122.465.5-175.4-68.22.9000111E133 S138E133-N136 PolarHBondContact O-N 2.88Å; N136-S138 PolarHBondContact O-N 3.13Å
137F40Very low39.9Very low108 Ų108119.3 Ų119.347%0.47468%0.676SS.*  trans-73.372.6167.5-79.4-72.7000110.6L134 L156L134-F137 HydrophobicContact CB-CE2 4.24Å; L134-F137 HydrophobicContact CD2-CE2 3.75Å; L134-F137 HydrophobicContact CD2-CZ 3.56Å; F137-L156 HydrophobicContact CE1-CD2 3.87Å; F137-L156 HydrophobicContact CZ-CD2 4.06Å
138S36.6Very low40.4Very low89 Ų89121.1 Ų121.162%0.62268%0.678SS**  trans-128.398173.362.70000110.2N136N136-S138 PolarHBondContact O-N 3.13Å
139V33.1Very low41.2Very low141 Ų141117.8 Ų117.886%0.85565%0.654SS**  trans3590.4157.9-168.40000115.8
140A33.8Very low42.3Very low89 Ų89118.9 Ų118.974%0.73665%0.654SS**  trans-144.866.9169.600000110.3D142A140-D142 PolarHBondContact O-N 2.99Å; A140-D142 VanDerWaalsContact O-N 3.13Å
141S37.5Very low43.1Very low98 Ų98117.9 Ų117.969%0.68564%0.642SS**  trans-75.96.1-166.4-490000116
142D37.8Very low44.3Very low155 Ų155113.6 Ų113.683%0.82961%0.612SS**  trans-100.310.7-158.8-62.5-28.3000115.2A140A140-D142 PolarHBondContact O-N 2.99Å; A140-D142 VanDerWaalsContact O-N 3.13Å
143L39.4Very low45.5Very low149 Ų149112.4 Ų112.478%0.7860%0.604SS**  trans-128.1113.6-172.7-80.2171000115.8
144I37.5Very low46.8Very low154 Ų154108.9 Ų108.979%0.7959%0.589SS**  trans85.9150.6150.7-57164.5000115.5
145S33.3Very low48.1Very low99 Ų99105.7 Ų105.769%0.69257%0.572SS**  trans-137.1118.1-155.7-176.20000112.7
146N46.4Very low49.4Very low104 Ų10497.6 Ų97.656%0.55655%0.546SS*.  trans-150.1164.6148.2-66.5-72.3000108.6L148 D149 K150N146-L148 VanDerWaalsContact C-N 3.35Å; N146-L148 PolarHBondContact O-N 2.75Å; N146-D149 HydrophobicContact CB-CB 4.43Å; N146-D149 WeakPolarHBondContact CB-OD2 3.41Å; N146-D149 PolarHBondContact ND2-OD2 3.11Å; N146-D149 PolarHBondContact O-N 3.49Å; N146-K150 PolarHBondContact O-N 2.82Å
147E46.3Very low51.1Low151 Ų15195.2 Ų95.271%0.70653%0.533SS*.Hα-helixtrans-73.4-25179.2-61.9-165.2117.700113.9
148L47.1Very low52.8Low138 Ų13891.7 Ų91.772%0.72352%0.519SS*.Hα-helixtrans-67.7-38.6168.1-12272.3000111.4N146 K150 K151 S152N146-L148 VanDerWaalsContact C-N 3.35Å; N146-L148 PolarHBondContact O-N 2.75Å; L148-K150 VanDerWaalsContact C-N 3.28Å; L148-K150 PolarHBondContact O-N 3.31Å; L148-K151 PolarHBondContact O-N 3.38Å; L148-K151 VanDerWaalsContact O-N 3.12Å; L148-S152 PolarHBondContact O-N 3.12Å
149D55.7Low54.8Low45 Ų4588.2 Ų88.224%0.24149%0.493CS..Hα-helixtrans-70.5-21.6180-64.9-45.9000112.6Q126 N146 K151 S152 S153Q126-D149 PolarHBondContact NE2-OD1 3.23Å; N146-D149 HydrophobicContact CB-CB 4.43Å; N146-D149 WeakPolarHBondContact CB-OD2 3.41Å; N146-D149 PolarHBondContact ND2-OD2 3.11Å; N146-D149 PolarHBondContact O-N 3.49Å; D149-K151 VanDerWaalsContact C-N 3.31Å; D149-K151 PolarHBondContact O-N 3.02Å; D149-S152 WeakPolarHBondContact CA-OG 3.43Å; D149-S152 PolarHBondContact O-OG 2.92Å; D149-S153 WeakPolarHBondContact O-CB 3.41Å; D149-S153 PolarHBondContact O-N 3.39Å
150K62Low57Low126 Ų12682.8 Ų82.855%0.54847%0.465SS..Hα-helixtrans-60.8-39.6168.1-72.9-177.8178.6171.40112.1N146 L148 N154N146-K150 PolarHBondContact O-N 2.82Å; L148-K150 VanDerWaalsContact C-N 3.28Å; L148-K150 PolarHBondContact O-N 3.31Å; K150-N154 WeakPolarHBondContact O-CB 3.36Å; K150-N154 PolarHBondContact O-N 2.9Å; K150-N154 PolarHBondContact O-OD1 2.79Å
151K57.8Low59.2Low54 Ų5483.7 Ų83.724%0.23545%0.454CS..Hα-helixtrans-72.2-39.4-177.9-68-169.3177.2-174.60111.9N33 F63 L148 D149 L155N33-K151 WeakPolarHBondContact OD1-CE 3.3Å; F63-K151 HydrophobicContact CE2-CB 4.38Å; L148-K151 PolarHBondContact O-N 3.38Å; L148-K151 VanDerWaalsContact O-N 3.12Å; D149-K151 VanDerWaalsContact C-N 3.31Å; D149-K151 PolarHBondContact O-N 3.02Å; K151-L155 WeakPolarHBondContact O-CB 3.43Å; K151-L155 PolarHBondContact O-N 2.76Å
152S64.6Low61.1Low16 Ų1680 Ų8011%0.11243%0.427CS..Hα-helixtrans-71.2-39.5172.454.40000112.1L148 D149 L155 L156L148-S152 PolarHBondContact O-N 3.12Å; D149-S152 WeakPolarHBondContact CA-OG 3.43Å; D149-S152 PolarHBondContact O-OG 2.92Å; S152-L155 PolarHBondContact O-N 3.09Å; S152-L156 WeakPolarHBondContact O-CB 3.47Å; S152-L156 VanDerWaalsContact O-CG 3.3Å; S152-L156 WeakPolarHBondContact O-CG 3.12Å; S152-L156 PolarHBondContact O-N 2.64Å
153S67.8Low63.1Low67 Ų6775.3 Ų75.347%0.46940%0.4SS..Hα-helixtrans-60.5-48.6176.9-176.50000112.5D149 L155 L156 L157D149-S153 WeakPolarHBondContact O-CB 3.41Å; D149-S153 PolarHBondContact O-N 3.39Å; S153-L155 VanDerWaalsContact C-N 3.29Å; S153-L155 PolarHBondContact O-N 2.79Å; S153-L156 PolarHBondContact O-N 3.08Å; S153-L157 WeakPolarHBondContact O-CB 3.33Å; S153-L157 PolarHBondContact O-N 3.4Å
154N72.3Confident65.1Low68 Ų6874 Ų7436%0.36439%0.39SS..Hα-helixtrans-60.4-39175.5-73.48.5000112F29 K150 L157 I158F29-N154 HydrophobicContact CD2-CB 4.34Å; F29-N154 HydrophobicContact CE2-CB 3.72Å; K150-N154 WeakPolarHBondContact O-CB 3.36Å; K150-N154 PolarHBondContact O-N 2.9Å; K150-N154 PolarHBondContact O-OD1 2.79Å; N154-L157 PolarHBondContact O-N 3.1Å; N154-I158 WeakPolarHBondContact O-CG1 3.43Å; N154-I158 PolarHBondContact O-N 3.2Å
155L73.4Confident67Low3 Ų368 Ų682%0.01636%0.359CS..Hα-helixtrans-67.9-39.9178.4-148.6165000111.5F63 C66 L70 I118 K151 S152 S153 L157 L159F63-L155 HydrophobicContact CE2-CD1 4.33Å; C66-L155 HydrophobicContact CB-CD1 3.9Å; L70-L155 HydrophobicContact CD1-CD2 3.91Å; L70-L155 HydrophobicContact CD1-CG 4.02Å; L70-L155 HydrophobicContact CD2-CD2 4.49Å; L70-L155 HydrophobicContact CG-CD2 4.46Å; I118-L155 HydrophobicContact CG2-CD2 3.8Å; K151-L155 WeakPolarHBondContact O-CB 3.43Å; K151-L155 PolarHBondContact O-N 2.76Å; S152-L155 PolarHBondContact O-N 3.09Å; S153-L155 VanDerWaalsContact C-N 3.29Å; S153-L155 PolarHBondContact O-N 2.79Å; L155-L157 VanDerWaalsContact C-N 3.34Å; L155-L159 HydrophobicContact CD2-CD1 3.76Å; L155-L159 HydrophobicContact CD2-CG 4.15Å; L155-L159 WeakPolarHBondContact O-CB 3.32Å; L155-L159 VanDerWaalsContact O-CG 3.3Å; L155-L159 WeakPolarHBondContact O-CG 3.31Å; L155-L159 PolarHBondContact O-N 3.26Å
156L74.3Confident69.3Low59 Ų5963.4 Ų63.431%0.30933%0.326SS..Hα-helixtrans-66.9-32.7173-71.4172.4000112.6F137 S152 S153 L159 G160F137-L156 HydrophobicContact CE1-CD2 3.87Å; F137-L156 HydrophobicContact CZ-CD2 4.06Å; S152-L156 WeakPolarHBondContact O-CB 3.47Å; S152-L156 VanDerWaalsContact O-CG 3.3Å; S152-L156 WeakPolarHBondContact O-CG 3.12Å; S152-L156 PolarHBondContact O-N 2.64Å; S153-L156 PolarHBondContact O-N 3.08Å; L156-L159 HydrophobicContact CD2-CD1 4.33Å; L156-G160 PolarHBondContact O-N 2.92Å
157L77Confident70.9Confident87 Ų8761.7 Ų61.746%0.45532%0.317SS..Hα-helixtrans-67.5-49.2174.9-168.5154.5000110.8S153 N154 L155 L159 G160 E161S153-L157 WeakPolarHBondContact O-CB 3.33Å; S153-L157 PolarHBondContact O-N 3.4Å; N154-L157 PolarHBondContact O-N 3.1Å; L155-L157 VanDerWaalsContact C-N 3.34Å; L157-L159 VanDerWaalsContact C-N 3.3Å; L157-L159 PolarHBondContact O-N 3.18Å; L157-G160 WeakPolarHBondContact O-CA 3.44Å; L157-G160 PolarHBondContact O-N 3.43Å; L157-E161 HydrophobicContact CD2-CG 4.26Å; L157-E161 PolarHBondContact O-N 2.82Å
158I75.9Confident72.5Confident33 Ų3357.9 Ų57.917%0.16930%0.299CS..Hα-helixtrans-58.7-41.4174.3-66.7164.4000111F29 L70 N154 G160 E161 L162F29-I158 HydrophobicContact CB-CD1 4.47Å; F29-I158 HydrophobicContact CD1-CD1 4.41Å; F29-I158 HydrophobicContact CD2-CD1 4.1Å; F29-I158 HydrophobicContact CE2-CD1 4.43Å; F29-I158 HydrophobicContact CG-CD1 4.07Å; L70-I158 HydrophobicContact CD1-CG2 4.48Å; L70-I158 HydrophobicContact CD2-CG2 4.18Å; N154-I158 WeakPolarHBondContact O-CG1 3.43Å; N154-I158 PolarHBondContact O-N 3.2Å; I158-G160 VanDerWaalsContact C-N 3.31Å; I158-G160 PolarHBondContact O-N 3.04Å; I158-E161 PolarHBondContact O-N 2.76Å; I158-L162 HydrophobicContact CG2-CD1 3.97Å; I158-L162 WeakPolarHBondContact O-CB 3.2Å; I158-L162 WeakPolarHBondContact O-CG 3.3Å; I158-L162 PolarHBondContact O-N 3.17Å
159L77.4Confident73.9Confident17 Ų1751.6 Ų51.69%0.08927%0.266CS..Hα-helixtrans-62.8-35.6173.3-77.9168.6000112.9L70 L73 I115 I118 L155 L156 L157 Q163L70-L159 HydrophobicContact CD2-CD2 3.93Å; L70-L159 HydrophobicContact CD2-CG 4.24Å; L73-L159 HydrophobicContact CD2-CD2 4.07Å; I115-L159 HydrophobicContact CG1-CD2 4.42Å; I118-L159 HydrophobicContact CD1-CD2 3.96Å; I118-L159 HydrophobicContact CG2-CD1 4.07Å; L155-L159 HydrophobicContact CD2-CD1 3.76Å; L155-L159 HydrophobicContact CD2-CG 4.15Å; L155-L159 WeakPolarHBondContact O-CB 3.32Å; L155-L159 VanDerWaalsContact O-CG 3.3Å; L155-L159 WeakPolarHBondContact O-CG 3.31Å; L155-L159 PolarHBondContact O-N 3.26Å; L156-L159 HydrophobicContact CD2-CD1 4.33Å; L157-L159 VanDerWaalsContact C-N 3.3Å; L157-L159 PolarHBondContact O-N 3.18Å; L159-Q163 WeakPolarHBondContact O-CB 3.37Å; L159-Q163 PolarHBondContact O-N 3.34Å
160G79.3Confident75Confident26 Ų2650.6 Ų50.627%0.26826%0.261SS..Hα-helixtrans-66.5-44.8175.700000112.8L156 L157 I158 Q163 Q164L156-G160 PolarHBondContact O-N 2.92Å; L157-G160 WeakPolarHBondContact O-CA 3.44Å; L157-G160 PolarHBondContact O-N 3.43Å; I158-G160 VanDerWaalsContact C-N 3.31Å; I158-G160 PolarHBondContact O-N 3.04Å; G160-Q163 PolarHBondContact O-N 3.28Å; G160-Q164 PolarHBondContact O-N 3.39Å
161E79.7Confident75.7Confident109 Ų10952.5 Ų52.551%0.50926%0.264SS..Hα-helixtrans-63.4-49.3176.6-67.9179.5160.100111.3L157 I158 Q163 Q164 E165L157-E161 HydrophobicContact CD2-CG 4.26Å; L157-E161 PolarHBondContact O-N 2.82Å; I158-E161 PolarHBondContact O-N 2.76Å; E161-Q163 VanDerWaalsContact C-N 3.26Å; E161-Q163 PolarHBondContact O-N 3.34Å; E161-Q164 PolarHBondContact O-N 2.58Å; E161-E165 PolarHBondContact O-N 2.92Å
162L78.7Confident76.4Confident20 Ų2057.1 Ų57.111%0.10529%0.285CS..Hα-helixtrans-60.7-34.4174.9-71.1171.4000112.4L70 L73 L77 I158 W166L70-L162 HydrophobicContact CD2-CD1 4.1Å; L73-L162 HydrophobicContact CD2-CB 4.43Å; L73-L162 HydrophobicContact CD2-CD1 3.98Å; L73-L162 HydrophobicContact CG-CD1 4.32Å; L77-L162 HydrophobicContact CD2-CD2 3.96Å; I158-L162 HydrophobicContact CG2-CD1 3.97Å; I158-L162 WeakPolarHBondContact O-CB 3.2Å; I158-L162 WeakPolarHBondContact O-CG 3.3Å; I158-L162 PolarHBondContact O-N 3.17Å; L162-W166 WeakPolarHBondContact O-CB 3.46Å; L162-W166 PolarHBondContact O-N 3.39Å
163Q79.7Confident76.7Confident56 Ų5657.2 Ų57.226%0.26228%0.284SS..Hα-helixtrans-69.4-40175.7174.553.533.700112.1L159 G160 E161 D167L159-Q163 WeakPolarHBondContact O-CB 3.37Å; L159-Q163 PolarHBondContact O-N 3.34Å; G160-Q163 PolarHBondContact O-N 3.28Å; E161-Q163 VanDerWaalsContact C-N 3.26Å; E161-Q163 PolarHBondContact O-N 3.34Å; Q163-D167 PolarHBondContact NE2-OD1 2.97Å; Q163-D167 PolarHBondContact NE2-OD2 2.8Å; Q163-D167 PolarHBondContact O-N 3.07Å; Q163-D167 VanDerWaalsContact O-N 3.17Å
164Q80.6Confident76.7Confident122 Ų12257.6 Ų57.657%0.5728%0.283SS*.Hα-helixtrans-64.5-50174.7-179.9179.6-29.300111.2G160 E161 W166 D167 E168G160-Q164 PolarHBondContact O-N 3.39Å; E161-Q164 PolarHBondContact O-N 2.58Å; Q164-W166 VanDerWaalsContact C-N 3.3Å; Q164-W166 PolarHBondContact O-N 3.45Å; Q164-D167 PolarHBondContact O-N 2.8Å; Q164-D167 VanDerWaalsContact O-N 3.14Å; Q164-E168 PolarHBondContact NE2-OE1 2.84Å; Q164-E168 PolarHBondContact O-N 2.75Å
165E77.2Confident76.5Confident29 Ų2956.5 Ų56.514%0.13628%0.28CS..Hα-helixtrans-64-36.8-178.3-166.5-166.5159.100111.8Y22 L77 R81 E161 D167 E168 T169Y22-E165 WeakPolarHBondContact CE1-OE2 3.49Å; Y22-E165 PolarHBondContact OH-OE2 3.21Å; Y22-E165 VanDerWaalsContact OH-OE2 3.11Å; L77-E165 HydrophobicContact CD2-CB 4.18Å; L77-E165 HydrophobicContact CD2-CG 4.2Å; R81-E165 IonicContact CZ-OE1 2.59Å; R81-E165 IonicContact NE-OE1 2.7Å; R81-E165 IonicContact NH2-OE1 3.14Å; R81-E165 PolarHBondContact NH2-OE1 3.31Å; E161-E165 PolarHBondContact O-N 2.92Å; E165-D167 PolarHBondContact O-N 2.95Å; E165-E168 PolarHBondContact O-N 3.13Å; E165-T169 WeakPolarHBondContact O-CB 3.13Å; E165-T169 PolarHBondContact O-N 2.97Å; E165-T169 PolarHBondContact O-OG1 3.14Å
166W82.2Confident76.6Confident2 Ų259.2 Ų59.21%0.00829%0.294CS..Hα-helixtrans-58.5-46.7172.5-176.6-72.2000112.1L76 L77 L80 Y107 K111 L162 Q164 E168 T169 I170L76-W166 HydrophobicContact CD2-CH2 3.68Å; L76-W166 HydrophobicContact CD2-CZ3 3.72Å; L76-W166 HydrophobicContact CG-CH2 4Å; L76-W166 HydrophobicContact CG-CZ3 3.87Å; L77-W166 HydrophobicContact CB-CE3 4.49Å; L77-W166 HydrophobicContact CD1-CB 4.41Å; L77-W166 HydrophobicContact CD1-CE3 4Å; L80-W166 HydrophobicContact CD2-CH2 4.37Å; L80-W166 HydrophobicContact CD2-CZ2 4.4Å; Y107-W166 VanDerWaalsContact C-CZ2 3.49Å; Y107-W166 HydrophobicContact CD1-CH2 4.17Å; Y107-W166 WeakPolarHBondContact O-CH2 3.39Å; Y107-W166 WeakPolarHBondContact O-CZ2 3.38Å; K111-W166 HydrophobicContact CB-CD2 4.41Å; K111-W166 HydrophobicContact CB-CE3 4.42Å; K111-W166 HydrophobicContact CB-CH2 3.88Å; K111-W166 HydrophobicContact CB-CZ2 3.84Å; K111-W166 HydrophobicContact CB-CZ3 4.18Å; K111-W166 HydrophobicContact CD-CB 4.39Å; K111-W166 HydrophobicContact CD-CD2 3.6Å; K111-W166 HydrophobicContact CD-CE3 4.1Å; K111-W166 HydrophobicContact CD-CG 3.7Å; K111-W166 HydrophobicContact CD-CZ2 4.43Å; K111-W166 HydrophobicContact CG-CD2 4.46Å; L162-W166 WeakPolarHBondContact O-CB 3.46Å; L162-W166 PolarHBondContact O-N 3.39Å; Q164-W166 VanDerWaalsContact C-N 3.3Å; Q164-W166 PolarHBondContact O-N 3.45Å; W166-E168 VanDerWaalsContact C-N 3.35Å; W166-T169 PolarHBondContact O-N 2.76Å; W166-I170 PolarHBondContact O-N 2.86Å
167D79.4Confident76.3Confident68 Ų6859.1 Ų59.136%0.36430%0.298SS..Hα-helixtrans-74.1-26.9-177.6-70.54.4000112.1K111 Q163 Q164 E165 R171K111-D167 IonicContact NZ-OD1 3.95Å; K111-D167 PolarHBondContact NZ-OD1 3.14Å; K111-D167 VanDerWaalsContact NZ-OD1 3.14Å; Q163-D167 PolarHBondContact NE2-OD1 2.97Å; Q163-D167 PolarHBondContact NE2-OD2 2.8Å; Q163-D167 PolarHBondContact O-N 3.07Å; Q163-D167 VanDerWaalsContact O-N 3.17Å; Q164-D167 PolarHBondContact O-N 2.8Å; Q164-D167 VanDerWaalsContact O-N 3.14Å; E165-D167 PolarHBondContact O-N 2.95Å; D167-R171 WeakPolarHBondContact O-CB 3.35Å; D167-R171 PolarHBondContact O-N 3.28Å
168E80Confident75.9Confident71 Ų7155.7 Ų55.733%0.33228%0.281SS..Hα-helixtrans-69.5-38.2166.1-73.4-175.6-156.100112.3Q164 E165 W166 R171 K172Q164-E168 PolarHBondContact NE2-OE1 2.84Å; Q164-E168 PolarHBondContact O-N 2.75Å; E165-E168 PolarHBondContact O-N 3.13Å; W166-E168 VanDerWaalsContact C-N 3.35Å; E168-R171 WeakPolarHBondContact O-CB 3.46Å; E168-R171 PolarHBondContact O-N 3.16Å; E168-K172 PolarHBondContact O-N 3.13Å
169T77.5Confident75.7Confident6 Ų657.4 Ų57.44%0.03729%0.287CS..Hα-helixtrans-67.6-46177-59.10000111.1L80 V84 E165 W166 R171 K172 I173L80-T169 HydrophobicContact CD2-CG2 3.73Å; L80-T169 HydrophobicContact CG-CG2 3.86Å; V84-T169 HydrophobicContact CG2-CG2 4.45Å; E165-T169 WeakPolarHBondContact O-CB 3.13Å; E165-T169 PolarHBondContact O-N 2.97Å; E165-T169 PolarHBondContact O-OG1 3.14Å; W166-T169 PolarHBondContact O-N 2.76Å; T169-R171 VanDerWaalsContact C-N 3.26Å; T169-R171 PolarHBondContact O-N 2.99Å; T169-K172 WeakPolarHBondContact O-CB 3.35Å; T169-K172 PolarHBondContact O-N 3.06Å; T169-K172 VanDerWaalsContact O-N 3.1Å; T169-I173 HydrophobicContact CG2-CD1 4.2Å; T169-I173 WeakPolarHBondContact O-CG1 3.05Å; T169-I173 PolarHBondContact O-N 3.45Å
170I78.5Confident75.6Confident23 Ų2361.8 Ų61.812%0.11832%0.315CS..Hα-helixtrans-59.4-36.6172.4-78.1-172.6000111.7I104 E108 W166 K172 I173 T174I104-I170 HydrophobicContact CG2-CD1 3.79Å; I104-I170 HydrophobicContact CG2-CG1 4.29Å; E108-I170 HydrophobicContact CG-CD1 3.73Å; W166-I170 PolarHBondContact O-N 2.86Å; I170-K172 PolarHBondContact O-N 3.11Å; I170-I173 PolarHBondContact O-N 3.31Å; I170-I173 VanDerWaalsContact O-N 3.11Å; I170-T174 PolarHBondContact O-N 3.2Å; I170-T174 PolarHBondContact O-OG1 3.28Å
171R76.6Confident75.5Confident166 Ų16663.7 Ų63.763%0.62632%0.319SS*.Hα-helixtrans-64-26.8177.4-160.7-174.9-49.4142.714.4113.2D167 E168 T169D167-R171 WeakPolarHBondContact O-CB 3.35Å; D167-R171 PolarHBondContact O-N 3.28Å; E168-R171 WeakPolarHBondContact O-CB 3.46Å; E168-R171 PolarHBondContact O-N 3.16Å; T169-R171 VanDerWaalsContact C-N 3.26Å; T169-R171 PolarHBondContact O-N 2.99Å
172K72.9Confident75.5Confident152 Ų15261.7 Ų61.766%0.66131%0.309SS*.Hα-helixtrans-77.3-28.1173-66.2171.4-176.6173.70113.1E168 T169 I170E168-K172 PolarHBondContact O-N 3.13Å; T169-K172 WeakPolarHBondContact O-CB 3.35Å; T169-K172 PolarHBondContact O-N 3.06Å; T169-K172 VanDerWaalsContact O-N 3.1Å; I170-K172 PolarHBondContact O-N 3.11Å
173I70.5Confident75.7Confident18 Ų1866.6 Ų66.69%0.09233%0.334CS..Hα-helixtrans-91.4-28.1-176.6-51.5161.6000111.9L80 V84 L100 T101 I104 T169 I170 P175L80-I173 HydrophobicContact CD1-CD1 3.79Å; L80-I173 HydrophobicContact CD2-CD1 4.31Å; L80-I173 HydrophobicContact CG-CD1 4.09Å; V84-I173 HydrophobicContact CG2-CD1 3.7Å; V84-I173 HydrophobicContact CG2-CG1 3.58Å; L100-I173 HydrophobicContact CB-CG2 4.1Å; L100-I173 HydrophobicContact CD2-CD1 3.7Å; L100-I173 HydrophobicContact CD2-CG1 3.95Å; L100-I173 HydrophobicContact CD2-CG2 3.93Å; L100-I173 HydrophobicContact CG-CD1 4.25Å; L100-I173 HydrophobicContact CG-CG2 4Å; T101-I173 HydrophobicContact CG2-CG2 4.2Å; I104-I173 HydrophobicContact CD1-CB 4.05Å; I104-I173 HydrophobicContact CD1-CG2 3.77Å; I104-I173 HydrophobicContact CG1-CG2 4.14Å; T169-I173 HydrophobicContact CG2-CD1 4.2Å; T169-I173 WeakPolarHBondContact O-CG1 3.05Å; T169-I173 PolarHBondContact O-N 3.45Å; I170-I173 PolarHBondContact O-N 3.31Å; I170-I173 VanDerWaalsContact O-N 3.11Å; I173-P175 WeakPolarHBondContact O-CD 3.37Å
174T68Low75.8Confident74 Ų7465.7 Ų65.745%0.45434%0.335SS..SBendtrans-65.8119.7-174.6-58.20000110.8I170 I176I170-T174 PolarHBondContact O-N 3.2Å; I170-T174 PolarHBondContact O-OG1 3.28Å; T174-I176 PolarHBondContact O-N 3.29Å
175P68.4Low76Confident46 Ų4659.9 Ų59.930%0.29931%0.307SS..PPolyproline II helixtrans-69.9131.6-169.725.9-33.6000112.4K94 E97 T101 I173K94-P175 WeakPolarHBondContact O-CA 3.4Å; E97-P175 HydrophobicContact CG-CG 4.17Å; T101-P175 HydrophobicContact CG2-CG 4.28Å; I173-P175 WeakPolarHBondContact O-CD 3.37Å
176I74.4Confident76.3Confident60 Ų6059.6 Ų59.631%0.30831%0.307SS..PPolyproline II helixtrans-76.9132.5176.1-59.6-179.5000108.7K94 Y95 T174 P178 N181K94-I176 HydrophobicContact CB-CD1 4.19Å; K94-I176 PolarHBondContact O-N 3.06Å; Y95-I176 HydrophobicContact CD1-CB 3.94Å; Y95-I176 HydrophobicContact CD1-CG2 3.99Å; Y95-I176 WeakPolarHBondContact CD1-O 3.14Å; Y95-I176 HydrophobicContact CE1-CB 3.93Å; Y95-I176 HydrophobicContact CE1-CG2 3.6Å; T174-I176 PolarHBondContact O-N 3.29Å; I176-P178 WeakPolarHBondContact O-CD 3.39Å; I176-N181 HydrophobicContact CG2-CB 3.92Å; I176-N181 WeakPolarHBondContact CG2-ND2 3.44Å
177S68.7Low76.6Confident56 Ų5665.2 Ų65.239%0.39233%0.333SS..PPolyproline II helixtrans-74.9122.4176.1-167.40000111F179 T180 N181S177-F179 PolarHBondContact O-N 3.39Å; S177-T180 PolarHBondContact O-N 2.97Å; S177-N181 PolarHBondContact O-N 3.4Å
178P69.2Low76.9Confident15 Ų1563 Ų6310%0.09732%0.321CS..THydrogen-bonded Turntrans-65.1-21.5-18028.3-36.8000112.5Y95 I176 Q182 F185 V256Y95-P178 HydrophobicContact CD1-CB 4.21Å; I176-P178 WeakPolarHBondContact O-CD 3.39Å; P178-Q182 WeakPolarHBondContact O-CA 3.46Å; P178-Q182 WeakPolarHBondContact O-CG 3.36Å; P178-Q182 PolarHBondContact O-N 3.06Å; P178-F185 HydrophobicContact CB-CB 4.29Å; P178-F185 HydrophobicContact CB-CD1 4.19Å; P178-F185 HydrophobicContact CB-CD2 3.39Å; P178-F185 HydrophobicContact CB-CE1 4.38Å; P178-F185 HydrophobicContact CB-CE2 3.59Å; P178-F185 HydrophobicContact CB-CG 3.69Å; P178-F185 HydrophobicContact CB-CZ 4.1Å; P178-F185 HydrophobicContact CG-CE2 4.47Å; P178-V256 HydrophobicContact CB-CG2 4.21Å; P178-V256 HydrophobicContact CG-CG2 3.94Å
179F71.5Confident77.2Confident70 Ų7059.6 Ų59.631%0.30731%0.305SS..THydrogen-bonded Turntrans-76.5-23175.6-56.9-74.3000113.4S177 Q182 V256 N259 T260S177-F179 PolarHBondContact O-N 3.39Å; F179-Q182 PolarHBondContact O-NE2 3.15Å; F179-V256 HydrophobicContact CE1-CG1 4.08Å; F179-V256 HydrophobicContact CZ-CG1 4.43Å; F179-V256 HydrophobicContact CZ-CG2 4.37Å; F179-N259 HydrophobicContact CE1-CB 4.18Å; F179-N259 HydrophobicContact CZ-CB 3.71Å; F179-T260 HydrophobicContact CE1-CG2 4.19Å
180T75.5Confident77.7Confident109 Ų10962.3 Ų62.367%0.66932%0.319SS*.THydrogen-bonded Turntrans-85.8-46.5175.9-52.40000110.4S177S177-T180 PolarHBondContact O-N 2.97Å
181N77.2Confident78.2Confident65 Ų6563.2 Ų63.235%0.34833%0.328SS..SBendtrans-106.253.1-174.7-67.312.5000111.3I176 S177 I183 S184 F185I176-N181 HydrophobicContact CG2-CB 3.92Å; I176-N181 WeakPolarHBondContact CG2-ND2 3.44Å; S177-N181 PolarHBondContact O-N 3.4Å; N181-I183 VanDerWaalsContact C-N 3.26Å; N181-I183 PolarHBondContact O-N 3.44Å; N181-S184 WeakPolarHBondContact CB-OG 3.41Å; N181-S184 PolarHBondContact O-N 3.45Å; N181-S184 PolarHBondContact O-OG 3.48Å; N181-F185 WeakPolarHBondContact O-CB 3.47Å; N181-F185 PolarHBondContact O-N 3.47Å
182Q79.6Confident78.6Confident67 Ų6755.5 Ų55.531%0.31330%0.299SS..Hα-helixtrans-56.3-34.8-172.4-72.4172.437.700114.2P178 F179 L186 F266P178-Q182 WeakPolarHBondContact O-CA 3.46Å; P178-Q182 WeakPolarHBondContact O-CG 3.36Å; P178-Q182 PolarHBondContact O-N 3.06Å; F179-Q182 PolarHBondContact O-NE2 3.15Å; Q182-L186 WeakPolarHBondContact O-CG 3.24Å; Q182-L186 PolarHBondContact O-N 3.48Å; Q182-F266 HydrophobicContact CB-CD2 3.85Å; Q182-F266 HydrophobicContact CB-CE2 3.56Å; Q182-F266 HydrophobicContact CB-CZ 4.14Å; Q182-F266 HydrophobicContact CG-CD2 4.16Å; Q182-F266 HydrophobicContact CG-CE1 4.32Å; Q182-F266 HydrophobicContact CG-CE2 3.8Å; Q182-F266 HydrophobicContact CG-CZ 3.88Å
183I81.8Confident79.4Confident123 Ų12348.6 Ų48.663%0.63127%0.269SS*.Hα-helixtrans-72.7-55.2-179.9-63175.4000110.2N181 F185 L186 E187N181-I183 VanDerWaalsContact C-N 3.26Å; N181-I183 PolarHBondContact O-N 3.44Å; I183-F185 PolarHBondContact O-N 2.75Å; I183-L186 PolarHBondContact O-N 3.04Å; I183-L186 VanDerWaalsContact O-N 3.07Å; I183-E187 HydrophobicContact CG2-CG 4.34Å; I183-E187 WeakPolarHBondContact CG2-OE1 3.4Å; I183-E187 WeakPolarHBondContact O-CG 3.49Å; I183-E187 PolarHBondContact O-N 3.46Å
184S83Confident80.4Confident38 Ų3853.5 Ų53.527%0.26629%0.29SS..Hα-helixtrans-64.8-28.6179.470.70000112.5Y95 N181 E187 D188Y95-S184 VanDerWaalsContact OH-C 3.23Å; Y95-S184 PolarHBondContact OH-O 3.24Å; Y95-S184 PolarHBondContact OH-OG 3.43Å; N181-S184 WeakPolarHBondContact CB-OG 3.41Å; N181-S184 PolarHBondContact O-N 3.45Å; N181-S184 PolarHBondContact O-OG 3.48Å; S184-E187 PolarHBondContact O-N 2.89Å; S184-D188 WeakPolarHBondContact O-CB 3.25Å; S184-D188 VanDerWaalsContact O-CG 3.27Å; S184-D188 PolarHBondContact O-N 3.15Å; S184-D188 VanDerWaalsContact O-OD2 3.13Å
185F83.8Confident81.3Confident0 Ų054.4 Ų54.40%029%0.287CS..Hα-helixtrans-60.6-44172.3173.2-102.9000112.3Y95 P178 N181 I183 I189 L252 V256 F266 L270Y95-F185 HydrophobicContact CD1-CB 4.39Å; Y95-F185 AromaticContact CD1-CD2 3.79Å; Y95-F185 HydrophobicContact CD1-CD2 3.79Å; Y95-F185 AromaticContact CD2-CD2 3.93Å; Y95-F185 HydrophobicContact CD2-CD2 3.93Å; Y95-F185 HydrophobicContact CE1-CB 3.91Å; Y95-F185 HydrophobicContact CE1-CD2 4.12Å; Y95-F185 HydrophobicContact CE2-CD2 4.27Å; Y95-F185 AromaticContact CG-CD2 3.71Å; Y95-F185 HydrophobicContact CG-CD2 3.71Å; Y95-F185 HydrophobicContact CG-CE2 4.3Å; Y95-F185 PolarHBondContact OH-N 3.45Å; P178-F185 HydrophobicContact CB-CB 4.29Å; P178-F185 HydrophobicContact CB-CD1 4.19Å; P178-F185 HydrophobicContact CB-CD2 3.39Å; P178-F185 HydrophobicContact CB-CE1 4.38Å; P178-F185 HydrophobicContact CB-CE2 3.59Å; P178-F185 HydrophobicContact CB-CG 3.69Å; P178-F185 HydrophobicContact CB-CZ 4.1Å; P178-F185 HydrophobicContact CG-CE2 4.47Å; N181-F185 WeakPolarHBondContact O-CB 3.47Å; N181-F185 PolarHBondContact O-N 3.47Å; I183-F185 PolarHBondContact O-N 2.75Å; F185-I189 HydrophobicContact CD1-CD1 4.48Å; F185-I189 HydrophobicContact CD2-CD1 3.96Å; F185-I189 HydrophobicContact CE1-CD1 3.98Å; F185-I189 HydrophobicContact CE2-CD1 3.43Å; F185-I189 VanDerWaalsContact CE2-CD1 3.43Å; F185-I189 HydrophobicContact CG-CD1 4.48Å; F185-I189 HydrophobicContact CZ-CD1 3.44Å; F185-I189 VanDerWaalsContact CZ-CD1 3.44Å; F185-I189 WeakPolarHBondContact O-CG1 3.35Å; F185-I189 PolarHBondContact O-N 3.12Å; F185-L252 HydrophobicContact CE2-CD1 4.38Å; F185-L252 HydrophobicContact CE2-CD2 3.91Å; F185-L252 HydrophobicContact CE2-CG 3.94Å; F185-L252 HydrophobicContact CZ-CG 4.16Å; F185-V256 HydrophobicContact CE1-CG1 4.43Å; F185-V256 HydrophobicContact CE1-CG2 4.23Å; F185-V256 HydrophobicContact CZ-CB 4.47Å; F185-V256 HydrophobicContact CZ-CG2 3.82Å; F185-F266 HydrophobicContact CD1-CE2 4.39Å; F185-F266 HydrophobicContact CD1-CZ 4.15Å; F185-F266 HydrophobicContact CE1-CZ 4.48Å; F185-L270 HydrophobicContact CE1-CD2 4Å
186L84.6Confident82.3Confident23 Ų2352.4 Ų52.412%0.1227%0.274CS..Hα-helixtrans-69.6-42.7175.7-68.5171.8000111.3Q182 I183 D190 F266 N269 L270 L273Q182-L186 WeakPolarHBondContact O-CG 3.24Å; Q182-L186 PolarHBondContact O-N 3.48Å; I183-L186 PolarHBondContact O-N 3.04Å; I183-L186 VanDerWaalsContact O-N 3.07Å; L186-D190 WeakPolarHBondContact O-CB 3.25Å; L186-D190 PolarHBondContact O-N 2.88Å; L186-F266 HydrophobicContact CD1-CD2 3.72Å; L186-F266 HydrophobicContact CD1-CE2 3.83Å; L186-F266 HydrophobicContact CD2-CE2 4.24Å; L186-F266 HydrophobicContact CG-CD2 4.3Å; L186-F266 HydrophobicContact CG-CE2 3.88Å; L186-N269 HydrophobicContact CD1-CB 3.6Å; L186-N269 HydrophobicContact CD2-CB 4.15Å; L186-L270 HydrophobicContact CD2-CD2 4.27Å; L186-L273 HydrophobicContact CD2-CD2 4.01Å
187E86.6Confident83.1Confident119 Ų11951.7 Ų51.756%0.55627%0.271SS*.Hα-helixtrans-68.1-40.3-179.7-67.3170.4160.900112.9I183 S184 S191I183-E187 HydrophobicContact CG2-CG 4.34Å; I183-E187 WeakPolarHBondContact CG2-OE1 3.4Å; I183-E187 WeakPolarHBondContact O-CG 3.49Å; I183-E187 PolarHBondContact O-N 3.46Å; S184-E187 PolarHBondContact O-N 2.89Å; E187-S191 WeakPolarHBondContact O-CB 3.41Å; E187-S191 PolarHBondContact O-N 3.32Å
188D86.3Confident84Confident22 Ų2251 Ų5112%0.11827%0.268CS..Hα-helixtrans-63.8-45176.6-83.6-48.8000110.8N91 K94 Y95 S184 D192N91-D188 HydrophobicContact CB-CB 3.78Å; N91-D188 VanDerWaalsContact CB-OD1 3.3Å; N91-D188 WeakPolarHBondContact CB-OD1 3.44Å; K94-D188 IonicContact NZ-OD1 2.75Å; K94-D188 PolarHBondContact NZ-OD1 3.38Å; K94-D188 IonicContact NZ-OD2 3.15Å; Y95-D188 HydrophobicContact CE2-CB 3.84Å; Y95-D188 WeakPolarHBondContact CE2-OD2 3.29Å; Y95-D188 VanDerWaalsContact CZ-OD2 3.3Å; Y95-D188 PolarHBondContact OH-OD2 3.4Å; S184-D188 WeakPolarHBondContact O-CB 3.25Å; S184-D188 VanDerWaalsContact O-CG 3.27Å; S184-D188 PolarHBondContact O-N 3.15Å; S184-D188 VanDerWaalsContact O-OD2 3.13Å; D188-D192 PolarHBondContact O-N 3.48Å; D188-D192 VanDerWaalsContact O-N 3.09Å
189I86.5Confident85Confident0 Ų052.2 Ų52.20%027%0.271CS..Hα-helixtrans-72.9-44.3178.4-62.4173.2000111.2F92 F185 S191 D192 L193 I249 L252 V253 L273F92-I189 HydrophobicContact CB-CG1 3.79Å; F185-I189 HydrophobicContact CD1-CD1 4.48Å; F185-I189 HydrophobicContact CD2-CD1 3.96Å; F185-I189 HydrophobicContact CE1-CD1 3.98Å; F185-I189 HydrophobicContact CE2-CD1 3.43Å; F185-I189 VanDerWaalsContact CE2-CD1 3.43Å; F185-I189 HydrophobicContact CG-CD1 4.48Å; F185-I189 HydrophobicContact CZ-CD1 3.44Å; F185-I189 VanDerWaalsContact CZ-CD1 3.44Å; F185-I189 WeakPolarHBondContact O-CG1 3.35Å; F185-I189 PolarHBondContact O-N 3.12Å; I189-S191 VanDerWaalsContact C-N 3.26Å; I189-S191 PolarHBondContact O-N 3.32Å; I189-D192 PolarHBondContact O-N 3.02Å; I189-D192 VanDerWaalsContact O-N 3.12Å; I189-L193 HydrophobicContact CG2-CD1 3.94Å; I189-L193 HydrophobicContact CG2-CG 4.01Å; I189-L193 WeakPolarHBondContact O-CB 3.47Å; I189-L193 VanDerWaalsContact O-CG 3.32Å; I189-L193 WeakPolarHBondContact O-CG 3.07Å; I189-L193 PolarHBondContact O-N 3.12Å; I189-I249 HydrophobicContact CG2-CG2 3.5Å; I189-I249 VanDerWaalsContact CG2-CG2 3.5Å; I189-L252 HydrophobicContact CD1-CD2 4.35Å; I189-V253 HydrophobicContact CD1-CG2 4.31Å; I189-L273 HydrophobicContact CB-CD1 4.46Å; I189-L273 HydrophobicContact CB-CD2 4.06Å; I189-L273 HydrophobicContact CD1-CD2 4.3Å; I189-L273 HydrophobicContact CG2-CD1 3.99Å; I189-L273 HydrophobicContact CG2-CD2 3.8Å; I189-L273 HydrophobicContact CG2-CG 4.07Å
190D88.4Confident85.8Confident62 Ų6248.9 Ų48.933%0.33226%0.257SS..Hα-helixtrans-58.6-38.4174.9172.464000111.5L186 K194 L273L186-D190 WeakPolarHBondContact O-CB 3.25Å; L186-D190 PolarHBondContact O-N 2.88Å; D190-K194 VanDerWaalsContact O-CB 3.31Å; D190-K194 WeakPolarHBondContact O-CB 3.39Å; D190-K194 WeakPolarHBondContact O-CD 3.23Å; D190-K194 VanDerWaalsContact O-CG 3.23Å; D190-K194 WeakPolarHBondContact O-CG 3.43Å; D190-K194 PolarHBondContact O-N 3.06Å; D190-K194 WeakPolarHBondContact OD1-CE 3.31Å; D190-K194 IonicContact OD1-NZ 2.76Å; D190-K194 PolarHBondContact OD1-NZ 2.95Å; D190-K194 WeakPolarHBondContact OD2-CE 3.14Å; D190-K194 IonicContact OD2-NZ 3.73Å; D190-K194 PolarHBondContact OD2-NZ 3.09Å; D190-L273 HydrophobicContact CB-CD1 4.32Å
191S87.9Confident86.5Confident42 Ų4246.8 Ų46.829%0.29424%0.242SC..Hα-helixtrans-60.6-47.7171.3179.90000112.3E187 I189 K194 K195E187-S191 WeakPolarHBondContact O-CB 3.41Å; E187-S191 PolarHBondContact O-N 3.32Å; I189-S191 VanDerWaalsContact C-N 3.26Å; I189-S191 PolarHBondContact O-N 3.32Å; S191-K194 PolarHBondContact O-N 2.79Å; S191-K195 WeakPolarHBondContact O-CG 3.36Å; S191-K195 PolarHBondContact O-N 3.2Å
192D86.7Confident87Confident5 Ų547 Ų473%0.02725%0.245CC..Hα-helixtrans-69.4-39.2179.9-71-23.7000112.8G90 N91 F92 D188 I189 K194 K195 I196 I249G90-D192 WeakPolarHBondContact CA-OD2 3.37Å; N91-D192 WeakPolarHBondContact CA-OD2 3.36Å; N91-D192 WeakPolarHBondContact CB-OD2 3.4Å; N91-D192 VanDerWaalsContact N-CG 3.33Å; N91-D192 PolarHBondContact N-OD1 2.89Å; N91-D192 VanDerWaalsContact N-OD1 3.16Å; N91-D192 PolarHBondContact N-OD2 3.36Å; F92-D192 WeakPolarHBondContact CD1-OD2 3.45Å; F92-D192 PolarHBondContact N-OD2 2.88Å; D188-D192 PolarHBondContact O-N 3.48Å; D188-D192 VanDerWaalsContact O-N 3.09Å; I189-D192 PolarHBondContact O-N 3.02Å; I189-D192 VanDerWaalsContact O-N 3.12Å; D192-K194 VanDerWaalsContact C-N 3.3Å; D192-K194 PolarHBondContact O-N 3.01Å; D192-K195 PolarHBondContact O-N 3.42Å; D192-K195 IonicContact OD1-NZ 3.94Å; D192-K195 PolarHBondContact OD1-NZ 3.09Å; D192-I196 VanDerWaalsContact O-CG1 3.27Å; D192-I196 WeakPolarHBondContact O-CG1 3.11Å; D192-I196 PolarHBondContact O-N 3.28Å; D192-I249 HydrophobicContact CB-CD1 4.42Å
193L89.6Confident87.4Confident6 Ų644.1 Ų44.13%0.03123%0.232CC..Hα-helixtrans-62.6-37.6173.2-66.2180000111.3I189 I196 D197 L246 I249 L273 V277 L280I189-L193 HydrophobicContact CG2-CD1 3.94Å; I189-L193 HydrophobicContact CG2-CG 4.01Å; I189-L193 WeakPolarHBondContact O-CB 3.47Å; I189-L193 VanDerWaalsContact O-CG 3.32Å; I189-L193 WeakPolarHBondContact O-CG 3.07Å; I189-L193 PolarHBondContact O-N 3.12Å; L193-I196 PolarHBondContact O-N 3.3Å; L193-D197 WeakPolarHBondContact O-CB 3.35Å; L193-D197 PolarHBondContact O-N 2.66Å; L193-L246 HydrophobicContact CD2-CD1 3.43Å; L193-L246 VanDerWaalsContact CD2-CD1 3.43Å; L193-I249 HydrophobicContact CD2-CD1 4.14Å; L193-I249 HydrophobicContact CD2-CG2 4.22Å; L193-L273 HydrophobicContact CD1-CD1 3.67Å; L193-L273 HydrophobicContact CD1-CG 4.12Å; L193-V277 HydrophobicContact CD1-CG2 3.78Å; L193-V277 HydrophobicContact CD2-CG2 3.93Å; L193-L280 HydrophobicContact CB-CD1 3.82Å; L193-L280 HydrophobicContact CD2-CD1 3.7Å; L193-L280 HydrophobicContact CG-CD1 4.24Å
194K89.9Confident87.7Confident121 Ų12140.3 Ų40.353%0.52622%0.219SC..Hα-helixtrans-67.8-38.8173.8-77.5167.1178.5164.70113.3D190 S191 D192 I196 D197 A198D190-K194 VanDerWaalsContact O-CB 3.31Å; D190-K194 WeakPolarHBondContact O-CB 3.39Å; D190-K194 WeakPolarHBondContact O-CD 3.23Å; D190-K194 VanDerWaalsContact O-CG 3.23Å; D190-K194 WeakPolarHBondContact O-CG 3.43Å; D190-K194 PolarHBondContact O-N 3.06Å; D190-K194 WeakPolarHBondContact OD1-CE 3.31Å; D190-K194 IonicContact OD1-NZ 2.76Å; D190-K194 PolarHBondContact OD1-NZ 2.95Å; D190-K194 WeakPolarHBondContact OD2-CE 3.14Å; D190-K194 IonicContact OD2-NZ 3.73Å; D190-K194 PolarHBondContact OD2-NZ 3.09Å; S191-K194 PolarHBondContact O-N 2.79Å; D192-K194 VanDerWaalsContact C-N 3.3Å; D192-K194 PolarHBondContact O-N 3.01Å; K194-I196 VanDerWaalsContact C-N 3.32Å; K194-D197 PolarHBondContact O-N 2.88Å; K194-A198 VanDerWaalsContact O-CB 3.29Å; K194-A198 WeakPolarHBondContact O-CB 3.43Å; K194-A198 PolarHBondContact O-N 3.35Å
195K88.5Confident87.7Confident93 Ų9342.7 Ų42.740%0.40424%0.236SC..Hα-helixtrans-59.9-44.7171-67.9169.7-163162.10110.8N91 S191 D192 W199N91-K195 PolarHBondContact ND2-NZ 3.17Å; S191-K195 WeakPolarHBondContact O-CG 3.36Å; S191-K195 PolarHBondContact O-N 3.2Å; D192-K195 PolarHBondContact O-N 3.42Å; D192-K195 IonicContact OD1-NZ 3.94Å; D192-K195 PolarHBondContact OD1-NZ 3.09Å; K195-W199 WeakPolarHBondContact O-CB 3.39Å; K195-W199 PolarHBondContact O-N 3.34Å
196I88.8Confident87.7Confident4 Ų447.1 Ų47.12%0.02126%0.259CS..Hα-helixtrans-65.5-43.5178.9-67.6167.4000110.9D192 L193 K194 W199 L200 Y242 T245 L280 F284D192-I196 VanDerWaalsContact O-CG1 3.27Å; D192-I196 WeakPolarHBondContact O-CG1 3.11Å; D192-I196 PolarHBondContact O-N 3.28Å; L193-I196 PolarHBondContact O-N 3.3Å; K194-I196 VanDerWaalsContact C-N 3.32Å; I196-W199 PolarHBondContact O-N 2.77Å; I196-L200 HydrophobicContact CG2-CD1 4.13Å; I196-L200 HydrophobicContact CG2-CG 4.48Å; I196-L200 WeakPolarHBondContact O-CB 3.4Å; I196-L200 WeakPolarHBondContact O-CG 3.38Å; I196-L200 PolarHBondContact O-N 3.12Å; I196-Y242 HydrophobicContact CD1-CD1 4.44Å; I196-Y242 HydrophobicContact CG1-CD1 3.92Å; I196-Y242 HydrophobicContact CG1-CE1 4.36Å; I196-T245 HydrophobicContact CD1-CG2 4.2Å; I196-L280 HydrophobicContact CG2-CD2 4.16Å; I196-F284 HydrophobicContact CG2-CE2 3.55Å; I196-F284 HydrophobicContact CG2-CZ 3.54Å
197D90.1Very high87.7Confident45 Ų4546.9 Ų46.924%0.24126%0.258CS..Hα-helixtrans-64-45.7176.9-158.568.2000111.8L193 K194 W199 L200 N201 L280 K283L193-D197 WeakPolarHBondContact O-CB 3.35Å; L193-D197 PolarHBondContact O-N 2.66Å; K194-D197 PolarHBondContact O-N 2.88Å; D197-W199 VanDerWaalsContact C-N 3.33Å; D197-W199 PolarHBondContact O-N 2.72Å; D197-L200 PolarHBondContact O-N 3.13Å; D197-N201 WeakPolarHBondContact O-CB 3.39Å; D197-N201 PolarHBondContact O-N 3.05Å; D197-N201 PolarHBondContact O-ND2 3.26Å; D197-N201 VanDerWaalsContact O-ND2 3.09Å; D197-N201 PolarHBondContact O-OD1 2.94Å; D197-N201 PolarHBondContact OD2-ND2 2.67Å; D197-L280 HydrophobicContact CB-CD2 3.85Å; D197-L280 VanDerWaalsContact OD1-CD2 3.25Å; D197-L280 WeakPolarHBondContact OD1-CD2 3.5Å; D197-K283 WeakPolarHBondContact OD1-CD 3.37Å; D197-K283 WeakPolarHBondContact OD1-CE 3.31Å; D197-K283 IonicContact OD1-NZ 2.64Å; D197-K283 PolarHBondContact OD1-NZ 3.3Å; D197-K283 IonicContact OD2-NZ 3.04Å; D197-K283 PolarHBondContact OD2-NZ 3.01Å
198A88.9Confident87.4Confident41 Ų4142.1 Ų42.134%0.33924%0.238SC..Hα-helixtrans-58-45.8175.700000111.3K194 N201 T202K194-A198 VanDerWaalsContact O-CB 3.29Å; K194-A198 WeakPolarHBondContact O-CB 3.43Å; K194-A198 PolarHBondContact O-N 3.35Å; A198-N201 PolarHBondContact O-N 3.46Å; A198-T202 WeakPolarHBondContact O-CB 3.31Å; A198-T202 PolarHBondContact O-N 2.97Å; A198-T202 PolarHBondContact O-OG1 3.28Å
199W90Very high87Confident42 Ų4246 Ų4616%0.15926%0.258CS..Hα-helixtrans-62.9-42.3176-178.681.5000112.8K195 I196 D197 T202 L203 Q238 I239 Y242 F284K195-W199 WeakPolarHBondContact O-CB 3.39Å; K195-W199 PolarHBondContact O-N 3.34Å; I196-W199 PolarHBondContact O-N 2.77Å; D197-W199 VanDerWaalsContact C-N 3.33Å; D197-W199 PolarHBondContact O-N 2.72Å; W199-T202 PolarHBondContact O-N 3.39Å; W199-L203 HydrophobicContact CH2-CD2 3.65Å; W199-L203 HydrophobicContact CZ2-CD2 4.13Å; W199-L203 HydrophobicContact CZ3-CD2 3.95Å; W199-L203 WeakPolarHBondContact O-CB 3.05Å; W199-L203 PolarHBondContact O-N 2.85Å; W199-Q238 HydrophobicContact CH2-CB 3.67Å; W199-Q238 HydrophobicContact CZ2-CB 3.47Å; W199-Q238 VanDerWaalsContact CZ2-CB 3.47Å; W199-Q238 HydrophobicContact CZ2-CG 4.39Å; W199-I239 HydrophobicContact CH2-CG1 3.85Å; W199-I239 HydrophobicContact CZ3-CG1 3.99Å; W199-Y242 AromaticContact CD2-CD2 3.92Å; W199-Y242 HydrophobicContact CD2-CD2 3.92Å; W199-Y242 AromaticContact CD2-CE2 3.51Å; W199-Y242 HydrophobicContact CD2-CE2 3.51Å; W199-Y242 AromaticContact CE2-CE2 3.64Å; W199-Y242 AromaticContact CE3-CD2 3.61Å; W199-Y242 HydrophobicContact CE3-CD2 3.61Å; W199-Y242 AromaticContact CE3-CE2 3.73Å; W199-Y242 HydrophobicContact CE3-CE2 3.73Å; W199-Y242 HydrophobicContact CE3-CG 4.5Å; W199-Y242 AromaticContact CG-CE2 3.99Å; W199-Y242 HydrophobicContact CG-CE2 3.99Å; W199-Y242 AromaticContact CH2-CD2 3.93Å; W199-Y242 HydrophobicContact CH2-CD2 3.93Å; W199-Y242 HydrophobicContact CH2-CE2 4.18Å; W199-Y242 HydrophobicContact CZ2-CD2 4.22Å; W199-Y242 HydrophobicContact CZ2-CE2 4.01Å; W199-Y242 AromaticContact CZ3-CD2 3.61Å; W199-Y242 HydrophobicContact CZ3-CD2 3.61Å; W199-Y242 HydrophobicContact CZ3-CE2 4.06Å; W199-F284 HydrophobicContact CZ3-CE1 4.24Å
200L89.1Confident86.4Confident0 Ų050.9 Ų50.90%029%0.288CS..Hα-helixtrans-65.4-39.9175.7-74.9174.4000112.5I196 D197 L203 A204 L280 K283 F284 L287I196-L200 HydrophobicContact CG2-CD1 4.13Å; I196-L200 HydrophobicContact CG2-CG 4.48Å; I196-L200 WeakPolarHBondContact O-CB 3.4Å; I196-L200 WeakPolarHBondContact O-CG 3.38Å; I196-L200 PolarHBondContact O-N 3.12Å; D197-L200 PolarHBondContact O-N 3.13Å; L200-L203 PolarHBondContact O-N 3.23Å; L200-A204 WeakPolarHBondContact O-CB 3.47Å; L200-A204 PolarHBondContact O-N 3.49Å; L200-L280 HydrophobicContact CD1-CD2 3.74Å; L200-K283 HydrophobicContact CD1-CB 4.03Å; L200-F284 HydrophobicContact CD1-CD1 4.3Å; L200-F284 HydrophobicContact CD1-CD2 3.9Å; L200-F284 HydrophobicContact CD1-CE1 4.2Å; L200-F284 HydrophobicContact CD1-CE2 3.76Å; L200-F284 HydrophobicContact CD1-CG 4.14Å; L200-F284 HydrophobicContact CD1-CZ 3.89Å; L200-F284 HydrophobicContact CD2-CD1 3.76Å; L200-F284 HydrophobicContact CD2-CE1 3.64Å; L200-F284 HydrophobicContact CD2-CG 4.34Å; L200-F284 HydrophobicContact CD2-CZ 4.1Å; L200-F284 HydrophobicContact CG-CE1 4.25Å; L200-F284 HydrophobicContact CG-CZ 4.2Å; L200-L287 HydrophobicContact CB-CD1 3.95Å; L200-L287 HydrophobicContact CD2-CD1 3.7Å; L200-L287 HydrophobicContact CG-CD1 4.37Å; L200-L287 WeakPolarHBondContact O-CD1 3.25Å
201N89.2Confident85.8Confident65 Ų6552.7 Ų52.735%0.34831%0.305SS..Hα-helixtrans-67.2-40.3176.7-61.4-27.2000110.6D197 A198 A204 S205 K283D197-N201 WeakPolarHBondContact O-CB 3.39Å; D197-N201 PolarHBondContact O-N 3.05Å; D197-N201 PolarHBondContact O-ND2 3.26Å; D197-N201 VanDerWaalsContact O-ND2 3.09Å; D197-N201 PolarHBondContact O-OD1 2.94Å; D197-N201 PolarHBondContact OD2-ND2 2.67Å; A198-N201 PolarHBondContact O-N 3.46Å; N201-A204 WeakPolarHBondContact O-CB 3.21Å; N201-A204 PolarHBondContact O-N 3.16Å; N201-S205 PolarHBondContact O-N 3.25Å; N201-S205 PolarHBondContact O-OG 3.37Å; N201-K283 PolarHBondContact OD1-NZ 3.19Å
202T88.2Confident85.1Confident70 Ų7052.8 Ų52.843%0.42931%0.309SS..Hα-helixtrans-63.1-40.4172.1-59.10000112.1A198 W199 S205 N206A198-T202 WeakPolarHBondContact O-CB 3.31Å; A198-T202 PolarHBondContact O-N 2.97Å; A198-T202 PolarHBondContact O-OG1 3.28Å; W199-T202 PolarHBondContact O-N 3.39Å; T202-S205 WeakPolarHBondContact CA-OG 3.28Å; T202-S205 PolarHBondContact O-N 3.2Å; T202-S205 PolarHBondContact O-OG 3.48Å; T202-N206 WeakPolarHBondContact O-CB 3.33Å; T202-N206 PolarHBondContact O-N 2.61Å; T202-N206 VanDerWaalsContact O-N 3.08Å; T202-N206 PolarHBondContact O-ND2 3.5Å
203L88Confident84.7Confident5 Ų553.7 Ų53.73%0.02631%0.312CS..Hα-helixtrans-64.5-41.3174.2-179.359.6000111.1W199 L200 N206 L207 C235 I239 L291W199-L203 HydrophobicContact CH2-CD2 3.65Å; W199-L203 HydrophobicContact CZ2-CD2 4.13Å; W199-L203 HydrophobicContact CZ3-CD2 3.95Å; W199-L203 WeakPolarHBondContact O-CB 3.05Å; W199-L203 PolarHBondContact O-N 2.85Å; L200-L203 PolarHBondContact O-N 3.23Å; L203-N206 PolarHBondContact O-N 3.13Å; L203-L207 HydrophobicContact CD1-CD1 4.4Å; L203-L207 HydrophobicContact CG-CD1 4.24Å; L203-L207 WeakPolarHBondContact O-CD1 3.33Å; L203-L207 VanDerWaalsContact O-CG 3.26Å; L203-L207 WeakPolarHBondContact O-CG 3.45Å; L203-L207 PolarHBondContact O-N 3.35Å; L203-C235 HydrophobicContact CD1-CB 3.93Å; L203-I239 HydrophobicContact CD2-CD1 3.97Å; L203-I239 HydrophobicContact CD2-CG1 4.13Å; L203-L291 HydrophobicContact CD1-CD1 4.48Å; L203-L291 HydrophobicContact CD2-CD1 4.08Å
204A86.8Confident84.1Confident43 Ų4356.1 Ų56.136%0.35532%0.324SS..Hα-helixtrans-61.4-45.5175.200000112.2L200 N201 N206 L207 L287L200-A204 WeakPolarHBondContact O-CB 3.47Å; L200-A204 PolarHBondContact O-N 3.49Å; N201-A204 WeakPolarHBondContact O-CB 3.21Å; N201-A204 PolarHBondContact O-N 3.16Å; A204-N206 VanDerWaalsContact C-N 3.28Å; A204-N206 PolarHBondContact O-N 3.12Å; A204-L207 PolarHBondContact O-N 3.32Å; A204-L287 HydrophobicContact CB-CD1 4.39Å; A204-L287 HydrophobicContact CB-CD2 3.8Å
205S84.5Confident83.6Confident89 Ų8955.4 Ų55.462%0.62233%0.33SS*.Hα-helixtrans-68-25.7178.158.20000113.7N201 T202 L207N201-S205 PolarHBondContact O-N 3.25Å; N201-S205 PolarHBondContact O-OG 3.37Å; T202-S205 WeakPolarHBondContact CA-OG 3.28Å; T202-S205 PolarHBondContact O-N 3.2Å; T202-S205 PolarHBondContact O-OG 3.48Å; S205-L207 VanDerWaalsContact C-N 3.33Å
206N83.5Confident83.2Confident92 Ų9255.2 Ų55.249%0.49233%0.329SS..THydrogen-bonded Turntrans-83-8176.2-70.7-20.5000113.4T202 L203 A204T202-N206 WeakPolarHBondContact O-CB 3.33Å; T202-N206 PolarHBondContact O-N 2.61Å; T202-N206 VanDerWaalsContact O-N 3.08Å; T202-N206 PolarHBondContact O-ND2 3.5Å; L203-N206 PolarHBondContact O-N 3.13Å; A204-N206 VanDerWaalsContact C-N 3.28Å; A204-N206 PolarHBondContact O-N 3.12Å
207L83.8Confident82.6Confident18 Ų1855.1 Ų55.19%0.09433%0.329CS..SBendtrans-95.4141.5178.3-71.7165.6000111.2L203 A204 S205 N209 Y232 L287 L291 L294L203-L207 HydrophobicContact CD1-CD1 4.4Å; L203-L207 HydrophobicContact CG-CD1 4.24Å; L203-L207 WeakPolarHBondContact O-CD1 3.33Å; L203-L207 VanDerWaalsContact O-CG 3.26Å; L203-L207 WeakPolarHBondContact O-CG 3.45Å; L203-L207 PolarHBondContact O-N 3.35Å; A204-L207 PolarHBondContact O-N 3.32Å; S205-L207 VanDerWaalsContact C-N 3.33Å; L207-N209 PolarHBondContact O-N 2.8Å; L207-Y232 HydrophobicContact CD2-CD1 4.05Å; L207-Y232 HydrophobicContact CD2-CE1 3.51Å; L207-L287 HydrophobicContact CD1-CD2 3.79Å; L207-L291 HydrophobicContact CD1-CD2 4.44Å; L207-L291 HydrophobicContact CD1-CG 4.07Å; L207-L291 HydrophobicContact CD2-CD2 3.72Å; L207-L291 HydrophobicContact CD2-CG 4.18Å; L207-L294 HydrophobicContact CD2-CD1 3.74Å
208P80.2Confident82Confident20 Ų2058.6 Ų58.613%0.1335%0.345CS..PPolyproline II helixtrans-68.9133.6-178.129.1-36.3000111.6W213 F216 Y232 R290 L294P208-W213 HydrophobicContact CB-CB 3.86Å; P208-W213 HydrophobicContact CG-CB 3.84Å; P208-F216 HydrophobicContact CB-CB 4.15Å; P208-F216 HydrophobicContact CB-CD1 3.74Å; P208-F216 HydrophobicContact CB-CE1 4.38Å; P208-F216 HydrophobicContact CB-CG 4.04Å; P208-F216 HydrophobicContact CG-CD1 3.81Å; P208-F216 HydrophobicContact CG-CE1 4.26Å; P208-Y232 WeakPolarHBondContact CD-OH 3.45Å; P208-R290 PolarHBondContact O-NH2 2.97Å; P208-L294 HydrophobicContact CG-CD1 4.09Å; P208-L294 HydrophobicContact CG-CD2 3.87Å
209N78.2Confident81.6Confident104 Ų10460.7 Ų60.756%0.55636%0.357SS*.PPolyproline II helixtrans-50.5142.8-177.3-169.5-23.7000112.5L207 S211 A212 W213 R290L207-N209 PolarHBondContact O-N 2.8Å; N209-S211 PolarHBondContact O-N 2.8Å; N209-S211 VanDerWaalsContact O-N 3.1Å; N209-S211 PolarHBondContact OD1-N 2.64Å; N209-S211 PolarHBondContact OD1-OG 2.98Å; N209-A212 PolarHBondContact O-N 3.28Å; N209-W213 WeakPolarHBondContact O-CB 3.49Å; N209-W213 PolarHBondContact O-N 3.35Å; N209-R290 PolarHBondContact O-NH2 2.58Å
210T73.2Confident81.2Confident101 Ų10159.5 Ų59.562%0.6235%0.354SS*.THydrogen-bonded Turntrans-56.1-23.3179.950.90000113.9W213T210-W213 PolarHBondContact O-NE1 3.18Å
211S77Confident80.9Confident100 Ų10062.2 Ų62.270%0.69937%0.373SS*.THydrogen-bonded Turntrans-83.5-27.4173.158.70000115.2N209N209-S211 PolarHBondContact O-N 2.8Å; N209-S211 VanDerWaalsContact O-N 3.1Å; N209-S211 PolarHBondContact OD1-N 2.64Å; N209-S211 PolarHBondContact OD1-OG 2.98Å
212A72.2Confident80.2Confident45 Ų4562 Ų6237%0.37237%0.372SS..THydrogen-bonded Turntrans-120-7.3-165.100000114.9N209 M214 T215 F216N209-A212 PolarHBondContact O-N 3.28Å; A212-M214 PolarHBondContact O-N 3.46Å; A212-T215 WeakPolarHBondContact O-CB 3.35Å; A212-T215 PolarHBondContact O-N 2.78Å; A212-T215 VanDerWaalsContact O-N 3.15Å; A212-F216 PolarHBondContact O-N 2.94Å
213W79.8Confident79.9Confident24 Ų2464 Ų649%0.09138%0.383CS..Hα-helixtrans-63-34.6-170.667-80.3000115.9P208 N209 T210 T215 F216 L217 E293 L294 Y297P208-W213 HydrophobicContact CB-CB 3.86Å; P208-W213 HydrophobicContact CG-CB 3.84Å; N209-W213 WeakPolarHBondContact O-CB 3.49Å; N209-W213 PolarHBondContact O-N 3.35Å; T210-W213 PolarHBondContact O-NE1 3.18Å; W213-T215 VanDerWaalsContact C-N 3.33Å; W213-F216 PolarHBondContact O-N 3.14Å; W213-L217 HydrophobicContact CE3-CD1 3.86Å; W213-L217 HydrophobicContact CZ3-CD1 4.24Å; W213-L217 WeakPolarHBondContact O-CB 3.28Å; W213-L217 WeakPolarHBondContact O-CG 3.25Å; W213-L217 PolarHBondContact O-N 3.38Å; W213-E293 HydrophobicContact CH2-CG 4.24Å; W213-E293 HydrophobicContact CZ2-CG 4.44Å; W213-E293 WeakPolarHBondContact CZ2-OE1 3.17Å; W213-L294 HydrophobicContact CB-CD2 3.84Å; W213-L294 HydrophobicContact CD2-CD2 3.91Å; W213-L294 HydrophobicContact CE3-CD2 3.54Å; W213-L294 HydrophobicContact CG-CD2 4.08Å; W213-L294 HydrophobicContact CZ3-CD2 4.31Å; W213-Y297 AromaticContact CH2-CD2 3.91Å; W213-Y297 HydrophobicContact CH2-CD2 3.91Å; W213-Y297 HydrophobicContact CH2-CE2 4.32Å; W213-Y297 HydrophobicContact CH2-CG 4.34Å; W213-Y297 HydrophobicContact CZ3-CD1 4.12Å; W213-Y297 AromaticContact CZ3-CD2 3.58Å; W213-Y297 HydrophobicContact CZ3-CD2 3.58Å; W213-Y297 HydrophobicContact CZ3-CE2 4.02Å; W213-Y297 AromaticContact CZ3-CG 3.61Å; W213-Y297 HydrophobicContact CZ3-CG 3.61Å
214M76.2Confident79.7Confident57 Ų5768.4 Ų68.428%0.28140%0.404SS..Hα-helixtrans-63.2-43.2174.9-68.3-168.4-175.900110.5A212 F216 L217 M218 Y297 Y846A212-M214 PolarHBondContact O-N 3.46Å; M214-F216 PolarHBondContact O-N 3.39Å; M214-L217 PolarHBondContact O-N 3.05Å; M214-M218 VanDerWaalsContact O-CB 3.3Å; M214-M218 WeakPolarHBondContact O-CB 3.33Å; M214-M218 VanDerWaalsContact O-CG 3.28Å; M214-M218 WeakPolarHBondContact O-CG 3.2Å; M214-M218 PolarHBondContact O-N 2.91Å; M214-Y297 HydrophobicContact CG-CE2 4.26Å; M214-Y846 HydrophobicContact CE-CE2 4.13Å; M214-Y846 PolarHBondContact SD-OH 3Å
215T78.7Confident79.4Confident106 Ų10667 Ų6765%0.6539%0.39SS*.Hα-helixtrans-60.9-44.6175.2-47.10000111.3A212 W213 S219A212-T215 WeakPolarHBondContact O-CB 3.35Å; A212-T215 PolarHBondContact O-N 2.78Å; A212-T215 VanDerWaalsContact O-N 3.15Å; W213-T215 VanDerWaalsContact C-N 3.33Å; T215-S219 WeakPolarHBondContact O-CB 3.26Å; T215-S219 PolarHBondContact O-N 3.3Å
216F80Confident79.2Confident88 Ų8869.1 Ų69.139%0.38639%0.388SS..Hα-helixtrans-59.4-54.7174.7177.1-103.7000111.6P208 A212 W213 M214 M218 S219 L220P208-F216 HydrophobicContact CB-CB 4.15Å; P208-F216 HydrophobicContact CB-CD1 3.74Å; P208-F216 HydrophobicContact CB-CE1 4.38Å; P208-F216 HydrophobicContact CB-CG 4.04Å; P208-F216 HydrophobicContact CG-CD1 3.81Å; P208-F216 HydrophobicContact CG-CE1 4.26Å; A212-F216 PolarHBondContact O-N 2.94Å; W213-F216 PolarHBondContact O-N 3.14Å; M214-F216 PolarHBondContact O-N 3.39Å; F216-M218 VanDerWaalsContact C-N 3.31Å; F216-M218 PolarHBondContact O-N 3.02Å; F216-S219 WeakPolarHBondContact O-CB 3.24Å; F216-S219 PolarHBondContact O-N 2.87Å; F216-S219 PolarHBondContact O-OG 2.77Å; F216-L220 HydrophobicContact CE1-CD1 4.16Å; F216-L220 HydrophobicContact CE1-CD2 4.34Å; F216-L220 HydrophobicContact CE2-CD2 4.24Å; F216-L220 HydrophobicContact CZ-CD2 4.02Å; F216-L220 PolarHBondContact O-N 3.32Å
217L77.8Confident79.1Confident2 Ų267.3 Ų67.31%0.0138%0.382CS..Hα-helixtrans-68.2-25.4-177.2-66.2-174.8000114W213 M214 L220 T228 L294 Y297 I298W213-L217 HydrophobicContact CE3-CD1 3.86Å; W213-L217 HydrophobicContact CZ3-CD1 4.24Å; W213-L217 WeakPolarHBondContact O-CB 3.28Å; W213-L217 WeakPolarHBondContact O-CG 3.25Å; W213-L217 PolarHBondContact O-N 3.38Å; M214-L217 PolarHBondContact O-N 3.05Å; L217-L220 HydrophobicContact CD2-CD1 3.76Å; L217-T228 HydrophobicContact CD2-CG2 4.47Å; L217-L294 HydrophobicContact CD1-CD2 3.83Å; L217-Y297 HydrophobicContact CB-CD1 3.84Å; L217-Y297 HydrophobicContact CB-CE1 3.63Å; L217-Y297 HydrophobicContact CD1-CD1 3.47Å; L217-Y297 VanDerWaalsContact CD1-CD1 3.47Å; L217-Y297 HydrophobicContact CD1-CE1 4.08Å; L217-Y297 HydrophobicContact CD1-CG 4.19Å; L217-Y297 HydrophobicContact CG-CD1 4.32Å; L217-I298 HydrophobicContact CD1-CG1 4.03Å; L217-I298 HydrophobicContact CD2-CD1 3.84Å; L217-I298 HydrophobicContact CD2-CG1 3.94Å
218M76.3Confident79.2Confident118 Ų11867.5 Ų67.558%0.58139%0.385SS*.Hα-helixtrans-76.6-25.7169.5-73.3-61.7-153.100113M214 F216 Y297M214-M218 VanDerWaalsContact O-CB 3.3Å; M214-M218 WeakPolarHBondContact O-CB 3.33Å; M214-M218 VanDerWaalsContact O-CG 3.28Å; M214-M218 WeakPolarHBondContact O-CG 3.2Å; M214-M218 PolarHBondContact O-N 2.91Å; F216-M218 VanDerWaalsContact C-N 3.31Å; F216-M218 PolarHBondContact O-N 3.02Å; M218-Y297 WeakPolarHBondContact CE-OH 3.25Å; M218-Y297 WeakPolarHBondContact CG-OH 3.34Å
219S81.7Confident79.3Confident85 Ų8567.5 Ų67.559%0.59439%0.386SS*.Hα-helixtrans-78.4-17.1176.275.60000114T215 F216T215-S219 WeakPolarHBondContact O-CB 3.26Å; T215-S219 PolarHBondContact O-N 3.3Å; F216-S219 WeakPolarHBondContact O-CB 3.24Å; F216-S219 PolarHBondContact O-N 2.87Å; F216-S219 PolarHBondContact O-OG 2.77Å
220L80.9Confident79.7Confident18 Ų1867.3 Ų67.39%0.09438%0.38CS..SBendtrans-70.6131178.4-60.9-175.7000111.5F216 L217 Q224 K225 T228F216-L220 HydrophobicContact CE1-CD1 4.16Å; F216-L220 HydrophobicContact CE1-CD2 4.34Å; F216-L220 HydrophobicContact CE2-CD2 4.24Å; F216-L220 HydrophobicContact CZ-CD2 4.02Å; F216-L220 PolarHBondContact O-N 3.32Å; L217-L220 HydrophobicContact CD2-CD1 3.76Å; L220-Q224 HydrophobicContact CB-CB 3.95Å; L220-Q224 HydrophobicContact CD2-CB 4.15Å; L220-Q224 HydrophobicContact CG-CB 4.47Å; L220-K225 HydrophobicContact CB-CG 3.92Å; L220-K225 VanDerWaalsContact O-CE 3.29Å; L220-K225 WeakPolarHBondContact O-CE 3.37Å; L220-T228 HydrophobicContact CD1-CG2 4.23Å
221S81.9Confident80.4Confident57 Ų5767.1 Ų67.140%0.39937%0.369SS..  trans-63.2162.1166.874.80000111.2V223 Q224 K225S221-V223 PolarHBondContact O-N 3.47Å; S221-Q224 CarbonylContact O-C 3.6Å; S221-Q224 WeakPolarHBondContact O-CA 3.34Å; S221-Q224 WeakPolarHBondContact O-CB 3.3Å; S221-Q224 PolarHBondContact O-N 2.9Å; S221-Q224 WeakPolarHBondContact OG-CG 3.5Å; S221-Q224 PolarHBondContact OG-N 3.33Å; S221-Q224 PolarHBondContact OG-OE1 3.49Å; S221-Q224 VanDerWaalsContact OG-OE1 3.05Å; S221-K225 WeakPolarHBondContact O-CG 3.27Å; S221-K225 PolarHBondContact O-N 2.79Å
222N76.3Confident81Confident61 Ų6162.5 Ų62.533%0.32634%0.336SS..Hα-helixtrans-66.5-25.5-174.3-69.121.3000113.6K225 F226 D305N222-K225 PolarHBondContact OD1-NZ 2.9Å; N222-F226 PolarHBondContact O-N 2.8Å; N222-D305 VanDerWaalsContact CG-OD2 3.28Å; N222-D305 WeakPolarHBondContact ND2-CB 3.41Å; N222-D305 PolarHBondContact ND2-OD2 3.46Å; N222-D305 PolarHBondContact OD1-OD2 3.28Å; N222-D305 VanDerWaalsContact OD1-OD2 3.09Å
223V80.6Confident81.6Confident111 Ų11166.1 Ų66.167%0.67335%0.345SS*.Hα-helixtrans-68.2-48169-177.60000110S221 K225 F226 S227S221-V223 PolarHBondContact O-N 3.47Å; V223-K225 PolarHBondContact O-N 3.45Å; V223-F226 PolarHBondContact O-N 3.45Å; V223-S227 PolarHBondContact O-N 3.47Å; V223-S227 PolarHBondContact O-OG 3.29Å
224Q84Confident81.9Confident97 Ų9768.2 Ų68.245%0.45336%0.361SS..Hα-helixtrans-61.8-42.9177.2-71.3166.3-41.500112L220 S221 F226 S227 T228L220-Q224 HydrophobicContact CB-CB 3.95Å; L220-Q224 HydrophobicContact CD2-CB 4.15Å; L220-Q224 HydrophobicContact CG-CB 4.47Å; S221-Q224 CarbonylContact O-C 3.6Å; S221-Q224 WeakPolarHBondContact O-CA 3.34Å; S221-Q224 WeakPolarHBondContact O-CB 3.3Å; S221-Q224 PolarHBondContact O-N 2.9Å; S221-Q224 WeakPolarHBondContact OG-CG 3.5Å; S221-Q224 PolarHBondContact OG-N 3.33Å; S221-Q224 PolarHBondContact OG-OE1 3.49Å; S221-Q224 VanDerWaalsContact OG-OE1 3.05Å; Q224-F226 VanDerWaalsContact C-N 3.3Å; Q224-F226 PolarHBondContact O-N 2.85Å; Q224-S227 PolarHBondContact O-N 2.78Å; Q224-T228 WeakPolarHBondContact O-CB 3.32Å; Q224-T228 PolarHBondContact O-N 3.14Å; Q224-T228 PolarHBondContact O-OG1 3.13Å
225K81.2Confident82.5Confident15 Ų1565.6 Ų65.67%0.06535%0.348CS..Hα-helixtrans-50.8-49.7172.1-72175.6-173.2153.50110.8L220 S221 N222 V223 T228 A229 I298 I302 D305L220-K225 HydrophobicContact CB-CG 3.92Å; L220-K225 VanDerWaalsContact O-CE 3.29Å; L220-K225 WeakPolarHBondContact O-CE 3.37Å; S221-K225 WeakPolarHBondContact O-CG 3.27Å; S221-K225 PolarHBondContact O-N 2.79Å; N222-K225 PolarHBondContact OD1-NZ 2.9Å; V223-K225 PolarHBondContact O-N 3.45Å; K225-T228 PolarHBondContact O-N 3.21Å; K225-A229 WeakPolarHBondContact O-CB 3.35Å; K225-A229 PolarHBondContact O-N 3.41Å; K225-I298 HydrophobicContact CB-CG2 4.03Å; K225-I298 WeakPolarHBondContact O-CG2 3.36Å; K225-I302 HydrophobicContact CB-CD1 4.34Å; K225-I302 HydrophobicContact CB-CG1 4.25Å; K225-D305 IonicContact NZ-OD2 3.02Å; K225-D305 PolarHBondContact NZ-OD2 3.3Å
226F78.9Confident82.9Confident133 Ų13361.7 Ų61.758%0.58332%0.323SS*.Hα-helixtrans-65.5-44.2179.4-171.6-98.9000112.7N222 V223 Q224 T228 A229 K230N222-F226 PolarHBondContact O-N 2.8Å; V223-F226 PolarHBondContact O-N 3.45Å; Q224-F226 VanDerWaalsContact C-N 3.3Å; Q224-F226 PolarHBondContact O-N 2.85Å; F226-T228 PolarHBondContact O-N 3.32Å; F226-A229 PolarHBondContact O-N 2.8Å; F226-K230 PolarHBondContact O-N 3.32Å
227S82.9Confident83.2Confident53 Ų5364.1 Ų64.137%0.37133%0.334SS..Hα-helixtrans-60.1-42.7174.1-610000112.5V223 Q224 K230 Y231V223-S227 PolarHBondContact O-N 3.47Å; V223-S227 PolarHBondContact O-OG 3.29Å; Q224-S227 PolarHBondContact O-N 2.78Å; S227-K230 PolarHBondContact O-N 2.87Å; S227-Y231 WeakPolarHBondContact O-CB 3.42Å; S227-Y231 PolarHBondContact O-N 3.28Å
228T84.7Confident83.6Confident23 Ų2366.5 Ų66.514%0.14135%0.345CS..Hα-helixtrans-67.9-38.4177.7-60.20000111.7L217 L220 Q224 K225 F226 Y231 Y232 I298L217-T228 HydrophobicContact CD2-CG2 4.47Å; L220-T228 HydrophobicContact CD1-CG2 4.23Å; Q224-T228 WeakPolarHBondContact O-CB 3.32Å; Q224-T228 PolarHBondContact O-N 3.14Å; Q224-T228 PolarHBondContact O-OG1 3.13Å; K225-T228 PolarHBondContact O-N 3.21Å; F226-T228 PolarHBondContact O-N 3.32Å; T228-Y231 PolarHBondContact O-N 2.82Å; T228-Y232 HydrophobicContact CG2-CD1 4.44Å; T228-Y232 HydrophobicContact CG2-CD2 4.06Å; T228-Y232 HydrophobicContact CG2-CE1 3.89Å; T228-Y232 HydrophobicContact CG2-CE2 3.47Å; T228-Y232 VanDerWaalsContact CG2-CE2 3.47Å; T228-Y232 VanDerWaalsContact O-CG 3.31Å; T228-Y232 PolarHBondContact O-N 3.46Å; T228-I298 HydrophobicContact CG2-CD1 3.63Å
229A83.5Confident84.1Confident20 Ų2061.2 Ų61.217%0.16532%0.318CS..Hα-helixtrans-61.6-45.1171.500000112K225 F226 Y231 Y232 Q233 I298K225-A229 WeakPolarHBondContact O-CB 3.35Å; K225-A229 PolarHBondContact O-N 3.41Å; F226-A229 PolarHBondContact O-N 2.8Å; A229-Y231 VanDerWaalsContact C-N 3.34Å; A229-Y231 PolarHBondContact O-N 3.46Å; A229-Y232 PolarHBondContact O-N 2.82Å; A229-Q233 WeakPolarHBondContact O-CB 3.44Å; A229-Q233 PolarHBondContact O-N 3.25Å; A229-I298 HydrophobicContact CB-CG2 3.93Å
230K85.2Confident84.1Confident99 Ų9962.1 Ų62.143%0.4331%0.313SS..Hα-helixtrans-61-41.7175.3-168.8-179.9179.9-1750111.4F226 S227 Q233 V234F226-K230 PolarHBondContact O-N 3.32Å; S227-K230 PolarHBondContact O-N 2.87Å; K230-Q233 PolarHBondContact O-N 2.83Å; K230-V234 WeakPolarHBondContact O-CG2 3.37Å; K230-V234 PolarHBondContact O-N 3.47Å; K230-V234 VanDerWaalsContact O-N 3.07Å
231Y88.1Confident84.2Confident97 Ų9767 Ų6738%0.3834%0.336SS..Hα-helixtrans-62-49.7174.6173.4-108.4000112.4S227 T228 A229 Q233 V234 C235S227-Y231 WeakPolarHBondContact O-CB 3.42Å; S227-Y231 PolarHBondContact O-N 3.28Å; T228-Y231 PolarHBondContact O-N 2.82Å; A229-Y231 VanDerWaalsContact C-N 3.34Å; A229-Y231 PolarHBondContact O-N 3.46Å; Y231-Q233 VanDerWaalsContact C-N 3.28Å; Y231-Q233 PolarHBondContact O-N 2.86Å; Y231-V234 PolarHBondContact O-N 3.36Å; Y231-V234 VanDerWaalsContact O-N 3.11Å; Y231-C235 VanDerWaalsContact CZ-SG 3.53Å; Y231-C235 PolarHBondContact O-N 3.43Å; Y231-C235 PolarHBondContact O-SG 2.83Å
232Y89Confident84.4Confident4 Ų468 Ų682%0.01633%0.331CS..Hα-helixtrans-62.3-35176.5-64.7-19.1000112.3L207 P208 T228 A229 C235 L236 L291 L294 I298L207-Y232 HydrophobicContact CD2-CD1 4.05Å; L207-Y232 HydrophobicContact CD2-CE1 3.51Å; P208-Y232 WeakPolarHBondContact CD-OH 3.45Å; T228-Y232 HydrophobicContact CG2-CD1 4.44Å; T228-Y232 HydrophobicContact CG2-CD2 4.06Å; T228-Y232 HydrophobicContact CG2-CE1 3.89Å; T228-Y232 HydrophobicContact CG2-CE2 3.47Å; T228-Y232 VanDerWaalsContact CG2-CE2 3.47Å; T228-Y232 VanDerWaalsContact O-CG 3.31Å; T228-Y232 PolarHBondContact O-N 3.46Å; A229-Y232 PolarHBondContact O-N 2.82Å; Y232-C235 PolarHBondContact O-N 2.96Å; Y232-L236 WeakPolarHBondContact O-CB 3.35Å; Y232-L236 WeakPolarHBondContact O-CG 3.39Å; Y232-L236 PolarHBondContact O-N 3.3Å; Y232-L291 HydrophobicContact CD1-CD2 3.52Å; Y232-L291 HydrophobicContact CE1-CD2 4.3Å; Y232-L291 HydrophobicContact CG-CD2 3.71Å; Y232-L294 HydrophobicContact CD2-CB 4.08Å; Y232-L294 HydrophobicContact CE2-CB 3.6Å; Y232-L294 HydrophobicContact CE2-CD1 4.44Å; Y232-I298 HydrophobicContact CD2-CD1 3.89Å; Y232-I298 HydrophobicContact CE2-CD1 3.62Å
233Q84.9Confident84.8Confident120 Ų12067 Ų6756%0.56133%0.329SS*.Hα-helixtrans-65.4-35.8174.1-165.2-175.33200112.6A229 K230 Y231 K237A229-Q233 WeakPolarHBondContact O-CB 3.44Å; A229-Q233 PolarHBondContact O-N 3.25Å; K230-Q233 PolarHBondContact O-N 2.83Å; Y231-Q233 VanDerWaalsContact C-N 3.28Å; Y231-Q233 PolarHBondContact O-N 2.86Å; Q233-K237 PolarHBondContact O-N 3.11Å
234V87.5Confident84.9Confident69 Ų6967.2 Ų67.242%0.41832%0.321SS..Hα-helixtrans-68.2-44.5171.71720000110.8K230 Y231 L236 K237 Q238K230-V234 WeakPolarHBondContact O-CG2 3.37Å; K230-V234 PolarHBondContact O-N 3.47Å; K230-V234 VanDerWaalsContact O-N 3.07Å; Y231-V234 PolarHBondContact O-N 3.36Å; Y231-V234 VanDerWaalsContact O-N 3.11Å; V234-L236 VanDerWaalsContact C-N 3.33Å; V234-L236 PolarHBondContact O-N 3.46Å; V234-K237 WeakPolarHBondContact O-CB 3.46Å; V234-K237 PolarHBondContact O-N 2.93Å; V234-K237 VanDerWaalsContact O-N 3.14Å; V234-Q238 HydrophobicContact CG1-CG 4.49Å; V234-Q238 WeakPolarHBondContact O-CG 3.45Å; V234-Q238 PolarHBondContact O-N 2.83Å
235C87.7Confident84.8Confident1 Ų164.3 Ų64.31%0.00731%0.31CS..Hα-helixtrans-60.2-40.9177.3-62.60000112.2L203 Y231 Y232 K237 Q238 I239 L291L203-C235 HydrophobicContact CD1-CB 3.93Å; Y231-C235 VanDerWaalsContact CZ-SG 3.53Å; Y231-C235 PolarHBondContact O-N 3.43Å; Y231-C235 PolarHBondContact O-SG 2.83Å; Y232-C235 PolarHBondContact O-N 2.96Å; C235-K237 PolarHBondContact O-N 3.3Å; C235-Q238 PolarHBondContact O-N 3.47Å; C235-I239 PolarHBondContact O-N 3.42Å; C235-L291 HydrophobicContact CB-CD1 3.89Å; C235-L291 HydrophobicContact CB-CD2 4.04Å
236L87.3Confident85Confident25 Ų2563.8 Ų63.813%0.13131%0.308CS..Hα-helixtrans-62.9-38.7175.3-75.7168.8000112.4Y232 V234 I239 E240 W288 L291 L292Y232-L236 WeakPolarHBondContact O-CB 3.35Å; Y232-L236 WeakPolarHBondContact O-CG 3.39Å; Y232-L236 PolarHBondContact O-N 3.3Å; V234-L236 VanDerWaalsContact C-N 3.33Å; V234-L236 PolarHBondContact O-N 3.46Å; L236-I239 PolarHBondContact O-N 2.88Å; L236-E240 PolarHBondContact O-N 2.94Å; L236-W288 HydrophobicContact CD2-CG 4.35Å; L236-L291 HydrophobicContact CD2-CB 3.69Å; L236-L291 HydrophobicContact CD2-CD1 4.35Å; L236-L291 HydrophobicContact CG-CB 4.02Å; L236-L292 HydrophobicContact CD1-CD2 4.14Å; L236-L292 HydrophobicContact CD2-CD2 4.44Å; L236-L292 HydrophobicContact CD2-CG 4.35Å
237K86.3Confident85.3Confident139 Ų13960.3 Ų60.360%0.60430%0.3SS*.Hα-helixtrans-66.4-39.6172.8-72.8-179.5178-176.10112.4Q233 V234 C235 E240 Q241Q233-K237 PolarHBondContact O-N 3.11Å; V234-K237 WeakPolarHBondContact O-CB 3.46Å; V234-K237 PolarHBondContact O-N 2.93Å; V234-K237 VanDerWaalsContact O-N 3.14Å; C235-K237 PolarHBondContact O-N 3.3Å; K237-E240 WeakPolarHBondContact O-CB 3.5Å; K237-E240 PolarHBondContact O-N 3.49Å; K237-Q241 PolarHBondContact O-N 3.24Å
238Q85.7Confident85.3Confident52 Ų5260.3 Ų60.324%0.24330%0.298CS..Hα-helixtrans-66.7-39.4176.4-70.9174.7-28.900111.5W199 V234 C235 E240 Q241 Y242W199-Q238 HydrophobicContact CH2-CB 3.67Å; W199-Q238 HydrophobicContact CZ2-CB 3.47Å; W199-Q238 VanDerWaalsContact CZ2-CB 3.47Å; W199-Q238 HydrophobicContact CZ2-CG 4.39Å; V234-Q238 HydrophobicContact CG1-CG 4.49Å; V234-Q238 WeakPolarHBondContact O-CG 3.45Å; V234-Q238 PolarHBondContact O-N 2.83Å; C235-Q238 PolarHBondContact O-N 3.47Å; Q238-E240 VanDerWaalsContact C-N 3.33Å; Q238-E240 PolarHBondContact O-N 3.41Å; Q238-Q241 PolarHBondContact O-N 3.42Å; Q238-Y242 VanDerWaalsContact O-CD2 3.25Å; Q238-Y242 WeakPolarHBondContact O-CD2 3.38Å; Q238-Y242 PolarHBondContact O-N 3.45Å
239I86.9Confident85.3Confident6 Ų659.2 Ų59.23%0.03129%0.291CS..Hα-helixtrans-57.4-44.6168.4-77.5-177.9000111W199 L203 C235 L236 Q241 Y242 S243 F284 L287 W288 L291W199-I239 HydrophobicContact CH2-CG1 3.85Å; W199-I239 HydrophobicContact CZ3-CG1 3.99Å; L203-I239 HydrophobicContact CD2-CD1 3.97Å; L203-I239 HydrophobicContact CD2-CG1 4.13Å; C235-I239 PolarHBondContact O-N 3.42Å; L236-I239 PolarHBondContact O-N 2.88Å; I239-Q241 VanDerWaalsContact C-N 3.28Å; I239-Q241 PolarHBondContact O-N 3.12Å; I239-Y242 PolarHBondContact O-N 3.05Å; I239-S243 VanDerWaalsContact O-CB 3.25Å; I239-S243 WeakPolarHBondContact O-CB 3.35Å; I239-S243 PolarHBondContact O-N 3.36Å; I239-S243 PolarHBondContact O-OG 3.44Å; I239-F284 HydrophobicContact CB-CD1 4.46Å; I239-F284 HydrophobicContact CG1-CD1 4.27Å; I239-F284 HydrophobicContact CG1-CE1 4.37Å; I239-F284 HydrophobicContact CG2-CD1 3.98Å; I239-F284 HydrophobicContact CG2-CE1 4.47Å; I239-L287 HydrophobicContact CD1-CB 4.29Å; I239-W288 HydrophobicContact CD1-CB 4.3Å; I239-W288 HydrophobicContact CG2-CB 4.24Å; I239-W288 HydrophobicContact CG2-CG 4.37Å; I239-L291 HydrophobicContact CD1-CD1 3.6Å
240E83Confident85.4Confident105 Ų10559.2 Ų59.249%0.49129%0.287SS..Hα-helixtrans-64.5-31.4178-155.8-157.3133.500112.6L236 K237 Q238 S243 K244L236-E240 PolarHBondContact O-N 2.94Å; K237-E240 WeakPolarHBondContact O-CB 3.5Å; K237-E240 PolarHBondContact O-N 3.49Å; Q238-E240 VanDerWaalsContact C-N 3.33Å; Q238-E240 PolarHBondContact O-N 3.41Å; E240-S243 WeakPolarHBondContact CA-OG 3.46Å; E240-S243 PolarHBondContact O-OG 2.96Å; E240-K244 VanDerWaalsContact O-CD 3.26Å; E240-K244 WeakPolarHBondContact O-CD 3.32Å; E240-K244 VanDerWaalsContact O-CE 3.31Å; E240-K244 WeakPolarHBondContact O-CE 3.34Å; E240-K244 VanDerWaalsContact O-CG 3.31Å; E240-K244 WeakPolarHBondContact O-CG 3.4Å; E240-K244 WeakPolarHBondContact OE1-CE 3.49Å; E240-K244 IonicContact OE1-NZ 3.95Å; E240-K244 PolarHBondContact OE1-NZ 2.9Å
241Q82.7Confident85.3Confident121 Ų12160.5 Ų60.557%0.56530%0.295SS*.Hα-helixtrans-73.6-53174.8-174.7172.2-8.600111.5K237 Q238 I239 S243 K244 T245K237-Q241 PolarHBondContact O-N 3.24Å; Q238-Q241 PolarHBondContact O-N 3.42Å; I239-Q241 VanDerWaalsContact C-N 3.28Å; I239-Q241 PolarHBondContact O-N 3.12Å; Q241-S243 VanDerWaalsContact C-N 3.34Å; Q241-S243 PolarHBondContact O-N 2.92Å; Q241-K244 WeakPolarHBondContact O-CB 3.37Å; Q241-K244 PolarHBondContact O-N 3.5Å; Q241-T245 PolarHBondContact O-N 2.95Å; Q241-T245 PolarHBondContact O-OG1 3.43Å
242Y85.5Confident85Confident78 Ų7856.6 Ų56.631%0.30628%0.281SS..Hα-helixtrans-68.5-28.5-179-70.7-67.9000113.6I196 W199 Q238 I239 K244 T245 L246 F284I196-Y242 HydrophobicContact CD1-CD1 4.44Å; I196-Y242 HydrophobicContact CG1-CD1 3.92Å; I196-Y242 HydrophobicContact CG1-CE1 4.36Å; W199-Y242 AromaticContact CD2-CD2 3.92Å; W199-Y242 HydrophobicContact CD2-CD2 3.92Å; W199-Y242 AromaticContact CD2-CE2 3.51Å; W199-Y242 HydrophobicContact CD2-CE2 3.51Å; W199-Y242 AromaticContact CE2-CE2 3.64Å; W199-Y242 AromaticContact CE3-CD2 3.61Å; W199-Y242 HydrophobicContact CE3-CD2 3.61Å; W199-Y242 AromaticContact CE3-CE2 3.73Å; W199-Y242 HydrophobicContact CE3-CE2 3.73Å; W199-Y242 HydrophobicContact CE3-CG 4.5Å; W199-Y242 AromaticContact CG-CE2 3.99Å; W199-Y242 HydrophobicContact CG-CE2 3.99Å; W199-Y242 AromaticContact CH2-CD2 3.93Å; W199-Y242 HydrophobicContact CH2-CD2 3.93Å; W199-Y242 HydrophobicContact CH2-CE2 4.18Å; W199-Y242 HydrophobicContact CZ2-CD2 4.22Å; W199-Y242 HydrophobicContact CZ2-CE2 4.01Å; W199-Y242 AromaticContact CZ3-CD2 3.61Å; W199-Y242 HydrophobicContact CZ3-CD2 3.61Å; W199-Y242 HydrophobicContact CZ3-CE2 4.06Å; Q238-Y242 VanDerWaalsContact O-CD2 3.25Å; Q238-Y242 WeakPolarHBondContact O-CD2 3.38Å; Q238-Y242 PolarHBondContact O-N 3.45Å; I239-Y242 PolarHBondContact O-N 3.05Å; Y242-K244 VanDerWaalsContact C-N 3.31Å; Y242-K244 PolarHBondContact O-N 3.37Å; Y242-T245 WeakPolarHBondContact O-CB 3.47Å; Y242-T245 PolarHBondContact O-N 3.23Å; Y242-L246 PolarHBondContact O-N 3.09Å; Y242-F284 VanDerWaalsContact CB-CZ 3.47Å
243S84.7Confident84.8Confident40 Ų4056.5 Ų56.528%0.2828%0.28SS..Hα-helixtrans-67.6-29.6173.7560000112.8I239 E240 Q241 S247I239-S243 VanDerWaalsContact O-CB 3.25Å; I239-S243 WeakPolarHBondContact O-CB 3.35Å; I239-S243 PolarHBondContact O-N 3.36Å; I239-S243 PolarHBondContact O-OG 3.44Å; E240-S243 WeakPolarHBondContact CA-OG 3.46Å; E240-S243 PolarHBondContact O-OG 2.96Å; Q241-S243 VanDerWaalsContact C-N 3.34Å; Q241-S243 PolarHBondContact O-N 2.92Å; S243-S247 WeakPolarHBondContact O-CB 3.3Å; S243-S247 PolarHBondContact O-N 3.41Å; S243-S247 PolarHBondContact O-OG 3.21Å
244K82.6Confident84.6Confident114 Ų11453.5 Ų53.550%0.49627%0.268SS..Hα-helixtrans-69.3-40.4169.3-66.5162.4-169.4164.20111.3E240 Q241 Y242 S247 T248E240-K244 VanDerWaalsContact O-CD 3.26Å; E240-K244 WeakPolarHBondContact O-CD 3.32Å; E240-K244 VanDerWaalsContact O-CE 3.31Å; E240-K244 WeakPolarHBondContact O-CE 3.34Å; E240-K244 VanDerWaalsContact O-CG 3.31Å; E240-K244 WeakPolarHBondContact O-CG 3.4Å; E240-K244 WeakPolarHBondContact OE1-CE 3.49Å; E240-K244 IonicContact OE1-NZ 3.95Å; E240-K244 PolarHBondContact OE1-NZ 2.9Å; Q241-K244 WeakPolarHBondContact O-CB 3.37Å; Q241-K244 PolarHBondContact O-N 3.5Å; Y242-K244 VanDerWaalsContact C-N 3.31Å; Y242-K244 PolarHBondContact O-N 3.37Å; K244-S247 PolarHBondContact O-N 3.02Å; K244-T248 PolarHBondContact O-N 2.74Å; K244-T248 PolarHBondContact O-OG1 3.26Å
245T81.7Confident84.2Confident36 Ų3655.7 Ų55.722%0.22127%0.274CS..Hα-helixtrans-59.3-48.1171.9-53.30000111.3F92 I196 Q241 Y242 S247 T248 I249F92-T245 HydrophobicContact CD1-CG2 4.49Å; F92-T245 HydrophobicContact CE1-CG2 3.6Å; F92-T245 HydrophobicContact CZ-CG2 3.83Å; I196-T245 HydrophobicContact CD1-CG2 4.2Å; Q241-T245 PolarHBondContact O-N 2.95Å; Q241-T245 PolarHBondContact O-OG1 3.43Å; Y242-T245 WeakPolarHBondContact O-CB 3.47Å; Y242-T245 PolarHBondContact O-N 3.23Å; T245-S247 VanDerWaalsContact C-N 3.34Å; T245-S247 PolarHBondContact O-N 3.08Å; T245-T248 PolarHBondContact O-N 3.4Å; T245-T248 PolarHBondContact O-OG1 3.47Å; T245-I249 HydrophobicContact CG2-CD1 4.13Å; T245-I249 WeakPolarHBondContact O-CG1 3.5Å; T245-I249 PolarHBondContact O-N 3.36Å
246L86.9Confident83.7Confident4 Ų455.8 Ų55.82%0.02127%0.274CS..Hα-helixtrans-64.2-38.2177.4-170.464.5000112L193 Y242 I249 K250 V277 L280 E281 F284L193-L246 HydrophobicContact CD2-CD1 3.43Å; L193-L246 VanDerWaalsContact CD2-CD1 3.43Å; Y242-L246 PolarHBondContact O-N 3.09Å; L246-I249 PolarHBondContact O-N 3.23Å; L246-K250 WeakPolarHBondContact O-CB 3.29Å; L246-K250 PolarHBondContact O-N 2.9Å; L246-V277 HydrophobicContact CD1-CB 4.3Å; L246-V277 HydrophobicContact CD1-CG1 3.99Å; L246-V277 HydrophobicContact CD1-CG2 4.08Å; L246-V277 HydrophobicContact CG-CG1 4.24Å; L246-L280 HydrophobicContact CD1-CB 4.26Å; L246-L280 HydrophobicContact CD1-CD1 4.4Å; L246-L280 HydrophobicContact CD2-CB 3.82Å; L246-E281 HydrophobicContact CD2-CB 4.39Å; L246-E281 HydrophobicContact CD2-CG 3.7Å; L246-E281 HydrophobicContact CG-CG 4.43Å; L246-F284 HydrophobicContact CB-CE2 4.36Å; L246-F284 HydrophobicContact CD2-CD2 3.62Å; L246-F284 HydrophobicContact CD2-CE2 3.74Å
247S85.5Confident83.2Confident60 Ų6058.2 Ų58.242%0.4229%0.285SS..Hα-helixtrans-63.7-41.7175.8-60.80000112.5S243 K244 T245 K250 E251S243-S247 WeakPolarHBondContact O-CB 3.3Å; S243-S247 PolarHBondContact O-N 3.41Å; S243-S247 PolarHBondContact O-OG 3.21Å; K244-S247 PolarHBondContact O-N 3.02Å; T245-S247 VanDerWaalsContact C-N 3.34Å; T245-S247 PolarHBondContact O-N 3.08Å; S247-K250 WeakPolarHBondContact O-CB 3.27Å; S247-K250 PolarHBondContact O-N 3.33Å; S247-E251 WeakPolarHBondContact O-CG 3.48Å; S247-E251 PolarHBondContact O-N 3.47Å
248T82.2Confident82.4Confident53 Ų5358.8 Ų58.833%0.32529%0.294SS..Hα-helixtrans-73.7-3417848.90000112.5F92 K244 T245 K250 L252F92-T248 WeakPolarHBondContact CE2-OG1 3.48Å; K244-T248 PolarHBondContact O-N 2.74Å; K244-T248 PolarHBondContact O-OG1 3.26Å; T245-T248 PolarHBondContact O-N 3.4Å; T245-T248 PolarHBondContact O-OG1 3.47Å; T248-K250 VanDerWaalsContact C-N 3.35Å; T248-L252 VanDerWaalsContact O-CB 3.3Å; T248-L252 WeakPolarHBondContact O-CB 3.39Å; T248-L252 PolarHBondContact O-N 3.32Å
249I84.3Confident81.4Confident0 Ų058 Ų580%029%0.291CS..Hα-helixtrans-59.7-45.8166.4-71168.4000110.4F92 I189 D192 L193 T245 L246 L252 V253 V277F92-I249 HydrophobicContact CB-CG1 4.26Å; F92-I249 HydrophobicContact CD1-CD1 4.21Å; F92-I249 HydrophobicContact CD1-CG1 4.12Å; F92-I249 HydrophobicContact CD2-CD1 4.44Å; F92-I249 HydrophobicContact CD2-CG1 3.49Å; F92-I249 VanDerWaalsContact CD2-CG1 3.49Å; F92-I249 HydrophobicContact CE1-CG1 4.39Å; F92-I249 HydrophobicContact CE2-CG1 3.76Å; F92-I249 HydrophobicContact CG-CD1 4.19Å; F92-I249 HydrophobicContact CG-CG1 3.68Å; F92-I249 HydrophobicContact CZ-CG1 4.22Å; I189-I249 HydrophobicContact CG2-CG2 3.5Å; I189-I249 VanDerWaalsContact CG2-CG2 3.5Å; D192-I249 HydrophobicContact CB-CD1 4.42Å; L193-I249 HydrophobicContact CD2-CD1 4.14Å; L193-I249 HydrophobicContact CD2-CG2 4.22Å; T245-I249 HydrophobicContact CG2-CD1 4.13Å; T245-I249 WeakPolarHBondContact O-CG1 3.5Å; T245-I249 PolarHBondContact O-N 3.36Å; L246-I249 PolarHBondContact O-N 3.23Å; I249-L252 WeakPolarHBondContact O-CB 3.47Å; I249-L252 PolarHBondContact O-N 3.4Å; I249-V253 HydrophobicContact CG2-CG2 4.31Å; I249-V253 WeakPolarHBondContact O-CG2 3.4Å; I249-V253 PolarHBondContact O-N 2.91Å; I249-V277 HydrophobicContact CG2-CG2 4.02Å
250K86.4Confident80.1Confident21 Ų2158.4 Ų58.49%0.09129%0.294CS..Hα-helixtrans-61.6-48.4179.3-169.4168-177.8169.50112.3L246 S247 T248 L252 V253 D254 V277 E281 Y754L246-K250 WeakPolarHBondContact O-CB 3.29Å; L246-K250 PolarHBondContact O-N 2.9Å; S247-K250 WeakPolarHBondContact O-CB 3.27Å; S247-K250 PolarHBondContact O-N 3.33Å; T248-K250 VanDerWaalsContact C-N 3.35Å; K250-L252 VanDerWaalsContact C-N 3.26Å; K250-L252 PolarHBondContact O-N 2.82Å; K250-V253 PolarHBondContact O-N 3.43Å; K250-D254 WeakPolarHBondContact O-CB 3.36Å; K250-D254 PolarHBondContact O-N 3.44Å; K250-V277 HydrophobicContact CB-CG1 3.82Å; K250-V277 HydrophobicContact CD-CG1 3.81Å; K250-V277 HydrophobicContact CG-CG1 3.88Å; K250-E281 WeakPolarHBondContact CD-OE1 3.36Å; K250-E281 IonicContact NZ-OE1 2.66Å; K250-E281 PolarHBondContact NZ-OE1 3.49Å; K250-E281 IonicContact NZ-OE2 3.77Å; K250-E281 PolarHBondContact NZ-OE2 2.88Å; K250-Y754 PolarHBondContact NZ-OH 2.92Å
251E83.3Confident78.8Confident125 Ų12560.7 Ų60.758%0.58431%0.309SS*.Hα-helixtrans-60.5-35.2175.7-73-175.9175.600112.2S247 H255S247-E251 WeakPolarHBondContact O-CG 3.48Å; S247-E251 PolarHBondContact O-N 3.47Å; E251-H255 WeakPolarHBondContact O-CB 3.33Å; E251-H255 PolarHBondContact O-N 2.83Å
252L81.4Confident77.7Confident16 Ų1656.4 Ų56.48%0.08429%0.294CS..Hα-helixtrans-69.9-42.9175.4-178.158.4000112.5F92 L96 F185 I189 T248 I249 K250 H255 V256F92-L252 HydrophobicContact CD2-CD2 4.27Å; L96-L252 HydrophobicContact CD2-CB 4.44Å; L96-L252 HydrophobicContact CD2-CD1 4.09Å; L96-L252 HydrophobicContact CD2-CD2 4.09Å; L96-L252 HydrophobicContact CD2-CG 4.44Å; L96-L252 HydrophobicContact CG-CD2 4.27Å; F185-L252 HydrophobicContact CE2-CD1 4.38Å; F185-L252 HydrophobicContact CE2-CD2 3.91Å; F185-L252 HydrophobicContact CE2-CG 3.94Å; F185-L252 HydrophobicContact CZ-CG 4.16Å; I189-L252 HydrophobicContact CD1-CD2 4.35Å; T248-L252 VanDerWaalsContact O-CB 3.3Å; T248-L252 WeakPolarHBondContact O-CB 3.39Å; T248-L252 PolarHBondContact O-N 3.32Å; I249-L252 WeakPolarHBondContact O-CB 3.47Å; I249-L252 PolarHBondContact O-N 3.4Å; K250-L252 VanDerWaalsContact C-N 3.26Å; K250-L252 PolarHBondContact O-N 2.82Å; L252-H255 PolarHBondContact O-N 3.12Å; L252-V256 WeakPolarHBondContact O-CG2 3.21Å; L252-V256 PolarHBondContact O-N 2.97Å
253V83.8Confident76.9Confident1 Ų158 Ų581%0.00631%0.308CS..Hα-helixtrans-65.4-49.2175.9172.10000110.8I189 I249 K250 H255 V256 E257 L270 L273I189-V253 HydrophobicContact CD1-CG2 4.31Å; I249-V253 HydrophobicContact CG2-CG2 4.31Å; I249-V253 WeakPolarHBondContact O-CG2 3.4Å; I249-V253 PolarHBondContact O-N 2.91Å; K250-V253 PolarHBondContact O-N 3.43Å; V253-H255 VanDerWaalsContact C-N 3.27Å; V253-H255 PolarHBondContact O-N 3.36Å; V253-V256 PolarHBondContact O-N 3.37Å; V253-V256 VanDerWaalsContact O-N 3.1Å; V253-E257 PolarHBondContact O-N 3.33Å; V253-L270 HydrophobicContact CG1-CD2 4.41Å; V253-L273 HydrophobicContact CG2-CD2 3.83Å; V253-L273 HydrophobicContact CG2-CG 4.41Å
254D81.7Confident76.4Confident57 Ų5761.7 Ų61.731%0.30532%0.323SS..Hα-helixtrans-56.4-41.9174.4-76.8-12.6000110.9K250 V256 E257 L258K250-D254 WeakPolarHBondContact O-CB 3.36Å; K250-D254 PolarHBondContact O-N 3.44Å; D254-V256 PolarHBondContact O-N 3.1Å; D254-E257 PolarHBondContact O-N 3.07Å; D254-L258 WeakPolarHBondContact O-CB 3.48Å; D254-L258 VanDerWaalsContact O-CG 3.29Å; D254-L258 WeakPolarHBondContact O-CG 3.4Å; D254-L258 PolarHBondContact O-N 3.42Å
255H78.8Confident76.3Confident116 Ų11662.9 Ų62.954%0.53733%0.331SS..Hα-helixtrans-68.2-32178.4-163.886.6000112.9E251 L252 V253 N259E251-H255 WeakPolarHBondContact O-CB 3.33Å; E251-H255 PolarHBondContact O-N 2.83Å; L252-H255 PolarHBondContact O-N 3.12Å; V253-H255 VanDerWaalsContact C-N 3.27Å; V253-H255 PolarHBondContact O-N 3.36Å; H255-N259 PolarHBondContact CD2-ND2 3.35Å; H255-N259 VanDerWaalsContact CD2-ND2 3.31Å; H255-N259 PolarHBondContact NE2-ND2 2.97Å; H255-N259 VanDerWaalsContact NE2-ND2 3.12Å; H255-N259 VanDerWaalsContact O-CB 3.29Å; H255-N259 WeakPolarHBondContact O-CB 3.24Å; H255-N259 PolarHBondContact O-ND2 2.96Å
256V77.7Confident76.3Confident2 Ų261.7 Ų61.71%0.01232%0.322CS..Hα-helixtrans-75.5-44.3173.4174.60000110.6P178 F179 F185 L252 V253 D254 L258 N259 T260 F266 L270P178-V256 HydrophobicContact CB-CG2 4.21Å; P178-V256 HydrophobicContact CG-CG2 3.94Å; F179-V256 HydrophobicContact CE1-CG1 4.08Å; F179-V256 HydrophobicContact CZ-CG1 4.43Å; F179-V256 HydrophobicContact CZ-CG2 4.37Å; F185-V256 HydrophobicContact CE1-CG1 4.43Å; F185-V256 HydrophobicContact CE1-CG2 4.23Å; F185-V256 HydrophobicContact CZ-CB 4.47Å; F185-V256 HydrophobicContact CZ-CG2 3.82Å; L252-V256 WeakPolarHBondContact O-CG2 3.21Å; L252-V256 PolarHBondContact O-N 2.97Å; V253-V256 PolarHBondContact O-N 3.37Å; V253-V256 VanDerWaalsContact O-N 3.1Å; D254-V256 PolarHBondContact O-N 3.1Å; V256-L258 PolarHBondContact O-N 3.38Å; V256-N259 CarbonylContact O-C 3.54Å; V256-N259 WeakPolarHBondContact O-CA 3.21Å; V256-N259 PolarHBondContact O-N 3.13Å; V256-T260 HydrophobicContact CG1-CG2 3.93Å; V256-T260 WeakPolarHBondContact O-CG2 3.39Å; V256-T260 PolarHBondContact O-N 2.9Å; V256-F266 HydrophobicContact CG1-CE1 3.8Å; V256-F266 HydrophobicContact CG1-CZ 4.09Å; V256-L270 HydrophobicContact CB-CD2 4.45Å; V256-L270 HydrophobicContact CG1-CD1 3.85Å; V256-L270 HydrophobicContact CG1-CD2 4.06Å
257E76.6Confident75.9Confident77 Ų7765.2 Ų65.236%0.3634%0.339SS..Hα-helixtrans-55.6-52.9178.1-168.2178.4170.700111V253 D254 N259 T260V253-E257 PolarHBondContact O-N 3.33Å; D254-E257 PolarHBondContact O-N 3.07Å; E257-N259 PolarHBondContact O-N 3.09Å; E257-T260 PolarHBondContact O-N 2.82Å; E257-T260 PolarHBondContact O-OG1 3.22Å
258L68.8Low75.8Confident151 Ų15166.9 Ų66.979%0.79134%0.343SS*.THydrogen-bonded Turntrans-58.2-18.4175.3-73.5169.3000114.6D254 V256D254-L258 WeakPolarHBondContact O-CB 3.48Å; D254-L258 VanDerWaalsContact O-CG 3.29Å; D254-L258 WeakPolarHBondContact O-CG 3.4Å; D254-L258 PolarHBondContact O-N 3.42Å; V256-L258 PolarHBondContact O-N 3.38Å
259N65.4Low75.9Confident34 Ų3467.5 Ų67.518%0.18234%0.344CS..THydrogen-bonded Turntrans-109.70.8-176.1-86.5-60.9000114.3F179 H255 V256 E257 R621F179-N259 HydrophobicContact CE1-CB 4.18Å; F179-N259 HydrophobicContact CZ-CB 3.71Å; H255-N259 PolarHBondContact CD2-ND2 3.35Å; H255-N259 VanDerWaalsContact CD2-ND2 3.31Å; H255-N259 PolarHBondContact NE2-ND2 2.97Å; H255-N259 VanDerWaalsContact NE2-ND2 3.12Å; H255-N259 VanDerWaalsContact O-CB 3.29Å; H255-N259 WeakPolarHBondContact O-CB 3.24Å; H255-N259 PolarHBondContact O-ND2 2.96Å; V256-N259 CarbonylContact O-C 3.54Å; V256-N259 WeakPolarHBondContact O-CA 3.21Å; V256-N259 PolarHBondContact O-N 3.13Å; E257-N259 PolarHBondContact O-N 3.09Å; N259-R621 PolarHBondContact O-NH1 3.17Å; N259-R621 PolarHBondContact O-NH2 3.27Å; N259-R621 VanDerWaalsContact O-NH2 3.08Å; N259-R621 PolarHBondContact OD1-NE 3.11Å; N259-R621 PolarHBondContact OD1-NH1 3.04Å; N259-R621 PolarHBondContact OD1-NH2 3.24Å
260T59.6Low75.9Confident16 Ų1667.5 Ų67.510%0.09834%0.344CS..  trans-90.7119.2-178.148.90000113.2F179 V256 E257 A262 F266 Q267 L270F179-T260 HydrophobicContact CE1-CG2 4.19Å; V256-T260 HydrophobicContact CG1-CG2 3.93Å; V256-T260 WeakPolarHBondContact O-CG2 3.39Å; V256-T260 PolarHBondContact O-N 2.9Å; E257-T260 PolarHBondContact O-N 2.82Å; E257-T260 PolarHBondContact O-OG1 3.22Å; T260-A262 VanDerWaalsContact C-N 3.26Å; T260-A262 HydrophobicContact CG2-CB 3.69Å; T260-F266 HydrophobicContact CG2-CD1 3.88Å; T260-F266 HydrophobicContact CG2-CE1 3.73Å; T260-Q267 PolarHBondContact O-NE2 2.85Å; T260-Q267 PolarHBondContact OG1-NE2 3.32Å; T260-Q267 VanDerWaalsContact OG1-NE2 3.1Å; T260-L270 HydrophobicContact CG2-CD1 4.11Å
261L56.2Low75.7Confident152 Ų15271.7 Ų71.780%0.79636%0.364SS*.  trans-102.741.6149.5-16491.9000108.2Y618L261-Y618 WeakPolarHBondContact CD1-OH 3.45Å
262A59.3Low75.9Confident31 Ų3170.1 Ų70.126%0.25636%0.359SS..  trans-95.5178.9-167.600000111.7T260 F266T260-A262 VanDerWaalsContact C-N 3.26Å; T260-A262 HydrophobicContact CG2-CB 3.69Å; A262-F266 HydrophobicContact CB-CD1 3.88Å
263D67.4Low76.1Confident112 Ų11269.9 Ų69.960%0.59936%0.358SS*.  trans-61.2146.9-176.3-151.2-36.1000112.1Q265 F266 Q267D263-Q265 PolarHBondContact O-N 2.9Å; D263-F266 WeakPolarHBondContact O-CA 3.36Å; D263-F266 WeakPolarHBondContact O-CB 3.25Å; D263-F266 PolarHBondContact O-N 2.97Å; D263-Q267 PolarHBondContact O-N 3.47Å
264I75.9Confident76.3Confident118 Ų11870.3 Ų70.361%0.60536%0.361SS*.Hα-helixtrans-59.5-34.9-178.4-60.4174.4000110Q267 N268I264-Q267 PolarHBondContact O-N 3.48Å; I264-N268 WeakPolarHBondContact O-CB 3.5Å; I264-N268 PolarHBondContact O-N 3.4Å; I264-N268 PolarHBondContact O-ND2 2.86Å
265Q79.8Confident76.6Confident139 Ų13974.5 Ų74.565%0.6537%0.373SS*.Hα-helixtrans-64.5-37.9174.8-173.8173.5-8.800112.5D263 N269D263-Q265 PolarHBondContact O-N 2.9Å; Q265-N269 WeakPolarHBondContact O-CB 3.43Å; Q265-N269 VanDerWaalsContact O-CG 3.22Å; Q265-N269 PolarHBondContact O-N 3.34Å; Q265-N269 VanDerWaalsContact O-N 3.09Å; Q265-N269 PolarHBondContact O-OD1 3.23Å
266F81Confident77.1Confident10 Ų1071.4 Ų71.44%0.04436%0.364CS..Hα-helixtrans-70.7-40.6176.5-172.3-113.6000111.1Q182 F185 L186 V256 T260 A262 D263 N269 L270Q182-F266 HydrophobicContact CB-CD2 3.85Å; Q182-F266 HydrophobicContact CB-CE2 3.56Å; Q182-F266 HydrophobicContact CB-CZ 4.14Å; Q182-F266 HydrophobicContact CG-CD2 4.16Å; Q182-F266 HydrophobicContact CG-CE1 4.32Å; Q182-F266 HydrophobicContact CG-CE2 3.8Å; Q182-F266 HydrophobicContact CG-CZ 3.88Å; F185-F266 HydrophobicContact CD1-CE2 4.39Å; F185-F266 HydrophobicContact CD1-CZ 4.15Å; F185-F266 HydrophobicContact CE1-CZ 4.48Å; L186-F266 HydrophobicContact CD1-CD2 3.72Å; L186-F266 HydrophobicContact CD1-CE2 3.83Å; L186-F266 HydrophobicContact CD2-CE2 4.24Å; L186-F266 HydrophobicContact CG-CD2 4.3Å; L186-F266 HydrophobicContact CG-CE2 3.88Å; V256-F266 HydrophobicContact CG1-CE1 3.8Å; V256-F266 HydrophobicContact CG1-CZ 4.09Å; T260-F266 HydrophobicContact CG2-CD1 3.88Å; T260-F266 HydrophobicContact CG2-CE1 3.73Å; A262-F266 HydrophobicContact CB-CD1 3.88Å; D263-F266 WeakPolarHBondContact O-CA 3.36Å; D263-F266 WeakPolarHBondContact O-CB 3.25Å; D263-F266 PolarHBondContact O-N 2.97Å; F266-N269 PolarHBondContact O-N 3.23Å; F266-L270 HydrophobicContact CD1-CD1 3.76Å; F266-L270 HydrophobicContact CD1-CG 4.39Å; F266-L270 HydrophobicContact CE1-CD1 3.6Å; F266-L270 HydrophobicContact CE1-CG 4.2Å; F266-L270 HydrophobicContact CZ-CD1 4.21Å; F266-L270 HydrophobicContact CZ-CD2 4.37Å; F266-L270 HydrophobicContact CZ-CG 4.36Å; F266-L270 WeakPolarHBondContact O-CG 3.46Å; F266-L270 PolarHBondContact O-N 2.7Å
267Q78.9Confident77.6Confident79 Ų7971.3 Ų71.337%0.36936%0.364SS..Hα-helixtrans-65.5-40.9175.6-67.1-167.6-40.300112.7T260 D263 I264 N269 L270 H271T260-Q267 PolarHBondContact O-NE2 2.85Å; T260-Q267 PolarHBondContact OG1-NE2 3.32Å; T260-Q267 VanDerWaalsContact OG1-NE2 3.1Å; D263-Q267 PolarHBondContact O-N 3.47Å; I264-Q267 PolarHBondContact O-N 3.48Å; Q267-N269 VanDerWaalsContact C-N 3.34Å; Q267-N269 PolarHBondContact O-N 3.03Å; Q267-L270 PolarHBondContact O-N 2.86Å; Q267-H271 WeakPolarHBondContact O-CB 3.25Å; Q267-H271 PolarHBondContact O-N 2.85Å
268N83.3Confident78.1Confident94 Ų9469.2 Ų69.250%0.50336%0.357SS..Hα-helixtrans-62.1-41.4173.8-71.6-11.2000111.7I264 H271 N272I264-N268 WeakPolarHBondContact O-CB 3.5Å; I264-N268 PolarHBondContact O-N 3.4Å; I264-N268 PolarHBondContact O-ND2 2.86Å; N268-H271 PolarHBondContact O-N 3.45Å; N268-N272 VanDerWaalsContact O-CG 3.3Å; N268-N272 PolarHBondContact O-N 2.86Å; N268-N272 PolarHBondContact O-ND2 3.48Å
269N84.1Confident79Confident66 Ų6665.6 Ų65.635%0.35334%0.336SS..Hα-helixtrans-66.9-41.6176.8-72.4-1.4000112L186 Q265 F266 Q267 H271 N272 L273L186-N269 HydrophobicContact CD1-CB 3.6Å; L186-N269 HydrophobicContact CD2-CB 4.15Å; Q265-N269 WeakPolarHBondContact O-CB 3.43Å; Q265-N269 VanDerWaalsContact O-CG 3.22Å; Q265-N269 PolarHBondContact O-N 3.34Å; Q265-N269 VanDerWaalsContact O-N 3.09Å; Q265-N269 PolarHBondContact O-OD1 3.23Å; F266-N269 PolarHBondContact O-N 3.23Å; Q267-N269 VanDerWaalsContact C-N 3.34Å; Q267-N269 PolarHBondContact O-N 3.03Å; N269-H271 VanDerWaalsContact C-N 3.35Å; N269-H271 PolarHBondContact O-N 3.42Å; N269-N272 PolarHBondContact O-N 3.07Å; N269-L273 WeakPolarHBondContact O-CB 3.31Å; N269-L273 PolarHBondContact O-N 3.43Å
270L84.2Confident80.2Confident1 Ų164.2 Ų64.21%0.00533%0.328CS..Hα-helixtrans-60-42.4172.6-74.7169.2000112.1F185 L186 V253 V256 T260 F266 Q267 L273 S274F185-L270 HydrophobicContact CE1-CD2 4Å; L186-L270 HydrophobicContact CD2-CD2 4.27Å; V253-L270 HydrophobicContact CG1-CD2 4.41Å; V256-L270 HydrophobicContact CB-CD2 4.45Å; V256-L270 HydrophobicContact CG1-CD1 3.85Å; V256-L270 HydrophobicContact CG1-CD2 4.06Å; T260-L270 HydrophobicContact CG2-CD1 4.11Å; F266-L270 HydrophobicContact CD1-CD1 3.76Å; F266-L270 HydrophobicContact CD1-CG 4.39Å; F266-L270 HydrophobicContact CE1-CD1 3.6Å; F266-L270 HydrophobicContact CE1-CG 4.2Å; F266-L270 HydrophobicContact CZ-CD1 4.21Å; F266-L270 HydrophobicContact CZ-CD2 4.37Å; F266-L270 HydrophobicContact CZ-CG 4.36Å; F266-L270 WeakPolarHBondContact O-CG 3.46Å; F266-L270 PolarHBondContact O-N 2.7Å; Q267-L270 PolarHBondContact O-N 2.86Å; L270-L273 WeakPolarHBondContact O-CB 3.41Å; L270-L273 PolarHBondContact O-N 2.93Å; L270-S274 WeakPolarHBondContact O-CB 3.33Å; L270-S274 PolarHBondContact O-N 2.82Å
271H83.7Confident81.5Confident108 Ų10865.1 Ų65.150%0.533%0.332SS..Hα-helixtrans-65.7-39.1178.1-174.4-80.2000111.9Q267 N268 N269 R275Q267-H271 WeakPolarHBondContact O-CB 3.25Å; Q267-H271 PolarHBondContact O-N 2.85Å; N268-H271 PolarHBondContact O-N 3.45Å; N269-H271 VanDerWaalsContact C-N 3.35Å; N269-H271 PolarHBondContact O-N 3.42Å; H271-R275 WeakPolarHBondContact O-CB 3.48Å; H271-R275 PolarHBondContact O-N 2.88Å
272N85.8Confident83Confident92 Ų9258.3 Ų58.349%0.49230%0.297SS..Hα-helixtrans-63.8-42.1172.2-69.4-17.6000111.6N268 N269 R275 S276N268-N272 VanDerWaalsContact O-CG 3.3Å; N268-N272 PolarHBondContact O-N 2.86Å; N268-N272 PolarHBondContact O-ND2 3.48Å; N269-N272 PolarHBondContact O-N 3.07Å; N272-R275 WeakPolarHBondContact O-CB 3.38Å; N272-R275 PolarHBondContact O-N 3.44Å; N272-S276 PolarHBondContact O-N 2.9Å; N272-S276 PolarHBondContact O-OG 3.28Å
273L86.8Confident84.4Confident11 Ų1159.5 Ų59.56%0.05830%0.297CS..Hα-helixtrans-63.8-44.3177.4-160.770.3000111.7L186 I189 D190 L193 V253 N269 L270 R275 S276 V277L186-L273 HydrophobicContact CD2-CD2 4.01Å; I189-L273 HydrophobicContact CB-CD1 4.46Å; I189-L273 HydrophobicContact CB-CD2 4.06Å; I189-L273 HydrophobicContact CD1-CD2 4.3Å; I189-L273 HydrophobicContact CG2-CD1 3.99Å; I189-L273 HydrophobicContact CG2-CD2 3.8Å; I189-L273 HydrophobicContact CG2-CG 4.07Å; D190-L273 HydrophobicContact CB-CD1 4.32Å; L193-L273 HydrophobicContact CD1-CD1 3.67Å; L193-L273 HydrophobicContact CD1-CG 4.12Å; V253-L273 HydrophobicContact CG2-CD2 3.83Å; V253-L273 HydrophobicContact CG2-CG 4.41Å; N269-L273 WeakPolarHBondContact O-CB 3.31Å; N269-L273 PolarHBondContact O-N 3.43Å; L270-L273 WeakPolarHBondContact O-CB 3.41Å; L270-L273 PolarHBondContact O-N 2.93Å; L273-R275 VanDerWaalsContact C-N 3.31Å; L273-R275 PolarHBondContact O-N 3.08Å; L273-S276 PolarHBondContact O-N 3.39Å; L273-V277 WeakPolarHBondContact O-CG2 3.43Å; L273-V277 PolarHBondContact O-N 3.43Å
274S87.4Confident85.4Confident10 Ų1054.6 Ų54.67%0.0727%0.27CS..Hα-helixtrans-61.3-37.7174.3-173.70000112L270 V277 C278L270-S274 WeakPolarHBondContact O-CB 3.33Å; L270-S274 PolarHBondContact O-N 2.82Å; S274-V277 PolarHBondContact O-N 3.01Å; S274-C278 PolarHBondContact O-N 3.37Å; S274-C278 VanDerWaalsContact O-N 3.09Å; S274-C278 PolarHBondContact O-SG 2.88Å
275R88.3Confident85.8Confident146 Ų14652.5 Ų52.555%0.55126%0.258SS*.Hα-helixtrans-63.9-49.7171.7178.9179.5174.6127.518111.8H271 N272 L273 V277 C278 E279H271-R275 WeakPolarHBondContact O-CB 3.48Å; H271-R275 PolarHBondContact O-N 2.88Å; N272-R275 WeakPolarHBondContact O-CB 3.38Å; N272-R275 PolarHBondContact O-N 3.44Å; L273-R275 VanDerWaalsContact C-N 3.31Å; L273-R275 PolarHBondContact O-N 3.08Å; R275-V277 VanDerWaalsContact C-N 3.27Å; R275-V277 PolarHBondContact O-N 2.73Å; R275-C278 PolarHBondContact O-N 3.08Å; R275-E279 HydrophobicContact CG-CG 4.45Å; R275-E279 IonicContact CZ-OE1 3.08Å; R275-E279 VanDerWaalsContact CZ-OE1 3.29Å; R275-E279 IonicContact NE-OE1 2.75Å; R275-E279 PolarHBondContact NE-OE1 2.82Å; R275-E279 IonicContact NH2-OE1 3.7Å; R275-E279 PolarHBondContact NH2-OE1 3.18Å; R275-E279 WeakPolarHBondContact O-CG 3.28Å; R275-E279 PolarHBondContact O-N 3.32Å
276S88.7Confident86.2Confident50 Ų5049.3 Ų49.335%0.3525%0.247SC..Hα-helixtrans-62.5-33.6177.4-61.70000112.7N272 L273 E279 L280N272-S276 PolarHBondContact O-N 2.9Å; N272-S276 PolarHBondContact O-OG 3.28Å; L273-S276 PolarHBondContact O-N 3.39Å; S276-E279 PolarHBondContact O-N 3.35Å; S276-L280 WeakPolarHBondContact O-CB 3.46Å; S276-L280 WeakPolarHBondContact O-CG 3.34Å; S276-L280 PolarHBondContact O-N 3.41Å
277V89.1Confident86.6Confident1 Ų149.7 Ų49.71%0.00625%0.25CC..Hα-helixtrans-60.2-45.4169.6166.20000111.4L193 L246 I249 K250 L273 S274 R275 L280 E281L193-V277 HydrophobicContact CD1-CG2 3.78Å; L193-V277 HydrophobicContact CD2-CG2 3.93Å; L246-V277 HydrophobicContact CD1-CB 4.3Å; L246-V277 HydrophobicContact CD1-CG1 3.99Å; L246-V277 HydrophobicContact CD1-CG2 4.08Å; L246-V277 HydrophobicContact CG-CG1 4.24Å; I249-V277 HydrophobicContact CG2-CG2 4.02Å; K250-V277 HydrophobicContact CB-CG1 3.82Å; K250-V277 HydrophobicContact CD-CG1 3.81Å; K250-V277 HydrophobicContact CG-CG1 3.88Å; L273-V277 WeakPolarHBondContact O-CG2 3.43Å; L273-V277 PolarHBondContact O-N 3.43Å; S274-V277 PolarHBondContact O-N 3.01Å; R275-V277 VanDerWaalsContact C-N 3.27Å; R275-V277 PolarHBondContact O-N 2.73Å; V277-L280 PolarHBondContact O-N 3.46Å; V277-E281 WeakPolarHBondContact O-CG 3.4Å; V277-E281 PolarHBondContact O-N 3.36Å
278C86.7Confident87.1Confident32 Ų3248.8 Ų48.822%0.21624%0.243CC..Hα-helixtrans-69.6-35.7178.3-63.50000113.2S274 R275 L280 E281 A282S274-C278 PolarHBondContact O-N 3.37Å; S274-C278 VanDerWaalsContact O-N 3.09Å; S274-C278 PolarHBondContact O-SG 2.88Å; R275-C278 PolarHBondContact O-N 3.08Å; C278-L280 VanDerWaalsContact C-N 3.32Å; C278-E281 PolarHBondContact O-N 3.25Å; C278-A282 PolarHBondContact O-N 2.94Å; C278-A282 VanDerWaalsContact O-N 3.09Å
279E88.5Confident87.3Confident75 Ų7549.2 Ų49.235%0.3525%0.245SC..Hα-helixtrans-65.8-36173.9-71169.4170.900110.8R275 S276 K283R275-E279 HydrophobicContact CG-CG 4.45Å; R275-E279 IonicContact CZ-OE1 3.08Å; R275-E279 VanDerWaalsContact CZ-OE1 3.29Å; R275-E279 IonicContact NE-OE1 2.75Å; R275-E279 PolarHBondContact NE-OE1 2.82Å; R275-E279 IonicContact NH2-OE1 3.7Å; R275-E279 PolarHBondContact NH2-OE1 3.18Å; R275-E279 WeakPolarHBondContact O-CG 3.28Å; R275-E279 PolarHBondContact O-N 3.32Å; S276-E279 PolarHBondContact O-N 3.35Å; E279-K283 PolarHBondContact O-N 3.38Å; E279-K283 VanDerWaalsContact O-N 3.12Å
280L89.1Confident87.3Confident5 Ų547.4 Ų47.43%0.02623%0.233CC..Hα-helixtrans-70.3-41.2171.6-80.8166000113.5L193 I196 D197 L200 L246 S276 V277 C278 A282 K283 F284L193-L280 HydrophobicContact CB-CD1 3.82Å; L193-L280 HydrophobicContact CD2-CD1 3.7Å; L193-L280 HydrophobicContact CG-CD1 4.24Å; I196-L280 HydrophobicContact CG2-CD2 4.16Å; D197-L280 HydrophobicContact CB-CD2 3.85Å; D197-L280 VanDerWaalsContact OD1-CD2 3.25Å; D197-L280 WeakPolarHBondContact OD1-CD2 3.5Å; L200-L280 HydrophobicContact CD1-CD2 3.74Å; L246-L280 HydrophobicContact CD1-CB 4.26Å; L246-L280 HydrophobicContact CD1-CD1 4.4Å; L246-L280 HydrophobicContact CD2-CB 3.82Å; S276-L280 WeakPolarHBondContact O-CB 3.46Å; S276-L280 WeakPolarHBondContact O-CG 3.34Å; S276-L280 PolarHBondContact O-N 3.41Å; V277-L280 PolarHBondContact O-N 3.46Å; C278-L280 VanDerWaalsContact C-N 3.32Å; L280-A282 VanDerWaalsContact C-N 3.25Å; L280-A282 PolarHBondContact O-N 3.5Å; L280-K283 PolarHBondContact O-N 3.46Å; L280-F284 VanDerWaalsContact O-CD2 3.26Å; L280-F284 WeakPolarHBondContact O-CD2 3.4Å; L280-F284 PolarHBondContact O-N 3.41Å
281E88Confident87.6Confident35 Ų3547.4 Ų47.416%0.16423%0.233CC..Hα-helixtrans-55.7-43172.5-76.8176141.100110.9L246 K250 V277 C278 F284 H285L246-E281 HydrophobicContact CD2-CB 4.39Å; L246-E281 HydrophobicContact CD2-CG 3.7Å; L246-E281 HydrophobicContact CG-CG 4.43Å; K250-E281 WeakPolarHBondContact CD-OE1 3.36Å; K250-E281 IonicContact NZ-OE1 2.66Å; K250-E281 PolarHBondContact NZ-OE1 3.49Å; K250-E281 IonicContact NZ-OE2 3.77Å; K250-E281 PolarHBondContact NZ-OE2 2.88Å; V277-E281 WeakPolarHBondContact O-CG 3.4Å; V277-E281 PolarHBondContact O-N 3.36Å; C278-E281 PolarHBondContact O-N 3.25Å; E281-F284 WeakPolarHBondContact O-CB 3.5Å; E281-F284 PolarHBondContact O-N 3.27Å; E281-H285 PolarHBondContact O-CD2 2.85Å; E281-H285 PolarHBondContact O-N 3.42Å
282A87.2Confident87.7Confident9 Ų943.2 Ų43.27%0.07421%0.214CC..Hα-helixtrans-62-48.3175.400000112.3C278 L280 F284 H285 T286 L766C278-A282 PolarHBondContact O-N 2.94Å; C278-A282 VanDerWaalsContact O-N 3.09Å; L280-A282 VanDerWaalsContact C-N 3.25Å; L280-A282 PolarHBondContact O-N 3.5Å; A282-F284 VanDerWaalsContact C-N 3.32Å; A282-F284 PolarHBondContact O-N 3.05Å; A282-H285 PolarHBondContact O-N 3.38Å; A282-T286 PolarHBondContact O-N 3.01Å; A282-T286 PolarHBondContact O-OG1 3.45Å; A282-L766 HydrophobicContact CB-CD2 3.79Å
283K88.6Confident87.8Confident56 Ų5641 Ų4124%0.24320%0.201CC..Hα-helixtrans-57-43.4174.3-75.5-172.3176.7-1730112.3D197 L200 N201 E279 L280 T286 L287D197-K283 WeakPolarHBondContact OD1-CD 3.37Å; D197-K283 WeakPolarHBondContact OD1-CE 3.31Å; D197-K283 IonicContact OD1-NZ 2.64Å; D197-K283 PolarHBondContact OD1-NZ 3.3Å; D197-K283 IonicContact OD2-NZ 3.04Å; D197-K283 PolarHBondContact OD2-NZ 3.01Å; L200-K283 HydrophobicContact CD1-CB 4.03Å; N201-K283 PolarHBondContact OD1-NZ 3.19Å; E279-K283 PolarHBondContact O-N 3.38Å; E279-K283 VanDerWaalsContact O-N 3.12Å; L280-K283 PolarHBondContact O-N 3.46Å; K283-T286 PolarHBondContact O-N 2.85Å; K283-L287 WeakPolarHBondContact O-CB 3.38Å; K283-L287 PolarHBondContact O-N 3.1Å
284F88.1Confident87.7Confident9 Ų940.5 Ų40.54%0.03920%0.198CC..Hα-helixtrans-58-49.7176-91.1-65.9000112.3I196 W199 L200 I239 Y242 L246 L280 E281 A282 L287 W288I196-F284 HydrophobicContact CG2-CE2 3.55Å; I196-F284 HydrophobicContact CG2-CZ 3.54Å; W199-F284 HydrophobicContact CZ3-CE1 4.24Å; L200-F284 HydrophobicContact CD1-CD1 4.3Å; L200-F284 HydrophobicContact CD1-CD2 3.9Å; L200-F284 HydrophobicContact CD1-CE1 4.2Å; L200-F284 HydrophobicContact CD1-CE2 3.76Å; L200-F284 HydrophobicContact CD1-CG 4.14Å; L200-F284 HydrophobicContact CD1-CZ 3.89Å; L200-F284 HydrophobicContact CD2-CD1 3.76Å; L200-F284 HydrophobicContact CD2-CE1 3.64Å; L200-F284 HydrophobicContact CD2-CG 4.34Å; L200-F284 HydrophobicContact CD2-CZ 4.1Å; L200-F284 HydrophobicContact CG-CE1 4.25Å; L200-F284 HydrophobicContact CG-CZ 4.2Å; I239-F284 HydrophobicContact CB-CD1 4.46Å; I239-F284 HydrophobicContact CG1-CD1 4.27Å; I239-F284 HydrophobicContact CG1-CE1 4.37Å; I239-F284 HydrophobicContact CG2-CD1 3.98Å; I239-F284 HydrophobicContact CG2-CE1 4.47Å; Y242-F284 VanDerWaalsContact CB-CZ 3.47Å; L246-F284 HydrophobicContact CB-CE2 4.36Å; L246-F284 HydrophobicContact CD2-CD2 3.62Å; L246-F284 HydrophobicContact CD2-CE2 3.74Å; L280-F284 VanDerWaalsContact O-CD2 3.26Å; L280-F284 WeakPolarHBondContact O-CD2 3.4Å; L280-F284 PolarHBondContact O-N 3.41Å; E281-F284 WeakPolarHBondContact O-CB 3.5Å; E281-F284 PolarHBondContact O-N 3.27Å; A282-F284 VanDerWaalsContact C-N 3.32Å; A282-F284 PolarHBondContact O-N 3.05Å; F284-L287 PolarHBondContact O-N 3.02Å; F284-W288 WeakPolarHBondContact O-CB 3.44Å; F284-W288 PolarHBondContact O-N 3.01Å
285H85.4Confident87.7Confident75 Ų7541.1 Ų41.135%0.34720%0.203SC..Hα-helixtrans-62.4-44-179.9-75-59.6000112E281 A282 W288 L289E281-H285 PolarHBondContact O-CD2 2.85Å; E281-H285 PolarHBondContact O-N 3.42Å; A282-H285 PolarHBondContact O-N 3.38Å; H285-W288 PolarHBondContact O-N 2.93Å; H285-L289 WeakPolarHBondContact O-CB 3.46Å; H285-L289 WeakPolarHBondContact O-CG 3.43Å; H285-L289 PolarHBondContact O-N 3.45Å
286T88Confident87.4Confident71 Ų7136.9 Ų36.944%0.43619%0.191SC..Hα-helixtrans-61.8-47.2177.5-58.90000112A282 K283 R290A282-T286 PolarHBondContact O-N 3.01Å; A282-T286 PolarHBondContact O-OG1 3.45Å; K283-T286 PolarHBondContact O-N 2.85Å; T286-R290 WeakPolarHBondContact O-CB 3.46Å; T286-R290 PolarHBondContact O-N 3Å
287L88.6Confident87.2Confident18 Ų1835.9 Ų35.99%0.09418%0.179CC..Hα-helixtrans-69.3-35.1179.4-76.5163000112.8L200 A204 L207 I239 K283 F284 R290 L291L200-L287 HydrophobicContact CB-CD1 3.95Å; L200-L287 HydrophobicContact CD2-CD1 3.7Å; L200-L287 HydrophobicContact CG-CD1 4.37Å; L200-L287 WeakPolarHBondContact O-CD1 3.25Å; A204-L287 HydrophobicContact CB-CD1 4.39Å; A204-L287 HydrophobicContact CB-CD2 3.8Å; L207-L287 HydrophobicContact CD1-CD2 3.79Å; I239-L287 HydrophobicContact CD1-CB 4.29Å; K283-L287 WeakPolarHBondContact O-CB 3.38Å; K283-L287 PolarHBondContact O-N 3.1Å; F284-L287 PolarHBondContact O-N 3.02Å; L287-R290 PolarHBondContact O-N 2.85Å; L287-L291 WeakPolarHBondContact O-CB 3.17Å; L287-L291 PolarHBondContact O-N 2.97Å
288W89.1Confident86.8Confident61 Ų6135.9 Ų35.923%0.23118%0.179CC..Hα-helixtrans-64.7-47.7174.8-177.979.5000112L236 I239 F284 H285 R290 L291 L292L236-W288 HydrophobicContact CD2-CG 4.35Å; I239-W288 HydrophobicContact CD1-CB 4.3Å; I239-W288 HydrophobicContact CG2-CB 4.24Å; I239-W288 HydrophobicContact CG2-CG 4.37Å; F284-W288 WeakPolarHBondContact O-CB 3.44Å; F284-W288 PolarHBondContact O-N 3.01Å; H285-W288 PolarHBondContact O-N 2.93Å; W288-R290 VanDerWaalsContact C-N 3.31Å; W288-R290 PolarHBondContact O-N 2.77Å; W288-L291 PolarHBondContact O-N 3.49Å; W288-L292 HydrophobicContact CD2-CD1 3.81Å; W288-L292 HydrophobicContact CE3-CD1 3.8Å; W288-L292 HydrophobicContact CH2-CD1 3.62Å; W288-L292 HydrophobicContact CZ2-CD1 3.61Å; W288-L292 HydrophobicContact CZ3-CD1 3.71Å; W288-L292 WeakPolarHBondContact O-CG 3.45Å; W288-L292 PolarHBondContact O-N 3.1Å
289L88.1Confident86.5Confident102 Ų10237 Ų3753%0.53418%0.183SC..Hα-helixtrans-59.8-42.2174.6-72172.7000111.5H285 L292 E293H285-L289 WeakPolarHBondContact O-CB 3.46Å; H285-L289 WeakPolarHBondContact O-CG 3.43Å; H285-L289 PolarHBondContact O-N 3.45Å; L289-L292 PolarHBondContact O-N 3.25Å; L289-E293 PolarHBondContact O-N 2.95Å
290R84.8Confident86.1Confident29 Ų2938.2 Ų38.211%0.10919%0.189CC..Hα-helixtrans-65.8-40.8178.9-172.960.1178.2155.68112.8P208 N209 T286 L287 W288 E293 L294P208-R290 PolarHBondContact O-NH2 2.97Å; N209-R290 PolarHBondContact O-NH2 2.58Å; T286-R290 WeakPolarHBondContact O-CB 3.46Å; T286-R290 PolarHBondContact O-N 3Å; L287-R290 PolarHBondContact O-N 2.85Å; W288-R290 VanDerWaalsContact C-N 3.31Å; W288-R290 PolarHBondContact O-N 2.77Å; R290-E293 WeakPolarHBondContact CD-OE2 3.36Å; R290-E293 IonicContact CZ-OE2 2.77Å; R290-E293 IonicContact NE-OE2 2.98Å; R290-E293 VanDerWaalsContact NH1-CD 3.27Å; R290-E293 IonicContact NH1-OE1 3.82Å; R290-E293 PolarHBondContact NH1-OE1 3.44Å; R290-E293 IonicContact NH1-OE2 2.64Å; R290-E293 PolarHBondContact NH1-OE2 3.27Å; R290-E293 PolarHBondContact O-N 3.12Å; R290-L294 HydrophobicContact CG-CD1 4.18Å; R290-L294 WeakPolarHBondContact O-CB 3.29Å; R290-L294 WeakPolarHBondContact O-CD1 3.48Å; R290-L294 WeakPolarHBondContact O-CG 3.35Å; R290-L294 PolarHBondContact O-N 3.31Å; R290-L294 VanDerWaalsContact O-N 3.1Å
291L89Confident85.4Confident0 Ų039 Ų390%019%0.193CC..Hα-helixtrans-65.4-36.9172.5-86.7160.5000112.4L203 L207 Y232 C235 L236 I239 L287 W288 S295L203-L291 HydrophobicContact CD1-CD1 4.48Å; L203-L291 HydrophobicContact CD2-CD1 4.08Å; L207-L291 HydrophobicContact CD1-CD2 4.44Å; L207-L291 HydrophobicContact CD1-CG 4.07Å; L207-L291 HydrophobicContact CD2-CD2 3.72Å; L207-L291 HydrophobicContact CD2-CG 4.18Å; Y232-L291 HydrophobicContact CD1-CD2 3.52Å; Y232-L291 HydrophobicContact CE1-CD2 4.3Å; Y232-L291 HydrophobicContact CG-CD2 3.71Å; C235-L291 HydrophobicContact CB-CD1 3.89Å; C235-L291 HydrophobicContact CB-CD2 4.04Å; L236-L291 HydrophobicContact CD2-CB 3.69Å; L236-L291 HydrophobicContact CD2-CD1 4.35Å; L236-L291 HydrophobicContact CG-CB 4.02Å; I239-L291 HydrophobicContact CD1-CD1 3.6Å; L287-L291 WeakPolarHBondContact O-CB 3.17Å; L287-L291 PolarHBondContact O-N 2.97Å; W288-L291 PolarHBondContact O-N 3.49Å; L291-S295 VanDerWaalsContact O-CB 3.29Å; L291-S295 WeakPolarHBondContact O-CB 3.29Å; L291-S295 PolarHBondContact O-N 2.82Å; L291-S295 PolarHBondContact O-OG 2.9Å
292L87.2Confident84.6Confident20 Ų2039.6 Ų39.611%0.10520%0.197CC..Hα-helixtrans-64.9-46.3174-74.9175.8000111.8L236 W288 L289 L294 S295 I296 Y739L236-L292 HydrophobicContact CD1-CD2 4.14Å; L236-L292 HydrophobicContact CD2-CD2 4.44Å; L236-L292 HydrophobicContact CD2-CG 4.35Å; W288-L292 HydrophobicContact CD2-CD1 3.81Å; W288-L292 HydrophobicContact CE3-CD1 3.8Å; W288-L292 HydrophobicContact CH2-CD1 3.62Å; W288-L292 HydrophobicContact CZ2-CD1 3.61Å; W288-L292 HydrophobicContact CZ3-CD1 3.71Å; W288-L292 WeakPolarHBondContact O-CG 3.45Å; W288-L292 PolarHBondContact O-N 3.1Å; L289-L292 PolarHBondContact O-N 3.25Å; L292-L294 PolarHBondContact O-N 3.25Å; L292-S295 WeakPolarHBondContact CA-OG 3.35Å; L292-S295 PolarHBondContact O-N 2.93Å; L292-S295 PolarHBondContact O-OG 3.29Å; L292-S295 VanDerWaalsContact O-OG 3.05Å; L292-I296 VanDerWaalsContact O-CB 3.28Å; L292-I296 WeakPolarHBondContact O-CB 3.4Å; L292-I296 WeakPolarHBondContact O-CD1 3.34Å; L292-I296 WeakPolarHBondContact O-CG1 3.41Å; L292-I296 PolarHBondContact O-N 3.33Å; L292-Y739 HydrophobicContact CD2-CE1 4.47Å
293E86.2Confident83.7Confident46 Ų4643.1 Ų43.122%0.21521%0.21CC..Hα-helixtrans-55.2-51.8175.2-175.8-170.1-172.900111.6W213 L289 R290 I296 Y297W213-E293 HydrophobicContact CH2-CG 4.24Å; W213-E293 HydrophobicContact CZ2-CG 4.44Å; W213-E293 WeakPolarHBondContact CZ2-OE1 3.17Å; L289-E293 PolarHBondContact O-N 2.95Å; R290-E293 WeakPolarHBondContact CD-OE2 3.36Å; R290-E293 IonicContact CZ-OE2 2.77Å; R290-E293 IonicContact NE-OE2 2.98Å; R290-E293 VanDerWaalsContact NH1-CD 3.27Å; R290-E293 IonicContact NH1-OE1 3.82Å; R290-E293 PolarHBondContact NH1-OE1 3.44Å; R290-E293 IonicContact NH1-OE2 2.64Å; R290-E293 PolarHBondContact NH1-OE2 3.27Å; R290-E293 PolarHBondContact O-N 3.12Å; E293-I296 PolarHBondContact O-N 3.46Å; E293-Y297 PolarHBondContact O-N 2.94Å
294L86.5Confident82.8Confident0 Ų043.8 Ų43.80%022%0.219CC..Hα-helixtrans-65.8-40.5-178.3-66.8167.8000112.6L207 P208 W213 L217 Y232 R290 L292 I298L207-L294 HydrophobicContact CD2-CD1 3.74Å; P208-L294 HydrophobicContact CG-CD1 4.09Å; P208-L294 HydrophobicContact CG-CD2 3.87Å; W213-L294 HydrophobicContact CB-CD2 3.84Å; W213-L294 HydrophobicContact CD2-CD2 3.91Å; W213-L294 HydrophobicContact CE3-CD2 3.54Å; W213-L294 HydrophobicContact CG-CD2 4.08Å; W213-L294 HydrophobicContact CZ3-CD2 4.31Å; L217-L294 HydrophobicContact CD1-CD2 3.83Å; Y232-L294 HydrophobicContact CD2-CB 4.08Å; Y232-L294 HydrophobicContact CE2-CB 3.6Å; Y232-L294 HydrophobicContact CE2-CD1 4.44Å; R290-L294 HydrophobicContact CG-CD1 4.18Å; R290-L294 WeakPolarHBondContact O-CB 3.29Å; R290-L294 WeakPolarHBondContact O-CD1 3.48Å; R290-L294 WeakPolarHBondContact O-CG 3.35Å; R290-L294 PolarHBondContact O-N 3.31Å; R290-L294 VanDerWaalsContact O-N 3.1Å; L292-L294 PolarHBondContact O-N 3.25Å; L294-I298 WeakPolarHBondContact O-CG1 3.38Å; L294-I298 PolarHBondContact O-N 2.85Å
295S85.9Confident81.5Confident24 Ų2445 Ų4517%0.16823%0.226CC..Hα-helixtrans-68.1-45.1176.656.10000111.8L291 L292 Y297 I298 D299L291-S295 VanDerWaalsContact O-CB 3.29Å; L291-S295 WeakPolarHBondContact O-CB 3.29Å; L291-S295 PolarHBondContact O-N 2.82Å; L291-S295 PolarHBondContact O-OG 2.9Å; L292-S295 WeakPolarHBondContact CA-OG 3.35Å; L292-S295 PolarHBondContact O-N 2.93Å; L292-S295 PolarHBondContact O-OG 3.29Å; L292-S295 VanDerWaalsContact O-OG 3.05Å; S295-Y297 VanDerWaalsContact C-N 3.26Å; S295-Y297 PolarHBondContact O-N 3.24Å; S295-I298 PolarHBondContact O-N 2.87Å; S295-D299 WeakPolarHBondContact O-CB 3.36Å; S295-D299 PolarHBondContact O-N 3.36Å
296I83.3Confident80.2Confident57 Ų5745.6 Ų45.629%0.29224%0.235SC..Hα-helixtrans-57.6-38.5176-72.3166.7000111.5L292 E293 D299 Q300L292-I296 VanDerWaalsContact O-CB 3.28Å; L292-I296 WeakPolarHBondContact O-CB 3.4Å; L292-I296 WeakPolarHBondContact O-CD1 3.34Å; L292-I296 WeakPolarHBondContact O-CG1 3.41Å; L292-I296 PolarHBondContact O-N 3.33Å; E293-I296 PolarHBondContact O-N 3.46Å; I296-D299 PolarHBondContact O-N 2.86Å; I296-Q300 VanDerWaalsContact CG2-NE2 3.26Å; I296-Q300 WeakPolarHBondContact O-CG 3.4Å; I296-Q300 PolarHBondContact O-N 2.82Å
297Y83Confident78.8Confident28 Ų2846.8 Ų46.811%0.1124%0.238CC..Hα-helixtrans-66.5-45.7176.9-174.4-90.5000112.7W213 M214 L217 M218 E293 S295 D299 Q300 N301W213-Y297 AromaticContact CH2-CD2 3.91Å; W213-Y297 HydrophobicContact CH2-CD2 3.91Å; W213-Y297 HydrophobicContact CH2-CE2 4.32Å; W213-Y297 HydrophobicContact CH2-CG 4.34Å; W213-Y297 HydrophobicContact CZ3-CD1 4.12Å; W213-Y297 AromaticContact CZ3-CD2 3.58Å; W213-Y297 HydrophobicContact CZ3-CD2 3.58Å; W213-Y297 HydrophobicContact CZ3-CE2 4.02Å; W213-Y297 AromaticContact CZ3-CG 3.61Å; W213-Y297 HydrophobicContact CZ3-CG 3.61Å; M214-Y297 HydrophobicContact CG-CE2 4.26Å; L217-Y297 HydrophobicContact CB-CD1 3.84Å; L217-Y297 HydrophobicContact CB-CE1 3.63Å; L217-Y297 HydrophobicContact CD1-CD1 3.47Å; L217-Y297 VanDerWaalsContact CD1-CD1 3.47Å; L217-Y297 HydrophobicContact CD1-CE1 4.08Å; L217-Y297 HydrophobicContact CD1-CG 4.19Å; L217-Y297 HydrophobicContact CG-CD1 4.32Å; M218-Y297 WeakPolarHBondContact CE-OH 3.25Å; M218-Y297 WeakPolarHBondContact CG-OH 3.34Å; E293-Y297 PolarHBondContact O-N 2.94Å; S295-Y297 VanDerWaalsContact C-N 3.26Å; S295-Y297 PolarHBondContact O-N 3.24Å; Y297-D299 VanDerWaalsContact C-N 3.29Å; Y297-D299 PolarHBondContact O-N 3.02Å; Y297-Q300 PolarHBondContact O-N 3.33Å; Y297-N301 WeakPolarHBondContact CE1-ND2 3.46Å; Y297-N301 PolarHBondContact O-N 3.22Å
298I82Confident77.4Confident1 Ų151 Ų511%0.00526%0.258CS..Hα-helixtrans-61-43.2174.7-64.2170.2000110.3L217 K225 T228 A229 Y232 L294 S295 Q300 N301 I302L217-I298 HydrophobicContact CD1-CG1 4.03Å; L217-I298 HydrophobicContact CD2-CD1 3.84Å; L217-I298 HydrophobicContact CD2-CG1 3.94Å; K225-I298 HydrophobicContact CB-CG2 4.03Å; K225-I298 WeakPolarHBondContact O-CG2 3.36Å; T228-I298 HydrophobicContact CG2-CD1 3.63Å; A229-I298 HydrophobicContact CB-CG2 3.93Å; Y232-I298 HydrophobicContact CD2-CD1 3.89Å; Y232-I298 HydrophobicContact CE2-CD1 3.62Å; L294-I298 WeakPolarHBondContact O-CG1 3.38Å; L294-I298 PolarHBondContact O-N 2.85Å; S295-I298 PolarHBondContact O-N 2.87Å; I298-Q300 PolarHBondContact O-N 3.04Å; I298-N301 PolarHBondContact O-N 2.94Å; I298-I302 HydrophobicContact CG2-CD1 3.65Å; I298-I302 HydrophobicContact CG2-CG1 4.13Å; I298-I302 WeakPolarHBondContact O-CG1 3.37Å; I298-I302 PolarHBondContact O-N 3.3Å
299D80.3Confident75.7Confident56 Ų5655.9 Ų55.930%0.29928%0.276SS..Hα-helixtrans-61.6-27.8179.1-130.350000112.9S295 I296 Y297 K303 W732S295-D299 WeakPolarHBondContact O-CB 3.36Å; S295-D299 PolarHBondContact O-N 3.36Å; I296-D299 PolarHBondContact O-N 2.86Å; Y297-D299 VanDerWaalsContact C-N 3.29Å; Y297-D299 PolarHBondContact O-N 3.02Å; D299-K303 VanDerWaalsContact CG-NZ 3.29Å; D299-K303 VanDerWaalsContact O-CD 3.29Å; D299-K303 WeakPolarHBondContact O-CD 3.26Å; D299-K303 WeakPolarHBondContact O-CE 3.31Å; D299-K303 WeakPolarHBondContact O-CG 3.24Å; D299-K303 PolarHBondContact O-NZ 2.69Å; D299-K303 IonicContact OD2-NZ 2.64Å; D299-K303 PolarHBondContact OD2-NZ 3.3Å; D299-W732 VanDerWaalsContact OD2-CD1 3.31Å; D299-W732 PolarHBondContact OD2-NE1 3.37Å
300Q79Confident73.9Confident100 Ų10055.3 Ų55.347%0.46728%0.276SS..Hα-helixtrans-80.6-45.7172.8-72.9177.244.900111.5I296 Y297 I298 I302 K303 T304I296-Q300 VanDerWaalsContact CG2-NE2 3.26Å; I296-Q300 WeakPolarHBondContact O-CG 3.4Å; I296-Q300 PolarHBondContact O-N 2.82Å; Y297-Q300 PolarHBondContact O-N 3.33Å; I298-Q300 PolarHBondContact O-N 3.04Å; Q300-I302 PolarHBondContact O-N 2.95Å; Q300-K303 CarbonylContact O-C 3.57Å; Q300-K303 WeakPolarHBondContact O-CA 3.26Å; Q300-K303 WeakPolarHBondContact O-CB 3.35Å; Q300-K303 PolarHBondContact O-N 2.99Å; Q300-K303 VanDerWaalsContact O-N 3.08Å; Q300-T304 PolarHBondContact O-N 2.97Å
301N74.9Confident72.4Confident22 Ų2256.4 Ų56.412%0.11829%0.287CS..Hα-helixtrans-64.1-37.7-179.8-810.1000113.2Y297 I298 K303 T304 D305Y297-N301 WeakPolarHBondContact CE1-ND2 3.46Å; Y297-N301 PolarHBondContact O-N 3.22Å; I298-N301 PolarHBondContact O-N 2.94Å; N301-K303 VanDerWaalsContact C-N 3.29Å; N301-K303 PolarHBondContact O-N 2.76Å; N301-T304 WeakPolarHBondContact CA-OG1 3.45Å; N301-T304 PolarHBondContact O-N 3.45Å; N301-T304 PolarHBondContact O-OG1 3.34Å; N301-D305 VanDerWaalsContact O-CG 3.3Å; N301-D305 PolarHBondContact O-N 2.82Å
302I72.5Confident70.7Confident47 Ų4760 Ų6024%0.24131%0.309CS..Hα-helixtrans-61.6-41.5172.9-68.6173000110K225 I298 Q300 D305 V306K225-I302 HydrophobicContact CB-CD1 4.34Å; K225-I302 HydrophobicContact CB-CG1 4.25Å; I298-I302 HydrophobicContact CG2-CD1 3.65Å; I298-I302 HydrophobicContact CG2-CG1 4.13Å; I298-I302 WeakPolarHBondContact O-CG1 3.37Å; I298-I302 PolarHBondContact O-N 3.3Å; Q300-I302 PolarHBondContact O-N 2.95Å; I302-D305 PolarHBondContact O-N 2.92Å; I302-V306 WeakPolarHBondContact O-CG2 3.39Å; I302-V306 PolarHBondContact O-N 2.75Å
303K67.8Low68.6Low84 Ų8464.4 Ų64.437%0.36533%0.332SS..Hα-helixtrans-68.8-33.7177.9-67.6175.8-167.9105.30112.4D299 Q300 N301 N307D299-K303 VanDerWaalsContact CG-NZ 3.29Å; D299-K303 VanDerWaalsContact O-CD 3.29Å; D299-K303 WeakPolarHBondContact O-CD 3.26Å; D299-K303 WeakPolarHBondContact O-CE 3.31Å; D299-K303 WeakPolarHBondContact O-CG 3.24Å; D299-K303 PolarHBondContact O-NZ 2.69Å; D299-K303 IonicContact OD2-NZ 2.64Å; D299-K303 PolarHBondContact OD2-NZ 3.3Å; Q300-K303 CarbonylContact O-C 3.57Å; Q300-K303 WeakPolarHBondContact O-CA 3.26Å; Q300-K303 WeakPolarHBondContact O-CB 3.35Å; Q300-K303 PolarHBondContact O-N 2.99Å; Q300-K303 VanDerWaalsContact O-N 3.08Å; N301-K303 VanDerWaalsContact C-N 3.29Å; N301-K303 PolarHBondContact O-N 2.76Å; K303-N307 PolarHBondContact O-N 2.89Å; K303-N307 PolarHBondContact O-ND2 3.03Å
304T68.8Low66.9Low69 Ų6967.9 Ų67.942%0.42335%0.351SS..Hα-helixtrans-70.4-42.1174.8510000112.5Q300 N301 V306 N307 Q308Q300-T304 PolarHBondContact O-N 2.97Å; N301-T304 WeakPolarHBondContact CA-OG1 3.45Å; N301-T304 PolarHBondContact O-N 3.45Å; N301-T304 PolarHBondContact O-OG1 3.34Å; T304-V306 VanDerWaalsContact C-N 3.34Å; T304-V306 PolarHBondContact O-N 3.26Å; T304-N307 PolarHBondContact O-N 3.4Å; T304-Q308 PolarHBondContact O-N 3.43Å
305D60.8Low64.9Low34 Ų3471.9 Ų71.918%0.18238%0.378CS..Hα-helixtrans-64.2-38.4-178.4-69.2-18.8000112.3N222 K225 N301 I302 Q308 R309N222-D305 VanDerWaalsContact CG-OD2 3.28Å; N222-D305 WeakPolarHBondContact ND2-CB 3.41Å; N222-D305 PolarHBondContact ND2-OD2 3.46Å; N222-D305 PolarHBondContact OD1-OD2 3.28Å; N222-D305 VanDerWaalsContact OD1-OD2 3.09Å; K225-D305 IonicContact NZ-OD2 3.02Å; K225-D305 PolarHBondContact NZ-OD2 3.3Å; N301-D305 VanDerWaalsContact O-CG 3.3Å; N301-D305 PolarHBondContact O-N 2.82Å; I302-D305 PolarHBondContact O-N 2.92Å; D305-Q308 PolarHBondContact O-N 3.16Å; D305-R309 PolarHBondContact O-N 2.9Å; D305-R309 VanDerWaalsContact O-N 3.15Å
306V59.6Low62.9Low88 Ų8878.2 Ų78.253%0.53341%0.405SS..Hα-helixtrans-62.6-44.7174.2171.70000111.1I302 T304 Q308 V310I302-V306 WeakPolarHBondContact O-CG2 3.39Å; I302-V306 PolarHBondContact O-N 2.75Å; T304-V306 VanDerWaalsContact C-N 3.34Å; T304-V306 PolarHBondContact O-N 3.26Å; V306-Q308 VanDerWaalsContact C-N 3.35Å; V306-Q308 PolarHBondContact O-N 3.41Å; V306-V310 WeakPolarHBondContact O-CG2 3.4Å; V306-V310 PolarHBondContact O-N 2.89Å
307N57.8Low61.2Low96 Ų9682.3 Ų82.351%0.51343%0.427SS..Hα-helixtrans-69.2-29.8178.2-77.6-77000113.1K303 T304 T311K303-N307 PolarHBondContact O-N 2.89Å; K303-N307 PolarHBondContact O-ND2 3.03Å; T304-N307 PolarHBondContact O-N 3.4Å; N307-T311 PolarHBondContact O-N 2.87Å; N307-T311 PolarHBondContact O-OG1 3.46Å
308Q58.6Low59.2Low107 Ų10784.9 Ų84.950%0.545%0.454SS..Hα-helixtrans-71.3-45.4176.2-78.3-168.7-4.900112.6T304 D305 V306 V310 T311 T312T304-Q308 PolarHBondContact O-N 3.43Å; D305-Q308 PolarHBondContact O-N 3.16Å; V306-Q308 VanDerWaalsContact C-N 3.35Å; V306-Q308 PolarHBondContact O-N 3.41Å; Q308-V310 VanDerWaalsContact C-N 3.32Å; Q308-V310 PolarHBondContact O-N 3.45Å; Q308-T311 CarbonylContact O-C 3.57Å; Q308-T311 PolarHBondContact O-N 3.27Å; Q308-T311 PolarHBondContact O-OG1 2.93Å; Q308-T311 VanDerWaalsContact O-OG1 3.08Å; Q308-T312 PolarHBondContact O-N 3.21Å; Q308-T312 PolarHBondContact O-OG1 3.46Å
309R53.2Low57.2Low164 Ų16490.3 Ų90.362%0.61949%0.491SS*.Hα-helixtrans-59.3-44.2176.9-68.1-176.9-175.2-150.40.1112.1D305 T311 T312 D313D305-R309 PolarHBondContact O-N 2.9Å; D305-R309 VanDerWaalsContact O-N 3.15Å; R309-T311 PolarHBondContact O-N 2.92Å; R309-T311 VanDerWaalsContact O-N 3.12Å; R309-T312 PolarHBondContact O-N 3.22Å; R309-T312 PolarHBondContact O-OG1 3.08Å; R309-D313 PolarHBondContact O-N 3.2Å
310V51.7Low55.3Low89 Ų8992.2 Ų92.254%0.53951%0.509SS..Hα-helixtrans-60.3-22.3174.9173.10000112.7V306 Q308 I314V306-V310 WeakPolarHBondContact O-CG2 3.4Å; V306-V310 PolarHBondContact O-N 2.89Å; Q308-V310 VanDerWaalsContact C-N 3.32Å; Q308-V310 PolarHBondContact O-N 3.45Å; V310-I314 WeakPolarHBondContact O-CD1 3.31Å; V310-I314 WeakPolarHBondContact O-CG1 3.45Å
311T52.1Low53.4Low53 Ų5394.9 Ų94.933%0.32553%0.526SS..Hα-helixtrans-98.8-22.6176.242.40000114.9N307 Q308 R309 C315 Y851N307-T311 PolarHBondContact O-N 2.87Å; N307-T311 PolarHBondContact O-OG1 3.46Å; Q308-T311 CarbonylContact O-C 3.57Å; Q308-T311 PolarHBondContact O-N 3.27Å; Q308-T311 PolarHBondContact O-OG1 2.93Å; Q308-T311 VanDerWaalsContact O-OG1 3.08Å; R309-T311 PolarHBondContact O-N 2.92Å; R309-T311 VanDerWaalsContact O-N 3.12Å; T311-C315 PolarHBondContact O-SG 3.29Å; T311-Y851 HydrophobicContact CG2-CE1 4.26Å; T311-Y851 PolarHBondContact OG1-OH 3.2Å
312T53.2Low51.4Low75 Ų75103 Ų10346%0.4656%0.561SS.*Hα-helixtrans-70.7-42.8173.947.20000112.4Q308 R309 I314 C315Q308-T312 PolarHBondContact O-N 3.21Å; Q308-T312 PolarHBondContact O-OG1 3.46Å; R309-T312 PolarHBondContact O-N 3.22Å; R309-T312 PolarHBondContact O-OG1 3.08Å; T312-I314 VanDerWaalsContact C-N 3.34Å; T312-I314 PolarHBondContact O-N 3.18Å; T312-C315 PolarHBondContact O-N 3.39Å; T312-C315 VanDerWaalsContact O-N 3.12Å
313D44.7Very low49.7Very low112 Ų112106.7 Ų106.760%0.59959%0.585SS**Hα-helixtrans-71.3-35.5-170.2-58.2-5.3000110.6R309 C315 H316R309-D313 PolarHBondContact O-N 3.2Å; D313-C315 VanDerWaalsContact C-N 3.26Å; D313-C315 PolarHBondContact O-N 3.28Å; D313-H316 PolarHBondContact O-N 2.83Å
314I49.5Very low48.1Very low119 Ų119113.4 Ų113.461%0.6161%0.608SS**Hα-helixtrans-64.5-27.1174.1-62.8178.1000112.3V310 T312V310-I314 WeakPolarHBondContact O-CD1 3.31Å; V310-I314 WeakPolarHBondContact O-CG1 3.45Å; T312-I314 VanDerWaalsContact C-N 3.34Å; T312-I314 PolarHBondContact O-N 3.18Å
315C45.1Very low46.5Very low85 Ų85118.9 Ų118.957%0.57463%0.629SS**Hα-helixtrans-79.4-21.6-177.2-80.40000114.4T311 T312 D313T311-C315 PolarHBondContact O-SG 3.29Å; T312-C315 PolarHBondContact O-N 3.39Å; T312-C315 VanDerWaalsContact O-N 3.12Å; D313-C315 VanDerWaalsContact C-N 3.26Å; D313-C315 PolarHBondContact O-N 3.28Å
316H44.1Very low45.2Very low157 Ų157124.1 Ų124.173%0.72766%0.657SS**Hα-helixtrans-77.8-41.6-176.5-93.4-77.8000113.5D313 A318D313-H316 PolarHBondContact O-N 2.83Å; H316-A318 PolarHBondContact O-N 3.33Å
317D46.7Very low44Very low142 Ų142125.6 Ų125.676%0.75967%0.666SS**Hα-helixtrans-71.6-29.5179.2-73.5-21000113C319 S320D317-C319 PolarHBondContact O-N 3.5Å; D317-C319 VanDerWaalsContact O-N 3.11Å; D317-S320 PolarHBondContact O-N 2.91Å
318A41.9Very low42.9Very low82 Ų82129.3 Ų129.368%0.67869%0.685SS**THydrogen-bonded Turntrans-63.2-19.2-175.900000114.4H316H316-A318 PolarHBondContact O-N 3.33Å
319C39.6Very low41.7Very low116 Ų116132 Ų13278%0.78470%0.697SS**THydrogen-bonded Turntrans-85.3-4.1-177.6-72.40000115.1D317D317-C319 PolarHBondContact O-N 3.5Å; D317-C319 VanDerWaalsContact O-N 3.11Å
320S39Very low40.9Very low95 Ų95133.4 Ų133.466%0.66471%0.71SS**SBendtrans-79.8-30-167.7-167.30000116D317D317-S320 PolarHBondContact O-N 2.91Å
321N39.6Very low40Very low156 Ų156135.2 Ų135.283%0.83472%0.717SS**  trans-115.292.6-163.3-80.8-44.8000114.9
322K34.2Very low39.2Very low193 Ų193144.5 Ų144.584%0.83975%0.748SS**  trans-88.3130.1161.2-74.1175.31761710110.6
323T36.4Very low38.4Very low124 Ų124144.2 Ų144.276%0.76176%0.76SS**  159.3140.6124.540.70000113.5
324R33.6Very low37.9Very low225 Ų225146.7 Ų146.785%0.84977%0.773SS**  trans64.3140.7167.1-59.3166.1178.3159.9-1.8114.9
325H36Very low37.2Very low185 Ų185146.1 Ų146.186%0.85678%0.779SS**  cis-141.2173.828.6-119.3-77.8000113.4
326D32.6Very low36.6Very low143 Ų143153.2 Ų153.277%0.76580%0.796SS**  trans-114.8161.1-165.2-119.2-47.5000114.8
327V33.8Very low35.9Very low120 Ų120153.2 Ų153.273%0.72780%0.801SS**  trans59117.3156.71770000119.8
328L36.4Very low35.2Very low173 Ų173152 Ų15291%0.90680%0.803SS**  -163.8129.7122-108.3171.1000111.9
329H32.2Very low34.7Very low163 Ų163157.3 Ų157.376%0.75581%0.814SS**  trans-130.1136.3-176.4-129.4-75000109
330Q37.1Very low34.3Very low194 Ų194160.3 Ų160.391%0.90781%0.814SS**  trans-164.1163.5151.8-114.3166.42500113.1
331N32.7Very low34Very low128 Ų128162.7 Ų162.768%0.68482%0.819SS**  trans-118.1149.9-153.9-50-41.8000114
332Y35.9Very low33.7Very low248 Ų248162 Ų16297%0.97382%0.821SS**  trans-169.7138.2145.2-90.2-69.9000107.6
333G35.2Very low33.6Very low68 Ų68163 Ų16370%0.70183%0.825SS**  cis-168.8159.2-7.100000110.4
334N34.3Very low33.5Very low164 Ų164166.3 Ų166.388%0.87783%0.832SS**  trans-85.5156.9-166.1-62.1-22.1000115.3
335S34.3Very low33.6Very low107 Ų107164 Ų16475%0.74883%0.834SS**  -171.8159.8124-82.60000113.6
336Y33.7Very low33.5Very low235 Ų235158.7 Ų158.792%0.92283%0.83SS**  trans70.780.4175.8-64.2-74.1000118.2
337L29.2Very low33.6Very low157 Ų157159 Ų15982%0.82283%0.83SS**  trans-152.7103.8160.9-154.7-172.7000108.8
338S32.3Very low33.7Very low115 Ų115161.2 Ų161.280%0.80483%0.832SS**  trans179.6105.3158.956.40000113.2
339E30.4Very low33.8Very low194 Ų194159.8 Ų159.891%0.90782%0.82SS**  trans-150.4124.2130.6-154.8161-139.900107
340F32.2Very low33.9Very low179 Ų179158.7 Ų158.779%0.78582%0.819SS**  trans-144.7150.4-168.5-128.2-82.8000109.9
341N32.5Very low33.8Very low146 Ų146153.4 Ų153.478%0.78180%0.804SS**  trans-46.6140.2-174.9-59-32.4000114.8
342T33Very low34Very low141 Ų141155 Ų15587%0.86581%0.807SS**  trans-159.7115.3145.31.70000111.4
343K31.6Very low34Very low214 Ų214151 Ų15193%0.9380%0.797SS**  trans-159.185.4167.3-127.7-170.8-173.4-175.70110.5
344E34.8Very low33.8Very low193 Ų193155.3 Ų155.390%0.90280%0.804SS**  trans-149.5163.2156.8-148.1162.2-155.200110.9
345I35.4Very low33.7Very low176 Ų176150.6 Ų150.690%0.90380%0.795SS**  trans-133.6134.5-162.5-60.7169000108.3
346G34.4Very low33.8Very low74 Ų74153.7 Ų153.776%0.76380%0.797SS**  trans137.8116.5165.700000114.2
347I34.1Very low33.9Very low149 Ų149150 Ų15076%0.76479%0.788SS**  trans-102.2133.8168.1-65.1165000107.1
348H36.8Very low34.3Very low167 Ų167148.2 Ų148.277%0.77379%0.789SS**  trans-178.4107.8130.4-107.1-84000114.9
349H36.6Very low34.6Very low143 Ų143146.1 Ų146.166%0.66279%0.785SS**  trans58.8127.7134.2-82.5-101.5000125.2
350L35.5Very low34.7Very low140 Ų140146 Ų14673%0.73378%0.782SS**  trans8789.3132-71.6167.1000123.7
351S35.2Very low34.9Very low83 Ų83145.9 Ų145.958%0.5878%0.784SS**  76.9140.4105.773.90000125.1
352H36.1Very low35Very low163 Ų163143.7 Ų143.776%0.75578%0.78SS**  trans71.4145.4149.9-71.8-54.5000119
353Q35.4Very low34.9Very low164 Ų164144.7 Ų144.777%0.76678%0.775SS**  cis-158.1-170.7-14.4-149.9163.5-7.100111
354N32.9Very low34.9Very low157 Ų157142.4 Ų142.484%0.8477%0.767SS**  trans-80.2154.6-163.9-53.8-16.5000116.7
355G31.3Very low34.7Very low66 Ų66138.6 Ų138.668%0.6876%0.762SS**  trans-82.6-163.6177.100000117.1
356H36.8Very low34.7Very low172 Ų172136.2 Ų136.280%0.79676%0.758SS**  trans-167.6150.4171.2-113.7-102.3000115
357E36.1Very low34.8Very low156 Ų156137.7 Ų137.773%0.72975%0.754SS**  trans78.9132.2141.5-88.5161.5-140.900130.1
358S37.7Very low34.7Very low121 Ų121138.3 Ų138.385%0.84676%0.758SS**  trans69.4146.5151.370.50000120.5
359G37.2Very low34.4Very low70 Ų70139.9 Ų139.972%0.72276%0.763SS**  cis167.4175.4-1.900000109.5
360F33.5Very low34.1Very low191 Ų191137.4 Ų137.484%0.83876%0.761SS**  cis-170.8147.5-14.4-125-65.5000109.9
361E36.9Very low33.8Very low177 Ų177141 Ų14183%0.82777%0.766SS**  trans60.7164.1168.8-53.8-167.416200119
362S32.9Very low33.7Very low100 Ų100147.1 Ų147.170%0.69978%0.779SS**  cis-160.5176-43.364.60000111.5
363E31.7Very low33.1Very low163 Ų163144.4 Ų144.476%0.76278%0.778SS**  trans73120.3168-56.9-153.5119.600123.9
364Q31Very low32.9Very low166 Ų166146.6 Ų146.678%0.77678%0.781SS**  trans42.8122.5138.7-50.2-170.831.100124.2
365S32.2Very low32.6Very low112 Ų112144.5 Ų144.578%0.78378%0.778SS**  trans14138.9142.1-51.10000120.7
366P34Very low32.6Very low127 Ų127147.1 Ų147.183%0.82579%0.785SS**  -139.8-115.15727.9-0.3000118
367P37.1Very low32.1Very low105 Ų105146.3 Ų146.368%0.68279%0.786SS**  -128.5173-121.841.7-23.4000118.4
368L32.1Very low31.9Very low162 Ų162147 Ų14785%0.84880%0.795SS**  trans44.1100.9153.3-77.1166.1000119.8
369K30.3Very low31.3Very low200 Ų200147.4 Ų147.487%0.8779%0.792SS**  175.1139.1124-100.5167.3-177.5179.10116.4
370S30.5Very low30.9Very low90 Ų90152.1 Ų152.163%0.62980%0.799SS**  trans24.3147.2142.5670000124.6
371Y29.9Very low30.6Very low215 Ų215149.7 Ų149.784%0.84380%0.8SS**  trans70.4134.2161-71.3-77.2000118.9
372Y32Very low30.2Very low213 Ų213145.1 Ų145.184%0.83580%0.801SS**  trans-150.9133.5131.6-106.1-72.4000111Y374Y372-Y374 HydrophobicContact CD1-CE2 4.21Å
373S24.6Very low29.8Very low106 Ų106145.8 Ų145.874%0.74181%0.805SS**  trans-107.2157163.557.20000108.6
374Y31Very low29.7Very low210 Ų210146 Ų14682%0.82481%0.812SS**  trans-135.3134.3172.6-104.6-88.3000111.2Y372Y372-Y374 HydrophobicContact CD1-CE2 4.21Å
375S25.9Very low29.4Very low112 Ų112143.9 Ų143.978%0.78381%0.81SS**  trans-138.2134.6175.360.70000109.2
376C30.5Very low29.2Very low121 Ų121146.9 Ų146.982%0.81882%0.817SS**  trans-130.4117.4170.8-71.70000109.8
377N27.2Very low28.8Very low156 Ų156146.3 Ų146.383%0.83481%0.811SS**  trans-82.9151.8164-76.6-30.4000109.7
378N31Very low28.3Very low170 Ų170147.1 Ų147.191%0.90981%0.813SS**  trans-160.7132.4135.4-103.6-25.3000111.3
379T26Very low28.1Very low129 Ų129149 Ų14979%0.79182%0.815SS**  trans-97.8151.2175.946.60000111.2
380I29.1Very low27.9Very low170 Ų170146.4 Ų146.487%0.87281%0.81SS**  trans-158.3157141.8-106.3151.4000109.9
381T26.3Very low27.9Very low139 Ų139150.2 Ų150.285%0.85382%0.818SS**  trans-96.3151.1-164.649.80000114.5
382G28.5Very low27.7Very low81 Ų81147.4 Ų147.484%0.83582%0.817SS**  trans-169.1125.3162.700000111.1
383S25.2Very low27.7Very low114 Ų114147.7 Ų147.780%0.79782%0.817SS**  trans-144.7135.8-174.357.40000111
384D29.9Very low27.8Very low168 Ų168150 Ų15090%0.89882%0.82SS**  trans-152.9150.9165.6-109.7-38.2000111.5
385T23.3Very low27.8Very low122 Ų122152.1 Ų152.175%0.74883%0.826SS**  trans-140.8126.1-170.842.60000113.9
386L28.2Very low27.9Very low174 Ų174154.5 Ų154.591%0.91182%0.822SS**  trans-143.5109165.4-73.9172.7000107.2
387V26.9Very low27.9Very low116 Ų116153.6 Ų153.670%0.70381%0.81SS**  90.388.450.6-179.80000113.6
388V25.9Very low28.1Very low121 Ų121154.1 Ų154.173%0.73381%0.812SS**  trans53.8124.4133.2-179.20000120.4
389K28.2Very low27.9Very low202 Ų202151.2 Ų151.288%0.87881%0.805SS**  -165.2122.7123.3-112.5173.8-175.9-179.10115
390D26.7Very low28.1Very low145 Ų145156.4 Ų156.478%0.77581%0.811SS**  trans-87.5154.9162.7-58.5-72.3000111.6
391E30Very low28.1Very low171 Ų171153.5 Ų153.580%0.79981%0.805SS**  trans-142.9112.1143.3-91.1-145.8132.200111.2
392L26.1Very low28.3Very low156 Ų156154 Ų15482%0.81780%0.802SS**  trans-85.3132.4168.5-92.4158.2000110.7
393R30.9Very low28.6Very low219 Ų219155.3 Ų155.383%0.82680%0.796SS**  trans-140.3103.2159-73.4-161.4178.1-165.40.1113.9
394L28Very low28.8Very low155 Ų155155.6 Ų155.681%0.81279%0.788SS**  trans-65.7149.7163.5-68.9125.5000111.9
395R30.3Very low29.1Very low254 Ų254153.4 Ų153.496%0.95878%0.777SS**  trans-147.8165.1142.9-111.5172.3-168.9-167.11.6110.4
396K28.6Very low29.5Very low161 Ų161154.9 Ų154.970%0.777%0.773SS**  trans-145.1155.9-141.6-144.2-174.6164.4-75.40112.7
397D29.5Very low29.9Very low103 Ų103153.2 Ų153.255%0.55177%0.765SS**  trans58.4123.2159.8-51.6-39.6000119.1
398N32.4Very low30.6Very low167 Ų167153.3 Ų153.389%0.89376%0.758SS**  -172.1148.398.1-96.8-71000112.2
399S25.4Very low31.1Very low109 Ų109152.3 Ų152.376%0.76275%0.747SS**  trans-108.2155.8-170.556.20000113.8
400R30.3Very low31.5Very low238 Ų238146.6 Ų146.690%0.89873%0.725SS**  trans-167113151.6-110.7162.5-166.2-161.21.8115.3
401S29.8Very low32Very low109 Ų109141.5 Ų141.576%0.76271%0.707SS**  trans48.1120.314255.70000122.7
402L30.2Very low32.5Very low149 Ų149139.3 Ų139.378%0.7870%0.695SS**  trans-57.4156.2151.3-93.285.7000112.4
403P34.4Very low32.9Very low109 Ų109136.7 Ų136.771%0.70868%0.681SS**  -142.5172.57829.5-7.8000116.2
404D30.8Very low33.2Very low120 Ų120131.3 Ų131.364%0.64267%0.669SS**  cis-1590.1-24.9-96.8-16.7000114.4F406D404-F406 VanDerWaalsContact C-N 3.29Å; D404-F406 PolarHBondContact O-N 3.38Å
405D36.1Very low33.6Very low122 Ų122129.2 Ų129.265%0.65266%0.659SS**  trans-65.414.6-149.8-59.3-14.3000120.4N407 E408 I409D405-N407 VanDerWaalsContact C-N 3.27Å; D405-N407 PolarHBondContact O-N 3.46Å; D405-N407 VanDerWaalsContact O-N 3.11Å; D405-E408 PolarHBondContact O-N 3.19Å; D405-I409 PolarHBondContact O-N 3.48Å
406F31.5Very low33.9Very low153 Ų153120.7 Ų120.767%0.67164%0.642SS**Hα-helixtrans-60.1-30.8-169.2-143.2-96.3000114.7D404 I410D404-F406 VanDerWaalsContact C-N 3.29Å; D404-F406 PolarHBondContact O-N 3.38Å; F406-I410 HydrophobicContact CD1-CD1 3.99Å; F406-I410 HydrophobicContact CE1-CD1 4.2Å; F406-I410 PolarHBondContact O-N 2.87Å
407N35.9Very low34.1Very low139 Ų139120 Ų12074%0.74365%0.646SS**Hα-helixtrans-75.2-27.2178.4-70.9-51.5000113.7D405 G411D405-N407 VanDerWaalsContact C-N 3.27Å; D405-N407 PolarHBondContact O-N 3.46Å; D405-N407 VanDerWaalsContact O-N 3.11Å; N407-G411 PolarHBondContact O-N 2.7Å
408E41.8Very low34.5Very low118 Ų118120.5 Ų120.555%0.55165%0.647SS**Hα-helixtrans-78.5-25.8178.5-170.8168.8153.300111.6D405 K412D405-E408 PolarHBondContact O-N 3.19Å; E408-K412 HydrophobicContact CG-CD 4.33Å; E408-K412 WeakPolarHBondContact O-CD 3.26Å; E408-K412 VanDerWaalsContact O-CG 3.3Å; E408-K412 WeakPolarHBondContact O-CG 3.46Å; E408-K412 PolarHBondContact O-N 2.97Å; E408-K412 VanDerWaalsContact OE1-CE 3.27Å; E408-K412 WeakPolarHBondContact OE1-CE 3.49Å; E408-K412 IonicContact OE1-NZ 3.43Å; E408-K412 PolarHBondContact OE1-NZ 3.22Å
409I35.9Very low34.7Very low99 Ų99116.9 Ų116.951%0.50863%0.628SS.*Hα-helixtrans-70.2-48.9173.8-62.7172.6000110.5D405 G411 K412 L413D405-I409 PolarHBondContact O-N 3.48Å; I409-G411 PolarHBondContact O-N 3.47Å; I409-K412 PolarHBondContact O-N 3.28Å; I409-K412 VanDerWaalsContact O-N 3.15Å; I409-L413 PolarHBondContact O-N 3.24Å
410I37.4Very low35.2Very low83 Ų83117.4 Ų117.443%0.42662%0.622SS.*Hα-helixtrans-60.1-47177.5-65.1171.3000110.6F406 K412 L413 D414F406-I410 HydrophobicContact CD1-CD1 3.99Å; F406-I410 HydrophobicContact CE1-CD1 4.2Å; F406-I410 PolarHBondContact O-N 2.87Å; I410-K412 PolarHBondContact O-N 3.32Å; I410-K412 VanDerWaalsContact O-N 3.11Å; I410-L413 PolarHBondContact O-N 3.48Å; I410-D414 PolarHBondContact O-N 2.64Å
411G36.9Very low35.3Very low38 Ų38114.3 Ų114.339%0.39262%0.618SS.*Hα-helixtrans-62.9-17.1177.900000115.3N407 I409 N415N407-G411 PolarHBondContact O-N 2.7Å; I409-G411 PolarHBondContact O-N 3.47Å; G411-N415 PolarHBondContact O-ND2 2.95Å
412K39.5Very low35.4Very low124 Ų124114.5 Ų114.554%0.53961%0.61SS.*Hα-helixtrans-93.7-35173.9-73.3171.9-173.9169.70112.7E408 I409 I410 N415 A416E408-K412 HydrophobicContact CG-CD 4.33Å; E408-K412 WeakPolarHBondContact O-CD 3.26Å; E408-K412 VanDerWaalsContact O-CG 3.3Å; E408-K412 WeakPolarHBondContact O-CG 3.46Å; E408-K412 PolarHBondContact O-N 2.97Å; E408-K412 VanDerWaalsContact OE1-CE 3.27Å; E408-K412 WeakPolarHBondContact OE1-CE 3.49Å; E408-K412 IonicContact OE1-NZ 3.43Å; E408-K412 PolarHBondContact OE1-NZ 3.22Å; I409-K412 PolarHBondContact O-N 3.28Å; I409-K412 VanDerWaalsContact O-N 3.15Å; I410-K412 PolarHBondContact O-N 3.32Å; I410-K412 VanDerWaalsContact O-N 3.11Å; K412-N415 PolarHBondContact O-N 3.31Å; K412-A416 PolarHBondContact O-N 3.14Å
413L34.6Very low35.7Very low101 Ų101114.4 Ų114.453%0.52960%0.603SS.*Hα-helixtrans-57.7-50.3175.2-118.370000111.5I409 I410 N415 A416 L417I409-L413 PolarHBondContact O-N 3.24Å; I410-L413 PolarHBondContact O-N 3.48Å; L413-N415 PolarHBondContact O-N 2.93Å; L413-N415 VanDerWaalsContact O-N 3.16Å; L413-A416 PolarHBondContact O-N 3.27Å; L413-L417 PolarHBondContact O-N 3.39Å
414D36.9Very low35.9Very low106 Ų106115 Ų11557%0.56760%0.599SS**Hα-helixtrans-65.1-19.3-176.3-72.2-13.4000114I410I410-D414 PolarHBondContact O-N 2.64Å
415N38.1Very low35.8Very low112 Ų112118 Ų11860%0.59960%0.603SS**Hα-helixtrans-99.2-25-178.7-76-76.4000113.8G411 K412 L413 N419G411-N415 PolarHBondContact O-ND2 2.95Å; K412-N415 PolarHBondContact O-N 3.31Å; L413-N415 PolarHBondContact O-N 2.93Å; L413-N415 VanDerWaalsContact O-N 3.16Å; N415-N419 PolarHBondContact O-ND2 3.43Å; N415-N419 VanDerWaalsContact O-ND2 3.14Å
416A35.5Very low35.3Very low74 Ų74118.2 Ų118.261%0.61261%0.611SS**Hα-helixtrans-79.6-41.3179.600000112.5K412 L413 L418K412-A416 PolarHBondContact O-N 3.14Å; L413-A416 PolarHBondContact O-N 3.27Å; A416-L418 PolarHBondContact O-N 3.05Å
417L33.8Very low35.3Very low148 Ų148119.2 Ų119.278%0.77562%0.618SS**THydrogen-bonded Turntrans-74.9-0.9-175.1-73.3165.7000115L413L413-L417 PolarHBondContact O-N 3.39Å
418L37.5Very low35Very low112 Ų112119.1 Ų119.159%0.58662%0.622SS**THydrogen-bonded Turntrans-112.71.1-165.1-112.8171.5000115.8A416 L422A416-L418 PolarHBondContact O-N 3.05Å; L418-L422 HydrophobicContact CD2-CD1 3.87Å
419N35.7Very low34.4Very low91 Ų91119.5 Ų119.549%0.48763%0.626SS.*SBendtrans-118.1-33.4-166.4-81.8-71000117.5N415 K423N415-N419 PolarHBondContact O-ND2 3.43Å; N415-N419 VanDerWaalsContact O-ND2 3.14Å; N419-K423 PolarHBondContact O-NZ 3.35Å
420D35.9Very low33.9Very low120 Ų120122.7 Ų122.764%0.64264%0.644SS**SBendtrans-109.5-35.5-161.6-66-43.7000116.3K423D420-K423 IonicContact OD1-NZ 3.54Å; D420-K423 PolarHBondContact OD1-NZ 3.21Å
421E33.2Very low33.4Very low173 Ų173124.3 Ų124.381%0.80865%0.653SS**G310 helixtrans-73.9-31.6171.4-67.6-170.8134.100113K423 I424E421-K423 PolarHBondContact O-N 3.35Å; E421-I424 PolarHBondContact O-N 3.12Å
422L31.7Very low32.8Very low114 Ų114129.4 Ų129.460%0.59767%0.671SS**G310 helixtrans-68.62.9-174.7-79168.2000115.1L418L418-L422 HydrophobicContact CD2-CD1 3.87Å
423K36.7Very low32.2Very low146 Ų146133.3 Ų133.364%0.63569%0.691SS**G310 helixtrans-95.2-16.2174.8-65.8-171.8-170.785.40114.3N419 D420 E421N419-K423 PolarHBondContact O-NZ 3.35Å; D420-K423 IonicContact OD1-NZ 3.54Å; D420-K423 PolarHBondContact OD1-NZ 3.21Å; E421-K423 PolarHBondContact O-N 3.35Å
424I38.1Very low31.7Very low122 Ų122133 Ų13363%0.62670%0.698SS**THydrogen-bonded Turntrans-97.8-29.6-170.8-58-178.8000112.2E421E421-I424 PolarHBondContact O-N 3.12Å
425Y29.6Very low31.1Very low183 Ų183133.5 Ų133.572%0.71870%0.704SS**  trans-127.988.7-179.6-67.3-75000112.7E427Y425-E427 PolarHBondContact O-N 3.01Å
426P25.5Very low30.6Very low126 Ų126136.4 Ų136.482%0.81871%0.711SS**  trans-80.640.3-175.635.2-38000113.8
427E30.7Very low30.2Very low174 Ų174138 Ų13881%0.81372%0.717SS**  trans-149.739.3-175.7-146.6162.2-122.500114.8Y425Y425-E427 PolarHBondContact O-N 3.01Å
428V30.4Very low29.7Very low137 Ų137139.9 Ų139.983%0.8373%0.727SS**  trans-113.6121.9162.7-175.70000108.7
429I28.7Very low29.1Very low127 Ų127138.9 Ų138.965%0.65173%0.729SS**  trans-116.2145.6-163.2-68.5170.5000110.4I431I429-I431 HydrophobicContact CG2-CG1 4.47Å; I429-I431 PolarHBondContact O-N 3.5Å; I429-I431 VanDerWaalsContact O-N 3.17Å
430N25.3Very low28.6Very low165 Ų165139.5 Ų139.588%0.88274%0.74SS**  trans-52.3116.1165.8-86.2-3.2000110.7
431I26.5Very low28.2Very low117 Ų117141.6 Ų141.660%0.675%0.747SS**  trans-127.4100.9171.2-64.3179.8000108.4I429 V435I429-I431 HydrophobicContact CG2-CG1 4.47Å; I429-I431 PolarHBondContact O-N 3.5Å; I429-I431 VanDerWaalsContact O-N 3.17Å; I431-V435 HydrophobicContact CG2-CB 4.44Å; I431-V435 HydrophobicContact CG2-CG2 3.82Å
432D25.3Very low27.8Very low145 Ų145137.8 Ų137.878%0.77574%0.739SS**  trans-53.8159.5159-85.5-52.6000110.5S434D432-S434 VanDerWaalsContact C-N 3.33Å; D432-S434 PolarHBondContact O-N 3.21Å; D432-S434 PolarHBondContact O-OG 3.14Å
433E26.4Very low27.5Very low207 Ų207138.9 Ų138.997%0.96775%0.745SS**SBendtrans-55.878.5-176.2-59.7-179.4108.300114.2
434S24.3Very low27Very low95 Ų95138.8 Ų138.866%0.66475%0.751SS**  trans-157.616.4-167.160.40000116.6D432D432-S434 VanDerWaalsContact C-N 3.33Å; D432-S434 PolarHBondContact O-N 3.21Å; D432-S434 PolarHBondContact O-OG 3.14Å
435V24.3Very low26.4Very low115 Ų115142.6 Ų142.670%0.69776%0.763SS**  trans-137.5105.4177.5-173.20000112.8I431I431-V435 HydrophobicContact CG2-CB 4.44Å; I431-V435 HydrophobicContact CG2-CG2 3.82Å
436K27.4Very low26.3Very low174 Ų174142.2 Ų142.276%0.75777%0.766SS**  trans-137.8144.7163-88.4-179.3-179.7167.60112.7L438K436-L438 PolarHBondContact O-N 3.35Å
437C26.3Very low26.4Very low108 Ų108145.2 Ų145.273%0.7377%0.766SS**  trans52.941.8148.1-61.20000121.4S439C437-S439 VanDerWaalsContact C-N 3.33Å; C437-S439 PolarHBondContact O-N 3.11Å
438L23.7Very low26.2Very low186 Ų186144.6 Ų144.697%0.97477%0.768SS**  trans-74.486151.8-87.1174.9000111.1K436K436-L438 PolarHBondContact O-N 3.35Å
439S25.1Very low26Very low91 Ų91146.2 Ų146.264%0.63677%0.767SS**  trans-139.7147.6164.5770000111.8C437C437-S439 VanDerWaalsContact C-N 3.33Å; C437-S439 PolarHBondContact O-N 3.11Å
440S25.6Very low26.1Very low104 Ų104147.4 Ų147.473%0.72777%0.774SS**  trans5578.1-179.762.10000117.2
441Q27Very low26.2Very low165 Ų165149.6 Ų149.677%0.77178%0.776SS**  trans-147.2127.3142.4-142.7160.6-800110.5
442S24.4Very low26.2Very low92 Ų92149.6 Ų149.664%0.64379%0.785SS**  trans-82.5169.6170.955.80000110.7
443D25.3Very low26.3Very low137 Ų137150.5 Ų150.573%0.73378%0.782SS**  trans69.157.4161.5-48.8-54.3000117.7
444L26.3Very low26.3Very low145 Ų145149.5 Ų149.576%0.75978%0.78SS**  trans-141.1103.3158.7-119.3156.4000112.3F446L444-F446 HydrophobicContact CD2-CD2 4.43Å; L444-F446 HydrophobicContact CD2-CE2 4.02Å; L444-F446 PolarHBondContact O-N 3.39Å
445F26.3Very low26.5Very low202 Ų202150.8 Ų150.889%0.88678%0.779SS**  trans-82.8100.8177.4-81.6-96.4000111.4
446F27.5Very low26.6Very low175 Ų175155.5 Ų155.577%0.76879%0.791SS**  trans-79.8127.5165-85.8-87.5000111.4L444L444-F446 HydrophobicContact CD2-CD2 4.43Å; L444-F446 HydrophobicContact CD2-CE2 4.02Å; L444-F446 PolarHBondContact O-N 3.39Å
447K27.8Very low26.7Very low189 Ų189156.4 Ų156.482%0.82279%0.791SS**  trans-80.2125.1169.5-77.2-174.5173.7-175.30110.1E449K447-E449 PolarHBondContact O-N 3.07Å
448N26.8Very low26.7Very low161 Ų161155 Ų15586%0.86179%0.794SS**  trans-87.589.6174.8-82.4-39.3000111.8
449E25.4Very low27Very low170 Ų170155 Ų15579%0.79479%0.786SS**  trans-132.265.5169.2-73-171174.300112.2K447K447-E449 PolarHBondContact O-N 3.07Å
450D30.3Very low27.1Very low152 Ų152158.3 Ų158.381%0.81380%0.797SS**  trans-163.475.3153.3-121.2-23.9000114.3C452D450-C452 PolarHBondContact O-N 3.24Å; D450-C452 VanDerWaalsContact O-N 3.12Å
451K27.9Very low27.2Very low211 Ų211160.2 Ų160.292%0.91780%0.798SS**  trans-84.971.9175-81.5-172.3176.1177.10112.4K453K451-K453 PolarHBondContact O-N 3.14Å
452C27.7Very low27.3Very low118 Ų118161.3 Ų161.380%0.79780%0.801SS**  trans-67.3109.1166.2-91.20000111.2D450 M454D450-C452 PolarHBondContact O-N 3.24Å; D450-C452 VanDerWaalsContact O-N 3.12Å; C452-M454 PolarHBondContact O-N 3.33Å
453K26.5Very low27.4Very low164 Ų164161.4 Ų161.471%0.71380%0.801SS**  trans-69.3111.3-179.6-65.6-179.2178.3-1780111.9K451K451-K453 PolarHBondContact O-N 3.14Å
454M26.6Very low27.5Very low185 Ų185160.6 Ų160.691%0.91181%0.806SS**  trans-91.5124.6154-92.3-66.2112.400109.7C452C452-M454 PolarHBondContact O-N 3.33Å
455N28.5Very low27.5Very low123 Ų123158.7 Ų158.766%0.65881%0.805SS**  trans-82.4135.7-173.1-77.1-33.3000112.2Y457N455-Y457 VanDerWaalsContact C-N 3.32Å; N455-Y457 HydrophobicContact CB-CD2 4.25Å; N455-Y457 PolarHBondContact O-N 3.01Å
456K26.9Very low27.8Very low214 Ų214158.7 Ų158.793%0.9381%0.808SS**  trans-64.590.3156-88.5-174.8171.1179.30109.6
457Y29.5Very low27.8Very low193 Ų193159.3 Ų159.376%0.75781%0.813SS**  trans-143.784.8165.8-94.4-66.9000111.5N455 K459N455-Y457 VanDerWaalsContact C-N 3.32Å; N455-Y457 HydrophobicContact CB-CD2 4.25Å; N455-Y457 PolarHBondContact O-N 3.01Å; Y457-K459 PolarHBondContact O-N 3.4Å
458G24.8Very low28Very low78 Ų78158.7 Ų158.780%0.80481%0.813SS**  trans-76.3109.616200000110.3
459K30.8Very low28.2Very low186 Ų186157.8 Ų157.881%0.80981%0.808SS**  trans-168.9103.4157.7-110.5157.8-172.9172.90113Y457Y457-K459 PolarHBondContact O-N 3.4Å
460N26.7Very low28.6Very low161 Ų161158 Ų15886%0.86181%0.813SS**  trans16104.7149.6-53.7-1.6000117.8
461L28.7Very low28.7Very low143 Ų143159.7 Ų159.775%0.74981%0.813SS**  trans-142.996.5164.9-75177.6000112.1
462F27.9Very low28.9Very low189 Ų189160.3 Ų160.383%0.82981%0.81SS**  trans61.1159.5150.8-60.8-74.4000120
463S26.3Very low29Very low93 Ų93161 Ų16165%0.6581%0.805SS**  cis178.7152.7-41.454.60000108.5
464S27.5Very low29.2Very low120 Ų120162.6 Ų162.684%0.83981%0.808SS**  trans70.8131.7173.6-166.40000114.1
465S27.1Very low29.2Very low105 Ų105163.2 Ų163.273%0.73480%0.801SS**  cis-147.5126.97.348.10000112.8
466E31.9Very low29.3Very low203 Ų203163.1 Ų163.195%0.94980%0.799SS**  -155142.5126.4-116.3171.5-171.200108.3
467Q27.5Very low29.4Very low187 Ų187159.4 Ų159.487%0.87479%0.785SS**  trans-142.396.9-166.2-179.1-171.2-5.600110.7
468Q33.1Very low29.1Very low177 Ų177158.3 Ų158.383%0.82779%0.789SS**  trans-159119.9154.3-115.615328.500112.1
469D30.8Very low29.4Very low141 Ų141161.4 Ų161.475%0.75479%0.793SS**  trans40.4113.9146.6-48.9-30.4000118.6
470I33.9Very low29.2Very low175 Ų175161.1 Ų161.190%0.89779%0.794SS**  -156.915475.2-88.7156.4000111.9
471K31.5Very low29.4Very low188 Ų188159.6 Ų159.682%0.81780%0.796SS**  trans-108.2139.7-175.4-64.8174.5177.3173.30114.4
472R31.8Very low29.4Very low223 Ų223156 Ų15684%0.84279%0.794SS**  trans162.8124.7130.7-89154.4175.2155.4-2.7109.3
473N30.2Very low29.3Very low132 Ų132154.1 Ų154.171%0.70679%0.793SS**  60.4128.281.2-58.314.4000111.8
474Y30.9Very low29.3Very low199 Ų199158.6 Ų158.678%0.7880%0.801SS**  cis-131.5165.319.3-73.9-111.4000110.2
475R27.6Very low29.4Very low198 Ų198160.2 Ų160.275%0.74780%0.799SS**  cis87.5142.121.6-165.6178.2178-154.4-9.1115.9E477R475-E477 IonicContact NH2-OE1 3.68Å; R475-E477 PolarHBondContact NH2-OE1 2.9Å
476L29Very low29.2Very low121 Ų121165.2 Ų165.263%0.63480%0.802SS**  trans89.8143.1175.7-50173.9000112.8
477E29.5Very low29.1Very low135 Ų135163.3 Ų163.363%0.63180%0.798SS**  cis177.1124.4-25-107.2158.4-151.600103R475R475-E477 IonicContact NH2-OE1 3.68Å; R475-E477 PolarHBondContact NH2-OE1 2.9Å
478M24.1Very low29Very low170 Ų170160.7 Ų160.784%0.83779%0.791SS**  64.3105.488-80.5-68.6-150.300116.7
479T30.6Very low28.8Very low144 Ų144159.3 Ų159.388%0.88379%0.794SS**  trans-154.6153.2145.7130000110.9
480E26.4Very low28.6Very low179 Ų179156 Ų15684%0.83679%0.794SS**  trans-106.1-168.8-176.3-60.6168.7112.500111.7
481S30.9Very low28.2Very low129 Ų129156.1 Ų156.190%0.90280%0.796SS**  trans75.4147.2-179.777.10000116
482G28.2Very low28.1Very low69 Ų69151 Ų15171%0.71180%0.797SS**  cis-167.8178.1-1.800000111.9
483D25.5Very low27.8Very low149 Ų149146.2 Ų146.280%0.79779%0.787SS**  trans-59.1159.2179.7-50.6-82.7000113.2
484F27.8Very low27.9Very low187 Ų187147.8 Ų147.882%0.8279%0.794SS**  177.9120.2110.2-107.3-87.1000113.4
485L28.2Very low27.8Very low153 Ų153142.9 Ų142.980%0.80178%0.781SS**  trans38.7144.3147.5-86.2160.3000124.3
486W24.5Very low27.9Very low210 Ų210138.3 Ų138.380%0.79579%0.786SS**  trans-55.9154.2170.3-70.722.6000114.8
487N29.4Very low27.9Very low163 Ų163137.8 Ų137.887%0.87279%0.788SS**  -159.6144.6118.2-103.6-36.2000113.4
488N25.2Very low27.9Very low133 Ų133138.3 Ų138.371%0.71179%0.793SS**  trans-81.9135168.1-68.6-51.1000110.1
489T27.7Very low28.2Very low147 Ų147138.1 Ų138.190%0.90279%0.79SS**  trans-175.5140.7140.124.10000112.7
490G26.7Very low28.2Very low73 Ų73137.2 Ų137.275%0.75378%0.78SS**  trans95.3108.6130.600000118.4
491N27.4Very low28.5Very low177 Ų177136.5 Ų136.595%0.94778%0.782SS**  trans-56.1143.4165.8-52.1-16.1000112.1
492G29.4Very low28.7Very low80 Ų80133.5 Ų133.583%0.82577%0.772SS**  trans-171.788.6171.700000113.9
493L25.1Very low28.7Very low122 Ų122135 Ų13564%0.63977%0.771SS**  trans-90.2136169.5-111.8162.2000109.8N1196L493-N1196 HydrophobicContact CD2-CB 4.22Å
494I32.7Very low29Very low165 Ų165136.6 Ų136.685%0.84677%0.774SS**  trans171.8138.3142-91.8155.1000109.8
495D26.8Very low29.1Very low96 Ų96132 Ų13251%0.51377%0.765SS.*  trans-71.2156.1-179.7-72.9-68.7000115.9N1197D495-N1197 PolarHBondContact OD2-ND2 3.32Å
496A31.2Very low29.1Very low103 Ų103129.2 Ų129.285%0.85176%0.758SS**  trans-146.9114.2146.300000109.8
497T28.3Very low29.4Very low109 Ų109126 Ų12667%0.66976%0.757SS**  trans-92.5-175.9-176.850.60000112.5
498I29.8Very low29.4Very low146 Ų146122.6 Ų122.675%0.74975%0.746SS**  trans80.3134.7164.3-61162.3000113.8
499Q30.7Very low29.7Very low166 Ų166124.6 Ų124.678%0.77675%0.748SS**  cis-147.5171.611.1-148.3148.21900115
500D30.3Very low29.9Very low125 Ų125124.7 Ų124.767%0.66874%0.743SS**  trans-58.1156.1171.4-42-100.3000116
501N32.8Very low30.1Very low165 Ų165125.5 Ų125.588%0.88274%0.743SS**  165.1163.2107.5-91.6-73.2000112.6
502G34Very low30.2Very low66 Ų66122 Ų12268%0.6874%0.738SS**  trans12242.4149.600000120.7
503S29.8Very low30.3Very low100 Ų100121.5 Ų121.570%0.69973%0.733SS**  trans13.1144.913863.80000122.5
504Q31.1Very low30.5Very low182 Ų182120.6 Ų120.685%0.8574%0.737SS**  trans73.8154.5153.8-66.9171.120.100118.3
505S29.7Very low30.3Very low90 Ų90119 Ų11963%0.62974%0.735SS**  cis-164.2147-2556.60000112.8
506S29.4Very low30.4Very low96 Ų96119 Ų11967%0.67174%0.742SS**  trans51.7137.8142.277.70000124.1
507N30.4Very low30.3Very low142 Ų142119.1 Ų119.176%0.75974%0.736SS**  trans82.286.2134.8-70.4-21.6000123.7
508S29.1Very low30.5Very low92 Ų92121.2 Ų121.264%0.64374%0.738SS**  89.9150.9101.882.70000123
509K31.5Very low30.4Very low175 Ų175122.1 Ų122.176%0.76174%0.739SS**  trans60.6106.9145.2-74168.5-180173.10119.6
510N31.4Very low30.4Very low148 Ų148122.3 Ų122.379%0.79175%0.746SS**  175138.296.7-85.7-39.8000109.1
511A30.6Very low30.3Very low91 Ų91120 Ų12075%0.75274%0.744SS**  63.9141.883.200000113.3
512A30.9Very low30.3Very low103 Ų103116.1 Ų116.185%0.85174%0.743SS**  cis-155.11809.600000112.1
513G31.3Very low30Very low69 Ų69118.4 Ų118.471%0.71174%0.743SS**  trans106.9142.315500000116.9
514S28.6Very low29.8Very low103 Ų103120 Ų12072%0.7274%0.743SS**  cis175.2144.2-31.435.30000109.4
515T29.2Very low29.6Very low132 Ų132120.6 Ų120.681%0.8174%0.738SS**  trans61158.4153.649.50000117.9
516S28.8Very low29.6Very low95 Ų95124.5 Ų124.566%0.66474%0.743SS**  cis-145.7152.4-0.910000108.3
517C27.7Very low29.5Very low106 Ų106126.8 Ų126.872%0.71674%0.741SS**  52.3138.885-40.50000113.4
518H33.6Very low29.3Very low154 Ų154127.8 Ų127.871%0.71374%0.739SS**  cis-127.41548.8-92-88000109.7
519E27Very low29.1Very low164 Ų164128.8 Ų128.877%0.76675%0.746SS**  40.8127.685.2-52.7-179135.300115
520D31.5Very low29.1Very low171 Ų171125.5 Ų125.591%0.91475%0.745SS**  -159155.2110.8-138.5-25.2000111.8
521A27.2Very low28.8Very low77 Ų77126.8 Ų126.864%0.63675%0.746SS**  trans-116.8114.3179.800000111.1V523A521-V523 WeakPolarHBondContact O-CG2 3.47Å
522G32.8Very low28.6Very low83 Ų83126.2 Ų126.286%0.85674%0.737SS**  trans-124.781.4179.400000111.7
523V28Very low28.5Very low114 Ų114127.6 Ų127.669%0.69174%0.739SS**  69.7100.963.6-179.80000113.4A521A521-V523 WeakPolarHBondContact O-CG2 3.47Å
524L26.3Very low28.4Very low133 Ų133130.5 Ų130.570%0.69674%0.738SS**  trans74.4139.7149.3-72.3171.7000122.4
525R26.2Very low28.3Very low195 Ų195132.9 Ų132.974%0.73674%0.741SS**  trans90.9135.1131-88.6163.4-175.6-175.20.9120.6
526K29.3Very low28.1Very low171 Ų171133.7 Ų133.774%0.74374%0.741SS**  trans73.3148149.3-66165.3-179.4179.40115.1
527K27.2Very low28.2Very low145 Ų145138.4 Ų138.463%0.6375%0.75SS**  cis-166.5153-11.9-123.5174.5164.7-159.20109.3
528F27.4Very low28.1Very low163 Ų163139.1 Ų139.172%0.71575%0.75SS**  trans63.3146161.3-55-46.3000116.1
529S25.2Very low27.9Very low113 Ų113139.3 Ų139.379%0.7975%0.752SS**  cis8579.126.7-49.60000114.8
530S30.7Very low27.9Very low105 Ų105137.5 Ų137.573%0.73475%0.747SS**  trans-146.5115.614847.70000105.7
531E26.3Very low27.9Very low176 Ų176138.5 Ų138.582%0.82274%0.739SS**  97.4122.764.8-84.2177142.600112.7
532S25.7Very low28.1Very low79 Ų79142.1 Ų142.155%0.55274%0.743SS**  trans32.5114152.859.90000121.5N534S532-N534 WeakPolarHBondContact CB-ND2 3.45Å
533C28.7Very low28.1Very low132 Ų132143.4 Ų143.489%0.89274%0.735SS**  -128.4107.9109-78.50000105.9
534N29.6Very low28.1Very low130 Ų130144.3 Ų144.370%0.69573%0.734SS**  44.192.652.2-64.7-4.2000109.3S532S532-N534 WeakPolarHBondContact CB-ND2 3.45Å
535L25.8Very low28.4Very low152 Ų152145.4 Ų145.480%0.79674%0.735SS**  cis6463.437.7-147.5174.2000111.6
536N26Very low28.7Very low149 Ų149144 Ų14480%0.79773%0.734SS**  trans-174.1158.7146.8-102.2-45000112
537K30.1Very low28.8Very low195 Ų195141.4 Ų141.485%0.84874%0.736SS**  trans73.5115-178.6-55.6-177.2179.5-178.40114.7
538V25.6Very low28.8Very low121 Ų121142.3 Ų142.373%0.73375%0.747SS**  cis91.4145.627.6-174.80000113.6
539Q29.8Very low28.9Very low158 Ų158139.8 Ų139.874%0.73875%0.75SS**  trans78.5107.4-174.5-75.6138.8-14.600114.4
540N27.1Very low29.2Very low125 Ų125142.4 Ų142.467%0.66875%0.754SS**  81.7134.884.8-67.814.5000110.2
541Y31.6Very low29.2Very low193 Ų193142 Ų14276%0.75775%0.749SS**  cis-125.8152.428.9-78.6-99.3000111.5
542E30.1Very low29.4Very low153 Ų153140.9 Ų140.972%0.71575%0.749SS**  63.2133.378.8-118.1171.7-130.200112.4
543T33.1Very low29.4Very low110 Ų110141.6 Ų141.668%0.67576%0.759SS**  cis-150122.723.8-53.70000114.4
544I28Very low29.4Very low133 Ų133144.1 Ų144.168%0.68276%0.755SS**  trans18.3124.9134-36.7172.1000118.9
545H34Very low29.1Very low155 Ų155142.5 Ų142.572%0.71875%0.754SS**  -175.1152.8117.9-109.7-113.5000116.9
546K30.6Very low29.2Very low166 Ų166144.6 Ų144.672%0.72276%0.757SS**  trans-44.6161.3-178.5-44.8166.6-174.2176.90116
547C33.2Very low29.2Very low116 Ų116142.6 Ų142.678%0.78475%0.75SS**  cis-134.5155.39.8-54.30000109.6
548L26.5Very low29Very low164 Ų164138.8 Ų138.886%0.85974%0.743SS**  cis80.575.49.7-127.1-178.4000117.7
549S30.4Very low29.2Very low110 Ų110136.4 Ų136.477%0.76974%0.744SS**  trans-169.892.9141.853.90000113.8
550L31.3Very low29.2Very low168 Ų168135.2 Ų135.288%0.8874%0.741SS**  trans-77.2154.2135.4-146.778000106.4
551P29.5Very low29.4Very low98 Ų98135 Ų13564%0.63674%0.74SS**  -160.2170.9107.641.4-23.1000118.1
552N30.3Very low29.3Very low152 Ų152134.5 Ų134.581%0.81374%0.741SS**  trans69.7132.2145.1-67.2-20.1000122.1
553A25.9Very low29.2Very low93 Ų93132 Ų13277%0.76974%0.741SS**  trans-93.3148.815900000111.9
554K28.9Very low29Very low185 Ų185136.1 Ų136.180%0.80475%0.75SS**  trans-178.4121.3157.7-94.7149.8-175.9-176.90104.3
555S23.4Very low29Very low97 Ų97134.2 Ų134.268%0.67875%0.748SS**  62.9141.952.785.30000113.7
556F27.6Very low28.8Very low195 Ų195133.9 Ų133.986%0.85575%0.75SS**  trans83.7145.4-172.1-71.5-105.1000117.8
557V26.7Very low28.8Very low107 Ų107133.1 Ų133.165%0.64875%0.754SS**  cis-170.2147.6-35.81050000112.3
558T26.5Very low28.7Very low115 Ų115132.9 Ų132.971%0.70674%0.744SS**  trans56.7147.5162.355.60000122.2I560T558-I560 HydrophobicContact CG2-CD1 4.02Å; T558-I560 HydrophobicContact CG2-CG1 4.47Å
559G29.6Very low28.9Very low72 Ų72130.7 Ų130.774%0.74274%0.739SS**  trans161.638.1168.800000113.4
560I29.1Very low28.9Very low133 Ų133132.5 Ų132.568%0.68273%0.734SS**  45.289.3100.5-52.2172.8000113.4T558T558-I560 HydrophobicContact CG2-CD1 4.02Å; T558-I560 HydrophobicContact CG2-CG1 4.47Å
561N31.1Very low28.7Very low121 Ų121132 Ų13265%0.64773%0.73SS**  178.5143119.4-98.5-67.6000112.3
562K30.7Very low28.6Very low181 Ų181132.5 Ų132.579%0.78774%0.736SS**  trans37.9142.3138.3-60.1167.4-174174.40121
563S26.5Very low28.5Very low100 Ų100131.7 Ų131.770%0.69973%0.732SS**  cis171.4146.2-20.345.10000108
564K30.1Very low28.7Very low198 Ų198131.4 Ų131.486%0.86172%0.724SS**  trans106112.9-179.8-66.5177.8175.8-175.60111.6
565S27.6Very low28.8Very low92 Ų92132 Ų13264%0.64372%0.721SS**  cis96.3139.929.775.80000113.5
566I30.1Very low29.1Very low148 Ų148135.1 Ų135.176%0.75973%0.725SS**  trans84.8119.5171.9-54.4162.4000111
567D30.2Very low29.3Very low150 Ų150131.2 Ų131.280%0.80272%0.716SS**  cis-135.616613.2-121.3-31.4000116.4
568L30.7Very low29.6Very low112 Ų112133 Ų13359%0.58672%0.722SS**  trans-150.4135.2178.6-125.8175.1000109.5F570L568-F570 HydrophobicContact CB-CD2 4.42Å; L568-F570 HydrophobicContact CB-CE2 4.23Å; L568-F570 HydrophobicContact CD1-CE2 4.44Å; L568-F570 HydrophobicContact CD1-CZ 4.38Å
569P31.5Very low29.9Very low117 Ų117132.2 Ų132.276%0.7671%0.714SS**  -128.8131.7120.92.718.8000112.6
570F29.8Very low30Very low149 Ų149138.3 Ų138.365%0.65471%0.714SS**  63.111268.7-64.7-63.7000111.6L568L568-F570 HydrophobicContact CB-CD2 4.42Å; L568-F570 HydrophobicContact CB-CE2 4.23Å; L568-F570 HydrophobicContact CD1-CE2 4.44Å; L568-F570 HydrophobicContact CD1-CZ 4.38Å
571I26.5Very low30.1Very low156 Ų156136.6 Ų136.680%0.871%0.714SS**  60.690.754.7-49.7177.4000113.2
572S28.9Very low30Very low110 Ų110136.4 Ų136.477%0.76972%0.721SS**  trans-151123145.3-169.10000107.5
573N27Very low29.9Very low135 Ų135132.8 Ų132.872%0.72272%0.718SS**  cis80.1144.835.8-1597.5000113.5
574C29.3Very low30.1Very low87 Ų87136.3 Ų136.359%0.58873%0.726SS**  trans76.7146-176.9-57.80000117.2
575R31.1Very low30Very low197 Ų197134.6 Ų134.674%0.74372%0.72SS**  cis-168133.2-13.7-111.2173.2-161.2-167.65.6111.4
576Q29.7Very low30.1Very low163 Ų163136.2 Ų136.276%0.76273%0.726SS**  trans62.2172145.8-57.3163.7-43.300115.6
577V32.9Very low29.9Very low113 Ų113135.3 Ų135.369%0.68572%0.723SS**  cis-147.4126.618.7176.10000111
578N32.6Very low29.8Very low143 Ų143134.7 Ų134.777%0.76572%0.718SS**  trans54.7165.6154.1-54.2-4.9000119.9
579D32.7Very low29.7Very low99 Ų99134.9 Ų134.953%0.52972%0.724SS.*  cis-149.4151.63.8-143.7-0.5000112.6
580R32.4Very low29.5Very low201 Ų201135.9 Ų135.976%0.75872%0.723SS**  trans35.8160.5143.8-76.6165.2-170.8162.2-8.5123
581S30.5Very low29.4Very low96 Ų96134.7 Ų134.767%0.67172%0.723SS**  cis177.9160.3-20.855.20000109.1
582C29.8Very low29.6Very low118 Ų118132.5 Ų132.580%0.79771%0.713SS**  cis-174.5145.3-23.6-94.90000108.6
583S28.7Very low29.6Very low104 Ų104133.5 Ų133.573%0.72771%0.71SS**  trans55.1139.4143-158.30000122.6
584M29.8Very low29.6Very low175 Ų175133.7 Ų133.786%0.86271%0.711SS**  161.8104.8107.9-164.3167.6-166.500110.4
585H27.9Very low29.6Very low161 Ų161136 Ų13675%0.74572%0.716SS**  90.1152.270.6-119.4-78000115.7
586V29.9Very low29.6Very low127 Ų127133.5 Ų133.577%0.7772%0.717SS**  trans78145.7172-169.70000115.5
587N26.1Very low29.5Very low129 Ų129135.6 Ų135.669%0.6972%0.718SS**  cis168.8154.2-40.1-127.2-10.5000106.5
588I27.5Very low29.3Very low136 Ų136139.4 Ų139.470%0.69773%0.725SS**  trans76.9101.3145.5-70.6168.5000120.2
589V28Very low29.3Very low117 Ų117138.4 Ų138.471%0.70972%0.724SS**  88.5134.9122.4170.60000122.9
590N28.8Very low29.3Very low138 Ų138141.1 Ų141.174%0.73874%0.737SS**  trans72.4101.9155.4-81.3-16.2000123.5
591N27.7Very low29.3Very low124 Ų124137 Ų13766%0.66374%0.739SS**  74153.598.2-153.916000120.6
592N31Very low29.2Very low110 Ų110135.5 Ų135.559%0.58874%0.739SS**  trans68.695.6166-66.5-38.5000119.5
593N27.3Very low29.4Very low131 Ų131142.1 Ų142.170%0.70175%0.747SS**  62.9127.6113.9-61.9-27.9000121.5
594N27.9Very low29.4Very low138 Ų138147.2 Ų147.274%0.73876%0.756SS**  90.9127.8126.3-82.5-12.3000122.2
595I28.8Very low29.4Very low135 Ų135143.9 Ų143.969%0.69275%0.75SS**  trans67.1102.9148.8-47.5150.6000117.3
596L31.6Very low29.4Very low146 Ų146144.5 Ų144.576%0.76476%0.757SS**  178.6107.2112.6-107.2113.5000107.3
597R28.1Very low29.4Very low206 Ų206145 Ų14578%0.77776%0.761SS**  78.1117.389.8-83.6-173.7173.9-179.80.4115
598K27.7Very low29.6Very low194 Ų194145.5 Ų145.584%0.84377%0.769SS**  trans48.1123.8144-60.6-175.6168.8-169.90118.7
599V32.6Very low29.7Very low121 Ų121149 Ų14973%0.73378%0.779SS**  -180121.197.3151.60000109.9
600I34.2Very low29.8Very low157 Ų157153.9 Ų153.981%0.80579%0.786SS**  trans38.5136.6134-53.8175000118.8
601S31.1Very low30.1Very low114 Ų114154 Ų15480%0.79779%0.787SS**  cis-175.1156.9-13.6-178.20000110.4
602G28.8Very low30.6Very low65 Ų65155.2 Ų155.267%0.6779%0.794SS**  trans80.674.7132.300000120.9
603R33.5Very low30.9Very low256 Ų256156.5 Ų156.597%0.96680%0.8SS**  -166.6120.9123.9-105.8167.7-177.4-175-0.3110.3
604K29.5Very low31.2Very low211 Ų211156.7 Ų156.792%0.91780%0.796SS**  trans-133.6116.6175.5-84.8-174.1175.6-179.10109
605S29.9Very low31.6Very low105 Ų105156 Ų15673%0.73479%0.792SS**  trans-165.6153.7159.242.80000111.6T607S605-T607 PolarHBondContact O-N 3.47Å
606L28.5Very low31.8Very low174 Ų174157.9 Ų157.991%0.91180%0.796SS**SBendtrans71.812.1158.1-107.372.6000123.4
607T29.5Very low31.9Very low137 Ų137158.8 Ų158.884%0.8479%0.79SS**  trans-122.539.7176.4510000117.1S605S605-T607 PolarHBondContact O-N 3.47Å
608T29.2Very low32.2Very low141 Ų141154.5 Ų154.587%0.86578%0.775SS**  trans-147.3102.3165.650.60000113.3
609K30.6Very low32.6Very low210 Ų210152.1 Ų152.191%0.91377%0.771SS**SBendtrans-146.7-5.1166.6-126.9-178.7-177.8-174.90116.9
610Y30.3Very low32.8Very low218 Ų218155 Ų15586%0.85577%0.773SS**SBendtrans-106.9-8.4-164.8-98.3-79.5000118.6
611N34.5Very low33.1Very low142 Ų142154.4 Ų154.476%0.75976%0.761SS**SBendtrans-99.310.3-168.1-79.3-15.6000117.2
612N38.3Very low33.4Very low149 Ų149154.4 Ų154.480%0.79775%0.751SS**SBendtrans-102-14.1-174.4-80.2-10.5000116.4
613L36.6Very low33.6Very low137 Ų137153.5 Ų153.572%0.71774%0.742SS**SBendtrans-77.8-35.1175-101.972.5000113N615 F616L613-N615 VanDerWaalsContact C-N 3.27Å; L613-N615 PolarHBondContact O-N 3.34Å; L613-F616 WeakPolarHBondContact O-CB 3.47Å; L613-F616 PolarHBondContact O-N 3.35Å
614H34.8Very low34Very low135 Ų135147.9 Ų147.963%0.62573%0.731SS**Hα-helixtrans-65-27.1-167.1-150.1-54.9000114.1Y618H614-Y618 AromaticContact CE1-CE2 3.72Å; H614-Y618 AromaticContact ND1-CD2 3.84Å; H614-Y618 AromaticContact ND1-CE2 4Å
615N35.3Very low34.8Very low123 Ų123142.3 Ų142.366%0.65872%0.718SS**Hα-helixtrans-80.4-16.3175.1-84-48.9000113.8L613L613-N615 VanDerWaalsContact C-N 3.27Å; L613-N615 PolarHBondContact O-N 3.34Å
616F33.6Very low35.9Very low175 Ų175145.2 Ų145.277%0.76871%0.713SS**Hα-helixtrans-79.7-36.9178.9-147.1-94.2000111.6L613L613-F616 WeakPolarHBondContact O-CB 3.47Å; L613-F616 PolarHBondContact O-N 3.35Å
617Y32.6Very low36.5Very low165 Ų165142.2 Ų142.265%0.64770%0.697SS**Hα-helixtrans-70.9-39.2175.6-91.3-89.9000113.2L619 K620Y617-L619 PolarHBondContact O-N 2.92Å; Y617-K620 WeakPolarHBondContact O-CB 3.44Å; Y617-K620 PolarHBondContact O-N 3.23Å
618Y35.8Very low37.4Very low115 Ų115141.1 Ų141.145%0.45168%0.684SS.*Hα-helixtrans-65.4-20.9-177.2-102.1-99.1000114.8L261 H614 K620L261-Y618 WeakPolarHBondContact CD1-OH 3.45Å; H614-Y618 AromaticContact CE1-CE2 3.72Å; H614-Y618 AromaticContact ND1-CD2 3.84Å; H614-Y618 AromaticContact ND1-CE2 4Å; Y618-K620 VanDerWaalsContact C-N 3.31Å; Y618-K620 PolarHBondContact O-N 2.87Å
619L34.5Very low39Very low144 Ų144142.4 Ų142.475%0.75467%0.673SS**G310 helixtrans-75-16.2173.6-84163.8000113.9Y617 R621Y617-L619 PolarHBondContact O-N 2.92Å; L619-R621 VanDerWaalsContact C-N 3.29Å; L619-R621 PolarHBondContact O-N 3.24Å
620K38.5Very low40.2Very low182 Ų182138 Ų13879%0.79166%0.656SS**G310 helixtrans-77.3-9.8-176.6-157.8176-180-175.10113.8Y617 Y618Y617-K620 WeakPolarHBondContact O-CB 3.44Å; Y617-K620 PolarHBondContact O-N 3.23Å; Y618-K620 VanDerWaalsContact C-N 3.31Å; Y618-K620 PolarHBondContact O-N 2.87Å
621R38.8Very low41.3Very low145 Ų145132.1 Ų132.155%0.54764%0.638SS.*G310 helixtrans-121.85.6-165.3-142.3168176.9-152.7-1.9115.8N259 L619N259-R621 PolarHBondContact O-NH1 3.17Å; N259-R621 PolarHBondContact O-NH2 3.27Å; N259-R621 VanDerWaalsContact O-NH2 3.08Å; N259-R621 PolarHBondContact OD1-NE 3.11Å; N259-R621 PolarHBondContact OD1-NH1 3.04Å; N259-R621 PolarHBondContact OD1-NH2 3.24Å; L619-R621 VanDerWaalsContact C-N 3.29Å; L619-R621 PolarHBondContact O-N 3.24Å
622I39.2Very low42.7Very low114 Ų114130.3 Ų130.359%0.58563%0.628SS**SBendtrans-113.990.1-175.1-53.9-179.8000112.7
623G33.1Very low44Very low46 Ų46127.2 Ų127.247%0.47461%0.609SS.*  trans61.7108.4148.600000119.2S625 R626G623-S625 PolarHBondContact O-N 2.82Å; G623-R626 PolarHBondContact O-N 2.83Å
624N40.6Very low44.8Very low138 Ų138127.4 Ų127.474%0.73860%0.604SS**Hα-helixtrans-47.1-29.3175.5-87.2-27.5000115.5R626 L627 M628N624-R626 PolarHBondContact O-N 2.89Å; N624-L627 PolarHBondContact O-N 2.99Å; N624-M628 WeakPolarHBondContact O-CB 3.47Å; N624-M628 PolarHBondContact O-N 2.81Å
625S46.7Very low46.1Very low94 Ų94128.4 Ų128.466%0.65761%0.607SS**Hα-helixtrans-66.8-30.5-179.661.30000114.3G623 R629G623-S625 PolarHBondContact O-N 2.82Å; S625-R629 PolarHBondContact O-N 2.82Å
626R52.1Low47.6Very low166 Ų166126.4 Ų126.463%0.62660%0.599SS**Hα-helixtrans-79.5-40.8174.5-109-177.7176.9173.8-0111.5G623 N624 R629 H630G623-R626 PolarHBondContact O-N 2.83Å; N624-R626 PolarHBondContact O-N 2.89Å; R626-R629 PolarHBondContact O-N 3.29Å; R626-H630 PolarHBondContact O-CD2 3.28Å; R626-H630 PolarHBondContact O-N 3.38Å; R626-H630 VanDerWaalsContact O-N 3.08Å
627L41.5Very low48.8Very low110 Ų110124 Ų12458%0.57659%0.588SS**Hα-helixtrans-60.8-46.9175.9-160.889.1000111.1N624 R629 H630 L631N624-L627 PolarHBondContact O-N 2.99Å; L627-R629 VanDerWaalsContact C-N 3.31Å; L627-R629 PolarHBondContact O-N 3.45Å; L627-H630 PolarHBondContact O-N 2.94Å; L627-L631 HydrophobicContact CD2-CD1 4.14Å; L627-L631 HydrophobicContact CG-CD1 4.26Å; L627-L631 WeakPolarHBondContact O-CB 3.31Å; L627-L631 PolarHBondContact O-N 3.07Å
628M49Very low49.6Very low115 Ų115120.8 Ų120.857%0.56758%0.579SS**Hα-helixtrans-61.5-35176-87.7-70.5-92.400113.1N624 L631 L632N624-M628 WeakPolarHBondContact O-CB 3.47Å; N624-M628 PolarHBondContact O-N 2.81Å; M628-L631 PolarHBondContact O-N 3.23Å; M628-L632 WeakPolarHBondContact O-CD1 3.37Å; M628-L632 PolarHBondContact O-N 3.42Å
629R63.8Low50.4Low167 Ų167118.9 Ų118.963%0.6358%0.579SS**Hα-helixtrans-65.9-45.5175-168.6179.6-60.6-179.21.4111.8S625 R626 L627 L632 E633S625-R629 PolarHBondContact O-N 2.82Å; R626-R629 PolarHBondContact O-N 3.29Å; L627-R629 VanDerWaalsContact C-N 3.31Å; L627-R629 PolarHBondContact O-N 3.45Å; R629-L632 PolarHBondContact O-N 3.48Å; R629-E633 PolarHBondContact O-N 2.83Å
630H54.6Low51.2Low118 Ų118116.7 Ų116.755%0.54657%0.568SS.*Hα-helixtrans-67.6-35.5175.9-74.3-61.1000112.5R626 L627 E633 F634R626-H630 PolarHBondContact O-CD2 3.28Å; R626-H630 PolarHBondContact O-N 3.38Å; R626-H630 VanDerWaalsContact O-N 3.08Å; L627-H630 PolarHBondContact O-N 2.94Å; H630-E633 PolarHBondContact O-N 3.18Å; H630-F634 VanDerWaalsContact O-CB 3.26Å; H630-F634 WeakPolarHBondContact O-CB 3.35Å; H630-F634 PolarHBondContact O-N 3.4Å
631L52.8Low51.8Low94 Ų94111.5 Ų111.549%0.49255%0.552SS.*Hα-helixtrans-63-42171-92.3158.8000112.3L627 M628 F634 K635L627-L631 HydrophobicContact CD2-CD1 4.14Å; L627-L631 HydrophobicContact CG-CD1 4.26Å; L627-L631 WeakPolarHBondContact O-CB 3.31Å; L627-L631 PolarHBondContact O-N 3.07Å; M628-L631 PolarHBondContact O-N 3.23Å; L631-F634 PolarHBondContact O-N 3.24Å; L631-K635 WeakPolarHBondContact O-CB 3.3Å; L631-K635 PolarHBondContact O-N 2.9Å
632L65.4Low52.1Low104 Ų104111.2 Ų111.255%0.54556%0.555SS.*Hα-helixtrans-62.4-48.9172.6-103.487.1000111.5M628 R629 F634 K635 V636M628-L632 WeakPolarHBondContact O-CD1 3.37Å; M628-L632 PolarHBondContact O-N 3.42Å; R629-L632 PolarHBondContact O-N 3.48Å; L632-F634 VanDerWaalsContact C-N 3.33Å; L632-F634 PolarHBondContact O-N 2.92Å; L632-K635 PolarHBondContact O-N 3.3Å; L632-V636 WeakPolarHBondContact O-CB 3.5Å; L632-V636 VanDerWaalsContact O-CG2 3.31Å; L632-V636 WeakPolarHBondContact O-CG2 3.26Å; L632-V636 PolarHBondContact O-N 3.49Å
633E65Low52.7Low84 Ų84110.9 Ų110.939%0.39355%0.554SS.*Hα-helixtrans-59.3-42.9177.2-83.6-165-15200112.5R629 H630 V636 K637R629-E633 PolarHBondContact O-N 2.83Å; H630-E633 PolarHBondContact O-N 3.18Å; E633-V636 PolarHBondContact O-N 3.03Å; E633-K637 WeakPolarHBondContact O-CB 3.49Å; E633-K637 VanDerWaalsContact O-CG 3.3Å; E633-K637 WeakPolarHBondContact O-CG 3.35Å; E633-K637 PolarHBondContact O-N 2.93Å; E633-K637 IonicContact OE2-NZ 2.66Å; E633-K637 PolarHBondContact OE2-NZ 2.73Å
634F52.4Low53.3Low141 Ų141118 Ų11862%0.61857%0.566SS**Hα-helixtrans-65.2-43.9178.2-162.4-94.8000110.5H630 L631 L632 V636 K637 H638H630-F634 VanDerWaalsContact O-CB 3.26Å; H630-F634 WeakPolarHBondContact O-CB 3.35Å; H630-F634 PolarHBondContact O-N 3.4Å; L631-F634 PolarHBondContact O-N 3.24Å; L632-F634 VanDerWaalsContact C-N 3.33Å; L632-F634 PolarHBondContact O-N 2.92Å; F634-V636 PolarHBondContact O-N 3.09Å; F634-K637 PolarHBondContact O-N 3.47Å; F634-H638 VanDerWaalsContact O-CB 3.23Å; F634-H638 WeakPolarHBondContact O-CB 3.23Å; F634-H638 PolarHBondContact O-N 2.65Å
635K62Low53.6Low156 Ų156116.5 Ų116.568%0.67856%0.558SS**Hα-helixtrans-61.2-40.8175.3-164.5171.8-174.2177.50111.8L631 L632 H638 T639L631-K635 WeakPolarHBondContact O-CB 3.3Å; L631-K635 PolarHBondContact O-N 2.9Å; L632-K635 PolarHBondContact O-N 3.3Å; K635-H638 PolarHBondContact O-N 3.35Å; K635-T639 WeakPolarHBondContact O-CG2 3.42Å; K635-T639 PolarHBondContact O-N 2.62Å; K635-T639 PolarHBondContact O-OG1 3.09Å
636V67.6Low53.9Low81 Ų81120.2 Ų120.249%0.49156%0.562SS.*Hα-helixtrans-70.6-37.7175.7170.40000112.4L632 E633 F634 H638 T639 N640L632-V636 WeakPolarHBondContact O-CB 3.5Å; L632-V636 VanDerWaalsContact O-CG2 3.31Å; L632-V636 WeakPolarHBondContact O-CG2 3.26Å; L632-V636 PolarHBondContact O-N 3.49Å; E633-V636 PolarHBondContact O-N 3.03Å; F634-V636 PolarHBondContact O-N 3.09Å; V636-H638 VanDerWaalsContact C-N 3.34Å; V636-T639 PolarHBondContact O-OG1 3.4Å; V636-T639 VanDerWaalsContact O-OG1 3.07Å; V636-N640 WeakPolarHBondContact O-CB 3.48Å; V636-N640 PolarHBondContact O-N 3.04Å; V636-N640 PolarHBondContact O-ND2 3.36Å
637K58.2Low54Low125 Ų125119.7 Ų119.754%0.54357%0.565SS.*Hα-helixtrans-65.5-39.9172-75.1161.5178.8159.30110.5E633 F634 N640 T641E633-K637 WeakPolarHBondContact O-CB 3.49Å; E633-K637 VanDerWaalsContact O-CG 3.3Å; E633-K637 WeakPolarHBondContact O-CG 3.35Å; E633-K637 PolarHBondContact O-N 2.93Å; E633-K637 IonicContact OE2-NZ 2.66Å; E633-K637 PolarHBondContact OE2-NZ 2.73Å; F634-K637 PolarHBondContact O-N 3.47Å; K637-N640 PolarHBondContact O-N 3.34Å; K637-T641 PolarHBondContact O-N 2.88Å; K637-T641 VanDerWaalsContact O-N 3.07Å; K637-T641 PolarHBondContact O-OG1 3.04Å
638H49.6Very low54.2Low97 Ų97119 Ų11945%0.44956%0.562SS.*Hα-helixtrans-76.7-29.1-177-153.9-30.7000114.3F634 K635 V636 T641 K642F634-H638 VanDerWaalsContact O-CB 3.23Å; F634-H638 WeakPolarHBondContact O-CB 3.23Å; F634-H638 PolarHBondContact O-N 2.65Å; K635-H638 PolarHBondContact O-N 3.35Å; V636-H638 VanDerWaalsContact C-N 3.34Å; H638-T641 WeakPolarHBondContact CA-OG1 3.22Å; H638-T641 PolarHBondContact O-OG1 3.36Å; H638-T641 VanDerWaalsContact O-OG1 3.12Å; H638-K642 PolarHBondContact O-N 2.89Å
639T54Low53.8Low76 Ų76120 Ų12047%0.46656%0.563SS.*Hα-helixtrans-69.2-42.5168.650.80000111.1K635 V636 T641 K642 L643K635-T639 WeakPolarHBondContact O-CG2 3.42Å; K635-T639 PolarHBondContact O-N 2.62Å; K635-T639 PolarHBondContact O-OG1 3.09Å; V636-T639 PolarHBondContact O-OG1 3.4Å; V636-T639 VanDerWaalsContact O-OG1 3.07Å; T639-T641 PolarHBondContact O-N 2.96Å; T639-K642 PolarHBondContact O-N 2.73Å; T639-L643 WeakPolarHBondContact O-CB 3.39Å; T639-L643 PolarHBondContact O-N 3.31Å
640N50.3Low53Low97 Ų97120 Ų12052%0.51957%0.568SS.*Hα-helixtrans-63.1-39.9178-83.1-62.4000113.1V636 K637 L643 R644V636-N640 WeakPolarHBondContact O-CB 3.48Å; V636-N640 PolarHBondContact O-N 3.04Å; V636-N640 PolarHBondContact O-ND2 3.36Å; K637-N640 PolarHBondContact O-N 3.34Å; N640-L643 PolarHBondContact O-N 3.12Å; N640-R644 PolarHBondContact O-N 3.21Å
641T51Low52.5Low73 Ų73117.7 Ų117.745%0.44857%0.565SS.*Hα-helixtrans-67.1-41.9173.652.60000112.4K637 H638 T639 L643 R644 N645K637-T641 PolarHBondContact O-N 2.88Å; K637-T641 VanDerWaalsContact O-N 3.07Å; K637-T641 PolarHBondContact O-OG1 3.04Å; H638-T641 WeakPolarHBondContact CA-OG1 3.22Å; H638-T641 PolarHBondContact O-OG1 3.36Å; H638-T641 VanDerWaalsContact O-OG1 3.12Å; T639-T641 PolarHBondContact O-N 2.96Å; T641-L643 VanDerWaalsContact C-N 3.3Å; T641-L643 PolarHBondContact O-N 3.44Å; T641-R644 PolarHBondContact O-N 3.06Å; T641-N645 WeakPolarHBondContact O-CB 3.45Å; T641-N645 PolarHBondContact O-N 3.09Å
642K46.4Very low52.2Low140 Ų140122.8 Ų122.861%0.60958%0.577SS**Hα-helixtrans-58.8-39.6172-83.7-169.1172-1740112.1H638 T639 K646H638-K642 PolarHBondContact O-N 2.89Å; T639-K642 PolarHBondContact O-N 2.73Å; K642-K646 WeakPolarHBondContact O-CB 3.49Å; K642-K646 PolarHBondContact O-N 2.73Å
643L51.5Low51Low107 Ų107123.5 Ų123.556%0.5658%0.581SS**Hα-helixtrans-67.2-40.1177.4-117.8157.9000112.9T639 N640 T641 K647T639-L643 WeakPolarHBondContact O-CB 3.39Å; T639-L643 PolarHBondContact O-N 3.31Å; N640-L643 PolarHBondContact O-N 3.12Å; T641-L643 VanDerWaalsContact C-N 3.3Å; T641-L643 PolarHBondContact O-N 3.44Å; L643-K647 PolarHBondContact O-N 3.46Å
644R45.1Very low50Low195 Ų195128 Ų12874%0.73660%0.599SS**Hα-helixtrans-65.3-46.1174.2-123.9178.1-176.6-178.91.5111.5N640 T641 K646 K647 N648N640-R644 PolarHBondContact O-N 3.21Å; T641-R644 PolarHBondContact O-N 3.06Å; R644-K646 PolarHBondContact O-N 2.86Å; R644-K647 PolarHBondContact O-N 2.99Å; R644-N648 PolarHBondContact O-N 3.23Å
645N47Very low49.6Very low107 Ų107132.2 Ų132.257%0.57261%0.611SS**Hα-helixtrans-65.4-40.6179.5-722.3000111.8T641 K647 N648 F649T641-N645 WeakPolarHBondContact O-CB 3.45Å; T641-N645 PolarHBondContact O-N 3.09Å; N645-K647 VanDerWaalsContact C-N 3.31Å; N645-K647 PolarHBondContact O-N 2.89Å; N645-N648 PolarHBondContact O-N 3.16Å; N645-N648 VanDerWaalsContact O-N 3.14Å; N645-F649 PolarHBondContact O-N 3.44Å
646K52.3Low48.5Very low171 Ų171130.3 Ų130.374%0.74361%0.613SS**Hα-helixtrans-64.1-31.9176.7-161.9167.6-172.8172.90112.9K642 R644 K650K642-K646 WeakPolarHBondContact O-CB 3.49Å; K642-K646 PolarHBondContact O-N 2.73Å; R644-K646 PolarHBondContact O-N 2.86Å; K646-K650 WeakPolarHBondContact O-CB 3.49Å; K646-K650 PolarHBondContact O-N 3.35Å
647K54.4Low46.8Very low155 Ų155131.4 Ų131.467%0.67462%0.624SS**Hα-helixtrans-69.2-45.7169.4-81.2-175.2173.1-179.40112.1L643 R644 N645 F649 K650 S651L643-K647 PolarHBondContact O-N 3.46Å; R644-K647 PolarHBondContact O-N 2.99Å; N645-K647 VanDerWaalsContact C-N 3.31Å; N645-K647 PolarHBondContact O-N 2.89Å; K647-F649 PolarHBondContact O-N 3.45Å; K647-K650 PolarHBondContact O-N 3.39Å; K647-S651 PolarHBondContact O-N 2.77Å
648N46.7Very low45.7Very low96 Ų96134.5 Ų134.551%0.51364%0.637SS.*Hα-helixtrans-64.1-41.7-179.9-72.8-5.9000112.2R644 N645 K650 S651 R652R644-N648 PolarHBondContact O-N 3.23Å; N645-N648 PolarHBondContact O-N 3.16Å; N645-N648 VanDerWaalsContact O-N 3.14Å; N648-K650 PolarHBondContact O-N 2.97Å; N648-S651 PolarHBondContact O-N 3.13Å; N648-S651 VanDerWaalsContact O-N 3.16Å; N648-S651 PolarHBondContact O-OG 3.17Å; N648-R652 PolarHBondContact O-N 3.09Å; N648-R652 VanDerWaalsContact O-N 3.12Å
649F39.9Very low45Very low135 Ų135138 Ų13859%0.59266%0.659SS**Hα-helixtrans-62.6-44177.2-139.4-87.3000111.7N645 K647 S651 R652 L653N645-F649 PolarHBondContact O-N 3.44Å; K647-F649 PolarHBondContact O-N 3.45Å; F649-S651 PolarHBondContact O-N 2.92Å; F649-R652 PolarHBondContact O-N 3.05Å; F649-R652 VanDerWaalsContact O-N 3.15Å; F649-L653 HydrophobicContact CD1-CD1 4.31Å; F649-L653 HydrophobicContact CE1-CD1 4.09Å; F649-L653 PolarHBondContact O-N 3.01Å
650K47.3Very low43.9Very low168 Ų168145.4 Ų145.473%0.7368%0.679SS**Hα-helixtrans-66.6-19177.1-156.9170.7-172.1177.30113.4K646 K647 N648K646-K650 WeakPolarHBondContact O-CB 3.49Å; K646-K650 PolarHBondContact O-N 3.35Å; K647-K650 PolarHBondContact O-N 3.39Å; N648-K650 PolarHBondContact O-N 2.97Å
651S44.9Very low43.1Very low70 Ų70148 Ų14849%0.4969%0.693SS.*Hα-helixtrans-85-32.5171.978.70000113.4K647 N648 F649K647-S651 PolarHBondContact O-N 2.77Å; N648-S651 PolarHBondContact O-N 3.13Å; N648-S651 VanDerWaalsContact O-N 3.16Å; N648-S651 PolarHBondContact O-OG 3.17Å; F649-S651 PolarHBondContact O-N 2.92Å
652R44.5Very low42.1Very low200 Ų200150.4 Ų150.476%0.75571%0.711SS**Hα-helixtrans-73-41.4173.6-83-173.6164.1-168.7-5.9112.5N648 F649 K654 R655N648-R652 PolarHBondContact O-N 3.09Å; N648-R652 VanDerWaalsContact O-N 3.12Å; F649-R652 PolarHBondContact O-N 3.05Å; F649-R652 VanDerWaalsContact O-N 3.15Å; R652-K654 PolarHBondContact O-N 2.76Å; R652-K654 VanDerWaalsContact O-N 3.1Å; R652-R655 PolarHBondContact O-N 3.48Å
653L40.5Very low41.2Very low119 Ų119152.5 Ų152.562%0.62373%0.725SS**THydrogen-bonded Turntrans-62.2-20.2-179.5-135.878000113.8F649 R655F649-L653 HydrophobicContact CD1-CD1 4.31Å; F649-L653 HydrophobicContact CE1-CD1 4.09Å; F649-L653 PolarHBondContact O-N 3.01Å; L653-R655 VanDerWaalsContact C-N 3.33Å
654K43.8Very low40.1Very low179 Ų179152 Ų15278%0.77873%0.731SS**THydrogen-bonded Turntrans-83.94.5174.3-84.3-162.1169.3-164.20114.7R652R652-K654 PolarHBondContact O-N 2.76Å; R652-K654 VanDerWaalsContact O-N 3.1Å
655R45Very low39.2Very low230 Ų230148.1 Ų148.187%0.86873%0.733SS**SBendtrans-118.3-5-176.7-79.6-176168170.3-3.6115.7R652 L653R652-R655 PolarHBondContact O-N 3.48Å; L653-R655 VanDerWaalsContact C-N 3.33Å
656T38.2Very low38.4Very low115 Ų115150.7 Ų150.771%0.70675%0.745SS**  trans-106.9-1.2-174.448.30000115K658T656-K658 VanDerWaalsContact C-N 3.28Å; T656-K658 PolarHBondContact O-N 3.41Å
657S31.9Very low37.1Very low104 Ų104147 Ų14773%0.72774%0.742SS**  trans-8161-178.461.70000113.2
658K36.4Very low35.8Very low190 Ų190147.5 Ų147.583%0.82675%0.751SS**  trans-163.968.2175.2-118.9176.7-173.2-173.80114.9T656T656-K658 VanDerWaalsContact C-N 3.28Å; T656-K658 PolarHBondContact O-N 3.41Å
659N35.2Very low35Very low170 Ų170149.7 Ų149.791%0.90976%0.762SS**  trans-178162.9139.2-96.1-9.4000111
660R30.5Very low34.6Very low233 Ų233149.2 Ų149.288%0.87977%0.765SS**  trans-136.2161.9-176.2-86.1-176170.2171.3-5.1111
661N32Very low33.7Very low152 Ų152150.3 Ų150.381%0.81377%0.766SS**  trans80.9162.2162.4-60.2-3000118.9
662C31.9Very low33.1Very low123 Ų123153.3 Ų153.383%0.83178%0.776SS**  trans81.270172.4-58.40000118.8
663M27.4Very low32.6Very low184 Ų184150.5 Ų150.591%0.90677%0.772SS**  50.4132.6120.2-87.9-64.5-177.400123.5
664S26.8Very low32.2Very low96 Ų96150.8 Ų150.867%0.67177%0.773SS**  trans75149.8142.6-1500000121
665S26.7Very low31.7Very low113 Ų113146.2 Ų146.279%0.7976%0.763SS**  trans6539.8151.5-490000119.6
666I29.4Very low31Very low161 Ų161141.1 Ų141.183%0.82675%0.753SS**  trans-124.5102.5156.4-59-177000110.4
667S25.5Very low30.6Very low95 Ų95143.7 Ų143.766%0.66476%0.757SS**  trans-77.1165.7170.947.30000112.1N669S667-N669 PolarHBondContact O-N 2.9Å
668L28Very low30.5Very low165 Ų165146.6 Ų146.686%0.86476%0.761SS**SBendtrans47.462.1153.2-70.4163.1000117.7
669N30.3Very low30.3Very low141 Ų141145 Ų14575%0.75476%0.761SS**SBendtrans-158-28.2151.9-112.4-60.1000116.6S667S667-N669 PolarHBondContact O-N 2.9Å
670L30.3Very low29.8Very low125 Ų125141.6 Ų141.665%0.65475%0.751SS**SBendtrans-90.2-22.3-171.3-89.8158000116.2N672 Q673L670-N672 PolarHBondContact O-N 3.37Å; L670-Q673 PolarHBondContact O-N 3.27Å
671Y28.6Very low29.8Very low192 Ų192139.4 Ų139.475%0.75375%0.75SS**Hα-helixtrans-66.4-39.6-175.7-154.2-104.7000112.6Q673 I674Y671-Q673 PolarHBondContact O-N 2.8Å; Y671-I674 PolarHBondContact O-N 3.24Å
672N33Very low29.7Very low132 Ų132138.7 Ų138.771%0.70675%0.752SS**Hα-helixtrans-67.6-15-179.4-76.9-18.4000114.7L670 N676L670-N672 PolarHBondContact O-N 3.37Å; N672-N676 PolarHBondContact O-ND2 2.94Å
673Q34.1Very low29.5Very low142 Ų142142.5 Ų142.566%0.66475%0.754SS**Hα-helixtrans-91-13.1175.9-72.6-169.1-9.800114L670 Y671L670-Q673 PolarHBondContact O-N 3.27Å; Y671-Q673 PolarHBondContact O-N 2.8Å
674I32.4Very low29.3Very low124 Ų124139.3 Ų139.364%0.63675%0.75SS**Hα-helixtrans-99.5-37.5-174.9-63.6177.3000111.7Y671 N676Y671-I674 PolarHBondContact O-N 3.24Å; I674-N676 PolarHBondContact O-N 3.08Å
675S31.6Very low29.4Very low83 Ų83139.3 Ų139.358%0.5875%0.746SS**THydrogen-bonded Turntrans-72.26.6178.9-580000115.5
676N30.2Very low29.5Very low123 Ų123139 Ų13966%0.65874%0.739SS**THydrogen-bonded Turntrans-106.60.7-178.9-84.5-70.7000114.9N672 I674N672-N676 PolarHBondContact O-ND2 2.94Å; I674-N676 PolarHBondContact O-N 3.08Å
677E30Very low29.5Very low170 Ų170136.6 Ų136.679%0.79474%0.736SS**SBendtrans-125.111.8-178.2-136.5178.7-175.800115.2
678M31.2Very low29.5Very low164 Ų164139.7 Ų139.781%0.80874%0.74SS**SBendtrans-135.381179.3-83.5-71.6-169.100113.3
679L30.4Very low29.6Very low156 Ų156143.4 Ų143.482%0.81774%0.744SS**  178.694.8126.8-118.677.5000110.1
680S26Very low29.4Very low100 Ų100141.7 Ų141.770%0.69974%0.743SS**  trans-121.366.1166.570.40000110.3
681H29.5Very low29.3Very low186 Ų186140 Ų14086%0.86174%0.742SS**  trans-169.680.4167-92.9-59000113.7
682T30.5Very low29.2Very low138 Ų138136.8 Ų136.885%0.84774%0.742SS**  trans-159.6153.4147.715.50000108.7
683K26.9Very low29.1Very low203 Ų203135.3 Ų135.388%0.88373%0.734SS**  trans-124.1151.5-178.3-74.1-177.8175.5179.10111
684S24.2Very low28.7Very low117 Ų117134.1 Ų134.182%0.81874%0.737SS**  trans77.3164.4144.9-155.40000119.3
685V27.8Very low28.7Very low96 Ų96134.4 Ų134.458%0.58274%0.735SS**  trans98.4105161.3-169.40000117.5
686V29.6Very low28.4Very low106 Ų106138.4 Ų138.464%0.64275%0.747SS**  trans69.294.5153.9178.70000118.1
687S28.9Very low28.4Very low110 Ų110141.4 Ų141.477%0.76976%0.755SS**  trans-70.1132.3133.155.40000110.2
688Q26.7Very low28.2Very low161 Ų161141.2 Ų141.275%0.75275%0.753SS**  trans158.8103.1151.7-94.2169.3-11.600109.9
689Y28.9Very low28.1Very low243 Ų243139 Ų13995%0.95375%0.749SS**  trans-149114.2135.7-103.1-73000108.1
690S25.9Very low28Very low105 Ų105138.8 Ų138.873%0.73475%0.748SS**  trans-88.6164.1171.646.90000110.4V692S690-V692 PolarHBondContact O-N 2.85Å
691S28.1Very low28.1Very low90 Ų90140 Ų14063%0.62976%0.757SS**  trans-53.6117.6-179.657.30000113.7
692V28.2Very low28Very low124 Ų124135 Ų13575%0.75276%0.755SS**  trans-142.3116.2150.5-177.40000106.5S690S690-V692 PolarHBondContact O-N 2.85Å
693D29.7Very low28.1Very low101 Ų101133.7 Ų133.754%0.5475%0.752SS.*  trans-151.967.1166.2-128-31.4000109.7Q695D693-Q695 PolarHBondContact O-N 3.07Å; D693-Q695 PolarHBondContact OD1-NE2 3.26Å
694T27Very low28.2Very low117 Ų117131.9 Ų131.972%0.71875%0.752SS**  trans-84.995.4168.1-520000107.9
695Q32.2Very low28.6Very low129 Ų129131.3 Ų131.360%0.60375%0.748SS**  trans-10983.6172.9-69.4-166.438.200111.4D693 F697D693-Q695 PolarHBondContact O-N 3.07Å; D693-Q695 PolarHBondContact OD1-NE2 3.26Å; Q695-F697 PolarHBondContact O-N 3.31Å
696M24.4Very low28.7Very low168 Ų168134.2 Ų134.283%0.82876%0.76SS**  trans-72.9110.6159.5176.6179.570.500108.5
697F29.4Very low28.7Very low186 Ų186135.2 Ų135.282%0.81677%0.77SS**  trans-126.9118.1163.3-88.7-73.7000110.2Q695Q695-F697 PolarHBondContact O-N 3.31Å
698H27.6Very low28.8Very low166 Ų166139.1 Ų139.177%0.76978%0.777SS**  trans-108.6169.8174.4-155.6-81.9000107.8
699V29.1Very low29.1Very low117 Ų117138.3 Ų138.371%0.70978%0.782SS**  trans72.2141.9178-158.40000110.7
700D28.4Very low29.1Very low151 Ų151132.9 Ų132.981%0.80778%0.775SS**  cis-96.9153.312.4-64.3-72.2000116.7
701S26.9Very low29.3Very low127 Ų127133.5 Ų133.589%0.88878%0.779SS**  trans-142.3106.6162.1-680000107.2
702G28.6Very low29.4Very low80 Ų80136.7 Ų136.783%0.82579%0.789SS**  trans-170.466.9-164.300000114.9
703S32.2Very low29.6Very low111 Ų111139.3 Ų139.378%0.77679%0.793SS**  trans-153.994.5161.761.90000110.8
704N29.4Very low29.5Very low164 Ų164139.9 Ų139.988%0.87781%0.805SS**  trans-70.1132.8162.1-71.92.6000108.5
705S31.6Very low29.7Very low105 Ų105144.4 Ų144.473%0.73481%0.81SS**  trans-151.798.3160.761.80000108.6C707S705-C707 PolarHBondContact O-N 3.43Å
706D29.5Very low29.6Very low157 Ų157148.8 Ų148.884%0.8482%0.822SS**  trans-63.4125.1175.9-54.1-79.9000110.2
707C30.4Very low29.7Very low127 Ų127146.8 Ų146.886%0.85882%0.824SS**  trans-150.690.6168-111.80000108.9S705S705-C707 PolarHBondContact O-N 3.43Å
708E30.5Very low29.7Very low193 Ų193147 Ų14790%0.90282%0.824SS**  trans-59136.7155.4-60-178.8116.300108.9
709V32.7Very low29.8Very low144 Ų144144.6 Ų144.687%0.87383%0.826SS**  trans-161.3135.61371340000108.8
710T28.8Very low30.2Very low129 Ų129146.1 Ų146.179%0.79183%0.829SS**  trans-74.7142-177.146.90000112.3
711S31Very low30.4Very low117 Ų117143.8 Ų143.882%0.81882%0.821SS**  176.5138.8122.942.50000114.2H713S711-H713 PolarHBondContact O-N 2.92Å
712N29.4Very low30.7Very low158 Ų158145.2 Ų145.285%0.84582%0.819SS**  trans-46.4121.7-178.5-54.9-29000115.8
713H33.2Very low31.2Very low179 Ų179146.4 Ų146.483%0.82981%0.807SS**  trans-144108.7146.6-111.748.9000110.7S711S711-H713 PolarHBondContact O-N 2.92Å
714S28.2Very low31.7Very low113 Ų113146.7 Ų146.779%0.7980%0.804SS**  trans-84.5118.6-175.143.20000112
715Y30.8Very low32.5Very low212 Ų212141.8 Ų141.883%0.83178%0.782SS**  trans-129.1117.7164.9-89.9-84.3000110.8C717Y715-C717 PolarHBondContact O-N 3.02Å
716Y29Very low33.1Very low220 Ų220141.9 Ų141.986%0.86377%0.771SS**  trans-47.3124.2-175.5-90.4-110.1000113.5K718Y716-K718 PolarHBondContact O-N 3.2Å
717C26.5Very low34.3Very low127 Ų127139.8 Ų139.886%0.85876%0.759SS**  trans-63.2126.3151.9-74.60000108.5Y715Y715-C717 PolarHBondContact O-N 3.02Å
718K30.4Very low35.6Very low191 Ų191139.8 Ų139.883%0.8375%0.747SS**  trans-98.3104.8163.6-85.6-172.4171-178.30108.2Y716Y716-K718 PolarHBondContact O-N 3.2Å
719S30.2Very low37Very low114 Ų114135.6 Ų135.680%0.79773%0.727SS**PPolyproline II helixtrans-53.8135.1163.534.70000109.9
720I35.8Very low38.3Very low150 Ų150135.9 Ų135.977%0.76971%0.713SS**PPolyproline II helixtrans-95.9123164.7-61.8175.6000104.4
721P33.2Very low40.1Very low101 Ų101134.9 Ų134.966%0.65670%0.699SS**PPolyproline II helixtrans-76.8129.9178.630.4-32.6000109.9
722D33.5Very low41.5Very low158 Ų158132.9 Ų132.985%0.84567%0.674SS**PPolyproline II helixtrans-65.2132.9170.5-66.4-69000110.4
723N38.4Very low43.3Very low104 Ų104132.4 Ų132.456%0.55666%0.66SS**  trans-141.291.8176.8-104-57.2000107.8S725 E726N723-S725 PolarHBondContact O-N 3.47Å; N723-S725 VanDerWaalsContact O-N 3.16Å; N723-E726 PolarHBondContact O-N 3.18Å
724T43.4Very low44.9Very low118 Ų118129.8 Ų129.872%0.72465%0.65SS**Hα-helixtrans-49.8-37.2176.3450000112.2E726 L727 E728T724-E726 PolarHBondContact O-N 3.21Å; T724-L727 WeakPolarHBondContact O-CB 3.26Å; T724-L727 PolarHBondContact O-N 2.99Å; T724-E728 PolarHBondContact O-N 3.21Å
725S45.4Very low46.6Very low60 Ų60129.2 Ų129.242%0.4264%0.635SS.*Hα-helixtrans-55-29.2175.761.30000115N723 Q729N723-S725 PolarHBondContact O-N 3.47Å; N723-S725 VanDerWaalsContact O-N 3.16Å; S725-Q729 VanDerWaalsContact O-CB 3.22Å; S725-Q729 WeakPolarHBondContact O-CB 3.35Å; S725-Q729 PolarHBondContact O-N 2.89Å
726E44.1Very low48.5Very low107 Ų107121.1 Ų121.150%0.561%0.607SS.*Hα-helixtrans-77.4-28.7176.2-143.1-151.4134.500112.2N723 T724 R730N723-E726 PolarHBondContact O-N 3.18Å; T724-E726 PolarHBondContact O-N 3.21Å; E726-R730 WeakPolarHBondContact O-CB 3.41Å; E726-R730 WeakPolarHBondContact O-CD 3.17Å; E726-R730 WeakPolarHBondContact O-CG 3.45Å; E726-R730 PolarHBondContact O-N 3.01Å; E726-R730 VanDerWaalsContact O-N 3.1Å; E726-R730 IonicContact OE1-CZ 2.62Å; E726-R730 IonicContact OE1-NE 3.81Å; E726-R730 PolarHBondContact OE1-NE 3.3Å; E726-R730 IonicContact OE1-NH2 2.73Å; E726-R730 PolarHBondContact OE1-NH2 2.93Å; E726-R730 IonicContact OE2-NH2 2.81Å
727L55.8Low50.4Low113 Ų113118.5 Ų118.559%0.59260%0.595SS**Hα-helixtrans-71.5-48.9175.8-168.772.6000110.4T724 Q729 R730 Q731T724-L727 WeakPolarHBondContact O-CB 3.26Å; T724-L727 PolarHBondContact O-N 2.99Å; L727-Q729 PolarHBondContact O-N 3.44Å; L727-R730 PolarHBondContact O-N 2.85Å; L727-Q731 WeakPolarHBondContact O-CG 3.47Å; L727-Q731 PolarHBondContact O-N 3.32Å
728E57.1Low52.4Low128 Ų128116.6 Ų116.660%0.59858%0.58SS**Hα-helixtrans-58.4-46.6174.7-66.6-174.114600111.5T724 R730 Q731 W732T724-E728 PolarHBondContact O-N 3.21Å; E728-R730 VanDerWaalsContact C-N 3.25Å; E728-R730 PolarHBondContact O-N 3.28Å; E728-Q731 PolarHBondContact O-N 3.44Å; E728-Q731 VanDerWaalsContact O-N 3.14Å; E728-W732 WeakPolarHBondContact O-CB 3.25Å; E728-W732 PolarHBondContact O-N 3.07Å
729Q60Low53.7Low105 Ų105112.6 Ų112.649%0.49156%0.561SS.*Hα-helixtrans-67.4-27-179.4-160.2-178.3109.800112.3S725 L727 R733S725-Q729 VanDerWaalsContact O-CB 3.22Å; S725-Q729 WeakPolarHBondContact O-CB 3.35Å; S725-Q729 PolarHBondContact O-N 2.89Å; L727-Q729 PolarHBondContact O-N 3.44Å; Q729-R733 WeakPolarHBondContact O-CB 3.28Å; Q729-R733 WeakPolarHBondContact O-CD 3.36Å; Q729-R733 WeakPolarHBondContact O-CG 3.49Å; Q729-R733 PolarHBondContact O-N 2.89Å
730R60Low55.6Low150 Ų150112.5 Ų112.557%0.56655%0.55SS**Hα-helixtrans-72.3-43.5169.5-74.8169.6-176.9-159.69111.8E726 L727 E728 M734E726-R730 WeakPolarHBondContact O-CB 3.41Å; E726-R730 WeakPolarHBondContact O-CD 3.17Å; E726-R730 WeakPolarHBondContact O-CG 3.45Å; E726-R730 PolarHBondContact O-N 3.01Å; E726-R730 VanDerWaalsContact O-N 3.1Å; E726-R730 IonicContact OE1-CZ 2.62Å; E726-R730 IonicContact OE1-NE 3.81Å; E726-R730 PolarHBondContact OE1-NE 3.3Å; E726-R730 IonicContact OE1-NH2 2.73Å; E726-R730 PolarHBondContact OE1-NH2 2.93Å; E726-R730 IonicContact OE2-NH2 2.81Å; L727-R730 PolarHBondContact O-N 2.85Å; E728-R730 VanDerWaalsContact C-N 3.25Å; E728-R730 PolarHBondContact O-N 3.28Å; R730-M734 WeakPolarHBondContact O-CB 3.47Å; R730-M734 PolarHBondContact O-N 2.67Å
731Q66.9Low57.3Low107 Ų107109 Ų10950%0.553%0.533SS..Hα-helixtrans-59.9-47.2174.9-73.8178.6-13.400111.4L727 E728 M734 Q735L727-Q731 WeakPolarHBondContact O-CG 3.47Å; L727-Q731 PolarHBondContact O-N 3.32Å; E728-Q731 PolarHBondContact O-N 3.44Å; E728-Q731 VanDerWaalsContact O-N 3.14Å; Q731-M734 CarbonylContact O-C 3.59Å; Q731-M734 WeakPolarHBondContact O-CA 3.41Å; Q731-M734 VanDerWaalsContact O-CB 3.3Å; Q731-M734 WeakPolarHBondContact O-CB 3.43Å; Q731-M734 PolarHBondContact O-N 3.33Å; Q731-Q735 WeakPolarHBondContact O-CG 3.42Å; Q731-Q735 PolarHBondContact O-N 3.31Å
732W60.8Low59Low75 Ų75106.4 Ų106.428%0.28452%0.521SS..Hα-helixtrans-63.6-44.1179.9-161.983.3000112.4D299 E728 M734 Q735 V736D299-W732 VanDerWaalsContact OD2-CD1 3.31Å; D299-W732 PolarHBondContact OD2-NE1 3.37Å; E728-W732 WeakPolarHBondContact O-CB 3.25Å; E728-W732 PolarHBondContact O-N 3.07Å; W732-M734 PolarHBondContact O-N 2.92Å; W732-Q735 PolarHBondContact O-N 3Å; W732-V736 HydrophobicContact CD2-CG2 3.98Å; W732-V736 HydrophobicContact CE3-CG2 3.89Å; W732-V736 HydrophobicContact CH2-CG2 3.9Å; W732-V736 HydrophobicContact CZ2-CG2 3.97Å; W732-V736 HydrophobicContact CZ3-CG2 3.85Å; W732-V736 WeakPolarHBondContact O-CG2 3.45Å; W732-V736 PolarHBondContact O-N 3.4Å
733R67.5Low60.5Low148 Ų148100.7 Ų100.756%0.55850%0.495SS*.Hα-helixtrans-61.4-29.9172-73.6174.8-167.9-156.711.1112.8Q729 R737Q729-R733 WeakPolarHBondContact O-CB 3.28Å; Q729-R733 WeakPolarHBondContact O-CD 3.36Å; Q729-R733 WeakPolarHBondContact O-CG 3.49Å; Q729-R733 PolarHBondContact O-N 2.89Å; R733-R737 WeakPolarHBondContact O-CB 3.38Å; R733-R737 VanDerWaalsContact O-CG 3.3Å; R733-R737 WeakPolarHBondContact O-CG 3.45Å; R733-R737 PolarHBondContact O-N 2.8Å
734M65.4Low62Low125 Ų125101.5 Ų101.562%0.61650%0.496SS*.Hα-helixtrans-73.6-47.4175.7-160-174.5-52.300110.7R730 Q731 W732 R737 T738R730-M734 WeakPolarHBondContact O-CB 3.47Å; R730-M734 PolarHBondContact O-N 2.67Å; Q731-M734 CarbonylContact O-C 3.59Å; Q731-M734 WeakPolarHBondContact O-CA 3.41Å; Q731-M734 VanDerWaalsContact O-CB 3.3Å; Q731-M734 WeakPolarHBondContact O-CB 3.43Å; Q731-M734 PolarHBondContact O-N 3.33Å; W732-M734 PolarHBondContact O-N 2.92Å; M734-R737 PolarHBondContact O-N 3.47Å; M734-T738 PolarHBondContact O-N 2.91Å; M734-T738 PolarHBondContact O-OG1 3.34Å; M734-T738 VanDerWaalsContact O-OG1 3.07Å
735Q64.7Low63.1Low101 Ų101100.7 Ų100.747%0.47248%0.482SS..Hα-helixtrans-58.2-50.8176-72.1172.3-11.300112.1Q731 W732 R737 T738 Y739Q731-Q735 WeakPolarHBondContact O-CG 3.42Å; Q731-Q735 PolarHBondContact O-N 3.31Å; W732-Q735 PolarHBondContact O-N 3Å; Q735-R737 VanDerWaalsContact C-N 3.3Å; Q735-R737 PolarHBondContact O-N 3Å; Q735-T738 WeakPolarHBondContact O-CB 3.5Å; Q735-T738 PolarHBondContact O-N 2.98Å; Q735-Y739 HydrophobicContact CB-CE2 4.23Å; Q735-Y739 WeakPolarHBondContact O-CD2 3.45Å; Q735-Y739 PolarHBondContact O-N 3.05Å
736V70Confident64Low41 Ų4199.5 Ų99.525%0.24848%0.476CS..Hα-helixtrans-60.5-38.7178.6173.30000111.8W732 Y739 L740W732-V736 HydrophobicContact CD2-CG2 3.98Å; W732-V736 HydrophobicContact CE3-CG2 3.89Å; W732-V736 HydrophobicContact CH2-CG2 3.9Å; W732-V736 HydrophobicContact CZ2-CG2 3.97Å; W732-V736 HydrophobicContact CZ3-CG2 3.85Å; W732-V736 WeakPolarHBondContact O-CG2 3.45Å; W732-V736 PolarHBondContact O-N 3.4Å; V736-Y739 PolarHBondContact O-N 3.34Å; V736-L740 HydrophobicContact CG1-CD1 4.07Å; V736-L740 WeakPolarHBondContact O-CG 3.38Å; V736-L740 PolarHBondContact O-N 3.47Å
737R68.4Low65Low165 Ų16599 Ų9962%0.62347%0.474SS*.Hα-helixtrans-65.8-39.9172.2-79.4177168.3-166.7-6.8112.7R733 M734 Q735 L740 N741R733-R737 WeakPolarHBondContact O-CB 3.38Å; R733-R737 VanDerWaalsContact O-CG 3.3Å; R733-R737 WeakPolarHBondContact O-CG 3.45Å; R733-R737 PolarHBondContact O-N 2.8Å; M734-R737 PolarHBondContact O-N 3.47Å; Q735-R737 VanDerWaalsContact C-N 3.3Å; Q735-R737 PolarHBondContact O-N 3Å; R737-L740 PolarHBondContact O-N 2.79Å; R737-N741 VanDerWaalsContact O-CB 3.31Å; R737-N741 WeakPolarHBondContact O-CB 3.34Å; R737-N741 VanDerWaalsContact O-CG 3.23Å; R737-N741 PolarHBondContact O-N 3.23Å; R737-N741 PolarHBondContact O-OD1 2.97Å; R737-N741 VanDerWaalsContact O-OD1 3.12Å
738T68.6Low65.7Low88 Ų8898 Ų9854%0.5447%0.466SS..Hα-helixtrans-62.8-42.1175.5-60.20000111.5M734 Q735 A742M734-T738 PolarHBondContact O-N 2.91Å; M734-T738 PolarHBondContact O-OG1 3.34Å; M734-T738 VanDerWaalsContact O-OG1 3.07Å; Q735-T738 WeakPolarHBondContact O-CB 3.5Å; Q735-T738 PolarHBondContact O-N 2.98Å; T738-A742 VanDerWaalsContact O-CB 3.26Å; T738-A742 WeakPolarHBondContact O-CB 3.48Å; T738-A742 PolarHBondContact O-N 3.39Å
739Y59Low66.3Low107 Ų10796.5 Ų96.542%0.4246%0.461SS..Hα-helixtrans-65.2-44.3175.8-67.2-55.8000112.6L292 Q735 V736 A742 A743L292-Y739 HydrophobicContact CD2-CE1 4.47Å; Q735-Y739 HydrophobicContact CB-CE2 4.23Å; Q735-Y739 WeakPolarHBondContact O-CD2 3.45Å; Q735-Y739 PolarHBondContact O-N 3.05Å; V736-Y739 PolarHBondContact O-N 3.34Å; Y739-A742 PolarHBondContact O-N 3.18Å; Y739-A743 PolarHBondContact O-N 3.27Å
740L70.6Confident66.6Low111 Ų11192.9 Ų92.958%0.58145%0.445SS*.Hα-helixtrans-63.8-45.5176.7-71170.2000112V736 R737 A742 A743 E744V736-L740 HydrophobicContact CG1-CD1 4.07Å; V736-L740 WeakPolarHBondContact O-CG 3.38Å; V736-L740 PolarHBondContact O-N 3.47Å; R737-L740 PolarHBondContact O-N 2.79Å; L740-A742 PolarHBondContact O-N 2.95Å; L740-A743 PolarHBondContact O-N 3.19Å; L740-E744 PolarHBondContact O-N 3.34Å
741N71.6Confident67Low77 Ų7792.3 Ų92.341%0.41244%0.443SS..Hα-helixtrans-65.3-27.7175.8-70.823000112.5R737 K745R737-N741 VanDerWaalsContact O-CB 3.31Å; R737-N741 WeakPolarHBondContact O-CB 3.34Å; R737-N741 VanDerWaalsContact O-CG 3.23Å; R737-N741 PolarHBondContact O-N 3.23Å; R737-N741 PolarHBondContact O-OD1 2.97Å; R737-N741 VanDerWaalsContact O-OD1 3.12Å; N741-K745 WeakPolarHBondContact O-CB 3.48Å; N741-K745 VanDerWaalsContact O-CG 3.29Å; N741-K745 WeakPolarHBondContact O-CG 3.48Å; N741-K745 PolarHBondContact O-N 3.35Å
742A67.4Low67.2Low47 Ų4793 Ų9339%0.38845%0.45SS..Hα-helixtrans-74.3-39.8173.700000111.7T738 Y739 L740 A746T738-A742 VanDerWaalsContact O-CB 3.26Å; T738-A742 WeakPolarHBondContact O-CB 3.48Å; T738-A742 PolarHBondContact O-N 3.39Å; Y739-A742 PolarHBondContact O-N 3.18Å; L740-A742 PolarHBondContact O-N 2.95Å; A742-A746 WeakPolarHBondContact O-CB 3.46Å; A742-A746 PolarHBondContact O-N 2.99Å
743A65.9Low67.2Low38 Ų3897 Ų9731%0.31447%0.465SS..Hα-helixtrans-65-45.2174.100000112Y739 L740 K745 A746 E747Y739-A743 PolarHBondContact O-N 3.27Å; L740-A743 PolarHBondContact O-N 3.19Å; A743-K745 PolarHBondContact O-N 2.85Å; A743-A746 WeakPolarHBondContact O-CB 3.41Å; A743-A746 PolarHBondContact O-N 3.11Å; A743-A746 VanDerWaalsContact O-N 3.11Å; A743-E747 PolarHBondContact O-N 3.07Å
744E69.9Low66.7Low121 Ų12191.3 Ų91.357%0.56544%0.444SS*.Hα-helixtrans-59.6-44.8175.6-173.5175.8-15900111.3L740 A746 E747 E748L740-E744 PolarHBondContact O-N 3.34Å; E744-A746 VanDerWaalsContact C-N 3.34Å; E744-A746 PolarHBondContact O-N 3.28Å; E744-E747 PolarHBondContact O-N 3.38Å; E744-E748 WeakPolarHBondContact O-CB 3.41Å; E744-E748 PolarHBondContact O-N 3.22Å
745K65.4Low66.4Low101 Ų10188.6 Ų88.644%0.43944%0.437SS..Hα-helixtrans-64.8-33.4173.6-77.2178.9178.3-176.90113.4N741 A743 L749N741-K745 WeakPolarHBondContact O-CB 3.48Å; N741-K745 VanDerWaalsContact O-CG 3.29Å; N741-K745 WeakPolarHBondContact O-CG 3.48Å; N741-K745 PolarHBondContact O-N 3.35Å; A743-K745 PolarHBondContact O-N 2.85Å; K745-L749 VanDerWaalsContact O-CB 3.32Å; K745-L749 WeakPolarHBondContact O-CB 3.45Å; K745-L749 WeakPolarHBondContact O-CD1 3.49Å; K745-L749 VanDerWaalsContact O-CG 3.23Å; K745-L749 WeakPolarHBondContact O-CG 3.42Å; K745-L749 PolarHBondContact O-N 2.93Å
746A64.3Low66.3Low35 Ų3588.4 Ų88.429%0.28945%0.445SS..Hα-helixtrans-69.7-44.4176.200000111.2A742 A743 E744 L749 I750A742-A746 WeakPolarHBondContact O-CB 3.46Å; A742-A746 PolarHBondContact O-N 2.99Å; A743-A746 WeakPolarHBondContact O-CB 3.41Å; A743-A746 PolarHBondContact O-N 3.11Å; A743-A746 VanDerWaalsContact O-N 3.11Å; E744-A746 VanDerWaalsContact C-N 3.34Å; E744-A746 PolarHBondContact O-N 3.28Å; A746-L749 PolarHBondContact O-N 3.36Å; A746-I750 VanDerWaalsContact O-CG1 3.28Å; A746-I750 WeakPolarHBondContact O-CG1 3.35Å; A746-I750 PolarHBondContact O-N 3.12Å
747E66Low65.8Low97 Ų9792 Ų9245%0.45346%0.463SS..Hα-helixtrans-62.3-43.8174.6-164-166.5151.100111.4A743 E744 L749 I750 R751A743-E747 PolarHBondContact O-N 3.07Å; E744-E747 PolarHBondContact O-N 3.38Å; E747-L749 PolarHBondContact O-N 3.24Å; E747-I750 PolarHBondContact O-N 2.94Å; E747-R751 WeakPolarHBondContact O-CB 3.41Å; E747-R751 WeakPolarHBondContact O-CG 3.49Å; E747-R751 PolarHBondContact O-N 3.37Å; E747-R751 IonicContact OE1-CZ 2.93Å; E747-R751 IonicContact OE1-NE 2.73Å; E747-R751 PolarHBondContact OE1-NE 2.95Å; E747-R751 IonicContact OE1-NH2 3.29Å; E747-R751 PolarHBondContact OE1-NH2 3.29Å
748E70Confident65.4Low92 Ų9290.5 Ų90.543%0.4346%0.457SS..Hα-helixtrans-61.1-42.5174.4-179.2174.9-146.500111.9E744 I750 R751 N752E744-E748 WeakPolarHBondContact O-CB 3.41Å; E744-E748 PolarHBondContact O-N 3.22Å; E748-I750 VanDerWaalsContact C-N 3.35Å; E748-I750 PolarHBondContact O-N 2.96Å; E748-R751 PolarHBondContact O-N 3.35Å; E748-N752 VanDerWaalsContact CG-ND2 3.3Å; E748-N752 WeakPolarHBondContact CG-ND2 3.44Å; E748-N752 VanDerWaalsContact O-CB 3.22Å; E748-N752 WeakPolarHBondContact O-CB 3.43Å; E748-N752 VanDerWaalsContact O-CG 3.27Å; E748-N752 PolarHBondContact O-N 3.03Å; E748-N752 PolarHBondContact O-ND2 3.28Å; E748-N752 VanDerWaalsContact O-ND2 3.15Å
749L69.9Low65.1Low95 Ų9588.1 Ų88.150%0.49744%0.439SS..Hα-helixtrans-65.3-35.3175.4-79.3168.3000112.8K745 A746 E747 R753K745-L749 VanDerWaalsContact O-CB 3.32Å; K745-L749 WeakPolarHBondContact O-CB 3.45Å; K745-L749 WeakPolarHBondContact O-CD1 3.49Å; K745-L749 VanDerWaalsContact O-CG 3.23Å; K745-L749 WeakPolarHBondContact O-CG 3.42Å; K745-L749 PolarHBondContact O-N 2.93Å; A746-L749 PolarHBondContact O-N 3.36Å; E747-L749 PolarHBondContact O-N 3.24Å; L749-R753 VanDerWaalsContact O-CB 3.26Å; L749-R753 WeakPolarHBondContact O-CB 3.48Å; L749-R753 WeakPolarHBondContact O-CG 3.48Å; L749-R753 PolarHBondContact O-N 3.07Å; L749-R753 VanDerWaalsContact O-N 3.09Å
750I66.8Low65.3Low29 Ų2989 Ų8915%0.14945%0.447CS..Hα-helixtrans-67.5-52.8174.7-72.1166.4000109.6A746 E747 E748 N752 R753 Y754 F759 W762A746-I750 VanDerWaalsContact O-CG1 3.28Å; A746-I750 WeakPolarHBondContact O-CG1 3.35Å; A746-I750 PolarHBondContact O-N 3.12Å; E747-I750 PolarHBondContact O-N 2.94Å; E748-I750 VanDerWaalsContact C-N 3.35Å; E748-I750 PolarHBondContact O-N 2.96Å; I750-N752 VanDerWaalsContact C-N 3.28Å; I750-N752 PolarHBondContact O-N 3.18Å; I750-R753 PolarHBondContact O-N 3.12Å; I750-R753 VanDerWaalsContact O-N 3.13Å; I750-Y754 HydrophobicContact CG2-CD2 3.79Å; I750-Y754 HydrophobicContact CG2-CE2 4.02Å; I750-Y754 VanDerWaalsContact O-CD2 3.28Å; I750-Y754 WeakPolarHBondContact O-CD2 3.49Å; I750-Y754 PolarHBondContact O-N 3.04Å; I750-F759 HydrophobicContact CG2-CD2 4Å; I750-F759 HydrophobicContact CG2-CE2 3.86Å; I750-W762 HydrophobicContact CD1-CH2 4.06Å; I750-W762 HydrophobicContact CD1-CZ2 4.08Å; I750-W762 HydrophobicContact CG2-CE3 4.26Å; I750-W762 HydrophobicContact CG2-CH2 4.12Å; I750-W762 HydrophobicContact CG2-CZ2 4.43Å; I750-W762 HydrophobicContact CG2-CZ3 4.03Å
751R67.1Low65Low139 Ų13987.6 Ų87.653%0.52545%0.446SS..Hα-helixtrans-58.7-35.7178-71.4178.1-178.4-87.52.8112.9E747 E748 F759E747-R751 WeakPolarHBondContact O-CB 3.41Å; E747-R751 WeakPolarHBondContact O-CG 3.49Å; E747-R751 PolarHBondContact O-N 3.37Å; E747-R751 IonicContact OE1-CZ 2.93Å; E747-R751 IonicContact OE1-NE 2.73Å; E747-R751 PolarHBondContact OE1-NE 2.95Å; E747-R751 IonicContact OE1-NH2 3.29Å; E747-R751 PolarHBondContact OE1-NH2 3.29Å; E748-R751 PolarHBondContact O-N 3.35Å; R751-F759 HydrophobicContact CG-CE2 4.32Å; R751-F759 HydrophobicContact CG-CZ 4.44Å
752N72.2Confident64.7Low122 Ų12286.4 Ų86.465%0.65244%0.436SS*.Hα-helixtrans-82.1-18.5178.3-73.8-33.3000114.2E748 I750E748-N752 VanDerWaalsContact CG-ND2 3.3Å; E748-N752 WeakPolarHBondContact CG-ND2 3.44Å; E748-N752 VanDerWaalsContact O-CB 3.22Å; E748-N752 WeakPolarHBondContact O-CB 3.43Å; E748-N752 VanDerWaalsContact O-CG 3.27Å; E748-N752 PolarHBondContact O-N 3.03Å; E748-N752 PolarHBondContact O-ND2 3.28Å; E748-N752 VanDerWaalsContact O-ND2 3.15Å; I750-N752 VanDerWaalsContact C-N 3.28Å; I750-N752 PolarHBondContact O-N 3.18Å
753R59.8Low64.3Low158 Ų15887.5 Ų87.560%0.59644%0.435SS*.Hα-helixtrans-91.9-30.9177.9-78.1178.3-177.5-138.65.1113.5L749 I750L749-R753 VanDerWaalsContact O-CB 3.26Å; L749-R753 WeakPolarHBondContact O-CB 3.48Å; L749-R753 WeakPolarHBondContact O-CG 3.48Å; L749-R753 PolarHBondContact O-N 3.07Å; L749-R753 VanDerWaalsContact O-N 3.09Å; I750-R753 PolarHBondContact O-N 3.12Å; I750-R753 VanDerWaalsContact O-N 3.13Å
754Y58.1Low64Low29 Ų2987.9 Ų87.911%0.11444%0.438CS..SBendtrans-103.7126-178.3-59.8-64.6000111.2K250 I750 R758K250-Y754 PolarHBondContact NZ-OH 2.92Å; I750-Y754 HydrophobicContact CG2-CD2 3.79Å; I750-Y754 HydrophobicContact CG2-CE2 4.02Å; I750-Y754 VanDerWaalsContact O-CD2 3.28Å; I750-Y754 WeakPolarHBondContact O-CD2 3.49Å; I750-Y754 PolarHBondContact O-N 3.04Å; Y754-R758 HydrophobicContact CD1-CG 4.09Å
755S59.6Low63.2Low68 Ų6883.5 Ų83.548%0.47643%0.425SS..  trans-60.5154.116752.60000110.4N757 R758 F759S755-N757 VanDerWaalsContact C-N 3.35Å; S755-N757 PolarHBondContact O-N 2.94Å; S755-N757 VanDerWaalsContact O-N 3.16Å; S755-R758 CarbonylContact O-C 3.6Å; S755-R758 WeakPolarHBondContact O-CA 3.33Å; S755-R758 WeakPolarHBondContact O-CB 3.46Å; S755-R758 PolarHBondContact O-N 3.24Å; S755-F759 PolarHBondContact O-N 3.34Å
756P62.1Low62.6Low97 Ų9780.4 Ų80.463%0.6341%0.413SS*.Hα-helixtrans-47.9-50-172.6-32.336.6000114.5R758 F759 E760P756-R758 VanDerWaalsContact C-N 3.27Å; P756-R758 PolarHBondContact O-N 3.25Å; P756-F759 CarbonylContact O-C 3.53Å; P756-F759 WeakPolarHBondContact O-CB 3.47Å; P756-F759 PolarHBondContact O-N 3.11Å; P756-F759 VanDerWaalsContact O-N 3.11Å; P756-E760 PolarHBondContact O-N 3.04Å
757N58.7Low61.7Low116 Ų11684.9 Ų84.962%0.6243%0.429SS*.Hα-helixtrans-62.2-30.3177.5-49.571.5000113.7S755 S761S755-N757 VanDerWaalsContact C-N 3.35Å; S755-N757 PolarHBondContact O-N 2.94Å; S755-N757 VanDerWaalsContact O-N 3.16Å; N757-S761 WeakPolarHBondContact O-CB 3.25Å; N757-S761 PolarHBondContact O-N 3.06Å; N757-S761 PolarHBondContact O-OG 3.27Å
758R59.6Low60.7Low133 Ų13384.2 Ų84.250%0.50243%0.431SS..Hα-helixtrans-82.7-26.1177.9-155.4174.4-165.5-154.77.3111.3Y754 S755 P756 W762Y754-R758 HydrophobicContact CD1-CG 4.09Å; S755-R758 CarbonylContact O-C 3.6Å; S755-R758 WeakPolarHBondContact O-CA 3.33Å; S755-R758 WeakPolarHBondContact O-CB 3.46Å; S755-R758 PolarHBondContact O-N 3.24Å; P756-R758 VanDerWaalsContact C-N 3.27Å; P756-R758 PolarHBondContact O-N 3.25Å; R758-W762 WeakPolarHBondContact O-CB 3.33Å; R758-W762 PolarHBondContact O-N 3.38Å; R758-W762 VanDerWaalsContact O-N 3.11Å
759F64.3Low59.3Low39 Ų3981.7 Ų81.717%0.17142%0.423CS..Hα-helixtrans-72.8-43.3168.6-179.2-106.1000111.2I750 R751 S755 P756 S761 W762 L763I750-F759 HydrophobicContact CG2-CD2 4Å; I750-F759 HydrophobicContact CG2-CE2 3.86Å; R751-F759 HydrophobicContact CG-CE2 4.32Å; R751-F759 HydrophobicContact CG-CZ 4.44Å; S755-F759 PolarHBondContact O-N 3.34Å; P756-F759 CarbonylContact O-C 3.53Å; P756-F759 WeakPolarHBondContact O-CB 3.47Å; P756-F759 PolarHBondContact O-N 3.11Å; P756-F759 VanDerWaalsContact O-N 3.11Å; F759-S761 VanDerWaalsContact C-N 3.33Å; F759-S761 PolarHBondContact O-N 2.99Å; F759-W762 HydrophobicContact CD2-CE3 4.04Å; F759-W762 HydrophobicContact CD2-CZ3 4.45Å; F759-W762 AromaticContact CE2-CE3 3.9Å; F759-W762 HydrophobicContact CE2-CE3 3.9Å; F759-W762 AromaticContact CE2-CZ3 3.87Å; F759-W762 HydrophobicContact CE2-CZ3 3.87Å; F759-W762 WeakPolarHBondContact O-CB 3.45Å; F759-W762 PolarHBondContact O-N 2.81Å; F759-W762 VanDerWaalsContact O-N 3.08Å; F759-L763 HydrophobicContact CD1-CD1 3.97Å; F759-L763 HydrophobicContact CE1-CD1 3.59Å; F759-L763 HydrophobicContact CE1-CG 4.24Å; F759-L763 HydrophobicContact CZ-CD1 4.09Å; F759-L763 HydrophobicContact CZ-CD2 4.42Å; F759-L763 HydrophobicContact CZ-CG 4.34Å; F759-L763 WeakPolarHBondContact O-CG 3.28Å; F759-L763 PolarHBondContact O-N 2.93Å
760E62.7Low58Low125 Ų12582.2 Ų82.258%0.58443%0.427SS*.Hα-helixtrans-58.2-43.7168.4-72.5173.9163.800111.5P756 W762 L763 A764P756-E760 PolarHBondContact O-N 3.04Å; E760-W762 PolarHBondContact O-N 3.03Å; E760-L763 PolarHBondContact O-N 3.21Å; E760-A764 WeakPolarHBondContact O-CB 3.28Å; E760-A764 PolarHBondContact O-N 3.17Å
761S63.7Low56.7Low81 Ų8187.8 Ų87.857%0.56646%0.456SS*.Hα-helixtrans-62.2-29174.8-58.70000113N757 F759 G765N757-S761 WeakPolarHBondContact O-CB 3.25Å; N757-S761 PolarHBondContact O-N 3.06Å; N757-S761 PolarHBondContact O-OG 3.27Å; F759-S761 VanDerWaalsContact C-N 3.33Å; F759-S761 PolarHBondContact O-N 2.99Å; S761-G765 PolarHBondContact O-N 3.43Å; S761-G765 VanDerWaalsContact O-N 3.12Å
762W65.1Low55.5Low52 Ų5289.7 Ų89.720%0.19747%0.468CS..Hα-helixtrans-79-38176.2178.581.3000111.6I750 R758 F759 E760 G765 L766I750-W762 HydrophobicContact CD1-CH2 4.06Å; I750-W762 HydrophobicContact CD1-CZ2 4.08Å; I750-W762 HydrophobicContact CG2-CE3 4.26Å; I750-W762 HydrophobicContact CG2-CH2 4.12Å; I750-W762 HydrophobicContact CG2-CZ2 4.43Å; I750-W762 HydrophobicContact CG2-CZ3 4.03Å; R758-W762 WeakPolarHBondContact O-CB 3.33Å; R758-W762 PolarHBondContact O-N 3.38Å; R758-W762 VanDerWaalsContact O-N 3.11Å; F759-W762 HydrophobicContact CD2-CE3 4.04Å; F759-W762 HydrophobicContact CD2-CZ3 4.45Å; F759-W762 AromaticContact CE2-CE3 3.9Å; F759-W762 HydrophobicContact CE2-CE3 3.9Å; F759-W762 AromaticContact CE2-CZ3 3.87Å; F759-W762 HydrophobicContact CE2-CZ3 3.87Å; F759-W762 WeakPolarHBondContact O-CB 3.45Å; F759-W762 PolarHBondContact O-N 2.81Å; F759-W762 VanDerWaalsContact O-N 3.08Å; E760-W762 PolarHBondContact O-N 3.03Å; W762-G765 WeakPolarHBondContact O-CA 3.35Å; W762-G765 PolarHBondContact O-N 2.95Å; W762-L766 HydrophobicContact CD2-CD1 4.26Å; W762-L766 HydrophobicContact CE3-CD1 4.04Å; W762-L766 HydrophobicContact CH2-CD1 3.86Å; W762-L766 HydrophobicContact CZ2-CD1 4.09Å; W762-L766 HydrophobicContact CZ3-CD1 3.84Å; W762-L766 PolarHBondContact O-N 3.4Å
763L58.4Low53.8Low71 Ų7190 Ų9037%0.37247%0.469SS..Hα-helixtrans-64.9-48.2171.8-70.2175.1000112.3F759 E760 G765 L766 E767F759-L763 HydrophobicContact CD1-CD1 3.97Å; F759-L763 HydrophobicContact CE1-CD1 3.59Å; F759-L763 HydrophobicContact CE1-CG 4.24Å; F759-L763 HydrophobicContact CZ-CD1 4.09Å; F759-L763 HydrophobicContact CZ-CD2 4.42Å; F759-L763 HydrophobicContact CZ-CG 4.34Å; F759-L763 WeakPolarHBondContact O-CG 3.28Å; F759-L763 PolarHBondContact O-N 2.93Å; E760-L763 PolarHBondContact O-N 3.21Å; L763-G765 PolarHBondContact O-N 3.15Å; L763-L766 HydrophobicContact CD2-CD1 4.28Å; L763-L766 WeakPolarHBondContact O-CA 3.17Å; L763-L766 WeakPolarHBondContact O-CB 3.41Å; L763-L766 PolarHBondContact O-N 3Å; L763-E767 PolarHBondContact O-N 2.91Å
764A59.9Low52.5Low45 Ų4585.9 Ų85.937%0.37248%0.475SS..Hα-helixtrans-60.9-30.4172.300000111.8E760 V768E760-A764 WeakPolarHBondContact O-CB 3.28Å; E760-A764 PolarHBondContact O-N 3.17Å; A764-V768 WeakPolarHBondContact O-CB 3.33Å; A764-V768 WeakPolarHBondContact O-CG2 3.49Å; A764-V768 PolarHBondContact O-N 3.49Å
765G54.1Low51.4Low29 Ų2993.2 Ų93.230%0.29951%0.511SS..Hα-helixtrans-62.4-39.7169.600000113.3S761 W762 L763 S769S761-G765 PolarHBondContact O-N 3.43Å; S761-G765 VanDerWaalsContact O-N 3.12Å; W762-G765 WeakPolarHBondContact O-CA 3.35Å; W762-G765 PolarHBondContact O-N 2.95Å; L763-G765 PolarHBondContact O-N 3.15Å; G765-S769 VanDerWaalsContact O-CB 3.25Å; G765-S769 WeakPolarHBondContact O-CB 3.47Å; G765-S769 PolarHBondContact O-N 3.34Å; G765-S769 PolarHBondContact O-OG 3.12Å
766L53.4Low50.1Low36 Ų3697.5 Ų97.519%0.18853%0.528CS..Hα-helixtrans-68.1-42.1175.5-73.2160.2000111.9A282 W762 L763 S769 N770A282-L766 HydrophobicContact CB-CD2 3.79Å; W762-L766 HydrophobicContact CD2-CD1 4.26Å; W762-L766 HydrophobicContact CE3-CD1 4.04Å; W762-L766 HydrophobicContact CH2-CD1 3.86Å; W762-L766 HydrophobicContact CZ2-CD1 4.09Å; W762-L766 HydrophobicContact CZ3-CD1 3.84Å; W762-L766 PolarHBondContact O-N 3.4Å; L763-L766 HydrophobicContact CD2-CD1 4.28Å; L763-L766 WeakPolarHBondContact O-CA 3.17Å; L763-L766 WeakPolarHBondContact O-CB 3.41Å; L763-L766 PolarHBondContact O-N 3Å; L766-S769 PolarHBondContact O-N 3.28Å; L766-N770 PolarHBondContact O-N 3.14Å; L766-N770 PolarHBondContact O-ND2 3.1Å; L766-N770 VanDerWaalsContact O-ND2 3.11Å
767E44.8Very low48.6Very low130 Ų130100.3 Ų100.361%0.60754%0.538SS*.Hα-helixtrans-60.1-51.5175.4-69.2169.6178.600111.4L763 S769 N770 L771L763-E767 PolarHBondContact O-N 2.91Å; E767-S769 VanDerWaalsContact C-N 3.3Å; E767-S769 PolarHBondContact O-N 3.24Å; E767-N770 PolarHBondContact O-N 3.23Å; E767-L771 PolarHBondContact O-N 2.95Å; E767-L771 VanDerWaalsContact O-N 3.07Å
768V45.2Very low47.4Very low83 Ų83101.1 Ų101.150%0.50354%0.542SS..Hα-helixtrans-65.4-31.61781740000112.3A764 K772A764-V768 WeakPolarHBondContact O-CB 3.33Å; A764-V768 WeakPolarHBondContact O-CG2 3.49Å; A764-V768 PolarHBondContact O-N 3.49Å; V768-K772 PolarHBondContact O-N 3.42Å
769S41Very low46.1Very low39 Ų39102.3 Ų102.327%0.27356%0.559SS.*Hα-helixtrans-68.4-40.3175.9-63.30000112.3G765 L766 E767 K772G765-S769 VanDerWaalsContact O-CB 3.25Å; G765-S769 WeakPolarHBondContact O-CB 3.47Å; G765-S769 PolarHBondContact O-N 3.34Å; G765-S769 PolarHBondContact O-OG 3.12Å; L766-S769 PolarHBondContact O-N 3.28Å; E767-S769 VanDerWaalsContact C-N 3.3Å; E767-S769 PolarHBondContact O-N 3.24Å; S769-K772 PolarHBondContact O-N 3.45Å
770N40.6Very low44.7Very low106 Ų106107.3 Ų107.357%0.56759%0.587SS**Hα-helixtrans-70-36.5177-70.6-37.9000111.8L766 E767 K772L766-N770 PolarHBondContact O-N 3.14Å; L766-N770 PolarHBondContact O-ND2 3.1Å; L766-N770 VanDerWaalsContact O-ND2 3.11Å; E767-N770 PolarHBondContact O-N 3.23Å; N770-K772 PolarHBondContact O-N 3.36Å
771L41Very low43.4Very low145 Ų145107.8 Ų107.876%0.75959%0.594SS**Hα-helixtrans-64.8-21.3173.6-88.7159.4000114.1E767E767-L771 PolarHBondContact O-N 2.95Å; E767-L771 VanDerWaalsContact O-N 3.07Å
772K41.6Very low41.9Very low180 Ų180109.9 Ų109.978%0.78360%0.599SS**THydrogen-bonded Turntrans-1008.8-177.6-95.6-166.4168.5-163.10115.9V768 S769 N770V768-K772 PolarHBondContact O-N 3.42Å; S769-K772 PolarHBondContact O-N 3.45Å; N770-K772 PolarHBondContact O-N 3.36Å
773L36.5Very low40.4Very low129 Ų129114 Ų11468%0.67562%0.624SS**SBendtrans-109.314.4-176.5-106.3154.1000113.9
774G33Very low39.2Very low70 Ų70118 Ų11872%0.72265%0.646SS**SBendtrans-121.9-24.6-17800000117
775E34.6Very low37.9Very low184 Ų184123.2 Ų123.286%0.8667%0.667SS**  trans-133.288.9-171.4-65.7-168.914900112.6
776D31.3Very low36.9Very low158 Ų158128.7 Ų128.785%0.84569%0.694SS**  trans-165.381.4158.5-114.6-26.9000110.2
777N31.3Very low35.8Very low155 Ų155133.1 Ų133.183%0.82972%0.718SS**  trans-177.5151.5146-96.4-42.1000112.7
778D33.6Very low35.3Very low133 Ų133135 Ų13571%0.71173%0.732SS**  trans51.288.9161.8-61.3-29.9000118.9
779N32.8Very low34.6Very low159 Ų159136 Ų13685%0.8574%0.738SS**  -160.6119.194.1-103.8-74.6000113.4
780N34.1Very low34.1Very low144 Ų144141 Ų14177%0.7776%0.762SS**  trans-72.5129160.8-85.7-72000109.6
781N34.6Very low34Very low135 Ų135145.4 Ų145.472%0.72278%0.776SS**  -174.6118.6127.9-96.9-48.5000114.3
782N33.3Very low33.6Very low125 Ų125146.9 Ų146.967%0.66878%0.779SS**  trans70.2117.9134.8-60.1-26.4000122.5
783N33.8Very low33.2Very low137 Ų137146 Ų14673%0.73378%0.782SS**  trans79.197.3135.2-56.3-16.2000120
784N33.7Very low33Very low155 Ų155147.4 Ų147.483%0.82979%0.789SS**  170.791.8122.9-83.1-30.2000108.4
785L30.8Very low33Very low156 Ų156149.6 Ų149.682%0.81779%0.788SS**  6080.274.9-166.878.6000114.9
786V34.5Very low33Very low143 Ų143150.4 Ų150.487%0.86779%0.789SS**  trans-142113.5147.1-179.60000109.4
787D29.5Very low33Very low130 Ų130151.7 Ų151.770%0.69579%0.787SS**  trans-73.7148.6163.8-94.7-59.8000111
788L33.5Very low33.2Very low169 Ų169152.1 Ų152.189%0.88579%0.789SS**  179.8160.3117.2-97.7158.5000113.9
789T31.3Very low33.2Very low105 Ų105153.6 Ų153.664%0.64479%0.792SS**  trans-120.3164.3-166.861.60000114.2
790N31.4Very low33.2Very low143 Ų143152.4 Ų152.477%0.76579%0.785SS**  trans68.3114.3151.1-68.4-53000121.4
791K37.2Very low33.1Very low199 Ų199152.2 Ų152.287%0.86579%0.785SS**  trans-164.8108142.1-99.2154.1-173.8174.30107.1
792Q33.5Very low32.8Very low175 Ų175153.5 Ų153.582%0.81879%0.792SS**  80.6140.371.2-75.2-165.61.200115.6
793L33.5Very low32.7Very low162 Ų162152.3 Ų152.385%0.84880%0.799SS**  trans75.1111.4-168.6-70.282.5000114.5
794L30.8Very low32.3Very low158 Ų158156.9 Ų156.983%0.82781%0.807SS**  cis78115.520.1-155.891.8000115.7
795V33.8Very low32.2Very low116 Ų116156.5 Ų156.570%0.70381%0.805SS**  169.9130.4126.6151.60000114.5
796K34.1Very low32.1Very low201 Ų201153.2 Ų153.287%0.87480%0.796SS**  trans67.6120.1159.2-78.7165.8-173.4173.80122.7
797K32.5Very low31.9Very low185 Ų185153.3 Ų153.380%0.80480%0.801SS**  trans-71.3156.6155.8-60.1169.1175.5173.40111.8
798N33.9Very low32Very low164 Ų164151.6 Ų151.688%0.87780%0.799SS**  -161172.8126.1-107.9-8.4000111.9
799Q34.9Very low32Very low164 Ų164150.4 Ų150.477%0.76679%0.793SS**  trans-105.1164-158.3-55.5171.8-73.300115.2
800N32.4Very low32.1Very low134 Ų134153 Ų15372%0.71780%0.796SS**  trans100.5126.3152.9-56.5-28.3000119.6
801N32.5Very low32.2Very low141 Ų141152.9 Ų152.975%0.75479%0.792SS**  trans7595.2147.3-58.1-7.9000120.5
802N28.7Very low32.1Very low162 Ų162150 Ų15087%0.86679%0.786SS**  41.3102.3127.5-5612.3000119.8
803A29.9Very low32.1Very low100 Ų100149.2 Ų149.283%0.82679%0.788SS**  trans-151.9156.6132.800000109.7
804Y26.5Very low32.1Very low232 Ų232150 Ų15091%0.9179%0.792SS**  trans-68.3142.8167.3-79.4-118.5000109.6
805D30.7Very low32.4Very low147 Ų147150.4 Ų150.479%0.78680%0.795SS**  -160.7166.7116.3-132.4-53.9000113.1
806S28.6Very low32.5Very low87 Ų87147.5 Ų147.561%0.60879%0.788SS**  trans-23.4143.3171.436.90000120
807C30.5Very low32.6Very low145 Ų145147 Ų14798%0.9879%0.786SS**  trans-95.3101.6159.1-77.40000110
808S31.4Very low32.7Very low94 Ų94145.2 Ų145.266%0.65779%0.785SS**  trans-139102.4172.943.60000110.4
809L33Very low32.7Very low144 Ų144146.8 Ų146.875%0.75479%0.787SS**  trans-153.4135.5176.5-66.1178.3000105.6
810F34Very low32.7Very low160 Ų160148.1 Ų148.170%0.70279%0.791SS**  cis-148.9170.913.8-91.7-59.8000108.1
811M33.9Very low32.7Very low140 Ų140152.8 Ų152.869%0.6980%0.798SS**  cis-156.9174.78.5-132.5-34.7178.800110.8
812N34.3Very low32.7Very low139 Ų139151.9 Ų151.974%0.74380%0.798SS**  trans75.287.9158.6-57-19.6000118.8
813D33.6Very low32.8Very low159 Ų159149.1 Ų149.185%0.8579%0.79SS**  trans-58.8149.8144-52.1-83000111.3
814L34.9Very low33.1Very low177 Ų177151.7 Ų151.793%0.92779%0.785SS**  -168.1129.4126.1-105.6166.9000111.2
815D36.1Very low33.4Very low167 Ų167146.6 Ų146.689%0.89377%0.774SS**  trans-95.2146-177178.725000111.9
816G34.9Very low33.7Very low55 Ų55146 Ų14657%0.56777%0.771SS**  trans130.6102.3157.500000119.3
817K37.3Very low34Very low191 Ų191148 Ų14883%0.8377%0.774SS**  trans74.7129.6139.4-58.9177.9-179.7176.50121.8
818D33.7Very low34.2Very low147 Ų147148.2 Ų148.279%0.78677%0.766SS**  25.7112.3128.5-47.3-47.1000119.5
819E35.6Very low34.3Very low197 Ų197152.1 Ų152.192%0.92178%0.778SS**  -170.7172.799.1-105.1-165.6170.100113.4
820K33.6Very low34Very low192 Ų192150.8 Ų150.884%0.83578%0.781SS**  trans-97.2135.9-174.8-59.8167179.4171.60112.6
821R33.9Very low33.9Very low232 Ų232148.7 Ų148.788%0.87578%0.784SS**  trans178.7109.1143.2-95.5145.1-162.5-149.96.6109.3
822T31.1Very low33.7Very low122 Ų122149.9 Ų149.975%0.74879%0.792SS**  70.2125.981.160.80000116
823C31.3Very low33.6Very low105 Ų105152.1 Ų152.171%0.70980%0.798SS**  trans81.6101156-64.70000119.9
824Q35.7Very low33.5Very low154 Ų154152.3 Ų152.372%0.7280%0.799SS**  78.6115.1115.8-73.8-176.6-99.900121.8
825D33.5Very low33.2Very low124 Ų124148.5 Ų148.566%0.66379%0.787SS**  81.6150.6122.7-51-15000121.6
826D37.6Very low32.9Very low135 Ų135148.8 Ų148.872%0.72278%0.783SS**  trans77.179.8163.4-65-28.2000122.3
827N34.8Very low32.8Very low129 Ų129155 Ų15569%0.6980%0.797SS**  89.1148.4118.2-56.3-40.1000123.2
828D33.1Very low32.6Very low150 Ų150149 Ų14980%0.80278%0.777SS**  trans60.778152.9-58.9-15.7000120.8
829L34Very low32.6Very low175 Ų175148.2 Ų148.292%0.91677%0.772SS**  trans-153.4119.7144.6-103.9139.6000110.8
830S27.9Very low32.5Very low117 Ų117146.6 Ų146.682%0.81877%0.769SS**  trans-92135.1176.5-50.20000111.7
831P30.6Very low32.6Very low116 Ų116143.4 Ų143.475%0.75376%0.762SS**  -116.4150.7114.4-2.723.3000109.7
832L29.9Very low32.6Very low165 Ų165138.8 Ų138.886%0.86475%0.748SS**  70.467.750.2-16579000113.3
833E31.8Very low32.8Very low186 Ų186141.4 Ų141.487%0.86974%0.744SS**  trans-162.6172.7158.3-112.8154.8-161.800109.8
834D31.3Very low33Very low163 Ų163143.7 Ų143.787%0.87275%0.749SS**  trans5683175.9-65.6-15.5000119.2
835S29.6Very low33.1Very low96 Ų96142 Ų14267%0.67175%0.745SS**  trans-13724.1168.8670000116
836H28.9Very low33Very low173 Ų173143.5 Ų143.580%0.80174%0.743SS**  trans-131.232.6-170.1-75.7-61.9000118.1
837E33.3Very low32.7Very low185 Ų185144.1 Ų144.186%0.86474%0.742SS**  trans-107.640.7166.7-67-153.8123.200118.5
838P33.3Very low32.5Very low65 Ų65141.9 Ų141.942%0.42274%0.741SS.*  trans-76.6-35175.8-14.429.9000115.1L840 N841 F842P838-L840 PolarHBondContact O-N 3.03Å; P838-N841 PolarHBondContact O-N 3.34Å; P838-F842 HydrophobicContact CB-CD2 4.49Å; P838-F842 HydrophobicContact CB-CE2 4.23Å; P838-F842 VanDerWaalsContact O-CD2 3.27Å; P838-F842 WeakPolarHBondContact O-CD2 3.29Å
839L33.9Very low32.2Very low131 Ų131140 Ų14069%0.68674%0.739SS**THydrogen-bonded Turntrans-72.5-28.8-149.7-83.9165.8000116.4
840L33.3Very low31.9Very low163 Ų163138.1 Ų138.185%0.85373%0.73SS**THydrogen-bonded Turntrans-74.2-29178.9-9771.6000113.3P838P838-L840 PolarHBondContact O-N 3.03Å
841N35.4Very low31.9Very low126 Ų126139.3 Ų139.367%0.67472%0.717SS**THydrogen-bonded Turntrans-87.6-17.9-169.7-71.4-42.7000114.3P838P838-N841 PolarHBondContact O-N 3.34Å
842F34.8Very low31.8Very low135 Ų135139.2 Ų139.259%0.59272%0.719SS**SBendtrans-81.1-17.1-174.4-85.7-113.1000114.6P838P838-F842 HydrophobicContact CB-CD2 4.49Å; P838-F842 HydrophobicContact CB-CE2 4.23Å; P838-F842 VanDerWaalsContact O-CD2 3.27Å; P838-F842 WeakPolarHBondContact O-CD2 3.29Å
843W35.5Very low31.7Very low176 Ų176138 Ų13867%0.66771%0.714SS**SBendtrans-76-24.4-175.7-81.270.7000114.1
844D34.8Very low31.7Very low153 Ų153135.1 Ų135.182%0.81871%0.714SS**SBendtrans-84.8-27.3-174.1-101.5-10.1000114.5
845D37.2Very low31.6Very low119 Ų119132.4 Ų132.464%0.63671%0.708SS**THydrogen-bonded Turntrans-87.3-8.1-176.8-100.6-32.9000114.3Q847 K1059D845-Q847 VanDerWaalsContact C-N 3.31Å; D845-Q847 PolarHBondContact O-N 3.43Å; D845-K1059 IonicContact OD1-NZ 3.31Å; D845-K1059 PolarHBondContact OD1-NZ 2.96Å; D845-K1059 IonicContact OD2-NZ 3.33Å
846Y32.9Very low31.8Very low156 Ų156136.1 Ų136.161%0.61272%0.72SS**THydrogen-bonded Turntrans-79.25.8-178.4-103-88.9000115.9M214M214-Y846 HydrophobicContact CE-CE2 4.13Å; M214-Y846 PolarHBondContact SD-OH 3Å
847Q30.9Very low32Very low148 Ų148132.5 Ų132.569%0.69271%0.714SS**  trans-107.853.5-175.9-71.8-159.915.900116.6D845 R1052D845-Q847 VanDerWaalsContact C-N 3.31Å; D845-Q847 PolarHBondContact O-N 3.43Å; Q847-R1052 VanDerWaalsContact OE1-NH2 3.07Å
848A29.6Very low31.9Very low82 Ų82132.2 Ų132.268%0.67871%0.713SS**  trans-160.8148156.900000110
849S27.4Very low31.7Very low110 Ų110133.5 Ų133.577%0.76973%0.729SS**  cis-152149.79.9-50.90000110.5
850L27.4Very low31.6Very low136 Ų136138.6 Ų138.671%0.71274%0.741SS**  trans-175.9168.7141-105165.7000111.3
851Y28.4Very low31.3Very low141 Ų141139.5 Ų139.555%0.55374%0.741SS**  trans58.8105.2176.9-55.2-73000117.9T311T311-Y851 HydrophobicContact CG2-CE1 4.26Å; T311-Y851 PolarHBondContact OG1-OH 3.2Å
852S28.2Very low31.1Very low115 Ų115138.8 Ų138.880%0.80474%0.743SS**  trans-135.9118.7157.7-75.50000109.7
853N27.3Very low30.9Very low140 Ų140138.3 Ų138.375%0.74975%0.754SS**  trans51.2109.7162.7-53.7-24000119
854S32.4Very low30.5Very low125 Ų125135.8 Ų135.887%0.87476%0.763SS**  -132171.1114.874.70000108.8
855S29Very low30.2Very low105 Ų105136 Ų13673%0.73476%0.76SS**  trans-157.9110.7-179.857.20000111
856D34.9Very low30Very low174 Ų174141 Ų14193%0.9377%0.772SS**  trans-149.2176.8162.8-98.3-47.1000109.9
857S31.9Very low29.8Very low97 Ų97138.3 Ų138.368%0.67878%0.782SS**  trans-126.9162-148.167.70000117
858Q31.9Very low30.1Very low180 Ų180140.2 Ų140.284%0.84179%0.791SS**  trans85.398.2164-60.5-175-33.200118.1
859A29.1Very low30.2Very low92 Ų92145.4 Ų145.476%0.7680%0.801SS**  38124.2129.700000120.7
860Y32Very low30.5Very low238 Ų238148.3 Ų148.393%0.93380%0.8SS**  -155.7157.9100.4-114-84.8000109.8
861E27.2Very low31.2Very low181 Ų181145.6 Ų145.685%0.84679%0.791SS**  trans-106.1124.1-178.6-173.7173.1-128.800110.2
862P30Very low31.9Very low111 Ų111145.8 Ų145.872%0.72179%0.791SS**  trans-86.5154.5174.434-32.8000112
863P31.7Very low32.3Very low126 Ų126147.5 Ų147.582%0.81879%0.791SS**  trans-81.1155.8-160.3-14.431.6000115.3M865P863-M865 PolarHBondContact O-N 3.36Å
864S26.6Very low32.9Very low123 Ų123148 Ų14886%0.8679%0.793SS**  trans-73.7109.9171.244.50000112.6
865M27.6Very low33Very low156 Ų156147.2 Ų147.277%0.76878%0.783SS**  trans-140.7116.4153.5-70.6-160-51.800109.6P863P863-M865 PolarHBondContact O-N 3.36Å
866Y33.7Very low33Very low225 Ų225144.4 Ų144.488%0.88277%0.771SS**  trans167.894.3132.7-92.1-63.3000107.5
867A29.7Very low32.8Very low99 Ų99140.9 Ų140.982%0.81876%0.76SS**  trans-91.2134.7161.200000107.6
868E36Very low32.7Very low188 Ų188139.8 Ų139.888%0.87975%0.751SS**  trans-147.1124.7159.2-155160.3-137.100108F870E868-F870 PolarHBondContact O-N 2.73Å
869E31.6Very low32.8Very low191 Ų191139 Ų13989%0.89375%0.745SS**  trans-83.9109.4-169.9-64.9170.9126.400109.5
870F34.7Very low33.2Very low171 Ų171141.1 Ų141.175%0.7574%0.737SS**  trans-96.1114.3173.7-133-85.6000110E868 W872E868-F870 PolarHBondContact O-N 2.73Å; F870-W872 PolarHBondContact O-N 2.94Å; F870-W872 VanDerWaalsContact O-N 3.13Å
871P42.2Very low33.4Very low80 Ų80133.9 Ų133.952%0.51972%0.718SS.*  trans-71.9108.2-177.628.3-33.4000110.2D873P871-D873 VanDerWaalsContact C-N 3.3Å
872W41.7Very low33.8Very low144 Ų144128.7 Ų128.755%0.54570%0.696SS.*  trans-84.1-6.1176.7-76.592.7000113.5F870 V875F870-W872 PolarHBondContact O-N 2.94Å; F870-W872 VanDerWaalsContact O-N 3.13Å; W872-V875 HydrophobicContact CE3-CG2 4.02Å; W872-V875 HydrophobicContact CZ3-CG2 4.5Å; W872-V875 PolarHBondContact O-N 3.36Å
873D37.2Very low34.2Very low152 Ų152127.4 Ų127.481%0.81368%0.682SS**G310 helixtrans-74.3-26.8-175.7-58.7-47.4000112.6P871 V875 G876P871-D873 VanDerWaalsContact C-N 3.3Å; D873-V875 PolarHBondContact O-N 2.75Å; D873-G876 PolarHBondContact O-N 2.95Å
874D39.4Very low34.5Very low149 Ų149127.5 Ų127.580%0.79767%0.672SS**G310 helixtrans-73.10.6172.8-83.2-25000114
875V36Very low35.1Very low109 Ų109130.2 Ų130.266%0.66166%0.663SS**G310 helixtrans-99.813.3176.8-152.40000112.1W872 D873W872-V875 HydrophobicContact CE3-CG2 4.02Å; W872-V875 HydrophobicContact CZ3-CG2 4.5Å; W872-V875 PolarHBondContact O-N 3.36Å; D873-V875 PolarHBondContact O-N 2.75Å
876G27.6Very low35.6Very low46 Ų46129.9 Ų129.947%0.47466%0.66SS.*  trans-82.2143.616800000112.9D873D873-G876 PolarHBondContact O-N 2.95Å
877S31.3Very low36Very low100 Ų100125.2 Ų125.270%0.69965%0.649SS**  trans35.1102.8164.154.90000117.8
878P29.8Very low36.5Very low75 Ų75126.9 Ų126.949%0.48764%0.644SS.*SBend-120.5-35.3102.2-8.526.9000115.1F880 T881P878-F880 VanDerWaalsContact C-N 3.27Å; P878-F880 PolarHBondContact O-N 3.46Å; P878-T881 PolarHBondContact O-N 2.89Å; P878-T881 VanDerWaalsContact O-N 3.12Å; P878-T881 PolarHBondContact O-OG1 2.96Å
879F33.8Very low36.3Very low163 Ų163121.2 Ų121.272%0.71563%0.626SS**Hα-helixtrans-60.8-23.5-161.5-73.2-77000116.6
880F36.8Very low36.2Very low137 Ų137116.8 Ų116.860%0.60161%0.613SS**Hα-helixtrans-82.9-33179.3-74.5-80.2000113.3P878 D882 E884P878-F880 VanDerWaalsContact C-N 3.27Å; P878-F880 PolarHBondContact O-N 3.46Å; F880-D882 VanDerWaalsContact C-N 3.3Å; F880-D882 PolarHBondContact O-N 3.1Å; F880-E884 PolarHBondContact O-N 3.43Å
881T36.8Very low36.1Very low86 Ų86115.2 Ų115.253%0.52862%0.62SS.*Hα-helixtrans-67.6-30.5173.726.70000112.5P878 R885P878-T881 PolarHBondContact O-N 2.89Å; P878-T881 VanDerWaalsContact O-N 3.12Å; P878-T881 PolarHBondContact O-OG1 2.96Å; T881-R885 WeakPolarHBondContact O-CB 3.4Å; T881-R885 PolarHBondContact O-N 2.69Å; T881-R885 VanDerWaalsContact O-N 3.15Å
882D36.4Very low35.4Very low72 Ų72118.3 Ų118.339%0.38563%0.632SS.*Hα-helixtrans-74.6-37.4-179.9-66.8-38000112.4F880 E884 R885 E886F880-D882 VanDerWaalsContact C-N 3.3Å; F880-D882 PolarHBondContact O-N 3.1Å; D882-E884 PolarHBondContact O-N 2.98Å; D882-R885 CarbonylContact O-C 3.44Å; D882-R885 WeakPolarHBondContact O-CA 3.46Å; D882-R885 WeakPolarHBondContact O-CB 3.25Å; D882-R885 PolarHBondContact O-N 3.46Å; D882-E886 PolarHBondContact O-N 3.1Å
883I37.6Very low34.9Very low83 Ų83122.8 Ų122.843%0.42665%0.65SS.*Hα-helixtrans-64.4-41.3176-65.2169.9000111.2R885 E886 L887I883-R885 PolarHBondContact O-N 2.83Å; I883-E886 PolarHBondContact O-N 3.47Å; I883-L887 HydrophobicContact CG2-CD1 3.86Å; I883-L887 HydrophobicContact CG2-CG 4.42Å; I883-L887 WeakPolarHBondContact O-CB 3.21Å; I883-L887 WeakPolarHBondContact O-CG 3.42Å; I883-L887 PolarHBondContact O-N 2.93Å
884E37.3Very low34.4Very low129 Ų129120.5 Ų120.560%0.60365%0.646SS**Hα-helixtrans-68-25.6173.4-67.4-165.6154.400112.5F880 D882 N888F880-E884 PolarHBondContact O-N 3.43Å; D882-E884 PolarHBondContact O-N 2.98Å; E884-N888 WeakPolarHBondContact O-CB 3.34Å; E884-N888 PolarHBondContact O-N 2.91Å; E884-N888 PolarHBondContact O-ND2 3.42Å
885R39Very low34.2Very low179 Ų179120.7 Ų120.768%0.67564%0.642SS**Hα-helixtrans-78.9-38.3176.3-156.1177.6-143.9155.85.7112.5T881 D882 I883 S889T881-R885 WeakPolarHBondContact O-CB 3.4Å; T881-R885 PolarHBondContact O-N 2.69Å; T881-R885 VanDerWaalsContact O-N 3.15Å; D882-R885 CarbonylContact O-C 3.44Å; D882-R885 WeakPolarHBondContact O-CA 3.46Å; D882-R885 WeakPolarHBondContact O-CB 3.25Å; D882-R885 PolarHBondContact O-N 3.46Å; I883-R885 PolarHBondContact O-N 2.83Å; R885-S889 PolarHBondContact O-N 3.46Å; R885-S889 PolarHBondContact O-OG 2.77Å
886E38.5Very low34.1Very low150 Ų150123.3 Ų123.370%0.70164%0.644SS**Hα-helixtrans-69.3-43.6173.8-71.7-169.1142.400111.3D882 I883 N888 S889D882-E886 PolarHBondContact O-N 3.1Å; I883-E886 PolarHBondContact O-N 3.47Å; E886-N888 VanDerWaalsContact C-N 3.34Å; E886-N888 PolarHBondContact O-N 3.05Å; E886-S889 WeakPolarHBondContact O-CB 3.4Å; E886-S889 PolarHBondContact O-N 3.26Å; E886-S889 VanDerWaalsContact O-N 3.12Å
887L43.1Very low34.4Very low126 Ų126127.9 Ų127.966%0.6665%0.653SS**Hα-helixtrans-70.4-25.3178.7-70.7174.2000114.1I883I883-L887 HydrophobicContact CG2-CD1 3.86Å; I883-L887 HydrophobicContact CG2-CG 4.42Å; I883-L887 WeakPolarHBondContact O-CB 3.21Å; I883-L887 WeakPolarHBondContact O-CG 3.42Å; I883-L887 PolarHBondContact O-N 2.93Å
888N40.5Very low34.4Very low134 Ų134128.5 Ų128.572%0.71766%0.655SS**THydrogen-bonded Turntrans-90.93.7171.5-71.9-65.4000113.5E884 E886E884-N888 WeakPolarHBondContact O-CB 3.34Å; E884-N888 PolarHBondContact O-N 2.91Å; E884-N888 PolarHBondContact O-ND2 3.42Å; E886-N888 VanDerWaalsContact C-N 3.34Å; E886-N888 PolarHBondContact O-N 3.05Å
889S30.7Very low34.7Very low70 Ų70132.2 Ų132.249%0.4966%0.663SS.*SBendtrans-81.5126.2173.4-69.60000110.6R885 E886R885-S889 PolarHBondContact O-N 3.46Å; R885-S889 PolarHBondContact O-OG 2.77Å; E886-S889 WeakPolarHBondContact O-CB 3.4Å; E886-S889 PolarHBondContact O-N 3.26Å; E886-S889 VanDerWaalsContact O-N 3.12Å
890P29.7Very low34.8Very low97 Ų97132.5 Ų132.563%0.6366%0.664SS**  trans-65.7139.3177.927.2-34000110.5L892P890-L892 PolarHBondContact O-N 2.93Å
891P32.2Very low34.5Very low138 Ų138134.3 Ų134.390%0.89667%0.672SS**  trans-71.685.5-170.427.8-35.7000112.7
892L28Very low34.5Very low146 Ų146137.9 Ų137.976%0.76469%0.685SS**  trans-100.474178.8-89.7170.4000112.1P890P890-L892 PolarHBondContact O-N 2.93Å
893Y31.8Very low34.4Very low238 Ų238142.7 Ų142.793%0.93370%0.702SS**  trans-142.199.7149.5-101-67.9000112.6
894S26.3Very low34.2Very low103 Ų103143.5 Ų143.572%0.7272%0.715SS**  trans-82.8134.4169.762.50000111.2
895H34.2Very low34Very low153 Ų153144.1 Ų144.171%0.70872%0.723SS**  trans-151.7121.9148.7-11017.6000113.3
896K35.8Very low33.7Very low164 Ų164140.2 Ų140.271%0.71372%0.723SS**  trans51.7130.9145.1-62.1156.2-178.9159.40117.7
897E32.4Very low33.4Very low142 Ų142138.3 Ų138.366%0.66473%0.726SS**  cis-157142.321.1-144.5-176-122.200112.3K899E897-K899 IonicContact OE2-NZ 3.8Å; E897-K899 PolarHBondContact OE2-NZ 3.38Å
898P32.5Very low33.1Very low114 Ų114137 Ų13774%0.7473%0.728SS**  trans-93.9150.6-178.735.8-35.4000113.6
899K35.8Very low32.8Very low152 Ų152137.6 Ų137.666%0.66173%0.729SS**  trans-158.5122.3160.6-92.5118.6-175.3179.70112.8E897E897-K899 IonicContact OE2-NZ 3.8Å; E897-K899 PolarHBondContact OE2-NZ 3.38Å
900K35.2Very low33.1Very low170 Ų170141 Ų14174%0.73974%0.741SS**  trans66.6147.2153-56.7163.2-175.1174.30114.9
901F31.6Very low33.4Very low175 Ų175143.7 Ų143.777%0.76875%0.745SS**  cis-157.4163.3-6.5-100.1-30.8000106.6
902M35.8Very low33.6Very low161 Ų161145.6 Ų145.679%0.79374%0.742SS**  cis-148.9-1697.4-145.5173.2169.200111.6
903K33.7Very low33.8Very low172 Ų172145.4 Ų145.475%0.74874%0.742SS**  trans-66.9158.9172.1-65.1169.2178.7178.50111.2
904S34Very low33.9Very low100 Ų100141 Ų14170%0.69973%0.734SS**  -166.2139.658.6-57.20000115.3
905N33.3Very low34Very low143 Ų143141 Ų14177%0.76573%0.733SS**  44.2144.9124.4-43.6-7.6000119.6
906S33.5Very low34Very low97 Ų97138.4 Ų138.468%0.67873%0.732SS**  cis-162.7152.827.851.90000114.6
907S32.6Very low33.9Very low109 Ų109138.8 Ų138.876%0.76273%0.733SS**  trans60.9139.9147.353.30000119.9
908S35.2Very low34Very low100 Ų100138 Ų13870%0.69973%0.734SS**  cis-158.7140.19.937.20000114
909I35.6Very low34.1Very low145 Ų145141.6 Ų141.674%0.74474%0.741SS**  24.9137.2127.2-8.2160.9000116.8
910I36.8Very low34Very low142 Ų142137.5 Ų137.573%0.72874%0.741SS**  cis-153.5127.845.9-63.8175.9000107
911E35.7Very low34Very low154 Ų154137.8 Ų137.872%0.7275%0.745SS**  55.111092.7-89.5157.1-153.500113.1
912E35.1Very low34.3Very low178 Ų178135.1 Ų135.183%0.83274%0.739SS**  83.9160.592.1-79.2-150.6143.400115.4
913N33Very low34.4Very low142 Ų142132.4 Ų132.476%0.75973%0.732SS**  trans-50.6149.9-175.4-50-63.4000112.1
914D33.7Very low34.6Very low145 Ų145130.3 Ų130.378%0.77573%0.729SS**  -171.5172.160.5-143.4-35.1000113.9
915C28.2Very low34.7Very low102 Ų102131.5 Ų131.569%0.68973%0.727SS**  trans45.9102.3149.9-80.10000121
916S34.6Very low34.8Very low99 Ų99131.1 Ų131.169%0.69272%0.724SS**  134.4153.294.373.80000118.6
917K33.4Very low34.8Very low172 Ų172133 Ų13375%0.74873%0.726SS**  trans74101.8150-75.2165.8-178.2169.60121.5
918N35Very low34.5Very low126 Ų126132.5 Ų132.567%0.67472%0.722SS**  84.8128.4114.7-67.18.3000121.5
919Q35.3Very low34.2Very low190 Ų190133.7 Ų133.789%0.88873%0.725SS**  trans69.9124.9144.1-67.7166.1-21.200117.9
920G32.5Very low33.8Very low65 Ų65131.8 Ų131.867%0.6773%0.725SS**  cis164.4-180-5.700000112.8
921Q35.6Very low33.5Very low176 Ų176130.7 Ų130.782%0.82273%0.725SS**  trans66.7143.2171.6-63.2-174.8-106.800115.3
922D37.4Very low33.1Very low120 Ų120128.7 Ų128.764%0.64273%0.728SS**  cis-159158-7.4-96.4-21000105.5
923T39.2Very low33Very low103 Ų103123.5 Ų123.563%0.63272%0.722SS**  cis-165.61469.124.60000108.4
924N37.2Very low32.8Very low128 Ų128123.9 Ų123.968%0.68472%0.724SS**  trans61.2159.8140.6-64.549.6000118.7
925D36.7Very low32.8Very low125 Ų125125.7 Ų125.767%0.66873%0.725SS**  cis-167.9158.1-8.3-106.1-7.7000107.4
926I34.6Very low33.1Very low136 Ų136126.8 Ų126.870%0.69772%0.724SS**  cis-155-162.7-3.1-138.3173.8000111.5
927L33.9Very low32.9Very low136 Ų136132.7 Ų132.771%0.71273%0.731SS**  trans-23.5144.9171.6-53.6168.9000119.2
928S26.6Very low32.9Very low99 Ų99134 Ų13469%0.69274%0.737SS**  cis89.3133.628.1-60.60000118.4
929T28.2Very low32.8Very low124 Ų124132.7 Ų132.776%0.76174%0.738SS**  trans73.9125.4146.746.70000123.6
930S26.8Very low32.6Very low105 Ų105129 Ų12973%0.73473%0.732SS**  trans77.4156137.7-58.30000118.7
931T30Very low32.6Very low120 Ų120133.8 Ų133.874%0.73674%0.742SS**  cis-155.3148.18-13.90000113.6
932S27.9Very low32.3Very low111 Ų111133.3 Ų133.378%0.77675%0.745SS**  trans22.4133.1145.564.60000124
933G33.2Very low32Very low69 Ų69131.7 Ų131.771%0.71175%0.748SS**  trans159.693.4151.800000112.6
934L29.5Very low31.4Very low151 Ų151132.1 Ų132.179%0.79176%0.756SS**  81.5138.477.9-78.4171.1000115.1
935F33.3Very low31.1Very low182 Ų182134.5 Ų134.580%0.79876%0.76SS**  trans72.8139.9-176.5-50.5-75000115.2
936N34.4Very low30.7Very low126 Ų126137 Ų13767%0.67477%0.768SS**  cis-152.5147.6-5.1-130.8-24.3000114.6
937R31.4Very low30.6Very low223 Ų223137.1 Ų137.184%0.84277%0.768SS**  trans-28.4135.4170.6-57.9151165.8171.3-6.6115.7
938K33.2Very low30.4Very low199 Ų199138.5 Ų138.587%0.86577%0.769SS**  178.5158.782.2-84.3173.7-179.2176.80108.5
939S32.4Very low30.4Very low99 Ų99141.1 Ų141.169%0.69278%0.775SS**  cis-164.3114.7-9.843.50000112
940S30.1Very low30.5Very low111 Ų111142.5 Ų142.578%0.77678%0.778SS**  trans26.1122.7145.759.40000121.6
941L32.2Very low30.5Very low167 Ų167143.6 Ų143.687%0.87478%0.78SS**  -163100.2114.3-111.5168.1000111.7
942D31Very low30.5Very low166 Ų166143 Ų14389%0.88878%0.781SS**  trans-80.4136159.7-81.1-62.6000109.3
943A29.4Very low30.8Very low86 Ų86144.3 Ų144.371%0.71178%0.778SS**  trans-146.888.5170.900000110.4
944S28.2Very low30.7Very low112 Ų112148 Ų14878%0.78378%0.781SS**  trans-66.6140.5173.253.70000112.3
945F29.9Very low30.9Very low177 Ų177147.3 Ų147.378%0.77678%0.778SS**  trans-131.378.9163-88.3-54.5000112.5I947F945-I947 HydrophobicContact CB-CG1 4.27Å; F945-I947 HydrophobicContact CD1-CD1 3.67Å; F945-I947 HydrophobicContact CD1-CG1 3.45Å; F945-I947 VanDerWaalsContact CD1-CG1 3.45Å; F945-I947 HydrophobicContact CE1-CD1 3.96Å; F945-I947 HydrophobicContact CE1-CG1 4.08Å; F945-I947 HydrophobicContact CG-CD1 4.24Å; F945-I947 HydrophobicContact CG-CG1 4.16Å
946E29.3Very low30.9Very low178 Ų178144 Ų14483%0.83277%0.773SS**  trans-74.3115.1137-69.3-174.6124.900107
947I31.5Very low30.9Very low138 Ų138147.1 Ų147.171%0.70878%0.783SS**PPolyproline II helixtrans-100.3118.5169.6-64.2-175.9000109.1F945F945-I947 HydrophobicContact CB-CG1 4.27Å; F945-I947 HydrophobicContact CD1-CD1 3.67Å; F945-I947 HydrophobicContact CD1-CG1 3.45Å; F945-I947 VanDerWaalsContact CD1-CG1 3.45Å; F945-I947 HydrophobicContact CE1-CD1 3.96Å; F945-I947 HydrophobicContact CE1-CG1 4.08Å; F945-I947 HydrophobicContact CG-CD1 4.24Å; F945-I947 HydrophobicContact CG-CG1 4.16Å
948F30.4Very low31Very low166 Ų166139.7 Ų139.773%0.72878%0.776SS**PPolyproline II helixtrans-60.8155.8178.9-90.7-120.2000113.5N950F948-N950 PolarHBondContact O-N 3.15Å
949N26.4Very low31Very low154 Ų154135.9 Ų135.982%0.82477%0.77SS**PPolyproline II helixtrans-47.7129.1151.3-70.4-55.3000109.9
950N30.6Very low31.1Very low153 Ų153139 Ų13982%0.81877%0.773SS**  trans-136.1116165.6-110.9-34.7000111.3F948F948-N950 PolarHBondContact O-N 3.15Å
951T25.2Very low31.1Very low128 Ų128138.6 Ų138.679%0.78577%0.77SS**  trans-98.8114.7176.7-50.60000109.3
952S31.6Very low31.2Very low106 Ų106142.4 Ų142.474%0.74177%0.773SS**  trans-128.898.1164.445.60000108.1
953I33.5Very low31.1Very low140 Ų140139.4 Ų139.472%0.71877%0.765SS**  58.9102.486.6-59.8167.8000111.3
954N31.9Very low31.3Very low146 Ų146140.1 Ų140.178%0.78177%0.771SS**  -156.7146.7127.2-100-32.3000111.8
955N32.7Very low31.4Very low136 Ų136143.1 Ų143.173%0.72777%0.773SS**  trans66.179.1160.3-60.1-5.3000120.2
956T34Very low31.6Very low112 Ų112142.6 Ų142.669%0.68777%0.772SS**  57.7121.8115.456.20000122
957H34.5Very low31.9Very low193 Ų193138.9 Ų138.989%0.89476%0.762SS**  trans55.8124150.5-55.3-66000118.7
958G32.8Very low32Very low66 Ų66139 Ų13968%0.6877%0.765SS**  cis171.6-174.2-1.600000113.1
959T34.2Very low32.2Very low120 Ų120138.5 Ų138.574%0.73677%0.769SS**  trans-6.2144.8151.652.20000118.4
960E33Very low32.4Very low164 Ų164138.7 Ų138.777%0.76677%0.769SS**  cis-176.2164.2-3.7-119.3166-149.600108.1
961S31.8Very low32.4Very low103 Ų103139.7 Ų139.772%0.7277%0.774SS**  trans66.1163.3159.582.80000117.6
962W33.5Very low32.5Very low246 Ų246139 Ų13993%0.93277%0.774SS**  cis-154.8174.2-23.1-114.417.3000108.9
963S28Very low32.5Very low104 Ų104139.9 Ų139.973%0.72778%0.777SS**  trans-49.1147.3176.653.10000117.6
964A33.9Very low32.4Very low101 Ų101141.9 Ų141.984%0.83578%0.784SS**  -169.2159.9124.100000112.7
965E30.3Very low32.2Very low174 Ų174140.6 Ų140.681%0.81379%0.786SS**  trans-76.7157.6179-58.5143.5124.500112.9
966H35.3Very low31.9Very low166 Ų166139.3 Ų139.377%0.76979%0.788SS**  -179.1124.8119.7-105.8-74.3000115.4
967T35.8Very low31.7Very low101 Ų101140.1 Ų140.162%0.6279%0.792SS**  trans32.8120.5143.352.70000122
968D32.9Very low31.3Very low141 Ų141142.1 Ų142.175%0.75479%0.792SS**  42.4112.1128.9-45.6-31.3000120.1
969N33.5Very low31.2Very low155 Ų155142.6 Ų142.683%0.82980%0.797SS**  -167.7153.8108.9-106.1-73.2000114.3
970L31.1Very low31Very low157 Ų157143.4 Ų143.482%0.82280%0.796SS**  trans-49.5132.5179.9-61153.3000115.2
971L31.9Very low30.9Very low174 Ų174147 Ų14791%0.91180%0.803SS**  179.7150.7128.6-97161.7000111.8
972S26Very low31.1Very low114 Ų114147.6 Ų147.680%0.79780%0.802SS**  trans-83.4157.6-170.9-43.80000114.8
973P31.1Very low31.1Very low124 Ų124141.5 Ų141.581%0.80580%0.796SS**  trans-125.8139.2146.335.9-25.6000113.1
974E32.9Very low31.6Very low182 Ų182141.9 Ų141.985%0.8580%0.796SS**  trans-87143.9169.7-63.8174.4108.800111.5
975S26.3Very low31.7Very low119 Ų119144.7 Ų144.783%0.83280%0.797SS**  trans58.7128.5154.671.90000120.5
976S28Very low31.7Very low109 Ų109139.5 Ų139.576%0.76279%0.79SS**  160.2115.6125-172.10000114.4
977V28.2Very low31.4Very low129 Ų129135.8 Ų135.878%0.78280%0.797SS**  trans41.4119.7140-173.40000121.1
978R27.8Very low31.1Very low235 Ų235136.2 Ų136.289%0.88780%0.804SS**  trans-175.4155132.9-107.6168.5-172.4-147.90.1114.7
979G29.6Very low31.1Very low77 Ų77137.8 Ų137.879%0.79481%0.806SS**  trans130.147.5164.200000116.6
980L30.3Very low31.1Very low137 Ų137137.8 Ų137.872%0.71780%0.801SS**  74.710169.2-125.2-177.7000116.4
981R31.4Very low30.9Very low240 Ų240137.2 Ų137.291%0.90680%0.798SS**  trans-160.4141.5153.3-78.6-161.1-173-170.63.1108.1
982T35.6Very low30.8Very low115 Ų115134 Ų13471%0.70679%0.788SS**  cis-156.5158.9-33.5-7.40000108.7
983C33.7Very low30.8Very low117 Ų117133.3 Ų133.379%0.79178%0.783SS**  trans-123-160.9164.5-49.50000107.6
984P38Very low30.9Very low112 Ų112134.8 Ų134.873%0.72778%0.783SS**  cis-100.7-159.728.545.6-40.9000111
985D36.1Very low30.7Very low160 Ų160133.5 Ų133.586%0.85678%0.782SS**  cis-150.8-169.5-4.4-133.5-16.6000107.5
986G29.6Very low31Very low66 Ų66133.5 Ų133.568%0.6878%0.776SS**  cis147.1108.8-1.400000112.7
987G29.8Very low30.9Very low88 Ų88135.9 Ų135.991%0.90778%0.777SS**  trans157.4107.6173.400000115.2
988S30.3Very low30.9Very low109 Ų109136.1 Ų136.176%0.76277%0.774SS**  trans-126.9137.3172.1171.70000110.3
989Q32.3Very low30.9Very low174 Ų174130.8 Ų130.881%0.81377%0.768SS**  trans-170126.8158.9-111.1147.588.100114.3
990H32.6Very low30.8Very low156 Ų156133.8 Ų133.872%0.72276%0.764SS**  trans65.2117.2142.3-73.1-126.3000119.8
991L26.7Very low30.7Very low145 Ų145131.6 Ų131.676%0.75976%0.76SS**  70.714478.7-89106.9000114.5
992P30.4Very low30.5Very low106 Ų106127 Ų12769%0.68875%0.754SS**  cis-143-168.1-29.841.1-22.2000114.4
993S26.8Very low30Very low99 Ų99129.3 Ų129.369%0.69276%0.757SS**  trans-36.7146.5167.154.50000118.1
994I33.1Very low29.7Very low156 Ų156130.2 Ų130.280%0.875%0.749SS**  trans-145.2121.3138.2-107.3157.2000110.1
995D27.8Very low29.3Very low155 Ų155132.6 Ų132.683%0.82975%0.75SS**  trans-84.9123.7157-73.9-62.9000108.5
996T33.2Very low29Very low118 Ų118130.1 Ų130.172%0.72474%0.736SS**  trans-149.3112.3150.3420000106.8
997M26.2Very low28.9Very low159 Ų159135.1 Ų135.178%0.78374%0.742SS**  69.5141.962.9-78.7-68.3-12700115.4
998D27.1Very low28.8Very low134 Ų134135.8 Ų135.872%0.71772%0.724SS**  trans78.1156.7157.5-66.1-39.9000121.6
999V29Very low28.8Very low123 Ų123136.8 Ų136.875%0.74572%0.72SS**  trans8283.2173.9-163.70000114.8
1000I27.6Very low28.6Very low141 Ų141135 Ų13572%0.72371%0.709SS**  70.5129.772.2-62.2164.7000111.7
1001S26.6Very low28.4Very low91 Ų91133.4 Ų133.464%0.63671%0.706SS**  cis-167175.9-13.1-98.70000109.1
1002N27.3Very low28.5Very low144 Ų144133.9 Ų133.977%0.7770%0.704SS**  trans-20.2133.7154.2-37-46.4000114.9
1003Q26.8Very low28.4Very low163 Ų163135.4 Ų135.476%0.76271%0.706SS**  178.1132.8118.2-102168.3-27.500113.8
1004H27.4Very low28.7Very low136 Ų136140.7 Ų140.763%0.6371%0.712SS**  trans59.4164.1158.3-59.8-62.9000117
1005E29.2Very low28.9Very low161 Ų161137.6 Ų137.675%0.75270%0.702SS**  cis-135.9123.7-0.6-131.5129.8-14800106.8
1006I29.1Very low28.7Very low108 Ų108138.3 Ų138.355%0.55470%0.702SS**  68.3126.587.2-67.4-179.2000113.7
1007Q27.3Very low28.3Very low172 Ų172136.6 Ų136.680%0.80470%0.696SS**  trans70154.1159.1-79.9160.310.200117.4
1008D28.6Very low28.3Very low101 Ų101133 Ų13354%0.5469%0.686SS.*  cis-157.2-174.4-8.4-145.2-38.6000111.1K1010D1008-K1010 IonicContact OD1-NZ 3.91Å; D1008-K1010 PolarHBondContact OD1-NZ 3.09Å; D1008-K1010 IonicContact OD2-NZ 2.6Å
1009I30.6Very low28.3Very low131 Ų131135.1 Ų135.167%0.67269%0.689SS**  trans68.889.6149.1-69.4156.1000114.7
1010K27.4Very low28.4Very low135 Ų135136.4 Ų136.459%0.58769%0.692SS**  79.8129.266-70.6171.2-170.196.50113.7D1008D1008-K1010 IonicContact OD1-NZ 3.91Å; D1008-K1010 PolarHBondContact OD1-NZ 3.09Å; D1008-K1010 IonicContact OD2-NZ 2.6Å
1011N28.1Very low28.5Very low124 Ų124136.5 Ų136.566%0.66369%0.689SS**  trans60.7141.2142.9-47.5-12.3000117.7
1012H29.2Very low28.7Very low154 Ų154139.6 Ų139.671%0.71369%0.693SS**  cis-157.5133.446.4-91.8-84.6000113.7
1013L28.6Very low28.6Very low139 Ų139141.4 Ų141.473%0.72870%0.695SS**  trans62.8142.5153.7-7576.8000118.2
1014Y32.1Very low28.6Very low209 Ų209141.2 Ų141.282%0.8270%0.699SS**  cis72.7150.540.9-84.9-125.4000113.9
1015P36.7Very low28.6Very low91 Ų91139.4 Ų139.459%0.59170%0.702SS**  cis-150.5-177.6-26.440-21.6000116.6
1016M25.3Very low28.3Very low170 Ų170136.5 Ų136.584%0.83770%0.699SS**  trans65.5155.7141.9-70.8-97.9-178.700118
1017S24.9Very low28.5Very low83 Ų83139.4 Ų139.458%0.5872%0.715SS**  cis-164.2173.7-1448.20000110
1018S24.6Very low28.3Very low82 Ų82141.3 Ų141.357%0.57372%0.717SS**  trans44.2128.4139.466.50000119.2
1019F27.9Very low28.1Very low179 Ų179141.9 Ų141.979%0.78572%0.724SS**  -145.1149.652.6-107.6-93.4000113.6
1020N31.5Very low28Very low151 Ų151146 Ų14681%0.80773%0.733SS**  trans-83-176.1157.8-155.9-7.2000108.2
1021E29.3Very low27.9Very low142 Ų142150.1 Ų150.166%0.66475%0.746SS**  trans96.1137.1-173.9-60.1176.4-157.300114.1
1022H31.4Very low27.9Very low156 Ų156151.3 Ų151.372%0.72276%0.758SS**  cis-142.7155.2-6.1-119.9-56.1000111.2
1023F25.5Very low27.8Very low183 Ų183154.1 Ų154.180%0.80376%0.763SS**  trans-54.2143.9169.3-73.5-113000111.5
1024N26.7Very low27.8Very low158 Ų158155.1 Ų155.185%0.84576%0.763SS**  -159149.3111.9-104.9-34.5000113.9
1025S25.9Very low27.7Very low99 Ų99153.7 Ų153.769%0.69276%0.763SS**  trans-86.7-174.1169.958.80000110.5
1026S24.6Very low27.3Very low100 Ų100154.6 Ų154.670%0.69977%0.772SS**  trans61.297.3177.963.80000116.4
1027N31.7Very low27.6Very low168 Ų168155.9 Ų155.990%0.89877%0.773SS**  -147.6136.898.6-100.7-46.3000111.7
1028Y23.7Very low27.9Very low213 Ų213158.8 Ų158.884%0.83578%0.781SS**  trans-85.5173.1-179.6-122.9-124.7000110.6
1029T25.7Very low28.3Very low112 Ų112161.5 Ų161.569%0.68778%0.784SS**  trans52.5100.7161.549.50000118.3
1030Y26.9Very low28.5Very low218 Ų218157.7 Ų157.786%0.85578%0.78SS**  174.942.5118.8-107.9-80.1000114.9
1031Y26.1Very low28.5Very low221 Ų221159.5 Ų159.587%0.86778%0.781SS**  trans-134.369.7177.3-99.9-82.1000114.5R1033Y1031-R1033 VanDerWaalsContact C-N 3.35Å; Y1031-R1033 PolarHBondContact O-N 3.23Å
1032T27.2Very low28.6Very low150 Ų150159.3 Ų159.392%0.9278%0.783SS**  trans-94.154.5168.339.30000111.9
1033R27.8Very low28.8Very low213 Ų213158.1 Ų158.180%0.80477%0.773SS**  trans-147.8144.2174-115.5177.9-175.6170.42.6110.8Y1031Y1031-R1033 VanDerWaalsContact C-N 3.35Å; Y1031-R1033 PolarHBondContact O-N 3.23Å
1034H27.8Very low29.3Very low159 Ų159156.8 Ų156.874%0.73677%0.77SS**  trans65.7100.1-176.8-61.7-92.4000117.1
1035H29.9Very low29.6Very low179 Ų179159.9 Ų159.983%0.82977%0.77SS**  trans-148.134.7146.1-113.7-73.3000114K1037H1035-K1037 PolarHBondContact O-N 3.08Å
1036S29.2Very low30Very low110 Ų110162.6 Ų162.677%0.76977%0.769SS**THydrogen-bonded Turntrans-76.173.4177.443.10000112.9
1037K31.8Very low30.4Very low198 Ų198162.4 Ų162.486%0.86175%0.754SS**THydrogen-bonded Turntrans-153.5-1.3177.1-118.7164.3-172.9178.40119.9H1035H1035-K1037 PolarHBondContact O-N 3.08Å
1038L31.4Very low30.4Very low143 Ų143161.2 Ų161.275%0.74974%0.743SS**SBendtrans-125.3-14.4-172.2-92.7163.1000117.7
1039H32Very low31.2Very low139 Ų139154 Ų15464%0.64472%0.721SS**THydrogen-bonded Turntrans-83.8-9.8-168.7-83.4-70.6000117.2K1041H1039-K1041 PolarHBondContact O-N 3.27Å
1040S32.2Very low31.7Very low99 Ų99152 Ų15269%0.69271%0.705SS**Hα-helixtrans-69.1-30.5-171.3510000115.1
1041K31.5Very low32.2Very low190 Ų190145.9 Ų145.983%0.82669%0.692SS**Hα-helixtrans-85-9.2-173.5-79.6-161.5169.6-163.50116.3H1039H1039-K1041 PolarHBondContact O-N 3.27Å
1042L32.8Very low32.8Very low137 Ų137140.3 Ų140.372%0.71767%0.67SS**Hα-helixtrans-101.1-12.7-175.2-80.5169.6000114.8
1043Y34.6Very low33.4Very low131 Ų131137.5 Ų137.551%0.51465%0.648SS.*Hα-helixtrans-91.6-32.4-171.5-91.6-79.3000114.9R1045 K1046 Y1047Y1043-R1045 PolarHBondContact O-N 3.03Å; Y1043-K1046 PolarHBondContact O-N 3.35Å; Y1043-K1046 VanDerWaalsContact O-N 3.14Å; Y1043-Y1047 HydrophobicContact CD1-CE1 4.43Å
1044E35.6Very low34.2Very low156 Ų156130.3 Ų130.373%0.72963%0.625SS**G310 helixtrans-60.8-30.4-177-66.9-179.8135.500113.5K1046E1044-K1046 PolarHBondContact O-N 2.88Å
1045R33Very low34.9Very low222 Ų222127.4 Ų127.484%0.83862%0.615SS**G310 helixtrans-70.6-5.2178.3-82-173.3172-176.7-1.9115.2Y1043Y1043-R1045 PolarHBondContact O-N 3.03Å
1046K34.9Very low35.6Very low157 Ų157127.9 Ų127.968%0.68361%0.609SS**G310 helixtrans-111.319-180-75.4-170.9174.7-177.90114.6Y1043 E1044 T1049Y1043-K1046 PolarHBondContact O-N 3.35Å; Y1043-K1046 VanDerWaalsContact O-N 3.14Å; E1044-K1046 PolarHBondContact O-N 2.88Å; K1046-T1049 PolarHBondContact O-OG1 3.02Å
1047Y31.6Very low36.3Very low96 Ų96129.5 Ų129.538%0.37660%0.602SS.*SBendtrans-107.512.9-169.3-64.8-23.6000117.1Y1043 R1105Y1043-Y1047 HydrophobicContact CD1-CE1 4.43Å; Y1047-R1105 VanDerWaalsContact CE1-NH1 3.28Å
1048Q33.3Very low36.7Very low143 Ų143126.7 Ų126.767%0.66859%0.586SS**SBendtrans-110.69.2170.9-74.2-170-17.300114.2
1049T39.1Very low37.3Very low61 Ų61125.5 Ų125.537%0.37458%0.575SS.*Hα-helixtrans-97.6-10.6-157.425.10000117K1046 R1052 I1053K1046-T1049 PolarHBondContact O-OG1 3.02Å; T1049-R1052 CarbonylContact O-C 3.56Å; T1049-R1052 PolarHBondContact O-N 3.15Å; T1049-I1053 VanDerWaalsContact O-CB 3.23Å; T1049-I1053 WeakPolarHBondContact O-CB 3.22Å; T1049-I1053 WeakPolarHBondContact O-CD1 3.44Å; T1049-I1053 WeakPolarHBondContact O-CG1 3.36Å; T1049-I1053 PolarHBondContact O-N 3.33Å
1050I37Very low37.8Very low69 Ų69122 Ų12235%0.35457%0.57SS.*Hα-helixtrans-71.6-54.2-174.7-66.9176000112.9R1052 I1053 I1054 H1101I1050-R1052 PolarHBondContact O-N 2.86Å; I1050-I1053 PolarHBondContact O-N 3.2Å; I1050-I1053 VanDerWaalsContact O-N 3.1Å; I1050-I1054 HydrophobicContact CG2-CD1 4.02Å; I1050-I1054 WeakPolarHBondContact O-CG1 3.4Å; I1050-I1054 PolarHBondContact O-N 2.91Å; I1050-H1101 HydrophobicContact CD1-CB 4.21Å; I1050-H1101 WeakPolarHBondContact CD1-CD2 3.48Å; I1050-H1101 VanDerWaalsContact CD1-CG 3.41Å; I1050-H1101 WeakPolarHBondContact CD1-NE2 3.38Å
1051P37.8Very low38.3Very low91 Ų91122.7 Ų122.759%0.59156%0.562SS**Hα-helixtrans-57-39.1171.9-24.934.8000112.1I1053 I1054 N1055P1051-I1053 PolarHBondContact O-N 3.46Å; P1051-I1054 PolarHBondContact O-N 3.3Å; P1051-N1055 WeakPolarHBondContact O-CB 3.5Å; P1051-N1055 PolarHBondContact O-N 3.21Å
1052R38.8Very low39Very low104 Ų104118 Ų11839%0.39255%0.546SS..Hα-helixtrans-69-27.4177-75.4178.6169.6153.5-3.8114Q847 T1049 I1050 R1056Q847-R1052 VanDerWaalsContact OE1-NH2 3.07Å; T1049-R1052 CarbonylContact O-C 3.56Å; T1049-R1052 PolarHBondContact O-N 3.15Å; I1050-R1052 PolarHBondContact O-N 2.86Å; R1052-R1056 WeakPolarHBondContact O-CB 3.43Å; R1052-R1056 WeakPolarHBondContact O-CG 3.44Å; R1052-R1056 PolarHBondContact O-N 3.41Å
1053I40.1Very low39.3Very low91 Ų91116.5 Ų116.547%0.46754%0.538SS..Hα-helixtrans-79.2-40.2174.3-76.9165.5000110.4T1049 I1050 P1051 R1056 K1057T1049-I1053 VanDerWaalsContact O-CB 3.23Å; T1049-I1053 WeakPolarHBondContact O-CB 3.22Å; T1049-I1053 WeakPolarHBondContact O-CD1 3.44Å; T1049-I1053 WeakPolarHBondContact O-CG1 3.36Å; T1049-I1053 PolarHBondContact O-N 3.33Å; I1050-I1053 PolarHBondContact O-N 3.2Å; I1050-I1053 VanDerWaalsContact O-N 3.1Å; P1051-I1053 PolarHBondContact O-N 3.46Å; I1053-R1056 PolarHBondContact O-N 2.89Å; I1053-K1057 PolarHBondContact O-N 3.02Å
1054I43.9Very low39.6Very low62 Ų62113.9 Ų113.932%0.31854%0.539SS..Hα-helixtrans-63.2-48.8174.8-65.3169.1000109.6I1050 P1051 R1056 K1057 R1058I1050-I1054 HydrophobicContact CG2-CD1 4.02Å; I1050-I1054 WeakPolarHBondContact O-CG1 3.4Å; I1050-I1054 PolarHBondContact O-N 2.91Å; P1051-I1054 PolarHBondContact O-N 3.3Å; I1054-R1056 PolarHBondContact O-N 3.49Å; I1054-K1057 PolarHBondContact O-N 2.88Å; I1054-R1058 PolarHBondContact O-N 3.4Å
1055N43.2Very low39.7Very low97 Ų97114.9 Ų114.952%0.51954%0.541SS..Hα-helixtrans-66.8-34.6175.5-80.14.4000113P1051 R1058 K1059P1051-N1055 WeakPolarHBondContact O-CB 3.5Å; P1051-N1055 PolarHBondContact O-N 3.21Å; N1055-R1058 PolarHBondContact O-N 3.45Å; N1055-K1059 WeakPolarHBondContact O-CB 3.16Å; N1055-K1059 PolarHBondContact O-N 2.91Å
1056R43.2Very low40Very low189 Ų189111 Ų11171%0.71353%0.532SS*.Hα-helixtrans-68-36172.8-80.4175177-172.7-1.8112.9R1052 I1053 I1054 A1060R1052-R1056 WeakPolarHBondContact O-CB 3.43Å; R1052-R1056 WeakPolarHBondContact O-CG 3.44Å; R1052-R1056 PolarHBondContact O-N 3.41Å; I1053-R1056 PolarHBondContact O-N 2.89Å; I1054-R1056 PolarHBondContact O-N 3.49Å; R1056-A1060 WeakPolarHBondContact O-CB 3.4Å; R1056-A1060 PolarHBondContact O-N 3.18Å
1057K43.8Very low40Very low144 Ų144108.7 Ų108.763%0.62654%0.537SS*.Hα-helixtrans-65.5-46.4171-80-168172.4-170.70111.3I1053 I1054 A1060 Q1061I1053-K1057 PolarHBondContact O-N 3.02Å; I1054-K1057 PolarHBondContact O-N 2.88Å; K1057-A1060 PolarHBondContact O-N 3.43Å; K1057-Q1061 WeakPolarHBondContact O-CB 3.28Å; K1057-Q1061 WeakPolarHBondContact O-CG 3.42Å; K1057-Q1061 PolarHBondContact O-N 2.7Å; K1057-Q1061 PolarHBondContact O-OE1 2.83Å
1058R41.3Very low40.1Very low139 Ų139111.1 Ų111.153%0.52555%0.551SS.*Hα-helixtrans-56.9-55.3173.6-78.1-177.9167.6179-5.5112.1I1054 N1055 A1060 Q1061 I1062I1054-R1058 PolarHBondContact O-N 3.4Å; N1055-R1058 PolarHBondContact O-N 3.45Å; R1058-A1060 VanDerWaalsContact C-N 3.31Å; R1058-A1060 PolarHBondContact O-N 3.44Å; R1058-Q1061 PolarHBondContact O-N 3.25Å; R1058-Q1061 VanDerWaalsContact O-N 3.14Å; R1058-I1062 WeakPolarHBondContact O-CB 3.29Å; R1058-I1062 VanDerWaalsContact O-CG1 3.26Å; R1058-I1062 WeakPolarHBondContact O-CG1 3.41Å; R1058-I1062 PolarHBondContact O-N 3.09Å
1059K42.9Very low40.4Very low119 Ų119111.9 Ų111.952%0.51755%0.552SS.*Hα-helixtrans-63.6-33.3-178.6-135.3163.6-173.6170.10111.6D845 N1055 N1063D845-K1059 IonicContact OD1-NZ 3.31Å; D845-K1059 PolarHBondContact OD1-NZ 2.96Å; D845-K1059 IonicContact OD2-NZ 3.33Å; N1055-K1059 WeakPolarHBondContact O-CB 3.16Å; N1055-K1059 PolarHBondContact O-N 2.91Å; K1059-N1063 WeakPolarHBondContact O-CB 3.4Å; K1059-N1063 PolarHBondContact O-N 3.14Å; K1059-N1063 VanDerWaalsContact O-N 3.12Å; K1059-N1063 PolarHBondContact O-OD1 3.5Å; K1059-N1063 VanDerWaalsContact O-OD1 3.12Å
1060A43.4Very low40.1Very low64 Ų64118.8 Ų118.853%0.52958%0.581SS.*Hα-helixtrans-69.3-39.1172.400000113.7R1056 K1057 R1058 S1064R1056-A1060 WeakPolarHBondContact O-CB 3.4Å; R1056-A1060 PolarHBondContact O-N 3.18Å; K1057-A1060 PolarHBondContact O-N 3.43Å; R1058-A1060 VanDerWaalsContact C-N 3.31Å; R1058-A1060 PolarHBondContact O-N 3.44Å; A1060-S1064 PolarHBondContact O-N 3.18Å
1061Q43.5Very low39.9Very low114 Ų114120.6 Ų120.653%0.53360%0.599SS.*Hα-helixtrans-72.2-40.8176.9-72.6174.6-61.600111.8K1057 R1058 N1063 S1064 F1065K1057-Q1061 WeakPolarHBondContact O-CB 3.28Å; K1057-Q1061 WeakPolarHBondContact O-CG 3.42Å; K1057-Q1061 PolarHBondContact O-N 2.7Å; K1057-Q1061 PolarHBondContact O-OE1 2.83Å; R1058-Q1061 PolarHBondContact O-N 3.25Å; R1058-Q1061 VanDerWaalsContact O-N 3.14Å; Q1061-N1063 VanDerWaalsContact C-N 3.31Å; Q1061-N1063 PolarHBondContact O-N 3.28Å; Q1061-S1064 WeakPolarHBondContact CA-OG 3.35Å; Q1061-S1064 PolarHBondContact O-N 3.37Å; Q1061-S1064 PolarHBondContact O-OG 3.49Å; Q1061-F1065 WeakPolarHBondContact O-CD2 3.38Å; Q1061-F1065 PolarHBondContact O-N 3.36Å
1062I44.7Very low39.8Very low93 Ų93120 Ų12048%0.47759%0.594SS.*Hα-helixtrans-56.8-45.7173-69.5163.3000110.4R1058 S1064 F1065R1058-I1062 WeakPolarHBondContact O-CB 3.29Å; R1058-I1062 VanDerWaalsContact O-CG1 3.26Å; R1058-I1062 WeakPolarHBondContact O-CG1 3.41Å; R1058-I1062 PolarHBondContact O-N 3.09Å; I1062-S1064 PolarHBondContact O-N 2.79Å; I1062-F1065 PolarHBondContact O-N 3.04Å; I1062-F1065 VanDerWaalsContact O-N 3.08Å
1063N40.4Very low39.5Very low104 Ų104124.8 Ų124.856%0.55662%0.617SS**Hα-helixtrans-65.2-24.5177.1-70.814.2000113.4K1059 Q1061 F1065K1059-N1063 WeakPolarHBondContact O-CB 3.4Å; K1059-N1063 PolarHBondContact O-N 3.14Å; K1059-N1063 VanDerWaalsContact O-N 3.12Å; K1059-N1063 PolarHBondContact O-OD1 3.5Å; K1059-N1063 VanDerWaalsContact O-OD1 3.12Å; Q1061-N1063 VanDerWaalsContact C-N 3.31Å; Q1061-N1063 PolarHBondContact O-N 3.28Å; N1063-F1065 VanDerWaalsContact C-N 3.33Å
1064S40.3Very low39.1Very low77 Ų77132.2 Ų132.254%0.53864%0.64SS.*Hα-helixtrans-78.5-12173.9660000114.6A1060 Q1061 I1062A1060-S1064 PolarHBondContact O-N 3.18Å; Q1061-S1064 WeakPolarHBondContact CA-OG 3.35Å; Q1061-S1064 PolarHBondContact O-N 3.37Å; Q1061-S1064 PolarHBondContact O-OG 3.49Å; I1062-S1064 PolarHBondContact O-N 2.79Å
1065F36.8Very low38.7Very low177 Ų177135.7 Ų135.778%0.77666%0.655SS**THydrogen-bonded Turntrans-97.1-4.3176.5-85.7-76.8000114.2Q1061 I1062 N1063 S1067Q1061-F1065 WeakPolarHBondContact O-CD2 3.38Å; Q1061-F1065 PolarHBondContact O-N 3.36Å; I1062-F1065 PolarHBondContact O-N 3.04Å; I1062-F1065 VanDerWaalsContact O-N 3.08Å; N1063-F1065 VanDerWaalsContact C-N 3.33Å; F1065-S1067 PolarHBondContact O-N 2.87Å
1066Q39.3Very low38.1Very low139 Ų139138.6 Ų138.665%0.6566%0.663SS**THydrogen-bonded Turntrans-86.94.2-176.8-74.9-171.1-2200115.3
1067S35.1Very low37.5Very low110 Ų110138.1 Ų138.177%0.76967%0.673SS**THydrogen-bonded Turntrans-881.5-173.859.60000115.8F1065F1065-S1067 PolarHBondContact O-N 2.87Å
1068E35.2Very low37Very low146 Ų146134.9 Ų134.968%0.68267%0.669SS**SBendtrans-122.2104.2-177.1-125.6-175.4156.400116.4
1069K38.7Very low36.4Very low160 Ų160134 Ų13470%0.69667%0.674SS**  trans51.592.6149-64169.6-167.91380119.2S1071K1069-S1071 PolarHBondContact O-N 3.23Å; K1069-S1071 VanDerWaalsContact O-N 3.13Å; K1069-S1071 PolarHBondContact O-OG 3.16Å
1070Q33.3Very low36.1Very low206 Ų206135.2 Ų135.296%0.96369%0.686SS**SBendtrans7.790136.6-66.2170.8-46.300116.9
1071S32.7Very low35.6Very low107 Ų107136 Ų13675%0.74869%0.693SS**  trans-163.6-46.8160.548.90000111.5K1069 K1073K1069-S1071 PolarHBondContact O-N 3.23Å; K1069-S1071 VanDerWaalsContact O-N 3.13Å; K1069-S1071 PolarHBondContact O-OG 3.16Å; S1071-K1073 PolarHBondContact O-N 3.33Å; S1071-K1073 VanDerWaalsContact O-N 3.13Å
1072V34.4Very low35.3Very low79 Ų79133.4 Ų133.448%0.47969%0.687SS.*  trans-85.385.2-175.7-1720000111.7E1075V1072-E1075 HydrophobicContact CG1-CB 3.83Å; V1072-E1075 HydrophobicContact CG1-CG 3.95Å; V1072-E1075 VanDerWaalsContact CG1-OE2 3.26Å; V1072-E1075 WeakPolarHBondContact CG1-OE2 3.46Å
1073K33.6Very low35Very low203 Ų203132.4 Ų132.488%0.88368%0.683SS**  trans-112.220.9176.9-142.3-176.9-176.9-172.60114.4S1071S1071-K1073 PolarHBondContact O-N 3.33Å; S1071-K1073 VanDerWaalsContact O-N 3.13Å
1074R32.5Very low34.9Very low248 Ų248131.4 Ų131.494%0.93668%0.677SS**SBendtrans-136.4-1.8-177-111.1-179.1-179.1173-0.1116.7
1075E33.8Very low34.7Very low135 Ų135138.8 Ų138.863%0.63169%0.693SS**  trans-108.65.3-170.9-60.7-175.6146.900115V1072 L1077 S1078V1072-E1075 HydrophobicContact CG1-CB 3.83Å; V1072-E1075 HydrophobicContact CG1-CG 3.95Å; V1072-E1075 VanDerWaalsContact CG1-OE2 3.26Å; V1072-E1075 WeakPolarHBondContact CG1-OE2 3.46Å; E1075-L1077 PolarHBondContact O-N 3.5Å; E1075-S1078 PolarHBondContact O-N 3.24Å; E1075-S1078 PolarHBondContact O-OG 3.46Å
1076F30.5Very low34.9Very low158 Ų158134.4 Ų134.469%0.69368%0.677SS**THydrogen-bonded Turntrans-71-0.4-174.1-89.3-83.8000116
1077L32.3Very low35.4Very low178 Ų178131.2 Ų131.293%0.93267%0.665SS**THydrogen-bonded Turntrans-94.3-3.2178.1-69.5173000114.3E1075E1075-L1077 PolarHBondContact O-N 3.5Å
1078S31.9Very low36.2Very low77 Ų77129.9 Ų129.954%0.53865%0.649SS.*  trans-102.128.2-177.8710000114.3E1075 D1080 A1081E1075-S1078 PolarHBondContact O-N 3.24Å; E1075-S1078 PolarHBondContact O-OG 3.46Å; S1078-D1080 VanDerWaalsContact C-N 3.34Å; S1078-D1080 PolarHBondContact O-N 3.19Å; S1078-A1081 PolarHBondContact O-N 2.73Å
1079L30Very low37Very low119 Ų119131.2 Ų131.262%0.62365%0.648SS**G310 helixtrans-67.2-29.8-166.8-157.572.6000113.9A1081 S1082L1079-A1081 PolarHBondContact O-N 3.23Å; L1079-S1082 WeakPolarHBondContact O-CB 3.42Å; L1079-S1082 PolarHBondContact O-N 3Å; L1079-S1082 PolarHBondContact O-OG 2.85Å
1080D35.5Very low37.8Very low145 Ų145130.8 Ų130.878%0.77564%0.643SS**G310 helixtrans-59.9-32.7177.1-80.2-23.7000113S1078 S1082S1078-D1080 VanDerWaalsContact C-N 3.34Å; S1078-D1080 PolarHBondContact O-N 3.19Å; D1080-S1082 PolarHBondContact O-N 3.28Å
1081A33.9Very low39.1Very low82 Ų82122 Ų12268%0.67860%0.601SS**G310 helixtrans-69.3-13.9175.800000113.5S1078 L1079S1078-A1081 PolarHBondContact O-N 2.73Å; L1079-A1081 PolarHBondContact O-N 3.23Å
1082S36.1Very low40.7Very low59 Ų59118 Ų11841%0.41357%0.573SS.*G310 helixtrans-91.6-13.6-175.675.60000114.5L1079 D1080 N1084 R1085L1079-S1082 WeakPolarHBondContact O-CB 3.42Å; L1079-S1082 PolarHBondContact O-N 3Å; L1079-S1082 PolarHBondContact O-OG 2.85Å; D1080-S1082 PolarHBondContact O-N 3.28Å; S1082-N1084 PolarHBondContact O-N 2.83Å; S1082-R1085 PolarHBondContact O-N 3.11Å
1083L39Very low42.4Very low72 Ų72119.1 Ų119.138%0.37758%0.577SS.*G310 helixtrans-63.7-25.6-179-114.2154.2000112.9R1085 L1086L1083-R1085 PolarHBondContact O-N 3.11Å; L1083-L1086 HydrophobicContact CD2-CD1 3.9Å; L1083-L1086 PolarHBondContact O-N 3.08Å
1084N37.8Very low44.2Very low82 Ų82113.8 Ų113.844%0.43956%0.557SS.*G310 helixtrans-66.4-2.4176-62.50.6000114.1S1082S1082-N1084 PolarHBondContact O-N 2.83Å
1085R36.4Very low46.3Very low233 Ų233102.6 Ų102.688%0.87952%0.515SS*.G310 helixtrans-106.28.7179.3-81-175.5160.6-168.4-4.9115.6S1082 L1083 D1087S1082-R1085 PolarHBondContact O-N 3.11Å; L1083-R1085 PolarHBondContact O-N 3.11Å; R1085-D1087 PolarHBondContact O-N 2.89Å
1086L41.3Very low48.5Very low85 Ų85101.1 Ų101.145%0.44551%0.507SS..SBendtrans-77.5115.3170.8-78.5168000110.9L1083 D1088L1083-L1086 HydrophobicContact CD2-CD1 3.9Å; L1083-L1086 PolarHBondContact O-N 3.08Å; L1086-D1088 PolarHBondContact O-N 3.26Å
1087D49.3Very low50.7Low72 Ų7295.4 Ų95.439%0.38549%0.492SS..  trans-50.1125.8173.8172.214.7000110.6R1085 R1089 Y1090R1085-D1087 PolarHBondContact O-N 2.89Å; D1087-R1089 PolarHBondContact O-N 2.8Å; D1087-R1089 IonicContact OD1-NE 2.61Å; D1087-R1089 IonicContact OD1-NH2 3.6Å; D1087-R1089 IonicContact OD2-CZ 2.87Å; D1087-R1089 IonicContact OD2-NE 3.65Å; D1087-R1089 PolarHBondContact OD2-NE 3.12Å; D1087-R1089 IonicContact OD2-NH2 3.33Å; D1087-R1089 PolarHBondContact OD2-NH2 3.05Å; D1087-Y1090 HydrophobicContact CB-CD2 4.11Å; D1087-Y1090 PolarHBondContact O-N 3.07Å
1088D52.8Low53.1Low81 Ų8188.3 Ų88.343%0.43346%0.455SS..Hα-helixtrans-42.8-36.8-169.1-85.6-60.5000114.2L1086 Y1090 F1091 S1092 Y1213L1086-D1088 PolarHBondContact O-N 3.26Å; D1088-Y1090 PolarHBondContact O-N 2.88Å; D1088-F1091 PolarHBondContact O-N 3.13Å; D1088-S1092 WeakPolarHBondContact O-CB 3.42Å; D1088-S1092 PolarHBondContact O-N 3.41Å; D1088-Y1213 VanDerWaalsContact OD1-CE2 3.29Å; D1088-Y1213 WeakPolarHBondContact OD1-CE2 3.37Å; D1088-Y1213 PolarHBondContact OD1-OH 3.37Å
1089R52Low55.7Low175 Ų17585.5 Ų85.566%0.6643%0.434SS*.Hα-helixtrans-59.5-43179.6-73.4174.2-73.3-158-2.3112.6D1087 S1092 D1093D1087-R1089 PolarHBondContact O-N 2.8Å; D1087-R1089 IonicContact OD1-NE 2.61Å; D1087-R1089 IonicContact OD1-NH2 3.6Å; D1087-R1089 IonicContact OD2-CZ 2.87Å; D1087-R1089 IonicContact OD2-NE 3.65Å; D1087-R1089 PolarHBondContact OD2-NE 3.12Å; D1087-R1089 IonicContact OD2-NH2 3.33Å; D1087-R1089 PolarHBondContact OD2-NH2 3.05Å; R1089-S1092 PolarHBondContact O-N 2.93Å; R1089-D1093 PolarHBondContact O-N 2.87Å
1090Y55.4Low58.2Low150 Ų15085.4 Ų85.459%0.58843%0.43SS*.Hα-helixtrans-70.1-33.7179.8-69.8-83.4000112.3D1087 D1088 I1094D1087-Y1090 HydrophobicContact CB-CD2 4.11Å; D1087-Y1090 PolarHBondContact O-N 3.07Å; D1088-Y1090 PolarHBondContact O-N 2.88Å; Y1090-I1094 WeakPolarHBondContact O-CD1 3.43Å; Y1090-I1094 WeakPolarHBondContact O-CG1 3.43Å; Y1090-I1094 PolarHBondContact O-N 3.48Å
1091F59.2Low60.5Low21 Ų2181.1 Ų81.19%0.09241%0.405CS..Hα-helixtrans-66.2-48174.2-166.8-79000110.6D1088 D1093 I1094 H1095 L1165 Y1168 Y1213D1088-F1091 PolarHBondContact O-N 3.13Å; F1091-D1093 PolarHBondContact O-N 3.29Å; F1091-I1094 PolarHBondContact O-N 3.09Å; F1091-H1095 AromaticContact CD1-CE1 3.49Å; F1091-H1095 VanDerWaalsContact CD1-CE1 3.49Å; F1091-H1095 WeakPolarHBondContact CD1-CE1 3.3Å; F1091-H1095 AromaticContact CD1-ND1 3.46Å; F1091-H1095 WeakPolarHBondContact CD1-ND1 3.36Å; F1091-H1095 AromaticContact CE1-CE1 3.03Å; F1091-H1095 WeakPolarHBondContact CE1-CE1 3.28Å; F1091-H1095 AromaticContact CE1-ND1 3.43Å; F1091-H1095 WeakPolarHBondContact CE1-ND1 3.41Å; F1091-H1095 AromaticContact CE1-NE2 3.49Å; F1091-H1095 WeakPolarHBondContact CE1-NE2 3.4Å; F1091-H1095 AromaticContact CE2-CE1 3.83Å; F1091-H1095 AromaticContact CZ-CE1 3.24Å; F1091-H1095 WeakPolarHBondContact CZ-CE1 3.29Å; F1091-H1095 AromaticContact CZ-NE2 3.65Å; F1091-H1095 PolarHBondContact O-N 2.89Å; F1091-H1095 PolarHBondContact O-ND1 2.9Å; F1091-L1165 HydrophobicContact CE1-CD2 3.88Å; F1091-L1165 HydrophobicContact CZ-CD2 4.49Å; F1091-Y1168 HydrophobicContact CD2-CD2 4.39Å; F1091-Y1168 HydrophobicContact CD2-CE2 4.14Å; F1091-Y1168 HydrophobicContact CE1-CD1 4.49Å; F1091-Y1168 AromaticContact CE2-CD2 3.71Å; F1091-Y1168 HydrophobicContact CE2-CD2 3.71Å; F1091-Y1168 AromaticContact CE2-CE2 3.92Å; F1091-Y1168 HydrophobicContact CE2-CE2 3.92Å; F1091-Y1168 HydrophobicContact CE2-CG 4.07Å; F1091-Y1168 HydrophobicContact CZ-CD1 4.23Å; F1091-Y1168 HydrophobicContact CZ-CD2 4.01Å; F1091-Y1168 HydrophobicContact CZ-CE2 4.47Å; F1091-Y1168 AromaticContact CZ-CG 3.87Å; F1091-Y1168 HydrophobicContact CZ-CG 3.87Å; F1091-Y1213 HydrophobicContact CD1-CD1 4.34Å; F1091-Y1213 AromaticContact CD1-CE1 3.44Å; F1091-Y1213 HydrophobicContact CD1-CE1 3.44Å; F1091-Y1213 VanDerWaalsContact CD1-CE1 3.44Å; F1091-Y1213 HydrophobicContact CE1-CD1 4.19Å; F1091-Y1213 AromaticContact CE1-CE1 3.56Å; F1091-Y1213 HydrophobicContact CE1-CE1 3.56Å; F1091-Y1213 HydrophobicContact CG-CE1 4.29Å; F1091-Y1213 HydrophobicContact CZ-CE1 4.48Å
1092S66.7Low62.9Low23 Ų2377.2 Ų77.216%0.16137%0.373CS..Hα-helixtrans-56.6-48.5177.6174.50000113D1088 R1089 I1094 H1095 K1096D1088-S1092 WeakPolarHBondContact O-CB 3.42Å; D1088-S1092 PolarHBondContact O-N 3.41Å; R1089-S1092 PolarHBondContact O-N 2.93Å; S1092-I1094 PolarHBondContact O-N 3.28Å; S1092-H1095 PolarHBondContact O-N 3.43Å; S1092-K1096 WeakPolarHBondContact O-CB 3.48Å; S1092-K1096 PolarHBondContact O-N 3.49Å
1093D70.7Confident65.3Low104 Ų10475.3 Ų75.356%0.55636%0.363SS*.Hα-helixtrans-65.4-35.5-176.9-81.2-17.3000113.4R1089 F1091 G1097R1089-D1093 PolarHBondContact O-N 2.87Å; F1091-D1093 PolarHBondContact O-N 3.29Å; D1093-G1097 PolarHBondContact O-N 3.24Å
1094I72Confident67.5Low90 Ų9076.2 Ų76.246%0.46237%0.371SS..Hα-helixtrans-64.8-47.3176-68.5168.3000110.5Y1090 F1091 S1092 G1097 I1098Y1090-I1094 WeakPolarHBondContact O-CD1 3.43Å; Y1090-I1094 WeakPolarHBondContact O-CG1 3.43Å; Y1090-I1094 PolarHBondContact O-N 3.48Å; F1091-I1094 PolarHBondContact O-N 3.09Å; S1092-I1094 PolarHBondContact O-N 3.28Å; I1094-G1097 PolarHBondContact O-N 2.94Å; I1094-I1098 HydrophobicContact CG2-CD1 4.23Å; I1094-I1098 WeakPolarHBondContact O-CG1 3.48Å; I1094-I1098 PolarHBondContact O-N 3.49Å; I1094-I1098 VanDerWaalsContact O-N 3.16Å
1095H76.6Confident69.9Low14 Ų1474.7 Ų74.77%0.06536%0.359CS..Hα-helixtrans-65.5-41.3-179.6-72.871.1000111.8F1091 S1092 G1097 I1098 L1099 L1161 I1216F1091-H1095 AromaticContact CD1-CE1 3.49Å; F1091-H1095 VanDerWaalsContact CD1-CE1 3.49Å; F1091-H1095 WeakPolarHBondContact CD1-CE1 3.3Å; F1091-H1095 AromaticContact CD1-ND1 3.46Å; F1091-H1095 WeakPolarHBondContact CD1-ND1 3.36Å; F1091-H1095 AromaticContact CE1-CE1 3.03Å; F1091-H1095 WeakPolarHBondContact CE1-CE1 3.28Å; F1091-H1095 AromaticContact CE1-ND1 3.43Å; F1091-H1095 WeakPolarHBondContact CE1-ND1 3.41Å; F1091-H1095 AromaticContact CE1-NE2 3.49Å; F1091-H1095 WeakPolarHBondContact CE1-NE2 3.4Å; F1091-H1095 AromaticContact CE2-CE1 3.83Å; F1091-H1095 AromaticContact CZ-CE1 3.24Å; F1091-H1095 WeakPolarHBondContact CZ-CE1 3.29Å; F1091-H1095 AromaticContact CZ-NE2 3.65Å; F1091-H1095 PolarHBondContact O-N 2.89Å; F1091-H1095 PolarHBondContact O-ND1 2.9Å; S1092-H1095 PolarHBondContact O-N 3.43Å; H1095-G1097 PolarHBondContact O-N 3.46Å; H1095-I1098 PolarHBondContact O-N 3.07Å; H1095-L1099 WeakPolarHBondContact O-CG 3.47Å; H1095-L1099 PolarHBondContact O-N 3.5Å; H1095-L1099 VanDerWaalsContact O-N 3.11Å; H1095-L1161 WeakPolarHBondContact CD2-CD1 3.47Å; H1095-I1216 HydrophobicContact CB-CD1 4.04Å; H1095-I1216 HydrophobicContact CB-CG1 4.44Å; H1095-I1216 HydrophobicContact CB-CG2 3.75Å
1096K78.8Confident72.4Confident104 Ų10463.8 Ų63.845%0.45232%0.319SS..Hα-helixtrans-57.7-45.7173.2-177.2179.2172.2-175.30112S1092 I1098 L1099 E1100S1092-K1096 WeakPolarHBondContact O-CB 3.48Å; S1092-K1096 PolarHBondContact O-N 3.49Å; K1096-I1098 VanDerWaalsContact C-N 3.31Å; K1096-I1098 PolarHBondContact O-N 3.19Å; K1096-L1099 PolarHBondContact O-N 3.11Å; K1096-E1100 WeakPolarHBondContact CE-OE1 3.35Å; K1096-E1100 WeakPolarHBondContact O-CG 3.43Å; K1096-E1100 PolarHBondContact O-N 2.92Å
1097G78Confident74.5Confident37 Ų3765.2 Ų65.238%0.38132%0.324SS..Hα-helixtrans-62.4-33.4177.200000114.2D1093 I1094 H1095 H1101D1093-G1097 PolarHBondContact O-N 3.24Å; I1094-G1097 PolarHBondContact O-N 2.94Å; H1095-G1097 PolarHBondContact O-N 3.46Å; G1097-H1101 WeakPolarHBondContact O-CB 3.45Å; G1097-H1101 PolarHBondContact O-N 2.9Å; G1097-H1101 VanDerWaalsContact O-N 3.08Å
1098I82.2Confident76.2Confident29 Ų2966.7 Ų66.715%0.14933%0.329CS..Hα-helixtrans-67.8-42.8174.3-66.6166.4000110.8I1094 H1095 K1096 H1101 S1102 L1157 L1161I1094-I1098 HydrophobicContact CG2-CD1 4.23Å; I1094-I1098 WeakPolarHBondContact O-CG1 3.48Å; I1094-I1098 PolarHBondContact O-N 3.49Å; I1094-I1098 VanDerWaalsContact O-N 3.16Å; H1095-I1098 PolarHBondContact O-N 3.07Å; K1096-I1098 VanDerWaalsContact C-N 3.31Å; K1096-I1098 PolarHBondContact O-N 3.19Å; I1098-H1101 PolarHBondContact O-N 3.3Å; I1098-S1102 WeakPolarHBondContact O-CB 3.38Å; I1098-S1102 PolarHBondContact O-N 3.45Å; I1098-L1157 HydrophobicContact CG2-CD2 4.24Å; I1098-L1157 HydrophobicContact CG2-CG 4.34Å; I1098-L1161 HydrophobicContact CD1-CD1 3.77Å; I1098-L1161 HydrophobicContact CG2-CD1 4.25Å; I1098-L1161 HydrophobicContact CG2-CD2 4.06Å
1099L85.6Confident77.9Confident19 Ų1963.1 Ų63.110%0.09931%0.31CS..Hα-helixtrans-65.8-46.9178.1-67.6168.9000112.2H1095 K1096 H1101 S1102 G1103 L1158 L1161 I1216 N1219 A1220 L1223H1095-L1099 WeakPolarHBondContact O-CG 3.47Å; H1095-L1099 PolarHBondContact O-N 3.5Å; H1095-L1099 VanDerWaalsContact O-N 3.11Å; K1096-L1099 PolarHBondContact O-N 3.11Å; L1099-H1101 VanDerWaalsContact C-N 3.31Å; L1099-H1101 PolarHBondContact O-N 3.28Å; L1099-S1102 PolarHBondContact O-N 2.9Å; L1099-G1103 PolarHBondContact O-N 3.45Å; L1099-L1158 HydrophobicContact CD2-CD2 3.95Å; L1099-L1161 HydrophobicContact CD2-CD2 4.11Å; L1099-L1161 HydrophobicContact CG-CD2 4.32Å; L1099-I1216 HydrophobicContact CD1-CG2 4.07Å; L1099-N1219 HydrophobicContact CD1-CB 3.86Å; L1099-A1220 HydrophobicContact CD2-CB 3.9Å; L1099-L1223 HydrophobicContact CD2-CD2 4.2Å
1100E83.5Confident79.5Confident117 Ų11758.6 Ų58.655%0.54730%0.297SS..Hα-helixtrans-60.7-39.3175.8-71.9177.8-175.300111.9K1096 T1104K1096-E1100 WeakPolarHBondContact CE-OE1 3.35Å; K1096-E1100 WeakPolarHBondContact O-CG 3.43Å; K1096-E1100 PolarHBondContact O-N 2.92Å; E1100-T1104 WeakPolarHBondContact O-CG2 3.42Å; E1100-T1104 PolarHBondContact O-N 3.45Å; E1100-T1104 VanDerWaalsContact O-N 3.08Å; E1100-T1104 PolarHBondContact O-OG1 3.22Å
1101H82.7Confident80.9Confident54 Ų5455.9 Ų55.925%0.2530%0.296CS..Hα-helixtrans-65.2-45.4173.5-168.364.5000112.1I1050 G1097 I1098 L1099 G1103 T1104 R1105I1050-H1101 HydrophobicContact CD1-CB 4.21Å; I1050-H1101 WeakPolarHBondContact CD1-CD2 3.48Å; I1050-H1101 VanDerWaalsContact CD1-CG 3.41Å; I1050-H1101 WeakPolarHBondContact CD1-NE2 3.38Å; G1097-H1101 WeakPolarHBondContact O-CB 3.45Å; G1097-H1101 PolarHBondContact O-N 2.9Å; G1097-H1101 VanDerWaalsContact O-N 3.08Å; I1098-H1101 PolarHBondContact O-N 3.3Å; L1099-H1101 VanDerWaalsContact C-N 3.31Å; L1099-H1101 PolarHBondContact O-N 3.28Å; H1101-G1103 VanDerWaalsContact C-N 3.33Å; H1101-G1103 PolarHBondContact O-N 3.47Å; H1101-T1104 PolarHBondContact O-N 2.94Å; H1101-T1104 PolarHBondContact O-OG1 3.2Å; H1101-R1105 PolarHBondContact CE1-NE 2.91Å; H1101-R1105 VanDerWaalsContact CE1-NE 3.27Å; H1101-R1105 PolarHBondContact NE2-NE 3.39Å; H1101-R1105 WeakPolarHBondContact O-CB 3.46Å; H1101-R1105 WeakPolarHBondContact O-CG 3.28Å; H1101-R1105 PolarHBondContact O-N 3.29Å
1102S85.9Confident82.1Confident0 Ų058.3 Ų58.30%031%0.305CS..Hα-helixtrans-67.4-32.9-177.3-170.70000112.4I1098 L1099 L1106 H1154 L1223 W1227I1098-S1102 WeakPolarHBondContact O-CB 3.38Å; I1098-S1102 PolarHBondContact O-N 3.45Å; L1099-S1102 PolarHBondContact O-N 2.9Å; S1102-L1106 PolarHBondContact O-N 3.45Å; S1102-L1106 VanDerWaalsContact O-N 3.15Å; S1102-H1154 PolarHBondContact OG-ND1 2.92Å; S1102-L1223 VanDerWaalsContact CB-CD2 3.47Å; S1102-W1227 PolarHBondContact O-NE1 3.07Å; S1102-W1227 PolarHBondContact OG-NE1 3.02Å; S1102-W1227 VanDerWaalsContact OG-NE1 3.11Å
1103G84.5Confident83Confident19 Ų1957.5 Ų57.520%0.19630%0.299CS..Hα-helixtrans-73.7-41.5174.600000113.8L1099 H1101 R1105 L1106 M1107L1099-G1103 PolarHBondContact O-N 3.45Å; H1101-G1103 VanDerWaalsContact C-N 3.33Å; H1101-G1103 PolarHBondContact O-N 3.47Å; G1103-R1105 PolarHBondContact O-N 3.45Å; G1103-L1106 PolarHBondContact O-N 3.08Å; G1103-M1107 PolarHBondContact O-N 2.93Å
1104T86.8Confident83.5Confident91 Ų9155.8 Ų55.856%0.55829%0.287SS*.Hα-helixtrans-65.3-28.5173.749.60000112.5E1100 H1101 H1108E1100-T1104 WeakPolarHBondContact O-CG2 3.42Å; E1100-T1104 PolarHBondContact O-N 3.45Å; E1100-T1104 VanDerWaalsContact O-N 3.08Å; E1100-T1104 PolarHBondContact O-OG1 3.22Å; H1101-T1104 PolarHBondContact O-N 2.94Å; H1101-T1104 PolarHBondContact O-OG1 3.2Å; T1104-H1108 PolarHBondContact O-N 3.25Å
1105R87.8Confident83.9Confident50 Ų5056.6 Ų56.619%0.18929%0.289CS..Hα-helixtrans-70.2-41172-73.6-71-168.4-1735.8113.5Y1047 H1101 G1103 H1108 A1109 W1227Y1047-R1105 VanDerWaalsContact CE1-NH1 3.28Å; H1101-R1105 PolarHBondContact CE1-NE 2.91Å; H1101-R1105 VanDerWaalsContact CE1-NE 3.27Å; H1101-R1105 PolarHBondContact NE2-NE 3.39Å; H1101-R1105 WeakPolarHBondContact O-CB 3.46Å; H1101-R1105 WeakPolarHBondContact O-CG 3.28Å; H1101-R1105 PolarHBondContact O-N 3.29Å; G1103-R1105 PolarHBondContact O-N 3.45Å; R1105-H1108 PolarHBondContact O-N 2.93Å; R1105-A1109 WeakPolarHBondContact O-CB 3.28Å; R1105-A1109 PolarHBondContact O-N 3.34Å; R1105-W1227 HydrophobicContact CB-CH2 4.24Å; R1105-W1227 HydrophobicContact CB-CZ2 3.76Å
1106L89.5Confident84Confident5 Ų557 Ų573%0.02629%0.291CS..Hα-helixtrans-58.2-52.9175.4-179.673.1000110.8S1102 G1103 H1108 A1109 E1110 Q1226 W1227 F1230S1102-L1106 PolarHBondContact O-N 3.45Å; S1102-L1106 VanDerWaalsContact O-N 3.15Å; G1103-L1106 PolarHBondContact O-N 3.08Å; L1106-H1108 PolarHBondContact O-N 3.44Å; L1106-A1109 WeakPolarHBondContact O-CA 3.26Å; L1106-A1109 WeakPolarHBondContact O-CB 3.49Å; L1106-A1109 PolarHBondContact O-N 2.9Å; L1106-E1110 WeakPolarHBondContact O-CG 3.32Å; L1106-E1110 PolarHBondContact O-N 3.39Å; L1106-Q1226 HydrophobicContact CD2-CB 3.62Å; L1106-Q1226 HydrophobicContact CD2-CG 4.38Å; L1106-W1227 HydrophobicContact CB-CH2 4.5Å; L1106-W1227 HydrophobicContact CB-CZ2 3.94Å; L1106-W1227 HydrophobicContact CD1-CD2 3.86Å; L1106-W1227 HydrophobicContact CD1-CE3 3.94Å; L1106-W1227 HydrophobicContact CD1-CG 4.29Å; L1106-W1227 HydrophobicContact CD1-CZ3 4.32Å; L1106-W1227 VanDerWaalsContact N-CZ2 3.35Å; L1106-F1230 HydrophobicContact CD1-CB 3.87Å; L1106-F1230 HydrophobicContact CD1-CG 4.15Å
1107M85.4Confident84Confident114 Ų11452.9 Ų52.956%0.56227%0.274SS*.Hα-helixtrans-55.1-37.7177.2-67.9-61.4-5300112.7G1103 T1111G1103-M1107 PolarHBondContact O-N 2.93Å; M1107-T1111 WeakPolarHBondContact O-CB 3.22Å; M1107-T1111 PolarHBondContact O-N 2.96Å; M1107-T1111 PolarHBondContact O-OG1 3.37Å
1108H84.5Confident84Confident103 Ų10354 Ų5448%0.47727%0.272SS..Hα-helixtrans-71.4-38.1176-174.3-74.1000112.2T1104 R1105 L1106 T1111 Y1112T1104-H1108 PolarHBondContact O-N 3.25Å; R1105-H1108 PolarHBondContact O-N 2.93Å; L1106-H1108 PolarHBondContact O-N 3.44Å; H1108-T1111 PolarHBondContact O-N 2.95Å; H1108-Y1112 VanDerWaalsContact O-CB 3.31Å; H1108-Y1112 WeakPolarHBondContact O-CB 3.49Å; H1108-Y1112 PolarHBondContact O-N 2.97Å
1109A87.2Confident83.5Confident6 Ų655.6 Ų55.65%0.0528%0.28CS..Hα-helixtrans-66.4-43.7177.100000111.7R1105 L1106 Y1112 L1113 L1147 W1227 F1230R1105-A1109 WeakPolarHBondContact O-CB 3.28Å; R1105-A1109 PolarHBondContact O-N 3.34Å; L1106-A1109 WeakPolarHBondContact O-CA 3.26Å; L1106-A1109 WeakPolarHBondContact O-CB 3.49Å; L1106-A1109 PolarHBondContact O-N 2.9Å; A1109-Y1112 PolarHBondContact O-N 3.3Å; A1109-L1113 WeakPolarHBondContact O-CB 3.23Å; A1109-L1113 PolarHBondContact O-N 3.35Å; A1109-L1147 HydrophobicContact CB-CD2 3.99Å; A1109-W1227 HydrophobicContact CB-CH2 4.13Å; A1109-W1227 HydrophobicContact CB-CZ3 4.21Å; A1109-F1230 HydrophobicContact CB-CE1 3.8Å; A1109-F1230 HydrophobicContact CB-CE2 4.15Å; A1109-F1230 HydrophobicContact CB-CZ 3.58Å
1110E85.6Confident82.5Confident81 Ų8159 Ų5938%0.37930%0.301SS..Hα-helixtrans-59.9-47.6171.7-69.1175.4170.600111.9L1106 Y1112 L1113 Q1114 F1230L1106-E1110 WeakPolarHBondContact O-CG 3.32Å; L1106-E1110 PolarHBondContact O-N 3.39Å; E1110-Y1112 VanDerWaalsContact C-N 3.28Å; E1110-Y1112 PolarHBondContact O-N 3.49Å; E1110-L1113 PolarHBondContact O-N 3.11Å; E1110-Q1114 WeakPolarHBondContact O-CB 3.29Å; E1110-Q1114 PolarHBondContact O-N 3.01Å; E1110-F1230 HydrophobicContact CG-CD2 3.82Å; E1110-F1230 HydrophobicContact CG-CE2 3.98Å
1111T86.1Confident81.7Confident92 Ų9257.7 Ų57.756%0.56429%0.294SS*.Hα-helixtrans-60.6-38.6176.8-59.50000111.8M1107 H1108 H1115M1107-T1111 WeakPolarHBondContact O-CB 3.22Å; M1107-T1111 PolarHBondContact O-N 2.96Å; M1107-T1111 PolarHBondContact O-OG1 3.37Å; H1108-T1111 PolarHBondContact O-N 2.95Å; T1111-H1115 WeakPolarHBondContact O-CB 3.35Å; T1111-H1115 PolarHBondContact O-N 2.9Å
1112Y84Confident80.7Confident73 Ų7362.7 Ų62.729%0.28631%0.311SS..Hα-helixtrans-70.6-41.8177.5-174.1-99.3000112.4H1108 A1109 E1110 H1115 L1116 R1143 L1147H1108-Y1112 VanDerWaalsContact O-CB 3.31Å; H1108-Y1112 WeakPolarHBondContact O-CB 3.49Å; H1108-Y1112 PolarHBondContact O-N 2.97Å; A1109-Y1112 PolarHBondContact O-N 3.3Å; E1110-Y1112 VanDerWaalsContact C-N 3.28Å; E1110-Y1112 PolarHBondContact O-N 3.49Å; Y1112-H1115 PolarHBondContact O-N 2.76Å; Y1112-L1116 HydrophobicContact CD1-CD1 3.84Å; Y1112-L1116 HydrophobicContact CD1-CG 4.42Å; Y1112-L1116 HydrophobicContact CE1-CD1 3.61Å; Y1112-L1116 HydrophobicContact CE1-CG 4.19Å; Y1112-L1116 PolarHBondContact O-N 3.08Å; Y1112-R1143 HydrophobicContact CE1-CB 4.26Å; Y1112-R1143 WeakPolarHBondContact OH-CD 3.38Å; Y1112-R1143 WeakPolarHBondContact OH-CG 3.18Å; Y1112-L1147 HydrophobicContact CD1-CD1 4.03Å; Y1112-L1147 HydrophobicContact CD1-CD2 3.88Å; Y1112-L1147 HydrophobicContact CD1-CG 3.97Å; Y1112-L1147 HydrophobicContact CE1-CG 4.34Å
1113L84.8Confident79.2Confident5 Ų566.5 Ų66.53%0.02633%0.331CS..Hα-helixtrans-60.4-44.7173.1-177.462.3000111.1A1109 E1110 H1115 L1116 I1117 L1147 F1230 T1233 V1234 I1237A1109-L1113 WeakPolarHBondContact O-CB 3.23Å; A1109-L1113 PolarHBondContact O-N 3.35Å; E1110-L1113 PolarHBondContact O-N 3.11Å; L1113-H1115 VanDerWaalsContact C-N 3.31Å; L1113-H1115 PolarHBondContact O-N 2.99Å; L1113-L1116 WeakPolarHBondContact O-CB 3.42Å; L1113-L1116 PolarHBondContact O-N 3.29Å; L1113-L1116 VanDerWaalsContact O-N 3.14Å; L1113-I1117 HydrophobicContact CD1-CD1 4.47Å; L1113-I1117 HydrophobicContact CG-CD1 4.17Å; L1113-I1117 WeakPolarHBondContact O-CG1 3.4Å; L1113-I1117 PolarHBondContact O-N 3.44Å; L1113-L1147 HydrophobicContact CB-CD1 4.05Å; L1113-L1147 HydrophobicContact CD1-CD1 3.98Å; L1113-F1230 HydrophobicContact CB-CE2 4.28Å; L1113-F1230 HydrophobicContact CB-CZ 4.45Å; L1113-F1230 HydrophobicContact CD2-CE2 3.83Å; L1113-F1230 HydrophobicContact CD2-CZ 4.34Å; L1113-T1233 HydrophobicContact CD2-CG2 4.44Å; L1113-V1234 HydrophobicContact CD1-CG2 4.5Å; L1113-V1234 HydrophobicContact CD2-CG2 4.09Å; L1113-I1237 HydrophobicContact CD1-CD1 4.1Å; L1113-I1237 HydrophobicContact CD2-CD1 4.37Å
1114Q83.1Confident77.5Confident68 Ų6870.1 Ų70.132%0.31835%0.353SS..Hα-helixtrans-66.6-32.2176.6-167.865.6-16.300112.1E1110 N1118E1110-Q1114 WeakPolarHBondContact O-CB 3.29Å; E1110-Q1114 PolarHBondContact O-N 3.01Å; Q1114-N1118 WeakPolarHBondContact O-CB 3.42Å; Q1114-N1118 PolarHBondContact O-N 3.34Å; Q1114-N1118 VanDerWaalsContact O-N 3.11Å; Q1114-N1118 PolarHBondContact O-ND2 3.08Å
1115H80Confident75.4Confident108 Ų10869.8 Ų69.850%0.536%0.355SS..Hα-helixtrans-68.6-38.5170.8-167-28.1000112T1111 Y1112 L1113 N1118 L1119T1111-H1115 WeakPolarHBondContact O-CB 3.35Å; T1111-H1115 PolarHBondContact O-N 2.9Å; Y1112-H1115 PolarHBondContact O-N 2.76Å; L1113-H1115 VanDerWaalsContact C-N 3.31Å; L1113-H1115 PolarHBondContact O-N 2.99Å; H1115-N1118 PolarHBondContact O-N 3.07Å; H1115-L1119 WeakPolarHBondContact O-CG 3.26Å; H1115-L1119 PolarHBondContact O-N 3.2Å
1116L78.2Confident73.2Confident21 Ų2171.8 Ų71.811%0.1137%0.372CS..Hα-helixtrans-60.6-50.9174.6-80.9167.5000111.7Y1112 L1113 N1118 L1119 V1120 R1143 L1147Y1112-L1116 HydrophobicContact CD1-CD1 3.84Å; Y1112-L1116 HydrophobicContact CD1-CG 4.42Å; Y1112-L1116 HydrophobicContact CE1-CD1 3.61Å; Y1112-L1116 HydrophobicContact CE1-CG 4.19Å; Y1112-L1116 PolarHBondContact O-N 3.08Å; L1113-L1116 WeakPolarHBondContact O-CB 3.42Å; L1113-L1116 PolarHBondContact O-N 3.29Å; L1113-L1116 VanDerWaalsContact O-N 3.14Å; L1116-N1118 VanDerWaalsContact C-N 3.29Å; L1116-N1118 PolarHBondContact O-N 3.18Å; L1116-L1119 WeakPolarHBondContact O-CB 3.46Å; L1116-L1119 PolarHBondContact O-N 3.5Å; L1116-V1120 PolarHBondContact O-N 3.34Å; L1116-R1143 HydrophobicContact CD1-CB 4.17Å; L1116-R1143 HydrophobicContact CD2-CB 4.25Å; L1116-L1147 HydrophobicContact CD1-CD1 4.13Å
1117I77.8Confident70.7Confident19 Ų1980.8 Ų80.810%0.09741%0.414CS..Hα-helixtrans-58.4-42.8177.9-65.7164.8000110.6L1113 L1119 V1120 K1121 I1237 I1348L1113-I1117 HydrophobicContact CD1-CD1 4.47Å; L1113-I1117 HydrophobicContact CG-CD1 4.17Å; L1113-I1117 WeakPolarHBondContact O-CG1 3.4Å; L1113-I1117 PolarHBondContact O-N 3.44Å; I1117-L1119 VanDerWaalsContact C-N 3.34Å; I1117-L1119 PolarHBondContact O-N 3.45Å; I1117-V1120 PolarHBondContact O-N 3.04Å; I1117-K1121 PolarHBondContact O-N 2.89Å; I1117-I1237 HydrophobicContact CD1-CD1 4.46Å; I1117-I1348 HydrophobicContact CD1-CG2 3.93Å
1118N78Confident68.4Low61 Ų6184.3 Ų84.333%0.32642%0.421SS..Hα-helixtrans-69.2-25.2176.5-79.3-59.1000114.4Q1114 H1115 L1116 R1122Q1114-N1118 WeakPolarHBondContact O-CB 3.42Å; Q1114-N1118 PolarHBondContact O-N 3.34Å; Q1114-N1118 VanDerWaalsContact O-N 3.11Å; Q1114-N1118 PolarHBondContact O-ND2 3.08Å; H1115-N1118 PolarHBondContact O-N 3.07Å; L1116-N1118 VanDerWaalsContact C-N 3.29Å; L1116-N1118 PolarHBondContact O-N 3.18Å; N1118-R1122 WeakPolarHBondContact O-CB 3.23Å; N1118-R1122 WeakPolarHBondContact O-CG 3.39Å; N1118-R1122 PolarHBondContact O-N 3.29Å
1119L71.7Confident66.6Low62 Ų6290.4 Ų90.433%0.32544%0.44SS..Hα-helixtrans-71.1-46.3169.7-79165.2000110.7H1115 L1116 I1117 K1121 R1122 N1123H1115-L1119 WeakPolarHBondContact O-CG 3.26Å; H1115-L1119 PolarHBondContact O-N 3.2Å; L1116-L1119 WeakPolarHBondContact O-CB 3.46Å; L1116-L1119 PolarHBondContact O-N 3.5Å; I1117-L1119 VanDerWaalsContact C-N 3.34Å; I1117-L1119 PolarHBondContact O-N 3.45Å; L1119-K1121 PolarHBondContact O-N 2.91Å; L1119-R1122 PolarHBondContact O-N 3.48Å; L1119-N1123 PolarHBondContact O-N 3.05Å; L1119-N1123 PolarHBondContact O-ND2 2.98Å; L1119-N1123 VanDerWaalsContact O-ND2 3.09Å
1120V65.7Low64.2Low90 Ų9097.4 Ų97.455%0.54548%0.477SS..Hα-helixtrans-56.9-49.1176.2176.40000110.6L1116 I1117 R1122 N1123 S1124L1116-V1120 PolarHBondContact O-N 3.34Å; I1117-V1120 PolarHBondContact O-N 3.04Å; V1120-R1122 VanDerWaalsContact C-N 3.33Å; V1120-R1122 PolarHBondContact O-N 2.78Å; V1120-N1123 PolarHBondContact O-N 2.95Å; V1120-N1123 VanDerWaalsContact O-N 3.13Å; V1120-S1124 PolarHBondContact O-N 3.3Å; V1120-S1124 PolarHBondContact O-OG 3.07Å
1121K66.6Low62Low89 Ų8998.8 Ų98.839%0.38749%0.486SS..Hα-helixtrans-60.5-33.8176.4-75.2-173.8172.6-176.80114.8I1117 L1119 S1124 S1125 T1351I1117-K1121 PolarHBondContact O-N 2.89Å; L1119-K1121 PolarHBondContact O-N 2.91Å; K1121-S1124 PolarHBondContact O-OG 3.3Å; K1121-S1125 PolarHBondContact O-N 2.98Å; K1121-S1125 PolarHBondContact O-OG 2.93Å; K1121-T1351 WeakPolarHBondContact CE-O 3.44Å
1122R62.4Low59.7Low159 Ų15998.4 Ų98.460%0.649%0.487SS*.Hα-helixtrans-74.9-32175.6-78.9177174.5144.91.7112.1N1118 L1119 V1120 S1125 V1126N1118-R1122 WeakPolarHBondContact O-CB 3.23Å; N1118-R1122 WeakPolarHBondContact O-CG 3.39Å; N1118-R1122 PolarHBondContact O-N 3.29Å; L1119-R1122 PolarHBondContact O-N 3.48Å; V1120-R1122 VanDerWaalsContact C-N 3.33Å; V1120-R1122 PolarHBondContact O-N 2.78Å; R1122-S1125 PolarHBondContact O-OG 2.87Å; R1122-V1126 VanDerWaalsContact O-CG2 3.28Å; R1122-V1126 WeakPolarHBondContact O-CG2 3.44Å; R1122-V1126 PolarHBondContact O-N 3.21Å
1123N54.1Low57.7Low80 Ų80103.8 Ų103.843%0.42851%0.512SS..Hα-helixtrans-78.8-24.9178.9-63.6-28.6000113L1119 V1120L1119-N1123 PolarHBondContact O-N 3.05Å; L1119-N1123 PolarHBondContact O-ND2 2.98Å; L1119-N1123 VanDerWaalsContact O-ND2 3.09Å; V1120-N1123 PolarHBondContact O-N 2.95Å; V1120-N1123 VanDerWaalsContact O-N 3.13Å
1124S47.5Very low55.4Low95 Ų95111 Ų11166%0.66455%0.546SS*.Hα-helixtrans-79.6-30.2171.158.90000113.7V1120 K1121V1120-S1124 PolarHBondContact O-N 3.3Å; V1120-S1124 PolarHBondContact O-OG 3.07Å; K1121-S1124 PolarHBondContact O-OG 3.3Å
1125S42.9Very low53.4Low85 Ų85111.4 Ų111.459%0.59455%0.553SS**Hα-helixtrans-87.2-23.1-179.150.80000115K1121 R1122 Q1127K1121-S1125 PolarHBondContact O-N 2.98Å; K1121-S1125 PolarHBondContact O-OG 2.93Å; R1122-S1125 PolarHBondContact O-OG 2.87Å; S1125-Q1127 PolarHBondContact O-N 2.85Å
1126V42.2Very low51.9Low92 Ų92110.9 Ų110.956%0.55855%0.554SS**  trans-83.798.2179.3175.60000111R1122 R1128R1122-V1126 VanDerWaalsContact O-CG2 3.28Å; R1122-V1126 WeakPolarHBondContact O-CG2 3.44Å; R1122-V1126 PolarHBondContact O-N 3.21Å; V1126-R1128 HydrophobicContact CG1-CB 4.35Å; V1126-R1128 HydrophobicContact CG1-CG 4.26Å; V1126-R1128 PolarHBondContact O-N 3.06Å
1127Q37.6Very low50.5Low193 Ų193112.2 Ų112.290%0.90256%0.564SS**  trans-67.928.8-172.7-149.3178.126.300116.1S1125S1125-Q1127 PolarHBondContact O-N 2.85Å
1128R37.4Very low49.4Very low188 Ų188114.7 Ų114.771%0.70958%0.584SS**  trans-93.9103.5-179.7-71.3-170.2175.3-163.7-1.6111.7V1126 N1130 L1131V1126-R1128 HydrophobicContact CG1-CB 4.35Å; V1126-R1128 HydrophobicContact CG1-CG 4.26Å; V1126-R1128 PolarHBondContact O-N 3.06Å; R1128-N1130 PolarHBondContact O-N 2.71Å; R1128-L1131 PolarHBondContact O-N 2.66Å
1129R44.8Very low48.8Very low232 Ų232114.9 Ų114.988%0.87559%0.585SS**THydrogen-bonded Turntrans-51.1-20.8-171.4-66178.5179156.3-0.2116.7
1130N38.5Very low48.6Very low153 Ų153114.8 Ų114.882%0.81858%0.58SS**THydrogen-bonded Turntrans-101.5-9.9-170.3-62.97.7000115R1128R1128-N1130 PolarHBondContact O-N 2.71Å
1131L38.3Very low48.8Very low109 Ų109114.1 Ų114.157%0.57157%0.568SS**THydrogen-bonded Turntrans-102.8-18.3-174.5-83.5159.7000114.7R1128 K1133 Q1134R1128-L1131 PolarHBondContact O-N 2.66Å; L1131-K1133 PolarHBondContact O-N 2.82Å; L1131-Q1134 PolarHBondContact O-N 3.3Å
1132S38.9Very low49.1Very low85 Ų85116 Ų11659%0.59458%0.578SS**G310 helixtrans-66.2-20.5-176.4540000114.4Q1134S1132-Q1134 VanDerWaalsContact C-N 3.33Å; S1132-Q1134 PolarHBondContact O-N 3.14Å
1133K40.7Very low49.7Very low186 Ų186112.2 Ų112.281%0.80956%0.563SS**G310 helixtrans-71-20.9177.8-70.8-172.7177.2-177.30114.3L1131L1131-K1133 PolarHBondContact O-N 2.82Å
1134Q36.6Very low50.9Low156 Ų156108.9 Ų108.973%0.72955%0.546SS*.G310 helixtrans-86-12.8-173.1-111.3-177.91.400114.7L1131 S1132 N1136L1131-Q1134 PolarHBondContact O-N 3.3Å; S1132-Q1134 VanDerWaalsContact C-N 3.33Å; S1132-Q1134 PolarHBondContact O-N 3.14Å; Q1134-N1136 PolarHBondContact O-N 2.91Å; Q1134-N1136 VanDerWaalsContact O-N 3.1Å
1135V41.1Very low52.4Low77 Ų77106.6 Ų106.647%0.46753%0.526SS..SBendtrans-89.168.5174.6-171.10000108.7
1136N48.5Very low54.2Low97 Ų97106.6 Ų106.652%0.51952%0.519SS..  trans-49140.6-178.9-78.7-17.4000112Q1134 S1138 N1139Q1134-N1136 PolarHBondContact O-N 2.91Å; Q1134-N1136 VanDerWaalsContact O-N 3.1Å; N1136-S1138 PolarHBondContact O-N 3.05Å; N1136-N1139 HydrophobicContact CB-CB 4.47Å; N1136-N1139 WeakPolarHBondContact O-CB 3.5Å; N1136-N1139 PolarHBondContact O-N 3.45Å
1137S48.8Very low56.3Low48 Ų48102.7 Ų102.734%0.33650%0.495SS..Hα-helixtrans-61.6-23.5176.249.90000113.4N1139 W1140 R1141S1137-N1139 VanDerWaalsContact C-N 3.34Å; S1137-W1140 PolarHBondContact O-NE1 2.9Å; S1137-R1141 WeakPolarHBondContact O-CG 3.4Å; S1137-R1141 PolarHBondContact O-N 3.44Å
1138S55Low58.7Low72 Ų7295.2 Ų95.250%0.50346%0.461SS..Hα-helixtrans-67.5-28.7169.854.70000113.9N1136 H1142N1136-S1138 PolarHBondContact O-N 3.05Å; S1138-H1142 VanDerWaalsContact O-CB 3.31Å; S1138-H1142 WeakPolarHBondContact O-CB 3.42Å; S1138-H1142 PolarHBondContact O-N 3.31Å
1139N64.7Low60.9Low64 Ų6491.5 Ų91.534%0.34245%0.452SS..Hα-helixtrans-78.6-29.4-174.3-162.1-10.1000112.3N1136 S1137 R1143N1136-N1139 HydrophobicContact CB-CB 4.47Å; N1136-N1139 WeakPolarHBondContact O-CB 3.5Å; N1136-N1139 PolarHBondContact O-N 3.45Å; S1137-N1139 VanDerWaalsContact C-N 3.34Å; N1139-R1143 WeakPolarHBondContact O-CD 3.45Å; N1139-R1143 WeakPolarHBondContact O-CG 3.14Å; N1139-R1143 PolarHBondContact O-NE 3.22Å; N1139-R1143 VanDerWaalsContact OD1-CZ 3.29Å; N1139-R1143 PolarHBondContact OD1-NE 3.39Å; N1139-R1143 PolarHBondContact OD1-NH2 3.15Å
1140W68.9Low62.9Low60 Ų6082.8 Ų82.823%0.22742%0.424CS..Hα-helixtrans-77.7-43.3168.969.5-108.2000111.2S1137 H1142 R1143 T1144 Y1238 S1241S1137-W1140 PolarHBondContact O-NE1 2.9Å; W1140-H1142 PolarHBondContact O-N 3.17Å; W1140-R1143 PolarHBondContact O-N 3.47Å; W1140-R1143 VanDerWaalsContact O-N 3.09Å; W1140-T1144 PolarHBondContact O-N 2.93Å; W1140-T1144 PolarHBondContact O-OG1 3.49Å; W1140-Y1238 HydrophobicContact CZ3-CD2 4.36Å; W1140-S1241 WeakPolarHBondContact CH2-OG 3.25Å; W1140-S1241 WeakPolarHBondContact CZ3-OG 3.49Å
1141R69.9Low65.2Low77 Ų7775.5 Ų75.529%0.29139%0.385SS..Hα-helixtrans-52.8-56177.5-80.1-178.9172.1156.70.6111.6S1137 R1143 T1144 D1145 N1242S1137-R1141 WeakPolarHBondContact O-CG 3.4Å; S1137-R1141 PolarHBondContact O-N 3.44Å; R1141-R1143 PolarHBondContact O-N 3.25Å; R1141-T1144 WeakPolarHBondContact CA-OG1 3.45Å; R1141-T1144 PolarHBondContact O-N 3.08Å; R1141-T1144 PolarHBondContact O-OG1 3.38Å; R1141-D1145 WeakPolarHBondContact O-CB 3.5Å; R1141-D1145 PolarHBondContact O-N 3.2Å; R1141-N1242 PolarHBondContact NE-OD1 3.17Å; R1141-N1242 PolarHBondContact NH2-OD1 3.06Å
1142H71.7Confident67.4Low129 Ų12974.2 Ų74.260%0.59738%0.376SS*.Hα-helixtrans-57.1-28.9-178.8-173.944.8000113.6S1138 W1140 L1146S1138-H1142 VanDerWaalsContact O-CB 3.31Å; S1138-H1142 WeakPolarHBondContact O-CB 3.42Å; S1138-H1142 PolarHBondContact O-N 3.31Å; W1140-H1142 PolarHBondContact O-N 3.17Å; H1142-L1146 VanDerWaalsContact O-CB 3.31Å; H1142-L1146 WeakPolarHBondContact O-CB 3.28Å; H1142-L1146 PolarHBondContact O-N 2.76Å; H1142-L1146 VanDerWaalsContact O-N 3.14Å
1143R76.7Confident69.6Low79 Ų7972.9 Ų72.930%0.29837%0.371SS..Hα-helixtrans-83.7-33.3177.8-64.4173.5-166.5-141.60.8113.1Y1112 L1116 N1139 W1140 R1141 L1147Y1112-R1143 HydrophobicContact CE1-CB 4.26Å; Y1112-R1143 WeakPolarHBondContact OH-CD 3.38Å; Y1112-R1143 WeakPolarHBondContact OH-CG 3.18Å; L1116-R1143 HydrophobicContact CD1-CB 4.17Å; L1116-R1143 HydrophobicContact CD2-CB 4.25Å; N1139-R1143 WeakPolarHBondContact O-CD 3.45Å; N1139-R1143 WeakPolarHBondContact O-CG 3.14Å; N1139-R1143 PolarHBondContact O-NE 3.22Å; N1139-R1143 VanDerWaalsContact OD1-CZ 3.29Å; N1139-R1143 PolarHBondContact OD1-NE 3.39Å; N1139-R1143 PolarHBondContact OD1-NH2 3.15Å; W1140-R1143 PolarHBondContact O-N 3.47Å; W1140-R1143 VanDerWaalsContact O-N 3.09Å; R1141-R1143 PolarHBondContact O-N 3.25Å; R1143-L1147 PolarHBondContact O-N 3.33Å; R1143-L1147 VanDerWaalsContact O-N 3.1Å
1144T78.6Confident71.8Confident9 Ų965 Ų656%0.05534%0.337CS..Hα-helixtrans-73.1-37.3170.944.90000111.7W1140 R1141 L1146 L1147 L1148W1140-T1144 PolarHBondContact O-N 2.93Å; W1140-T1144 PolarHBondContact O-OG1 3.49Å; R1141-T1144 WeakPolarHBondContact CA-OG1 3.45Å; R1141-T1144 PolarHBondContact O-N 3.08Å; R1141-T1144 PolarHBondContact O-OG1 3.38Å; T1144-L1146 VanDerWaalsContact C-N 3.33Å; T1144-L1146 PolarHBondContact O-N 3.18Å; T1144-L1147 PolarHBondContact O-N 3.39Å; T1144-L1148 WeakPolarHBondContact O-CB 3.49Å; T1144-L1148 PolarHBondContact O-N 2.83Å
1145D78.3Confident74.2Confident47 Ų4759.1 Ų59.125%0.25131%0.311SS..Hα-helixtrans-59.6-44.3171.6-60.3-39.3000110.3R1141 L1148 Q1149 Y1238R1141-D1145 WeakPolarHBondContact O-CB 3.5Å; R1141-D1145 PolarHBondContact O-N 3.2Å; D1145-L1148 PolarHBondContact O-N 3.25Å; D1145-Q1149 WeakPolarHBondContact O-CG 3.41Å; D1145-Q1149 PolarHBondContact O-N 3.42Å; D1145-Y1238 WeakPolarHBondContact OD1-CE2 3.27Å; D1145-Y1238 PolarHBondContact OD1-OH 3.17Å; D1145-Y1238 VanDerWaalsContact OD1-OH 3.12Å
1146L81.6Confident76.4Confident86 Ų8662.5 Ų62.545%0.4532%0.32SS..Hα-helixtrans-64.7-38.9176.9-176.765.9000112.9H1142 T1144 T1150H1142-L1146 VanDerWaalsContact O-CB 3.31Å; H1142-L1146 WeakPolarHBondContact O-CB 3.28Å; H1142-L1146 PolarHBondContact O-N 2.76Å; H1142-L1146 VanDerWaalsContact O-N 3.14Å; T1144-L1146 VanDerWaalsContact C-N 3.33Å; T1144-L1146 PolarHBondContact O-N 3.18Å; L1146-T1150 WeakPolarHBondContact O-CB 3.44Å; L1146-T1150 PolarHBondContact O-N 3.25Å; L1146-T1150 PolarHBondContact O-OG1 3.15Å
1147L85.6Confident78.1Confident10 Ų1061.5 Ų61.55%0.05231%0.314CS..Hα-helixtrans-63.1-42.9172.5-82.7180000111.6A1109 Y1112 L1113 L1116 R1143 T1144 T1150 A1151 F1230 V1234A1109-L1147 HydrophobicContact CB-CD2 3.99Å; Y1112-L1147 HydrophobicContact CD1-CD1 4.03Å; Y1112-L1147 HydrophobicContact CD1-CD2 3.88Å; Y1112-L1147 HydrophobicContact CD1-CG 3.97Å; Y1112-L1147 HydrophobicContact CE1-CG 4.34Å; L1113-L1147 HydrophobicContact CB-CD1 4.05Å; L1113-L1147 HydrophobicContact CD1-CD1 3.98Å; L1116-L1147 HydrophobicContact CD1-CD1 4.13Å; R1143-L1147 PolarHBondContact O-N 3.33Å; R1143-L1147 VanDerWaalsContact O-N 3.1Å; T1144-L1147 PolarHBondContact O-N 3.39Å; L1147-T1150 WeakPolarHBondContact O-CB 3.3Å; L1147-T1150 PolarHBondContact O-N 2.73Å; L1147-A1151 PolarHBondContact O-N 3.48Å; L1147-F1230 HydrophobicContact CD1-CZ 4.26Å; L1147-F1230 HydrophobicContact CD2-CE1 4.27Å; L1147-F1230 HydrophobicContact CD2-CZ 3.98Å; L1147-V1234 HydrophobicContact CB-CG1 4.34Å; L1147-V1234 HydrophobicContact CB-CG2 4.47Å; L1147-V1234 HydrophobicContact CD1-CG2 4.43Å
1148L87.3Confident80Confident35 Ų3559.2 Ų59.218%0.18330%0.298CS..Hα-helixtrans-65.6-47.3179.9-175.360.9000111.5T1144 D1145 T1150 A1151 E1152 S1231 V1234 R1235T1144-L1148 WeakPolarHBondContact O-CB 3.49Å; T1144-L1148 PolarHBondContact O-N 2.83Å; D1145-L1148 PolarHBondContact O-N 3.25Å; L1148-T1150 VanDerWaalsContact C-N 3.26Å; L1148-T1150 PolarHBondContact O-N 3.03Å; L1148-A1151 PolarHBondContact O-N 3.33Å; L1148-A1151 VanDerWaalsContact O-N 3.11Å; L1148-E1152 HydrophobicContact CD1-CG 4.4Å; L1148-E1152 WeakPolarHBondContact O-CG 3.14Å; L1148-E1152 PolarHBondContact O-N 3.12Å; L1148-S1231 WeakPolarHBondContact CD1-OG 3.49Å; L1148-V1234 HydrophobicContact CB-CG1 4.33Å; L1148-R1235 HydrophobicContact CD1-CG 3.85Å; L1148-R1235 HydrophobicContact CD2-CG 4.29Å
1149Q85Confident81.5Confident111 Ų11156.9 Ų56.952%0.51928%0.282SS..Hα-helixtrans-58.9-36.9174-72.2175.64.700112.2D1145 A1153D1145-Q1149 WeakPolarHBondContact O-CG 3.41Å; D1145-Q1149 PolarHBondContact O-N 3.42Å; Q1149-A1153 VanDerWaalsContact O-CB 3.3Å; Q1149-A1153 WeakPolarHBondContact O-CB 3.49Å; Q1149-A1153 PolarHBondContact O-N 3.16Å
1150T85.4Confident82.4Confident48 Ų4857.7 Ų57.729%0.29429%0.286SS..Hα-helixtrans-65.5-45.2174.5-570000111.1L1146 L1147 L1148 A1153 H1154 W1227L1146-T1150 WeakPolarHBondContact O-CB 3.44Å; L1146-T1150 PolarHBondContact O-N 3.25Å; L1146-T1150 PolarHBondContact O-OG1 3.15Å; L1147-T1150 WeakPolarHBondContact O-CB 3.3Å; L1147-T1150 PolarHBondContact O-N 2.73Å; L1148-T1150 VanDerWaalsContact C-N 3.26Å; L1148-T1150 PolarHBondContact O-N 3.03Å; T1150-A1153 PolarHBondContact O-N 3.07Å; T1150-H1154 PolarHBondContact O-CD2 2.75Å; T1150-H1154 PolarHBondContact O-N 3.15Å; T1150-W1227 HydrophobicContact CG2-CH2 4.19Å
1151A87.1Confident83Confident0 Ų055.1 Ų55.10%028%0.277CS..Hα-helixtrans-64-45.4178.700000112.1L1147 L1148 A1153 H1154 V1155 W1227 F1230L1147-A1151 PolarHBondContact O-N 3.48Å; L1148-A1151 PolarHBondContact O-N 3.33Å; L1148-A1151 VanDerWaalsContact O-N 3.11Å; A1151-A1153 PolarHBondContact O-N 3.04Å; A1151-H1154 PolarHBondContact O-N 2.69Å; A1151-V1155 WeakPolarHBondContact O-CG2 3.47Å; A1151-V1155 PolarHBondContact O-N 2.88Å; A1151-W1227 HydrophobicContact CB-CE3 3.73Å; A1151-W1227 HydrophobicContact CB-CZ3 3.95Å; A1151-F1230 HydrophobicContact CB-CD1 4.1Å
1152E85.5Confident83.7Confident82 Ų8252.8 Ų52.838%0.38327%0.27SS..Hα-helixtrans-64.8-38.3179-70172.8174.900111.9L1148 V1155 K1156 R1235L1148-E1152 HydrophobicContact CD1-CG 4.4Å; L1148-E1152 WeakPolarHBondContact O-CG 3.14Å; L1148-E1152 PolarHBondContact O-N 3.12Å; E1152-V1155 PolarHBondContact O-N 2.97Å; E1152-K1156 WeakPolarHBondContact O-CB 3.29Å; E1152-K1156 PolarHBondContact O-N 3.1Å; E1152-R1235 IonicContact OE1-CZ 3.99Å; E1152-R1235 IonicContact OE1-NE 2.73Å; E1152-R1235 IonicContact OE1-NH2 2.95Å; E1152-R1235 PolarHBondContact OE1-NH2 3.22Å
1153A85.3Confident84.1Confident58 Ų5851.2 Ų51.248%0.47927%0.266SS..Hα-helixtrans-62.9-40.4171.900000112.7Q1149 T1150 A1151 K1156 L1157Q1149-A1153 VanDerWaalsContact O-CB 3.3Å; Q1149-A1153 WeakPolarHBondContact O-CB 3.49Å; Q1149-A1153 PolarHBondContact O-N 3.16Å; T1150-A1153 PolarHBondContact O-N 3.07Å; A1151-A1153 PolarHBondContact O-N 3.04Å; A1153-K1156 PolarHBondContact O-N 3.38Å; A1153-L1157 WeakPolarHBondContact O-CB 3.44Å; A1153-L1157 PolarHBondContact O-N 2.91Å
1154H87Confident84Confident20 Ų2051.9 Ų51.99%0.09328%0.275CS..Hα-helixtrans-71.4-36.4176.6-88.2-90.3000113.1S1102 T1150 A1151 L1157 L1158 W1227S1102-H1154 PolarHBondContact OG-ND1 2.92Å; T1150-H1154 PolarHBondContact O-CD2 2.75Å; T1150-H1154 PolarHBondContact O-N 3.15Å; A1151-H1154 PolarHBondContact O-N 2.69Å; H1154-L1157 PolarHBondContact O-N 3.28Å; H1154-L1158 WeakPolarHBondContact O-CB 3.48Å; H1154-L1158 WeakPolarHBondContact O-CG 3.22Å; H1154-L1158 PolarHBondContact O-N 3.05Å; H1154-W1227 HydrophobicContact CB-CD2 3.72Å; H1154-W1227 VanDerWaalsContact CB-CE2 3.48Å; H1154-W1227 HydrophobicContact CB-CE3 4.25Å; H1154-W1227 HydrophobicContact CB-CG 4.06Å; H1154-W1227 HydrophobicContact CB-CH2 4.31Å; H1154-W1227 HydrophobicContact CB-CZ2 3.79Å; H1154-W1227 AromaticContact CD2-CH2 3.96Å; H1154-W1227 AromaticContact CD2-CZ2 3.72Å; H1154-W1227 AromaticContact CG-CE2 3.61Å; H1154-W1227 AromaticContact CG-CZ2 3.44Å; H1154-W1227 VanDerWaalsContact CG-CZ2 3.44Å; H1154-W1227 AromaticContact CG-NE1 3.93Å; H1154-W1227 AromaticContact ND1-CE2 3.85Å; H1154-W1227 AromaticContact ND1-CZ2 3.69Å; H1154-W1227 AromaticContact ND1-NE1 3.82Å
1155V86.8Confident83.9Confident32 Ų3251.5 Ų51.519%0.19427%0.273CS..Hα-helixtrans-65.4-39172.3173.20000111.1A1151 E1152 S1159 W1227 I1228A1151-V1155 WeakPolarHBondContact O-CG2 3.47Å; A1151-V1155 PolarHBondContact O-N 2.88Å; E1152-V1155 PolarHBondContact O-N 2.97Å; V1155-S1159 WeakPolarHBondContact O-CB 3.37Å; V1155-S1159 PolarHBondContact O-N 3.27Å; V1155-S1159 PolarHBondContact O-OG 2.96Å; V1155-W1227 HydrophobicContact CG2-CB 3.74Å; V1155-I1228 HydrophobicContact CG1-CG1 4.47Å; V1155-I1228 HydrophobicContact CG2-CG1 4.08Å
1156K86.6Confident83.8Confident148 Ų14856 Ų5664%0.64329%0.29SS*.Hα-helixtrans-64.6-50.2173.6-170.1173.4-177.8-179.90111.1E1152 A1153 L1158 S1159 N1160E1152-K1156 WeakPolarHBondContact O-CB 3.29Å; E1152-K1156 PolarHBondContact O-N 3.1Å; A1153-K1156 PolarHBondContact O-N 3.38Å; K1156-L1158 VanDerWaalsContact C-N 3.3Å; K1156-L1158 PolarHBondContact O-N 2.74Å; K1156-S1159 WeakPolarHBondContact O-CB 3.34Å; K1156-S1159 PolarHBondContact O-N 3.19Å; K1156-N1160 PolarHBondContact O-N 3.33Å; K1156-N1160 PolarHBondContact O-OD1 2.9Å; K1156-N1160 VanDerWaalsContact O-OD1 3.04Å
1157L85.2Confident83.3Confident76 Ų7655.6 Ų55.640%0.39830%0.295SS..Hα-helixtrans-53.4-44.7176.6179.566000112.6I1098 A1153 H1154 S1159 L1161I1098-L1157 HydrophobicContact CG2-CD2 4.24Å; I1098-L1157 HydrophobicContact CG2-CG 4.34Å; A1153-L1157 WeakPolarHBondContact O-CB 3.44Å; A1153-L1157 PolarHBondContact O-N 2.91Å; H1154-L1157 PolarHBondContact O-N 3.28Å; L1157-S1159 VanDerWaalsContact C-N 3.34Å; L1157-L1161 WeakPolarHBondContact O-CB 3.41Å; L1157-L1161 PolarHBondContact O-N 3.02Å
1158L87.1Confident82.2Confident0 Ų056.6 Ų56.60%030%0.298CS..Hα-helixtrans-73.9-22.3178.2-70.5168.7000113.6L1099 H1154 K1156 L1161 L1162 L1223 K1224L1099-L1158 HydrophobicContact CD2-CD2 3.95Å; H1154-L1158 WeakPolarHBondContact O-CB 3.48Å; H1154-L1158 WeakPolarHBondContact O-CG 3.22Å; H1154-L1158 PolarHBondContact O-N 3.05Å; K1156-L1158 VanDerWaalsContact C-N 3.3Å; K1156-L1158 PolarHBondContact O-N 2.74Å; L1158-L1161 HydrophobicContact CD2-CD2 4.38Å; L1158-L1162 WeakPolarHBondContact O-CD1 3.5Å; L1158-L1162 VanDerWaalsContact O-CG 3.3Å; L1158-L1162 WeakPolarHBondContact O-CG 3.39Å; L1158-L1162 PolarHBondContact O-N 3.15Å; L1158-L1223 HydrophobicContact CD1-CB 4.05Å; L1158-L1223 HydrophobicContact CD1-CD2 4.21Å; L1158-L1223 HydrophobicContact CD1-CG 4.25Å; L1158-L1223 HydrophobicContact CD2-CD2 4.15Å; L1158-K1224 HydrophobicContact CB-CB 4.25Å; L1158-K1224 HydrophobicContact CD1-CB 4.23Å
1159S86.8Confident81Confident24 Ų2457 Ų5717%0.16830%0.303CS..Hα-helixtrans-76.1-51.3173.2-56.10000110.3V1155 K1156 L1157 L1161 L1162 D1163 K1224V1155-S1159 WeakPolarHBondContact O-CB 3.37Å; V1155-S1159 PolarHBondContact O-N 3.27Å; V1155-S1159 PolarHBondContact O-OG 2.96Å; K1156-S1159 WeakPolarHBondContact O-CB 3.34Å; K1156-S1159 PolarHBondContact O-N 3.19Å; L1157-S1159 VanDerWaalsContact C-N 3.34Å; S1159-L1161 VanDerWaalsContact C-N 3.25Å; S1159-L1161 PolarHBondContact O-N 3.38Å; S1159-L1162 WeakPolarHBondContact O-CA 3.48Å; S1159-L1162 WeakPolarHBondContact O-CB 3.3Å; S1159-L1162 PolarHBondContact O-N 3.42Å; S1159-D1163 PolarHBondContact O-N 3.41Å; S1159-D1163 VanDerWaalsContact O-OD2 3.12Å; S1159-K1224 WeakPolarHBondContact OG-CE 3.33Å; S1159-K1224 PolarHBondContact OG-NZ 3.36Å
1160N83.4Confident79.6Confident80 Ų8055.2 Ų55.243%0.42830%0.303SS..Hα-helixtrans-50-45.9170.7-76.565000111.7K1156 L1162 D1163 D1164K1156-N1160 PolarHBondContact O-N 3.33Å; K1156-N1160 PolarHBondContact O-OD1 2.9Å; K1156-N1160 VanDerWaalsContact O-OD1 3.04Å; N1160-L1162 VanDerWaalsContact C-N 3.29Å; N1160-L1162 PolarHBondContact O-N 3.35Å; N1160-D1163 PolarHBondContact O-N 3.13Å; N1160-D1163 VanDerWaalsContact O-N 3.16Å; N1160-D1164 WeakPolarHBondContact O-CB 3.49Å; N1160-D1164 VanDerWaalsContact O-CG 3.23Å; N1160-D1164 PolarHBondContact O-N 3.12Å
1161L81.8Confident77.8Confident6 Ų655 Ų553%0.03130%0.303CS..Hα-helixtrans-59.9-37177.3-164.174.6000113.1H1095 I1098 L1099 L1157 L1158 S1159 L1165 A1220H1095-L1161 WeakPolarHBondContact CD2-CD1 3.47Å; I1098-L1161 HydrophobicContact CD1-CD1 3.77Å; I1098-L1161 HydrophobicContact CG2-CD1 4.25Å; I1098-L1161 HydrophobicContact CG2-CD2 4.06Å; L1099-L1161 HydrophobicContact CD2-CD2 4.11Å; L1099-L1161 HydrophobicContact CG-CD2 4.32Å; L1157-L1161 WeakPolarHBondContact O-CB 3.41Å; L1157-L1161 PolarHBondContact O-N 3.02Å; L1158-L1161 HydrophobicContact CD2-CD2 4.38Å; S1159-L1161 VanDerWaalsContact C-N 3.25Å; S1159-L1161 PolarHBondContact O-N 3.38Å; L1161-L1165 HydrophobicContact CG-CD1 4.35Å; L1161-L1165 WeakPolarHBondContact O-CB 3.38Å; L1161-L1165 VanDerWaalsContact O-CD1 3.25Å; L1161-L1165 WeakPolarHBondContact O-CD1 3.37Å; L1161-L1165 WeakPolarHBondContact O-CG 3.35Å; L1161-L1165 PolarHBondContact O-N 2.82Å; L1161-L1165 VanDerWaalsContact O-N 3.08Å; L1161-A1220 HydrophobicContact CD2-CB 4.4Å
1162L85.2Confident75.9Confident28 Ų2857 Ų5715%0.14732%0.315CS..Hα-helixtrans-74.4-34.5176.7-74.9164.9000111.9L1158 S1159 N1160 K1166 I1217 A1220 L1221 K1224L1158-L1162 WeakPolarHBondContact O-CD1 3.5Å; L1158-L1162 VanDerWaalsContact O-CG 3.3Å; L1158-L1162 WeakPolarHBondContact O-CG 3.39Å; L1158-L1162 PolarHBondContact O-N 3.15Å; S1159-L1162 WeakPolarHBondContact O-CA 3.48Å; S1159-L1162 WeakPolarHBondContact O-CB 3.3Å; S1159-L1162 PolarHBondContact O-N 3.42Å; N1160-L1162 VanDerWaalsContact C-N 3.29Å; N1160-L1162 PolarHBondContact O-N 3.35Å; L1162-K1166 WeakPolarHBondContact O-CB 3.38Å; L1162-K1166 PolarHBondContact O-N 3.49Å; L1162-I1217 HydrophobicContact CD2-CG2 4.23Å; L1162-A1220 HydrophobicContact CD2-CB 3.83Å; L1162-A1220 HydrophobicContact CG-CB 4.08Å; L1162-L1221 HydrophobicContact CD1-CD2 3.74Å; L1162-L1221 HydrophobicContact CD1-CG 4.35Å; L1162-L1221 HydrophobicContact CD2-CD2 4.2Å; L1162-L1221 HydrophobicContact CD2-CG 4.11Å; L1162-K1224 HydrophobicContact CD1-CD 3.97Å
1163D79.5Confident73.8Confident96 Ų9657.5 Ų57.551%0.51332%0.323SS..Hα-helixtrans-72.5-39.1176-64.5-45.5000111.5S1159 N1160 K1166 S1167S1159-D1163 PolarHBondContact O-N 3.41Å; S1159-D1163 VanDerWaalsContact O-OD2 3.12Å; N1160-D1163 PolarHBondContact O-N 3.13Å; N1160-D1163 VanDerWaalsContact O-N 3.16Å; D1163-K1166 PolarHBondContact O-N 3.41Å; D1163-S1167 WeakPolarHBondContact O-CB 3.48Å; D1163-S1167 PolarHBondContact O-N 2.86Å
1164D76.2Confident71.4Confident93 Ų9359.4 Ų59.450%0.49733%0.332SS..Hα-helixtrans-60.3-47.8170.7-70.3-24.7000110.9N1160 K1166 S1167 Y1168N1160-D1164 WeakPolarHBondContact O-CB 3.49Å; N1160-D1164 VanDerWaalsContact O-CG 3.23Å; N1160-D1164 PolarHBondContact O-N 3.12Å; D1164-K1166 PolarHBondContact O-N 3.18Å; D1164-S1167 WeakPolarHBondContact O-CB 3.36Å; D1164-S1167 PolarHBondContact O-N 3.49Å; D1164-Y1168 WeakPolarHBondContact O-CB 3.41Å; D1164-Y1168 PolarHBondContact O-N 2.92Å
1165L75.7Confident68.9Low1 Ų166.3 Ų66.31%0.00537%0.365CS..Hα-helixtrans-62.6-40.1175.3-76.4163.3000112F1091 L1161 Y1168 C1169 Y1213 I1216 I1217F1091-L1165 HydrophobicContact CE1-CD2 3.88Å; F1091-L1165 HydrophobicContact CZ-CD2 4.49Å; L1161-L1165 HydrophobicContact CG-CD1 4.35Å; L1161-L1165 WeakPolarHBondContact O-CB 3.38Å; L1161-L1165 VanDerWaalsContact O-CD1 3.25Å; L1161-L1165 WeakPolarHBondContact O-CD1 3.37Å; L1161-L1165 WeakPolarHBondContact O-CG 3.35Å; L1161-L1165 PolarHBondContact O-N 2.82Å; L1161-L1165 VanDerWaalsContact O-N 3.08Å; L1165-Y1168 PolarHBondContact O-N 3.34Å; L1165-C1169 VanDerWaalsContact O-CB 3.3Å; L1165-C1169 WeakPolarHBondContact O-CB 3.31Å; L1165-C1169 PolarHBondContact O-N 3.47Å; L1165-C1169 PolarHBondContact O-SG 2.93Å; L1165-C1169 VanDerWaalsContact O-SG 3.35Å; L1165-Y1213 HydrophobicContact CD2-CD1 4.08Å; L1165-I1216 HydrophobicContact CD1-CG2 3.69Å; L1165-I1216 HydrophobicContact CD2-CG2 4.26Å; L1165-I1217 HydrophobicContact CB-CG1 4.41Å; L1165-I1217 HydrophobicContact CD1-CG1 3.97Å
1166K75.8Confident66.3Low142 Ų14270.3 Ų70.362%0.61739%0.385SS*.Hα-helixtrans-65.2-39.5175.7-177.9-177.8176.6-172.50111.6L1162 D1163 D1164 S1170L1162-K1166 WeakPolarHBondContact O-CB 3.38Å; L1162-K1166 PolarHBondContact O-N 3.49Å; D1163-K1166 PolarHBondContact O-N 3.41Å; D1164-K1166 PolarHBondContact O-N 3.18Å; K1166-S1170 WeakPolarHBondContact O-CB 3.36Å; K1166-S1170 PolarHBondContact O-N 3.34Å; K1166-S1170 PolarHBondContact O-OG 3.34Å
1167S70.5Confident63.5Low78 Ų7868.8 Ų68.855%0.54539%0.393SS..Hα-helixtrans-62.9-50.5174.4-170.70000111D1163 D1164 C1169 S1170 S1171D1163-S1167 WeakPolarHBondContact O-CB 3.48Å; D1163-S1167 PolarHBondContact O-N 2.86Å; D1164-S1167 WeakPolarHBondContact O-CB 3.36Å; D1164-S1167 PolarHBondContact O-N 3.49Å; S1167-C1169 PolarHBondContact O-N 3.39Å; S1167-S1170 CarbonylContact O-C 3.57Å; S1167-S1170 WeakPolarHBondContact O-CA 3.4Å; S1167-S1170 WeakPolarHBondContact O-CB 3.49Å; S1167-S1170 PolarHBondContact O-N 3.29Å; S1167-S1171 PolarHBondContact O-N 3.25Å; S1167-S1171 PolarHBondContact O-OG 2.95Å
1168Y63.5Low60.9Low30 Ų3071 Ų7112%0.11841%0.405CS..Hα-helixtrans-61.1-40.5177.5-170.3-95.7000112.9F1091 D1164 L1165 S1170 S1171 N1172 Y1213F1091-Y1168 HydrophobicContact CD2-CD2 4.39Å; F1091-Y1168 HydrophobicContact CD2-CE2 4.14Å; F1091-Y1168 HydrophobicContact CE1-CD1 4.49Å; F1091-Y1168 AromaticContact CE2-CD2 3.71Å; F1091-Y1168 HydrophobicContact CE2-CD2 3.71Å; F1091-Y1168 AromaticContact CE2-CE2 3.92Å; F1091-Y1168 HydrophobicContact CE2-CE2 3.92Å; F1091-Y1168 HydrophobicContact CE2-CG 4.07Å; F1091-Y1168 HydrophobicContact CZ-CD1 4.23Å; F1091-Y1168 HydrophobicContact CZ-CD2 4.01Å; F1091-Y1168 HydrophobicContact CZ-CE2 4.47Å; F1091-Y1168 AromaticContact CZ-CG 3.87Å; F1091-Y1168 HydrophobicContact CZ-CG 3.87Å; D1164-Y1168 WeakPolarHBondContact O-CB 3.41Å; D1164-Y1168 PolarHBondContact O-N 2.92Å; L1165-Y1168 PolarHBondContact O-N 3.34Å; Y1168-S1170 PolarHBondContact O-N 3.3Å; Y1168-S1171 PolarHBondContact O-OG 3.29Å; Y1168-S1171 VanDerWaalsContact O-OG 3.14Å; Y1168-N1172 VanDerWaalsContact CE1-ND2 3.31Å; Y1168-N1172 WeakPolarHBondContact CE1-ND2 3.49Å; Y1168-N1172 PolarHBondContact O-N 3.03Å; Y1168-N1172 PolarHBondContact OH-ND2 3.04Å; Y1168-Y1213 HydrophobicContact CD1-CD1 4.29Å; Y1168-Y1213 AromaticContact CD1-CE1 3.7Å; Y1168-Y1213 HydrophobicContact CD1-CE1 3.7Å; Y1168-Y1213 HydrophobicContact CE1-CD1 4.35Å; Y1168-Y1213 AromaticContact CE1-CE1 3.43Å; Y1168-Y1213 HydrophobicContact CE1-CE1 3.43Å; Y1168-Y1213 VanDerWaalsContact CE1-CE1 3.43Å; Y1168-Y1213 HydrophobicContact CE1-CE2 4.39Å; Y1168-Y1213 AromaticContact CE1-CZ 3.48Å; Y1168-Y1213 VanDerWaalsContact CE1-CZ 3.48Å; Y1168-Y1213 WeakPolarHBondContact CE1-OH 3.27Å; Y1168-Y1213 PolarHBondContact OH-OH 3.24Å
1169C61.6Low58.3Low43 Ų4378.9 Ų78.929%0.29145%0.447SS..Hα-helixtrans-70.9-13.5172.1-71.80000113.9L1165 S1167 V1173L1165-C1169 VanDerWaalsContact O-CB 3.3Å; L1165-C1169 WeakPolarHBondContact O-CB 3.31Å; L1165-C1169 PolarHBondContact O-N 3.47Å; L1165-C1169 PolarHBondContact O-SG 2.93Å; L1165-C1169 VanDerWaalsContact O-SG 3.35Å; S1167-C1169 PolarHBondContact O-N 3.39Å; C1169-V1173 WeakPolarHBondContact O-CG2 3.34Å
1170S56.8Low55.9Low75 Ų7588.3 Ų88.352%0.52448%0.479SS..Hα-helixtrans-94.1-40.3175.2-57.60000112K1166 S1167 Y1168K1166-S1170 WeakPolarHBondContact O-CB 3.36Å; K1166-S1170 PolarHBondContact O-N 3.34Å; K1166-S1170 PolarHBondContact O-OG 3.34Å; S1167-S1170 CarbonylContact O-C 3.57Å; S1167-S1170 WeakPolarHBondContact O-CA 3.4Å; S1167-S1170 WeakPolarHBondContact O-CB 3.49Å; S1167-S1170 PolarHBondContact O-N 3.29Å; Y1168-S1170 PolarHBondContact O-N 3.3Å
1171S47.5Very low53.5Low42 Ų4290.2 Ų90.229%0.29449%0.488SS..Hα-helixtrans-63.6-47.2178.557.40000111.7S1167 Y1168 V1173 S1174S1167-S1171 PolarHBondContact O-N 3.25Å; S1167-S1171 PolarHBondContact O-OG 2.95Å; Y1168-S1171 PolarHBondContact O-OG 3.29Å; Y1168-S1171 VanDerWaalsContact O-OG 3.14Å; S1171-V1173 PolarHBondContact O-N 3.02Å; S1171-S1174 VanDerWaalsContact O-CB 3.29Å; S1171-S1174 WeakPolarHBondContact O-CB 3.3Å; S1171-S1174 PolarHBondContact O-N 2.79Å; S1171-S1174 VanDerWaalsContact O-N 3.11Å; S1171-S1174 PolarHBondContact O-OG 3.1Å
1172N45.7Very low51.1Low44 Ų4493.5 Ų93.524%0.23551%0.512CS..THydrogen-bonded Turntrans-75.5-8.6-173-65.32.6000113.7Y1168 S1174Y1168-N1172 VanDerWaalsContact CE1-ND2 3.31Å; Y1168-N1172 WeakPolarHBondContact CE1-ND2 3.49Å; Y1168-N1172 PolarHBondContact O-N 3.03Å; Y1168-N1172 PolarHBondContact OH-ND2 3.04Å; N1172-S1174 PolarHBondContact O-N 3.18Å
1173V41.6Very low48.7Very low92 Ų9295.8 Ų95.856%0.55854%0.535SS*.THydrogen-bonded Turntrans-70.6-15.3169.7166.30000111.8C1169 S1171C1169-V1173 WeakPolarHBondContact O-CG2 3.34Å; S1171-V1173 PolarHBondContact O-N 3.02Å
1174S35.1Very low46.5Very low97 Ų9793.8 Ų93.868%0.67853%0.528SS*.THydrogen-bonded Turntrans-72.4-34.7178.8-45.30000114S1171 N1172S1171-S1174 VanDerWaalsContact O-CB 3.29Å; S1171-S1174 WeakPolarHBondContact O-CB 3.3Å; S1171-S1174 PolarHBondContact O-N 2.79Å; S1171-S1174 VanDerWaalsContact O-N 3.11Å; S1171-S1174 PolarHBondContact O-OG 3.1Å; N1172-S1174 PolarHBondContact O-N 3.18Å
1175E35.3Very low44.6Very low165 Ų16594 Ų9477%0.77153%0.525SS*.THydrogen-bonded Turntrans-102.9-11.4-175.4-66-168.8126.100113.4S1177E1175-S1177 PolarHBondContact O-N 3.06Å
1176L31.9Very low42.9Very low117 Ų117100.3 Ų100.361%0.61356%0.557SS**  trans-81.162171.6-88.4162.2000111.5D1178L1176-D1178 PolarHBondContact O-N 3.19Å
1177S27.7Very low41.1Very low116 Ų116100.5 Ų100.581%0.81156%0.56SS**  trans-75.255.1176.1720000112.6E1175E1175-S1177 PolarHBondContact O-N 3.06Å
1178D29.8Very low39.5Very low123 Ų123100.6 Ų100.666%0.65856%0.555SS**SBendtrans-140.8138.2174.5-146.7-14.6000111.7L1176 R1180L1176-D1178 PolarHBondContact O-N 3.19Å; D1178-R1180 VanDerWaalsContact C-N 3.3Å; D1178-R1180 PolarHBondContact O-N 2.99Å
1179N33.1Very low38.2Very low165 Ų165103.9 Ų103.988%0.88257%0.574SS**THydrogen-bonded Turntrans-83.457.8-153.2-63.3-84.3000113.7
1180R36.8Very low36.9Very low222 Ų222106.4 Ų106.484%0.83859%0.588SS**THydrogen-bonded Turntrans-134.3-9-168.2-77.9-172.3160-158.8-8118.5D1178 S1182D1178-R1180 VanDerWaalsContact C-N 3.3Å; D1178-R1180 PolarHBondContact O-N 2.99Å; R1180-S1182 PolarHBondContact O-N 3.12Å; R1180-S1182 VanDerWaalsContact O-N 3.13Å
1181L32.4Very low35.6Very low120 Ų120108.4 Ų108.463%0.62860%0.599SS**  trans-83.586.2171.2-76.8169.2000110.3
1182S32.4Very low34.8Very low75 Ų75112.1 Ų112.152%0.52462%0.624SS.*  trans-70.2157178.248.10000113.1R1180 S1184 F1185R1180-S1182 PolarHBondContact O-N 3.12Å; R1180-S1182 VanDerWaalsContact O-N 3.13Å; S1182-S1184 PolarHBondContact O-N 3.18Å; S1182-S1184 PolarHBondContact OG-OG 2.92Å; S1182-F1185 PolarHBondContact O-N 3.05Å
1183A34.3Very low34Very low76 Ų76118.8 Ų118.863%0.62865%0.654SS**THydrogen-bonded Turntrans-56.3-15.9179.600000115F1185 I1186 Q1187A1183-F1185 PolarHBondContact O-N 3Å; A1183-I1186 PolarHBondContact O-N 3.08Å; A1183-I1186 VanDerWaalsContact O-N 3.08Å; A1183-Q1187 PolarHBondContact O-N 2.9Å
1184S33.7Very low33.7Very low53 Ų53122.2 Ų122.237%0.37167%0.669SS.*Hα-helixtrans-52.2-32.1169.752.60000113.3S1182 I1186 Q1187 D1188S1182-S1184 PolarHBondContact O-N 3.18Å; S1182-S1184 PolarHBondContact OG-OG 2.92Å; S1184-I1186 PolarHBondContact O-N 3.34Å; S1184-I1186 VanDerWaalsContact O-N 3.09Å; S1184-Q1187 PolarHBondContact O-N 2.95Å; S1184-Q1187 VanDerWaalsContact O-N 3.15Å; S1184-D1188 VanDerWaalsContact O-CB 3.29Å; S1184-D1188 WeakPolarHBondContact O-CB 3.42Å; S1184-D1188 PolarHBondContact O-N 3.16Å
1185F36Very low33.4Very low99 Ų99124.7 Ų124.743%0.43467%0.674SS.*Hα-helixtrans-60.8-21.7178.4-165.9-94.8000113.7S1182 A1183S1182-F1185 PolarHBondContact O-N 3.05Å; A1183-F1185 PolarHBondContact O-N 3Å
1186I39.3Very low33.3Very low133 Ų133121.7 Ų121.768%0.68266%0.663SS**Hα-helixtrans-97.1-31.7177-60.7178.3000111.3A1183 S1184A1183-I1186 PolarHBondContact O-N 3.08Å; A1183-I1186 VanDerWaalsContact O-N 3.08Å; S1184-I1186 PolarHBondContact O-N 3.34Å; S1184-I1186 VanDerWaalsContact O-N 3.09Å
1187Q38.7Very low33.3Very low145 Ų145121.5 Ų121.568%0.67866%0.663SS**Hα-helixtrans-72.9-34.3175.6-68.9-177.7-63.200112.8A1183 S1184 L1189 T1190A1183-Q1187 PolarHBondContact O-N 2.9Å; S1184-Q1187 PolarHBondContact O-N 2.95Å; S1184-Q1187 VanDerWaalsContact O-N 3.15Å; Q1187-L1189 PolarHBondContact O-N 3.12Å; Q1187-T1190 PolarHBondContact O-N 3.34Å; Q1187-T1190 PolarHBondContact O-OG1 3.44Å
1188D37.3Very low33.3Very low81 Ų81127.2 Ų127.243%0.43367%0.669SS.*THydrogen-bonded Turntrans-63.2-5.5176.1-92.538000114.7S1184 R1214S1184-D1188 VanDerWaalsContact O-CB 3.29Å; S1184-D1188 WeakPolarHBondContact O-CB 3.42Å; S1184-D1188 PolarHBondContact O-N 3.16Å; D1188-R1214 IonicContact OD2-CZ 3.2Å; D1188-R1214 IonicContact OD2-NH1 2.79Å; D1188-R1214 PolarHBondContact OD2-NH1 2.92Å; D1188-R1214 IonicContact OD2-NH2 2.72Å; D1188-R1214 PolarHBondContact OD2-NH2 3.49Å
1189L35.5Very low33.5Very low98 Ų98126.6 Ų126.651%0.51367%0.669SS.*THydrogen-bonded Turntrans-96.3-1178.1-69.8171000113.5Q1187Q1187-L1189 PolarHBondContact O-N 3.12Å
1190T33.3Very low33.4Very low96 Ų96128 Ų12859%0.58967%0.667SS**SBendtrans-73.7124.6171.8-37.70000109.2Q1187 C1192Q1187-T1190 PolarHBondContact O-N 3.34Å; Q1187-T1190 PolarHBondContact O-OG1 3.44Å; T1190-C1192 PolarHBondContact O-N 3.48Å
1191P30Very low33.1Very low118 Ų118123 Ų12377%0.76666%0.662SS**  trans-75.196.617530.5-32.5000109.4E1193P1191-E1193 PolarHBondContact O-N 3.12Å
1192C31.3Very low33Very low120 Ų120123.8 Ų123.881%0.81167%0.667SS**  trans-63.7117.3168.2-63.60000109.4T1190 D1194T1190-C1192 PolarHBondContact O-N 3.48Å; C1192-D1194 PolarHBondContact O-N 3.46Å
1193E28.9Very low32.9Very low184 Ų184128 Ų12886%0.8668%0.683SS**  trans-67.8118155-63.1-168.1132.800108P1191P1191-E1193 PolarHBondContact O-N 3.12Å
1194D34Very low32.9Very low164 Ų164130.5 Ų130.588%0.87769%0.691SS**  trans-160118.1149.3-109.3-29.6000108.5C1192C1192-D1194 PolarHBondContact O-N 3.46Å
1195D30.7Very low32.9Very low149 Ų149135.9 Ų135.980%0.79772%0.715SS**  trans-82.6146.9178.5-106.1-32.4000110.5
1196N32.3Very low32.8Very low101 Ų101137.6 Ų137.654%0.5473%0.729SS.*  trans61.593.9170.5-48.3-69000117.2L493L493-N1196 HydrophobicContact CD2-CB 4.22Å
1197N31.6Very low32.4Very low114 Ų114134.5 Ų134.561%0.6173%0.73SS**  -149.7129.6128.5-123-62.6000114.4D495D495-N1197 PolarHBondContact OD2-ND2 3.32Å
1198Y28.9Very low32.3Very low235 Ų235135.2 Ų135.292%0.92273%0.733SS**  trans-111.371.2-170.5-135.4-74.6000109.7
1199V33.1Very low32.3Very low110 Ų110140.8 Ų140.867%0.66776%0.756SS**  trans-94.1123.3-174.8-178.40000111.7
1200K30.5Very low32.6Very low195 Ų195143.6 Ų143.685%0.84877%0.766SS**  trans-85121.8165.3-71.5176.7175.5178.20110
1201T31.7Very low33.8Very low117 Ų117141.7 Ų141.772%0.71876%0.757SS**  trans-150.7100.9155.343.30000106.2
1202D29.1Very low35.4Very low137 Ų137138.6 Ų138.673%0.73374%0.737SS**  72.198.881.8-77.7-22.3000113.8T1204D1202-T1204 PolarHBondContact O-N 3.37Å
1203N31.2Very low37.2Very low164 Ų164133.9 Ų133.988%0.87770%0.702SS**  trans2087.1149.8-55.1-24.6000118.1
1204T33.9Very low39.2Very low127 Ų127129.8 Ų129.878%0.77968%0.679SS**  trans-134.8135.2146.916.60000109.6D1202 D1206D1202-T1204 PolarHBondContact O-N 3.37Å; T1204-D1206 PolarHBondContact O-N 3.49Å
1205D32.7Very low41.2Very low166 Ų166127.6 Ų127.689%0.88867%0.666SS**  trans-10166.8-168.4-167.319.2000110.1
1206D34Very low43.4Very low135 Ų135121 Ų12172%0.72263%0.631SS**  trans-106.2111.1-177.4-95.4-55.8000111.8T1204 H1208T1204-D1206 PolarHBondContact O-N 3.49Å; D1206-H1208 PolarHBondContact O-N 2.72Å; D1206-H1208 VanDerWaalsContact O-N 3.09Å
1207G31.3Very low45.7Very low69 Ų69117.6 Ų117.671%0.71161%0.613SS**  trans-71.9100.3-175.300000113.2
1208H37.4Very low48.1Very low160 Ų160116.3 Ų116.374%0.74161%0.605SS**  trans-111.5109.5164.7-77.27.1000110.5D1206 H1210D1206-H1208 PolarHBondContact O-N 2.72Å; D1206-H1208 VanDerWaalsContact O-N 3.09Å; H1208-H1210 VanDerWaalsContact C-N 3.32Å; H1208-H1210 PolarHBondContact O-N 2.98Å
1209H36.9Very low50.7Low197 Ų197108.6 Ų108.691%0.91258%0.58SS**  trans-66.185.3176.6-72.9-83.4000111.1S1211H1209-S1211 PolarHBondContact O-N 3.49Å
1210H42.1Very low53.2Low157 Ų157103.3 Ų103.373%0.72755%0.548SS*.  trans-60.1118.7162.6-74.9-12.7000109.1H1208H1208-H1210 VanDerWaalsContact C-N 3.32Å; H1208-H1210 PolarHBondContact O-N 2.98Å
1211S58.5Low55.8Low56 Ų5697.9 Ų97.939%0.39253%0.528SS..  trans-65.2138.6175.873.30000109.6H1209 Y1213 R1214H1209-S1211 PolarHBondContact O-N 3.49Å; S1211-Y1213 PolarHBondContact O-N 3.18Å; S1211-Y1213 VanDerWaalsContact O-N 3.1Å; S1211-R1214 PolarHBondContact O-N 3.19Å; S1211-R1214 VanDerWaalsContact O-N 3.08Å
1212P64Low58.5Low53 Ų5398.9 Ų98.934%0.34452%0.522SS..Hα-helixtrans-58.3-30.4-177.221.7-32.1000111.8R1214 L1215 I1216P1212-R1214 PolarHBondContact O-N 3.47Å; P1212-L1215 PolarHBondContact O-N 3.38Å; P1212-I1216 WeakPolarHBondContact O-CG1 3.37Å; P1212-I1216 PolarHBondContact O-N 2.92Å
1213Y68.2Low61.4Low21 Ų2193.3 Ų93.38%0.08249%0.492CS..Hα-helixtrans-53.7-41.1174.7-56-84.5000114.2D1088 F1091 L1165 Y1168 S1211 L1215 I1216 I1217D1088-Y1213 VanDerWaalsContact OD1-CE2 3.29Å; D1088-Y1213 WeakPolarHBondContact OD1-CE2 3.37Å; D1088-Y1213 PolarHBondContact OD1-OH 3.37Å; F1091-Y1213 HydrophobicContact CD1-CD1 4.34Å; F1091-Y1213 AromaticContact CD1-CE1 3.44Å; F1091-Y1213 HydrophobicContact CD1-CE1 3.44Å; F1091-Y1213 VanDerWaalsContact CD1-CE1 3.44Å; F1091-Y1213 HydrophobicContact CE1-CD1 4.19Å; F1091-Y1213 AromaticContact CE1-CE1 3.56Å; F1091-Y1213 HydrophobicContact CE1-CE1 3.56Å; F1091-Y1213 HydrophobicContact CG-CE1 4.29Å; F1091-Y1213 HydrophobicContact CZ-CE1 4.48Å; L1165-Y1213 HydrophobicContact CD2-CD1 4.08Å; Y1168-Y1213 HydrophobicContact CD1-CD1 4.29Å; Y1168-Y1213 AromaticContact CD1-CE1 3.7Å; Y1168-Y1213 HydrophobicContact CD1-CE1 3.7Å; Y1168-Y1213 HydrophobicContact CE1-CD1 4.35Å; Y1168-Y1213 AromaticContact CE1-CE1 3.43Å; Y1168-Y1213 HydrophobicContact CE1-CE1 3.43Å; Y1168-Y1213 VanDerWaalsContact CE1-CE1 3.43Å; Y1168-Y1213 HydrophobicContact CE1-CE2 4.39Å; Y1168-Y1213 AromaticContact CE1-CZ 3.48Å; Y1168-Y1213 VanDerWaalsContact CE1-CZ 3.48Å; Y1168-Y1213 WeakPolarHBondContact CE1-OH 3.27Å; Y1168-Y1213 PolarHBondContact OH-OH 3.24Å; S1211-Y1213 PolarHBondContact O-N 3.18Å; S1211-Y1213 VanDerWaalsContact O-N 3.1Å; Y1213-L1215 VanDerWaalsContact C-N 3.32Å; Y1213-L1215 PolarHBondContact O-N 3.05Å; Y1213-I1216 PolarHBondContact O-N 2.93Å; Y1213-I1217 WeakPolarHBondContact O-CG1 3.34Å; Y1213-I1217 PolarHBondContact O-N 3.12Å
1214R71.7Confident64.2Low98 Ų9888.2 Ų88.237%0.3746%0.462SS..Hα-helixtrans-61.7-41.5-180-173.9175.6-179.4154.35.8111.5D1188 S1211 P1212 L1218D1188-R1214 IonicContact OD2-CZ 3.2Å; D1188-R1214 IonicContact OD2-NH1 2.79Å; D1188-R1214 PolarHBondContact OD2-NH1 2.92Å; D1188-R1214 IonicContact OD2-NH2 2.72Å; D1188-R1214 PolarHBondContact OD2-NH2 3.49Å; S1211-R1214 PolarHBondContact O-N 3.19Å; S1211-R1214 VanDerWaalsContact O-N 3.08Å; P1212-R1214 PolarHBondContact O-N 3.47Å; R1214-L1218 HydrophobicContact CG-CD1 4.2Å; R1214-L1218 WeakPolarHBondContact O-CG 3.44Å; R1214-L1218 PolarHBondContact O-N 3.27Å
1215L74.8Confident66.7Low118 Ų11885.1 Ų85.162%0.61845%0.446SS*.Hα-helixtrans-70.9-34.8178.8-16967.6000111.9P1212 Y1213 N1219P1212-L1215 PolarHBondContact O-N 3.38Å; Y1213-L1215 VanDerWaalsContact C-N 3.32Å; Y1213-L1215 PolarHBondContact O-N 3.05Å; L1215-N1219 WeakPolarHBondContact O-CB 3.37Å; L1215-N1219 PolarHBondContact O-N 3.45Å; L1215-N1219 PolarHBondContact O-ND2 3.48Å
1216I78Confident69.4Low10 Ų1081 Ų815%0.05142%0.422CS..Hα-helixtrans-66.4-47.8176.4-68.3163.3000110.8H1095 L1099 L1165 P1212 Y1213 N1219 A1220H1095-I1216 HydrophobicContact CB-CD1 4.04Å; H1095-I1216 HydrophobicContact CB-CG1 4.44Å; H1095-I1216 HydrophobicContact CB-CG2 3.75Å; L1099-I1216 HydrophobicContact CD1-CG2 4.07Å; L1165-I1216 HydrophobicContact CD1-CG2 3.69Å; L1165-I1216 HydrophobicContact CD2-CG2 4.26Å; P1212-I1216 WeakPolarHBondContact O-CG1 3.37Å; P1212-I1216 PolarHBondContact O-N 2.92Å; Y1213-I1216 PolarHBondContact O-N 2.93Å; I1216-N1219 PolarHBondContact O-N 3.44Å; I1216-A1220 WeakPolarHBondContact O-CB 3.17Å; I1216-A1220 PolarHBondContact O-N 3.06Å
1217I80.2Confident72.1Confident31 Ų3174.6 Ų74.616%0.15939%0.387CS..Hα-helixtrans-62-47.5-179.4-67.6164.6000111.2L1162 L1165 Y1213 N1219 A1220 L1221L1162-I1217 HydrophobicContact CD2-CG2 4.23Å; L1165-I1217 HydrophobicContact CB-CG1 4.41Å; L1165-I1217 HydrophobicContact CD1-CG1 3.97Å; Y1213-I1217 WeakPolarHBondContact O-CG1 3.34Å; Y1213-I1217 PolarHBondContact O-N 3.12Å; I1217-N1219 VanDerWaalsContact C-N 3.34Å; I1217-N1219 PolarHBondContact O-N 3.48Å; I1217-A1220 PolarHBondContact O-N 3.11Å; I1217-L1221 HydrophobicContact CG2-CD1 4.01Å; I1217-L1221 WeakPolarHBondContact O-CG 3.39Å; I1217-L1221 PolarHBondContact O-N 3.49Å
1218L81Confident74.7Confident86 Ų8675.2 Ų75.245%0.4537%0.373SS..Hα-helixtrans-60.2-42178-73.7169.4000112.3R1214 K1222R1214-L1218 HydrophobicContact CG-CD1 4.2Å; R1214-L1218 WeakPolarHBondContact O-CG 3.44Å; R1214-L1218 PolarHBondContact O-N 3.27Å; L1218-K1222 WeakPolarHBondContact O-CB 3.32Å; L1218-K1222 PolarHBondContact O-N 3.42Å
1219N84.2Confident77Confident73 Ų7372 Ų7239%0.3936%0.361SS..Hα-helixtrans-66.7-40.5175.3-78.9-53.9000112.1L1099 L1215 I1216 I1217 K1222 L1223L1099-N1219 HydrophobicContact CD1-CB 3.86Å; L1215-N1219 WeakPolarHBondContact O-CB 3.37Å; L1215-N1219 PolarHBondContact O-N 3.45Å; L1215-N1219 PolarHBondContact O-ND2 3.48Å; I1216-N1219 PolarHBondContact O-N 3.44Å; I1217-N1219 VanDerWaalsContact C-N 3.34Å; I1217-N1219 PolarHBondContact O-N 3.48Å; N1219-K1222 PolarHBondContact O-N 3.3Å; N1219-L1223 VanDerWaalsContact O-CB 3.27Å; N1219-L1223 WeakPolarHBondContact O-CB 3.16Å; N1219-L1223 PolarHBondContact O-N 2.89Å
1220A85.3Confident79.5Confident0 Ų063.1 Ų63.10%032%0.32CS..Hα-helixtrans-61.6-44.9177.200000112.4L1099 L1161 L1162 I1216 I1217 L1223 K1224L1099-A1220 HydrophobicContact CD2-CB 3.9Å; L1161-A1220 HydrophobicContact CD2-CB 4.4Å; L1162-A1220 HydrophobicContact CD2-CB 3.83Å; L1162-A1220 HydrophobicContact CG-CB 4.08Å; I1216-A1220 WeakPolarHBondContact O-CB 3.17Å; I1216-A1220 PolarHBondContact O-N 3.06Å; I1217-A1220 PolarHBondContact O-N 3.11Å; A1220-L1223 PolarHBondContact O-N 3.13Å; A1220-K1224 VanDerWaalsContact O-CB 3.3Å; A1220-K1224 WeakPolarHBondContact O-CB 3.41Å; A1220-K1224 PolarHBondContact O-N 2.95Å
1221L85.1Confident81.6Confident80 Ų8056.1 Ų56.142%0.41929%0.289SS..Hα-helixtrans-63.3-48176.3-71169.7000112L1162 I1217 L1223 K1224 S1225L1162-L1221 HydrophobicContact CD1-CD2 3.74Å; L1162-L1221 HydrophobicContact CD1-CG 4.35Å; L1162-L1221 HydrophobicContact CD2-CD2 4.2Å; L1162-L1221 HydrophobicContact CD2-CG 4.11Å; I1217-L1221 HydrophobicContact CG2-CD1 4.01Å; I1217-L1221 WeakPolarHBondContact O-CG 3.39Å; I1217-L1221 PolarHBondContact O-N 3.49Å; L1221-L1223 VanDerWaalsContact C-N 3.32Å; L1221-L1223 PolarHBondContact O-N 3.06Å; L1221-K1224 PolarHBondContact O-N 3.41Å; L1221-S1225 PolarHBondContact O-N 2.93Å
1222K89.6Confident82.7Confident139 Ų13956.4 Ų56.460%0.60429%0.291SS*.Hα-helixtrans-57.2-45.9177.1-176.9171.5-176.4169.60111.7L1218 N1219 S1225 Q1226L1218-K1222 WeakPolarHBondContact O-CB 3.32Å; L1218-K1222 PolarHBondContact O-N 3.42Å; N1219-K1222 PolarHBondContact O-N 3.3Å; K1222-S1225 PolarHBondContact O-N 3.12Å; K1222-Q1226 WeakPolarHBondContact O-CG 3.48Å; K1222-Q1226 PolarHBondContact O-N 3.29Å; K1222-Q1226 VanDerWaalsContact O-N 3.08Å
1223L88.5Confident83.6Confident20 Ų2055.8 Ų55.811%0.10529%0.286CS..Hα-helixtrans-69.7-35-179.3-148.772.8000112.3L1099 S1102 L1158 N1219 A1220 L1221 Q1226 W1227L1099-L1223 HydrophobicContact CD2-CD2 4.2Å; S1102-L1223 VanDerWaalsContact CB-CD2 3.47Å; L1158-L1223 HydrophobicContact CD1-CB 4.05Å; L1158-L1223 HydrophobicContact CD1-CD2 4.21Å; L1158-L1223 HydrophobicContact CD1-CG 4.25Å; L1158-L1223 HydrophobicContact CD2-CD2 4.15Å; N1219-L1223 VanDerWaalsContact O-CB 3.27Å; N1219-L1223 WeakPolarHBondContact O-CB 3.16Å; N1219-L1223 PolarHBondContact O-N 2.89Å; A1220-L1223 PolarHBondContact O-N 3.13Å; L1221-L1223 VanDerWaalsContact C-N 3.32Å; L1221-L1223 PolarHBondContact O-N 3.06Å; L1223-Q1226 PolarHBondContact O-N 3.02Å; L1223-W1227 VanDerWaalsContact O-CD1 3.32Å; L1223-W1227 PolarHBondContact O-N 3.06Å
1224K90Very high84.2Confident57 Ų5754.9 Ų54.925%0.24828%0.283CS..Hα-helixtrans-64.3-43.5174.5178.6168.9169.3170.30111L1158 S1159 L1162 A1220 L1221 W1227 I1228L1158-K1224 HydrophobicContact CB-CB 4.25Å; L1158-K1224 HydrophobicContact CD1-CB 4.23Å; S1159-K1224 WeakPolarHBondContact OG-CE 3.33Å; S1159-K1224 PolarHBondContact OG-NZ 3.36Å; L1162-K1224 HydrophobicContact CD1-CD 3.97Å; A1220-K1224 VanDerWaalsContact O-CB 3.3Å; A1220-K1224 WeakPolarHBondContact O-CB 3.41Å; A1220-K1224 PolarHBondContact O-N 2.95Å; L1221-K1224 PolarHBondContact O-N 3.41Å; K1224-W1227 PolarHBondContact O-N 2.84Å; K1224-I1228 HydrophobicContact CG-CD1 4.05Å; K1224-I1228 WeakPolarHBondContact O-CD1 3.16Å; K1224-I1228 VanDerWaalsContact O-CG1 3.28Å; K1224-I1228 WeakPolarHBondContact O-CG1 3.41Å; K1224-I1228 PolarHBondContact O-N 3.12Å
1225S86.9Confident84.7Confident62 Ų6256.4 Ų56.443%0.43429%0.289SS..Hα-helixtrans-59.2-46.3172.7177.80000112.1L1221 K1222 W1227 I1228 N1229L1221-S1225 PolarHBondContact O-N 2.93Å; K1222-S1225 PolarHBondContact O-N 3.12Å; S1225-W1227 PolarHBondContact O-N 2.73Å; S1225-I1228 PolarHBondContact O-N 3.04Å; S1225-N1229 PolarHBondContact O-N 3Å
1226Q88.9Confident84.9Confident80 Ų8054.8 Ų54.837%0.37428%0.28SS..Hα-helixtrans-60.8-43177-70.2179-56.900113.1L1106 K1222 L1223 I1228 N1229 F1230L1106-Q1226 HydrophobicContact CD2-CB 3.62Å; L1106-Q1226 HydrophobicContact CD2-CG 4.38Å; K1222-Q1226 WeakPolarHBondContact O-CG 3.48Å; K1222-Q1226 PolarHBondContact O-N 3.29Å; K1222-Q1226 VanDerWaalsContact O-N 3.08Å; L1223-Q1226 PolarHBondContact O-N 3.02Å; Q1226-I1228 VanDerWaalsContact C-N 3.34Å; Q1226-I1228 PolarHBondContact O-N 3.07Å; Q1226-N1229 PolarHBondContact O-N 3.17Å; Q1226-F1230 PolarHBondContact O-N 3.33Å
1227W91.8Very high84.8Confident0 Ų055.6 Ų55.60%028%0.284CS..Hα-helixtrans-66.2-32.9175.4-85.1110.6000113.5S1102 R1105 L1106 A1109 T1150 A1151 H1154 V1155 L1223 K1224 S1225 F1230 S1231S1102-W1227 PolarHBondContact O-NE1 3.07Å; S1102-W1227 PolarHBondContact OG-NE1 3.02Å; S1102-W1227 VanDerWaalsContact OG-NE1 3.11Å; R1105-W1227 HydrophobicContact CB-CH2 4.24Å; R1105-W1227 HydrophobicContact CB-CZ2 3.76Å; L1106-W1227 HydrophobicContact CB-CH2 4.5Å; L1106-W1227 HydrophobicContact CB-CZ2 3.94Å; L1106-W1227 HydrophobicContact CD1-CD2 3.86Å; L1106-W1227 HydrophobicContact CD1-CE3 3.94Å; L1106-W1227 HydrophobicContact CD1-CG 4.29Å; L1106-W1227 HydrophobicContact CD1-CZ3 4.32Å; L1106-W1227 VanDerWaalsContact N-CZ2 3.35Å; A1109-W1227 HydrophobicContact CB-CH2 4.13Å; A1109-W1227 HydrophobicContact CB-CZ3 4.21Å; T1150-W1227 HydrophobicContact CG2-CH2 4.19Å; A1151-W1227 HydrophobicContact CB-CE3 3.73Å; A1151-W1227 HydrophobicContact CB-CZ3 3.95Å; H1154-W1227 HydrophobicContact CB-CD2 3.72Å; H1154-W1227 VanDerWaalsContact CB-CE2 3.48Å; H1154-W1227 HydrophobicContact CB-CE3 4.25Å; H1154-W1227 HydrophobicContact CB-CG 4.06Å; H1154-W1227 HydrophobicContact CB-CH2 4.31Å; H1154-W1227 HydrophobicContact CB-CZ2 3.79Å; H1154-W1227 AromaticContact CD2-CH2 3.96Å; H1154-W1227 AromaticContact CD2-CZ2 3.72Å; H1154-W1227 AromaticContact CG-CE2 3.61Å; H1154-W1227 AromaticContact CG-CZ2 3.44Å; H1154-W1227 VanDerWaalsContact CG-CZ2 3.44Å; H1154-W1227 AromaticContact CG-NE1 3.93Å; H1154-W1227 AromaticContact ND1-CE2 3.85Å; H1154-W1227 AromaticContact ND1-CZ2 3.69Å; H1154-W1227 AromaticContact ND1-NE1 3.82Å; V1155-W1227 HydrophobicContact CG2-CB 3.74Å; L1223-W1227 VanDerWaalsContact O-CD1 3.32Å; L1223-W1227 PolarHBondContact O-N 3.06Å; K1224-W1227 PolarHBondContact O-N 2.84Å; S1225-W1227 PolarHBondContact O-N 2.73Å; W1227-F1230 HydrophobicContact CE3-CD1 4.06Å; W1227-F1230 AromaticContact CZ3-CD1 3.98Å; W1227-F1230 HydrophobicContact CZ3-CD1 3.98Å; W1227-F1230 HydrophobicContact CZ3-CE1 4.32Å; W1227-S1231 WeakPolarHBondContact O-CB 3.44Å; W1227-S1231 PolarHBondContact O-N 3.4Å
1228I86.6Confident84.5Confident82 Ų8257.6 Ų57.642%0.42129%0.291SS..Hα-helixtrans-66.1-44.7173.2-70.6164.3000110.5V1155 K1224 S1225 Q1226 F1230 S1231 S1232V1155-I1228 HydrophobicContact CG1-CG1 4.47Å; V1155-I1228 HydrophobicContact CG2-CG1 4.08Å; K1224-I1228 HydrophobicContact CG-CD1 4.05Å; K1224-I1228 WeakPolarHBondContact O-CD1 3.16Å; K1224-I1228 VanDerWaalsContact O-CG1 3.28Å; K1224-I1228 WeakPolarHBondContact O-CG1 3.41Å; K1224-I1228 PolarHBondContact O-N 3.12Å; S1225-I1228 PolarHBondContact O-N 3.04Å; Q1226-I1228 VanDerWaalsContact C-N 3.34Å; Q1226-I1228 PolarHBondContact O-N 3.07Å; I1228-F1230 VanDerWaalsContact C-N 3.35Å; I1228-F1230 PolarHBondContact O-N 2.93Å; I1228-S1231 WeakPolarHBondContact O-CB 3.22Å; I1228-S1231 PolarHBondContact O-N 2.74Å; I1228-S1231 VanDerWaalsContact O-N 3.16Å; I1228-S1232 PolarHBondContact O-N 2.91Å; I1228-S1232 PolarHBondContact O-OG 3.27Å
1229N85.4Confident84.2Confident91 Ų9159.2 Ų59.249%0.48730%0.296SS..Hα-helixtrans-66.9-33.7177.4-69.8-21.5000112.9S1225 Q1226 S1232 T1233S1225-N1229 PolarHBondContact O-N 3Å; Q1226-N1229 PolarHBondContact O-N 3.17Å; N1229-S1232 PolarHBondContact O-OG 2.66Å; N1229-T1233 WeakPolarHBondContact O-CB 3.33Å; N1229-T1233 PolarHBondContact O-N 2.89Å; N1229-T1233 PolarHBondContact O-OG1 3.2Å
1230F88.5Confident83.4Confident11 Ų1157.6 Ų57.65%0.04829%0.286CS..Hα-helixtrans-65.9-44.2169.5-178.2-98.2000111.5L1106 A1109 E1110 L1113 L1147 A1151 Q1226 W1227 I1228 T1233 V1234L1106-F1230 HydrophobicContact CD1-CB 3.87Å; L1106-F1230 HydrophobicContact CD1-CG 4.15Å; A1109-F1230 HydrophobicContact CB-CE1 3.8Å; A1109-F1230 HydrophobicContact CB-CE2 4.15Å; A1109-F1230 HydrophobicContact CB-CZ 3.58Å; E1110-F1230 HydrophobicContact CG-CD2 3.82Å; E1110-F1230 HydrophobicContact CG-CE2 3.98Å; L1113-F1230 HydrophobicContact CB-CE2 4.28Å; L1113-F1230 HydrophobicContact CB-CZ 4.45Å; L1113-F1230 HydrophobicContact CD2-CE2 3.83Å; L1113-F1230 HydrophobicContact CD2-CZ 4.34Å; L1147-F1230 HydrophobicContact CD1-CZ 4.26Å; L1147-F1230 HydrophobicContact CD2-CE1 4.27Å; L1147-F1230 HydrophobicContact CD2-CZ 3.98Å; A1151-F1230 HydrophobicContact CB-CD1 4.1Å; Q1226-F1230 PolarHBondContact O-N 3.33Å; W1227-F1230 HydrophobicContact CE3-CD1 4.06Å; W1227-F1230 AromaticContact CZ3-CD1 3.98Å; W1227-F1230 HydrophobicContact CZ3-CD1 3.98Å; W1227-F1230 HydrophobicContact CZ3-CE1 4.32Å; I1228-F1230 VanDerWaalsContact C-N 3.35Å; I1228-F1230 PolarHBondContact O-N 2.93Å; F1230-T1233 PolarHBondContact O-N 3.1Å; F1230-V1234 HydrophobicContact CD1-CG2 4.24Å; F1230-V1234 HydrophobicContact CE1-CG2 3.74Å; F1230-V1234 HydrophobicContact CE2-CG2 4.26Å; F1230-V1234 HydrophobicContact CZ-CG2 3.74Å; F1230-V1234 WeakPolarHBondContact O-CG2 3.36Å; F1230-V1234 PolarHBondContact O-N 2.75Å
1231S87Confident82.7Confident10 Ų1058.9 Ų58.97%0.0730%0.295CS..Hα-helixtrans-62.6-44.1178.7-173.30000112.7L1148 W1227 I1228 T1233 V1234 R1235L1148-S1231 WeakPolarHBondContact CD1-OG 3.49Å; W1227-S1231 WeakPolarHBondContact O-CB 3.44Å; W1227-S1231 PolarHBondContact O-N 3.4Å; I1228-S1231 WeakPolarHBondContact O-CB 3.22Å; I1228-S1231 PolarHBondContact O-N 2.74Å; I1228-S1231 VanDerWaalsContact O-N 3.16Å; S1231-T1233 PolarHBondContact O-N 3.19Å; S1231-V1234 PolarHBondContact O-N 3.43Å; S1231-R1235 WeakPolarHBondContact O-CB 3.39Å; S1231-R1235 WeakPolarHBondContact O-CG 3.38Å; S1231-R1235 PolarHBondContact O-N 3.46Å
1232S81.4Confident82Confident63 Ų6357.6 Ų57.644%0.44129%0.288SS..Hα-helixtrans-63.3-40.6175.762.20000112.1I1228 N1229 V1234 R1235 L1236I1228-S1232 PolarHBondContact O-N 2.91Å; I1228-S1232 PolarHBondContact O-OG 3.27Å; N1229-S1232 PolarHBondContact O-OG 2.66Å; S1232-V1234 PolarHBondContact O-N 3.49Å; S1232-R1235 PolarHBondContact O-N 3.31Å; S1232-L1236 PolarHBondContact O-N 2.91Å
1233T81.5Confident81.2Confident40 Ų4053.7 Ų53.725%0.24527%0.272CS..Hα-helixtrans-60.6-44.2174.3-56.80000112L1113 N1229 F1230 S1231 L1236 I1237 I1348L1113-T1233 HydrophobicContact CD2-CG2 4.44Å; N1229-T1233 WeakPolarHBondContact O-CB 3.33Å; N1229-T1233 PolarHBondContact O-N 2.89Å; N1229-T1233 PolarHBondContact O-OG1 3.2Å; F1230-T1233 PolarHBondContact O-N 3.1Å; S1231-T1233 PolarHBondContact O-N 3.19Å; T1233-L1236 PolarHBondContact O-N 3.33Å; T1233-I1237 HydrophobicContact CG2-CD1 4.36Å; T1233-I1237 WeakPolarHBondContact O-CG1 3.22Å; T1233-I1237 PolarHBondContact O-N 3.11Å; T1233-I1348 HydrophobicContact CG2-CG2 4.19Å
1234V81.9Confident80.3Confident2 Ų255.9 Ų55.91%0.01228%0.28CS..Hα-helixtrans-67-40.9177172.50000111.6L1113 L1147 L1148 F1230 S1231 S1232 I1237 Y1238L1113-V1234 HydrophobicContact CD1-CG2 4.5Å; L1113-V1234 HydrophobicContact CD2-CG2 4.09Å; L1147-V1234 HydrophobicContact CB-CG1 4.34Å; L1147-V1234 HydrophobicContact CB-CG2 4.47Å; L1147-V1234 HydrophobicContact CD1-CG2 4.43Å; L1148-V1234 HydrophobicContact CB-CG1 4.33Å; F1230-V1234 HydrophobicContact CD1-CG2 4.24Å; F1230-V1234 HydrophobicContact CE1-CG2 3.74Å; F1230-V1234 HydrophobicContact CE2-CG2 4.26Å; F1230-V1234 HydrophobicContact CZ-CG2 3.74Å; F1230-V1234 WeakPolarHBondContact O-CG2 3.36Å; F1230-V1234 PolarHBondContact O-N 2.75Å; S1231-V1234 PolarHBondContact O-N 3.43Å; S1232-V1234 PolarHBondContact O-N 3.49Å; V1234-I1237 PolarHBondContact O-N 2.66Å; V1234-Y1238 WeakPolarHBondContact O-CB 3.4Å; V1234-Y1238 PolarHBondContact O-N 2.85Å
1235R82Confident79.3Confident130 Ų13055 Ų5549%0.49128%0.276SS..Hα-helixtrans-62.8-40.4176.3-74.1177.6178.4-178.21.2112.3L1148 E1152 S1231 S1232 Y1238 Q1239L1148-R1235 HydrophobicContact CD1-CG 3.85Å; L1148-R1235 HydrophobicContact CD2-CG 4.29Å; E1152-R1235 IonicContact OE1-CZ 3.99Å; E1152-R1235 IonicContact OE1-NE 2.73Å; E1152-R1235 IonicContact OE1-NH2 2.95Å; E1152-R1235 PolarHBondContact OE1-NH2 3.22Å; S1231-R1235 WeakPolarHBondContact O-CB 3.39Å; S1231-R1235 WeakPolarHBondContact O-CG 3.38Å; S1231-R1235 PolarHBondContact O-N 3.46Å; S1232-R1235 PolarHBondContact O-N 3.31Å; R1235-Y1238 WeakPolarHBondContact O-CB 3.42Å; R1235-Y1238 PolarHBondContact O-N 2.95Å; R1235-Q1239 PolarHBondContact O-N 2.6Å
1236L78.1Confident78.6Confident83 Ų8354.3 Ų54.344%0.43527%0.274SS..Hα-helixtrans-60.3-47.8176.6-176.466.5000111.9S1232 T1233 Y1238 Q1239 Q1240S1232-L1236 PolarHBondContact O-N 2.91Å; T1233-L1236 PolarHBondContact O-N 3.33Å; L1236-Y1238 VanDerWaalsContact C-N 3.3Å; L1236-Y1238 PolarHBondContact O-N 2.78Å; L1236-Q1239 PolarHBondContact O-N 2.75Å; L1236-Q1240 WeakPolarHBondContact O-CG 3.31Å; L1236-Q1240 PolarHBondContact O-N 2.7Å; L1236-Q1240 VanDerWaalsContact O-N 3.09Å
1237I76.7Confident78Confident27 Ų2751.1 Ų51.114%0.13826%0.259CS..Hα-helixtrans-62.1-39177.2-65.3167.1000110.9L1113 I1117 T1233 V1234 S1241 I1348 I1352L1113-I1237 HydrophobicContact CD1-CD1 4.1Å; L1113-I1237 HydrophobicContact CD2-CD1 4.37Å; I1117-I1237 HydrophobicContact CD1-CD1 4.46Å; T1233-I1237 HydrophobicContact CG2-CD1 4.36Å; T1233-I1237 WeakPolarHBondContact O-CG1 3.22Å; T1233-I1237 PolarHBondContact O-N 3.11Å; V1234-I1237 PolarHBondContact O-N 2.66Å; I1237-S1241 WeakPolarHBondContact O-CB 3.45Å; I1237-S1241 PolarHBondContact O-N 3.2Å; I1237-S1241 VanDerWaalsContact O-N 3.15Å; I1237-S1241 PolarHBondContact O-OG 3.06Å; I1237-I1348 HydrophobicContact CD1-CG2 4.34Å; I1237-I1352 HydrophobicContact CG1-CD1 4.3Å; I1237-I1352 HydrophobicContact CG2-CD1 4.33Å
1238Y74.8Confident77.2Confident74 Ų7456.1 Ų56.129%0.2928%0.28SS..Hα-helixtrans-65.3-39.1176.2-167.8-94.7000112.9W1140 D1145 V1234 R1235 L1236 S1241 N1242W1140-Y1238 HydrophobicContact CZ3-CD2 4.36Å; D1145-Y1238 WeakPolarHBondContact OD1-CE2 3.27Å; D1145-Y1238 PolarHBondContact OD1-OH 3.17Å; D1145-Y1238 VanDerWaalsContact OD1-OH 3.12Å; V1234-Y1238 WeakPolarHBondContact O-CB 3.4Å; V1234-Y1238 PolarHBondContact O-N 2.85Å; R1235-Y1238 WeakPolarHBondContact O-CB 3.42Å; R1235-Y1238 PolarHBondContact O-N 2.95Å; L1236-Y1238 VanDerWaalsContact C-N 3.3Å; L1236-Y1238 PolarHBondContact O-N 2.78Å; Y1238-S1241 WeakPolarHBondContact CA-OG 3.45Å; Y1238-S1241 PolarHBondContact O-OG 2.7Å; Y1238-N1242 WeakPolarHBondContact CD1-ND2 3.34Å; Y1238-N1242 WeakPolarHBondContact CE1-ND2 3.42Å; Y1238-N1242 PolarHBondContact O-N 3.27Å; Y1238-N1242 PolarHBondContact O-ND2 3.15Å; Y1238-N1242 VanDerWaalsContact O-ND2 3.11Å
1239Q74.1Confident76.7Confident119 Ų11958.9 Ų58.956%0.55629%0.289SS*.Hα-helixtrans-66.9-52.7178.8-171.5174.5-28.500111.3R1235 L1236 S1241 N1242 Q1243R1235-Q1239 PolarHBondContact O-N 2.6Å; L1236-Q1239 PolarHBondContact O-N 2.75Å; Q1239-S1241 VanDerWaalsContact C-N 3.3Å; Q1239-S1241 PolarHBondContact O-N 3.2Å; Q1239-N1242 PolarHBondContact O-N 3.03Å; Q1239-Q1243 PolarHBondContact O-N 3.33Å; Q1239-Q1243 VanDerWaalsContact O-N 3.11Å; Q1239-Q1243 PolarHBondContact O-OE1 3.11Å
1240Q68.3Low76.4Confident40 Ų4058.9 Ų58.919%0.18729%0.287CS..Hα-helixtrans-55.4-43.6177.8-70.9175-21.700112.5L1236 N1242 Q1243 Y1244L1236-Q1240 WeakPolarHBondContact O-CG 3.31Å; L1236-Q1240 PolarHBondContact O-N 2.7Å; L1236-Q1240 VanDerWaalsContact O-N 3.09Å; Q1240-N1242 VanDerWaalsContact C-N 3.28Å; Q1240-N1242 PolarHBondContact O-N 3.24Å; Q1240-Q1243 PolarHBondContact O-N 3.3Å; Q1240-Y1244 PolarHBondContact O-N 3.29Å
1241S69.3Low76Confident26 Ų2658.8 Ų58.818%0.18229%0.286CS..Hα-helixtrans-69.4-21.9-179.455.40000114W1140 I1237 Y1238 Q1239W1140-S1241 WeakPolarHBondContact CH2-OG 3.25Å; W1140-S1241 WeakPolarHBondContact CZ3-OG 3.49Å; I1237-S1241 WeakPolarHBondContact O-CB 3.45Å; I1237-S1241 PolarHBondContact O-N 3.2Å; I1237-S1241 VanDerWaalsContact O-N 3.15Å; I1237-S1241 PolarHBondContact O-OG 3.06Å; Y1238-S1241 WeakPolarHBondContact CA-OG 3.45Å; Y1238-S1241 PolarHBondContact O-OG 2.7Å; Q1239-S1241 VanDerWaalsContact C-N 3.3Å; Q1239-S1241 PolarHBondContact O-N 3.2Å
1242N71.8Confident75.6Confident53 Ų5364.6 Ų64.628%0.28331%0.308SS..Hα-helixtrans-80.6-37170.3-72.2-33000112.4R1141 Y1238 Q1239 Q1240 E1245 A1246R1141-N1242 PolarHBondContact NE-OD1 3.17Å; R1141-N1242 PolarHBondContact NH2-OD1 3.06Å; Y1238-N1242 WeakPolarHBondContact CD1-ND2 3.34Å; Y1238-N1242 WeakPolarHBondContact CE1-ND2 3.42Å; Y1238-N1242 PolarHBondContact O-N 3.27Å; Y1238-N1242 PolarHBondContact O-ND2 3.15Å; Y1238-N1242 VanDerWaalsContact O-ND2 3.11Å; Q1239-N1242 PolarHBondContact O-N 3.03Å; Q1240-N1242 VanDerWaalsContact C-N 3.28Å; Q1240-N1242 PolarHBondContact O-N 3.24Å; N1242-E1245 PolarHBondContact O-N 3.39Å; N1242-A1246 PolarHBondContact O-N 2.92Å; N1242-A1246 VanDerWaalsContact O-N 3.13Å
1243Q71.3Confident75.6Confident57 Ų5766.3 Ų66.327%0.26631%0.311SS..Hα-helixtrans-63.9-40.7174.2-69.1166.1-84.100111.3Q1239 Q1240 E1245 A1246 W1247 E1333Q1239-Q1243 PolarHBondContact O-N 3.33Å; Q1239-Q1243 VanDerWaalsContact O-N 3.11Å; Q1239-Q1243 PolarHBondContact O-OE1 3.11Å; Q1240-Q1243 PolarHBondContact O-N 3.3Å; Q1243-E1245 PolarHBondContact O-N 3.35Å; Q1243-A1246 WeakPolarHBondContact O-CB 3.5Å; Q1243-A1246 PolarHBondContact O-N 2.98Å; Q1243-W1247 PolarHBondContact O-N 3.48Å; Q1243-E1333 PolarHBondContact NE2-OE1 3.09Å
1244Y69.9Low75.6Confident67 Ų6764.9 Ų64.926%0.26330%0.302SS..Hα-helixtrans-58.6-43.7175-171.2-106.4000113.7Q1240 A1246 K1248 L1354 D1355 L1358Q1240-Y1244 PolarHBondContact O-N 3.29Å; Y1244-A1246 VanDerWaalsContact C-N 3.32Å; Y1244-A1246 PolarHBondContact O-N 2.99Å; Y1244-K1248 VanDerWaalsContact O-CB 3.25Å; Y1244-K1248 WeakPolarHBondContact O-CB 3.33Å; Y1244-K1248 PolarHBondContact O-N 3.26Å; Y1244-L1354 HydrophobicContact CD2-CD2 3.64Å; Y1244-L1354 HydrophobicContact CE2-CD2 4.14Å; Y1244-D1355 HydrophobicContact CE2-CB 4.31Å; Y1244-D1355 WeakPolarHBondContact OH-CB 3.4Å; Y1244-L1358 HydrophobicContact CD2-CD1 3.89Å; Y1244-L1358 HydrophobicContact CE2-CB 4.47Å; Y1244-L1358 HydrophobicContact CE2-CD1 3.4Å
1245E70.2Confident75.8Confident38 Ų3867.3 Ų67.318%0.17831%0.313CS..Hα-helixtrans-69.7-26.9174.7-84.3-73.7141.600112.8N1242 Q1243 K1248 K1249N1242-E1245 PolarHBondContact O-N 3.39Å; Q1243-E1245 PolarHBondContact O-N 3.35Å; E1245-K1248 WeakPolarHBondContact OE1-CD 3.31Å; E1245-K1248 IonicContact OE1-NZ 3.68Å; E1245-K1248 PolarHBondContact OE1-NZ 3.23Å; E1245-K1248 IonicContact OE2-NZ 2.7Å; E1245-K1249 WeakPolarHBondContact O-CG 3.11Å; E1245-K1249 PolarHBondContact O-N 2.8Å
1246A72.1Confident75.8Confident48 Ų4864.1 Ų64.140%0.39731%0.305SS..Hα-helixtrans-69.7-50.317300000111.6N1242 Q1243 Y1244 K1248 K1249 Q1250N1242-A1246 PolarHBondContact O-N 2.92Å; N1242-A1246 VanDerWaalsContact O-N 3.13Å; Q1243-A1246 WeakPolarHBondContact O-CB 3.5Å; Q1243-A1246 PolarHBondContact O-N 2.98Å; Y1244-A1246 VanDerWaalsContact C-N 3.32Å; Y1244-A1246 PolarHBondContact O-N 2.99Å; A1246-K1248 VanDerWaalsContact C-N 3.33Å; A1246-K1248 PolarHBondContact O-N 3.23Å; A1246-K1249 PolarHBondContact O-N 3.15Å; A1246-K1249 VanDerWaalsContact O-N 3.13Å; A1246-Q1250 PolarHBondContact O-N 3.16Å
1247W75.9Confident76.1Confident13 Ų1363.7 Ų63.75%0.04930%0.298CS..Hα-helixtrans-59.2-43.2175.8-65.6-28.3000112Q1243 K1249 Q1250 L1251 E1329 L1330 E1333 L1354 L1358Q1243-W1247 PolarHBondContact O-N 3.48Å; W1247-K1249 VanDerWaalsContact C-N 3.28Å; W1247-K1249 PolarHBondContact O-N 3.14Å; W1247-Q1250 PolarHBondContact O-N 2.75Å; W1247-Q1250 VanDerWaalsContact O-N 3.15Å; W1247-L1251 VanDerWaalsContact O-CB 3.31Å; W1247-L1251 WeakPolarHBondContact O-CB 3.28Å; W1247-L1251 PolarHBondContact O-N 3.32Å; W1247-E1329 HydrophobicContact CZ2-CB 4.04Å; W1247-L1330 HydrophobicContact CD2-CD2 4.47Å; W1247-L1330 HydrophobicContact CD2-CG 4.4Å; W1247-L1330 HydrophobicContact CE3-CD2 3.74Å; W1247-L1330 HydrophobicContact CE3-CG 4.15Å; W1247-L1330 HydrophobicContact CH2-CD2 3.83Å; W1247-L1330 HydrophobicContact CH2-CG 4.08Å; W1247-L1330 HydrophobicContact CZ2-CG 4.34Å; W1247-L1330 HydrophobicContact CZ3-CD2 3.37Å; W1247-L1330 HydrophobicContact CZ3-CG 3.99Å; W1247-E1333 HydrophobicContact CH2-CB 4.39Å; W1247-E1333 HydrophobicContact CH2-CG 4.32Å; W1247-E1333 WeakPolarHBondContact CH2-OE1 3.28Å; W1247-E1333 WeakPolarHBondContact CH2-OE2 3.45Å; W1247-E1333 WeakPolarHBondContact CZ2-OE1 3.4Å; W1247-L1354 HydrophobicContact CE3-CD2 4.4Å; W1247-L1354 HydrophobicContact CH2-CD1 4.26Å; W1247-L1354 HydrophobicContact CZ3-CD1 3.87Å; W1247-L1354 HydrophobicContact CZ3-CD2 3.77Å; W1247-L1354 HydrophobicContact CZ3-CG 4.49Å; W1247-L1358 HydrophobicContact CB-CD1 4.5Å
1248K74.6Confident76.5Confident104 Ų10462.5 Ų62.545%0.45229%0.292SS..Hα-helixtrans-58-36.1175.5179.1-179.1164.9-165.10113.2Y1244 E1245 A1246 Y1252Y1244-K1248 VanDerWaalsContact O-CB 3.25Å; Y1244-K1248 WeakPolarHBondContact O-CB 3.33Å; Y1244-K1248 PolarHBondContact O-N 3.26Å; E1245-K1248 WeakPolarHBondContact OE1-CD 3.31Å; E1245-K1248 IonicContact OE1-NZ 3.68Å; E1245-K1248 PolarHBondContact OE1-NZ 3.23Å; E1245-K1248 IonicContact OE2-NZ 2.7Å; A1246-K1248 VanDerWaalsContact C-N 3.33Å; A1246-K1248 PolarHBondContact O-N 3.23Å; K1248-Y1252 PolarHBondContact O-N 2.91Å
1249K76.8Confident76.9Confident140 Ų14064.6 Ų64.661%0.60930%0.304SS*.Hα-helixtrans-72.7-41.7173.6-74.1176.5180-173.80112.4E1245 A1246 W1247 L1251 Y1252 I1253E1245-K1249 WeakPolarHBondContact O-CG 3.11Å; E1245-K1249 PolarHBondContact O-N 2.8Å; A1246-K1249 PolarHBondContact O-N 3.15Å; A1246-K1249 VanDerWaalsContact O-N 3.13Å; W1247-K1249 VanDerWaalsContact C-N 3.28Å; W1247-K1249 PolarHBondContact O-N 3.14Å; K1249-L1251 VanDerWaalsContact C-N 3.33Å; K1249-L1251 PolarHBondContact O-N 3.34Å; K1249-Y1252 PolarHBondContact O-N 2.86Å; K1249-I1253 WeakPolarHBondContact O-CG1 3.34Å; K1249-I1253 PolarHBondContact O-N 3.38Å
1250Q78.5Confident77.3Confident91 Ų9163 Ų6343%0.42530%0.299SS..Hα-helixtrans-61.5-42.1174.7-68.8171.3-34.200111.4A1246 W1247 Y1252 I1253 L1254 I1326A1246-Q1250 PolarHBondContact O-N 3.16Å; W1247-Q1250 PolarHBondContact O-N 2.75Å; W1247-Q1250 VanDerWaalsContact O-N 3.15Å; Q1250-Y1252 VanDerWaalsContact C-N 3.33Å; Q1250-Y1252 PolarHBondContact O-N 2.8Å; Q1250-I1253 PolarHBondContact O-N 2.98Å; Q1250-L1254 WeakPolarHBondContact O-CG 3.38Å; Q1250-L1254 PolarHBondContact O-N 3.04Å; Q1250-I1326 HydrophobicContact CB-CD1 3.78Å
1251L79.4Confident78Confident9 Ų961.1 Ų61.15%0.04729%0.291CS..Hα-helixtrans-59.9-39.5177.1-164.773.8000112.5W1247 K1249 L1254 Q1255 L1358 E1361 I1362 L1365W1247-L1251 VanDerWaalsContact O-CB 3.31Å; W1247-L1251 WeakPolarHBondContact O-CB 3.28Å; W1247-L1251 PolarHBondContact O-N 3.32Å; K1249-L1251 VanDerWaalsContact C-N 3.33Å; K1249-L1251 PolarHBondContact O-N 3.34Å; L1251-L1254 PolarHBondContact O-N 3.09Å; L1251-Q1255 WeakPolarHBondContact O-CG 3.29Å; L1251-Q1255 PolarHBondContact O-N 3.01Å; L1251-L1358 HydrophobicContact CD2-CG 4.3Å; L1251-E1361 HydrophobicContact CD2-CB 3.87Å; L1251-I1362 HydrophobicContact CD1-CG1 3.83Å; L1251-L1365 HydrophobicContact CD1-CD1 3.54Å; L1251-L1365 HydrophobicContact CG-CD1 4.23Å
1252Y78.2Confident78.7Confident133 Ų13361.1 Ų61.152%0.52229%0.29SS..Hα-helixtrans-66.6-41.5174.3179.8-108000112.6K1248 K1249 Q1250 L1254 Q1255 L1256K1248-Y1252 PolarHBondContact O-N 2.91Å; K1249-Y1252 PolarHBondContact O-N 2.86Å; Q1250-Y1252 VanDerWaalsContact C-N 3.33Å; Q1250-Y1252 PolarHBondContact O-N 2.8Å; Y1252-L1254 VanDerWaalsContact C-N 3.31Å; Y1252-L1254 PolarHBondContact O-N 3.43Å; Y1252-Q1255 WeakPolarHBondContact O-CB 3.46Å; Y1252-Q1255 PolarHBondContact O-N 2.89Å; Y1252-L1256 HydrophobicContact CD1-CD1 4.06Å; Y1252-L1256 HydrophobicContact CE1-CD1 3.61Å; Y1252-L1256 PolarHBondContact O-N 2.95Å; Y1252-L1256 VanDerWaalsContact O-N 3.08Å
1253I81.3Confident79.2Confident99 Ų9965.6 Ų65.651%0.50830%0.303SS..Hα-helixtrans-63.8-37.5174.7-65.1165.5000111K1249 Q1250 L1256 R1257K1249-I1253 WeakPolarHBondContact O-CG1 3.34Å; K1249-I1253 PolarHBondContact O-N 3.38Å; Q1250-I1253 PolarHBondContact O-N 2.98Å; I1253-L1256 PolarHBondContact O-N 3.47Å; I1253-R1257 PolarHBondContact O-N 2.7Å; I1253-R1257 VanDerWaalsContact O-N 3.08Å
1254L83.2Confident79.7Confident10 Ų1064.7 Ų64.75%0.05230%0.3CS..Hα-helixtrans-65.5-38.8173.2-71.4171.4000112.4Q1250 L1251 Y1252 R1257 M1258 L1319 A1322 L1323 I1326 L1365Q1250-L1254 WeakPolarHBondContact O-CG 3.38Å; Q1250-L1254 PolarHBondContact O-N 3.04Å; L1251-L1254 PolarHBondContact O-N 3.09Å; Y1252-L1254 VanDerWaalsContact C-N 3.31Å; Y1252-L1254 PolarHBondContact O-N 3.43Å; L1254-R1257 PolarHBondContact O-N 3.33Å; L1254-M1258 VanDerWaalsContact O-CB 3.27Å; L1254-M1258 WeakPolarHBondContact O-CB 3.21Å; L1254-M1258 WeakPolarHBondContact O-CG 3.4Å; L1254-M1258 PolarHBondContact O-N 3.35Å; L1254-L1319 HydrophobicContact CD2-CD2 3.6Å; L1254-A1322 HydrophobicContact CD2-CB 3.82Å; L1254-L1323 HydrophobicContact CD1-CD2 4Å; L1254-L1323 HydrophobicContact CD1-CG 4.35Å; L1254-I1326 HydrophobicContact CD1-CD1 3.56Å; L1254-L1365 HydrophobicContact CB-CD1 4.12Å
1255Q84.6Confident80.2Confident53 Ų5361.8 Ų61.825%0.24829%0.289CS..Hα-helixtrans-62.1-42.3174.7-74.5175.119.200112.1L1251 Y1252 M1258 H1259 E1361 L1365L1251-Q1255 WeakPolarHBondContact O-CG 3.29Å; L1251-Q1255 PolarHBondContact O-N 3.01Å; Y1252-Q1255 WeakPolarHBondContact O-CB 3.46Å; Y1252-Q1255 PolarHBondContact O-N 2.89Å; Q1255-M1258 PolarHBondContact O-N 3.41Å; Q1255-H1259 PolarHBondContact O-N 2.98Å; Q1255-E1361 PolarHBondContact NE2-OE2 3.09Å; Q1255-L1365 HydrophobicContact CG-CD1 4.21Å; Q1255-L1365 HydrophobicContact CG-CD2 3.84Å; Q1255-L1365 HydrophobicContact CG-CG 4.38Å
1256L82.2Confident80.7Confident62 Ų6269.3 Ų69.333%0.32532%0.316SS..Hα-helixtrans-61.7-51.8174.6-79.4161.1000112.2Y1252 I1253 M1258 H1259 D1260Y1252-L1256 HydrophobicContact CD1-CD1 4.06Å; Y1252-L1256 HydrophobicContact CE1-CD1 3.61Å; Y1252-L1256 PolarHBondContact O-N 2.95Å; Y1252-L1256 VanDerWaalsContact O-N 3.08Å; I1253-L1256 PolarHBondContact O-N 3.47Å; L1256-M1258 VanDerWaalsContact C-N 3.32Å; L1256-M1258 PolarHBondContact O-N 2.88Å; L1256-H1259 WeakPolarHBondContact O-CB 3.38Å; L1256-H1259 PolarHBondContact O-N 2.88Å; L1256-H1259 VanDerWaalsContact O-N 3.15Å; L1256-D1260 PolarHBondContact O-N 3.24Å; L1256-D1260 VanDerWaalsContact O-N 3.09Å
1257R85.9Confident81Confident74 Ų7472 Ų7228%0.27932%0.321SS..Hα-helixtrans-62.9-36.4178.6-70.8-177.471.1-170.13.9112.7I1253 L1254 D1260 L1261 E1315 S1318 L1319I1253-R1257 PolarHBondContact O-N 2.7Å; I1253-R1257 VanDerWaalsContact O-N 3.08Å; L1254-R1257 PolarHBondContact O-N 3.33Å; R1257-D1260 PolarHBondContact O-N 3.33Å; R1257-L1261 PolarHBondContact O-N 2.93Å; R1257-E1315 IonicContact CZ-OE1 2.69Å; R1257-E1315 IonicContact CZ-OE2 2.66Å; R1257-E1315 IonicContact NE-OE1 2.85Å; R1257-E1315 PolarHBondContact NE-OE1 2.75Å; R1257-E1315 IonicContact NE-OE2 3.7Å; R1257-E1315 IonicContact NH2-OE1 3.01Å; R1257-E1315 PolarHBondContact NH2-OE1 3.4Å; R1257-E1315 IonicContact NH2-OE2 3.15Å; R1257-E1315 PolarHBondContact NH2-OE2 3.32Å; R1257-S1318 PolarHBondContact NH1-OG 3.06Å; R1257-S1318 PolarHBondContact NH2-OG 3.36Å; R1257-L1319 HydrophobicContact CB-CD1 4.41Å; R1257-L1319 HydrophobicContact CB-CD2 3.74Å
1258M84.2Confident81.1Confident2 Ų271.8 Ų71.81%0.0132%0.32CS..Hα-helixtrans-64.4-37.4173.8-87.3-60.9-58.600113.1L1254 Q1255 L1256 L1261 S1262 L1319 L1365 Q1368 L1369 N1372L1254-M1258 VanDerWaalsContact O-CB 3.27Å; L1254-M1258 WeakPolarHBondContact O-CB 3.21Å; L1254-M1258 WeakPolarHBondContact O-CG 3.4Å; L1254-M1258 PolarHBondContact O-N 3.35Å; Q1255-M1258 PolarHBondContact O-N 3.41Å; L1256-M1258 VanDerWaalsContact C-N 3.32Å; L1256-M1258 PolarHBondContact O-N 2.88Å; M1258-L1261 HydrophobicContact SD-CD2 4.11Å; M1258-S1262 PolarHBondContact O-N 3.06Å; M1258-S1262 VanDerWaalsContact O-N 3.08Å; M1258-S1262 PolarHBondContact O-OG 3.04Å; M1258-L1319 HydrophobicContact CG-CD1 4.28Å; M1258-L1319 HydrophobicContact CG-CD2 4.47Å; M1258-L1319 HydrophobicContact SD-CD1 3.8Å; M1258-L1365 HydrophobicContact CB-CD2 4.13Å; M1258-L1365 HydrophobicContact CG-CD2 3.78Å; M1258-Q1368 VanDerWaalsContact CE-C 3.42Å; M1258-Q1368 HydrophobicContact CE-CB 3.7Å; M1258-Q1368 HydrophobicContact CE-CG 3.45Å; M1258-Q1368 VanDerWaalsContact CE-CG 3.45Å; M1258-L1369 HydrophobicContact CE-CB 4.14Å; M1258-L1369 HydrophobicContact SD-CB 4.01Å; M1258-L1369 HydrophobicContact SD-CD1 3.78Å; M1258-L1369 HydrophobicContact SD-CG 4.47Å; M1258-N1372 VanDerWaalsContact CE-ND2 3.28Å; M1258-N1372 WeakPolarHBondContact CE-ND2 3.48Å
1259H84Confident81.3Confident118 Ų11867.4 Ų67.455%0.54631%0.305SS..Hα-helixtrans-63.9-45.6173.5174.6-93.9000111.5Q1255 L1256 S1262 R1263Q1255-H1259 PolarHBondContact O-N 2.98Å; L1256-H1259 WeakPolarHBondContact O-CB 3.38Å; L1256-H1259 PolarHBondContact O-N 2.88Å; L1256-H1259 VanDerWaalsContact O-N 3.15Å; H1259-S1262 PolarHBondContact O-N 3.12Å; H1259-R1263 WeakPolarHBondContact O-CB 3.36Å; H1259-R1263 PolarHBondContact O-N 2.69Å
1260D81.4Confident81.2Confident85 Ų8566.3 Ų66.346%0.45531%0.305SS..Hα-helixtrans-66.7-35.6177.6-81.6-18.7000113.2L1256 R1257 R1263 L1264L1256-D1260 PolarHBondContact O-N 3.24Å; L1256-D1260 VanDerWaalsContact O-N 3.09Å; R1257-D1260 PolarHBondContact O-N 3.33Å; D1260-R1263 WeakPolarHBondContact O-CB 3.07Å; D1260-R1263 PolarHBondContact O-N 3.12Å; D1260-L1264 WeakPolarHBondContact O-CB 3.48Å; D1260-L1264 PolarHBondContact O-N 3.47Å
1261L84Confident80.8Confident2 Ų264 Ų641%0.0130%0.299CS..Hα-helixtrans-61.2-44.6170.5173.862.1000111.7R1257 M1258 R1263 L1264 T1265 C1312 E1315 V1316 L1319 L1369 N1372R1257-L1261 PolarHBondContact O-N 2.93Å; M1258-L1261 HydrophobicContact SD-CD2 4.11Å; L1261-R1263 VanDerWaalsContact C-N 3.34Å; L1261-L1264 PolarHBondContact O-N 3.26Å; L1261-T1265 WeakPolarHBondContact O-CB 3.12Å; L1261-T1265 PolarHBondContact O-N 3.43Å; L1261-T1265 PolarHBondContact O-OG1 2.9Å; L1261-C1312 HydrophobicContact CD1-CB 4.18Å; L1261-E1315 HydrophobicContact CB-CG 4.37Å; L1261-E1315 HydrophobicContact CD1-CB 4.37Å; L1261-E1315 HydrophobicContact CD1-CG 4.47Å; L1261-V1316 HydrophobicContact CD1-CG2 4.01Å; L1261-V1316 HydrophobicContact CD2-CG2 3.58Å; L1261-V1316 HydrophobicContact CG-CG2 4.42Å; L1261-L1319 HydrophobicContact CB-CD1 4.35Å; L1261-L1319 HydrophobicContact CD2-CD1 3.84Å; L1261-L1369 HydrophobicContact CD2-CD1 3.89Å; L1261-N1372 HydrophobicContact CD2-CB 4.06Å; L1261-N1372 WeakPolarHBondContact CD2-ND2 3.44Å; L1261-N1372 HydrophobicContact CG-CB 4.34Å
1262S83Confident80.2Confident25 Ų2565.1 Ų65.118%0.17530%0.304CS..Hα-helixtrans-65.2-36.2175.1-68.40000112M1258 H1259 R1266 N1372M1258-S1262 PolarHBondContact O-N 3.06Å; M1258-S1262 VanDerWaalsContact O-N 3.08Å; M1258-S1262 PolarHBondContact O-OG 3.04Å; H1259-S1262 PolarHBondContact O-N 3.12Å; S1262-R1266 WeakPolarHBondContact O-CG 3.43Å; S1262-R1266 PolarHBondContact O-N 3.11Å; S1262-N1372 VanDerWaalsContact OG-CG 3.29Å; S1262-N1372 PolarHBondContact OG-ND2 2.94Å; S1262-N1372 PolarHBondContact OG-OD1 2.97Å
1263R83Confident79.5Confident148 Ų14866.7 Ų66.756%0.55831%0.31SS*.Hα-helixtrans-64.5-47.5174.5-174.3-177.9-176.5-179.73.9112H1259 D1260 L1261 R1266 Q1267H1259-R1263 WeakPolarHBondContact O-CB 3.36Å; H1259-R1263 PolarHBondContact O-N 2.69Å; D1260-R1263 WeakPolarHBondContact O-CB 3.07Å; D1260-R1263 PolarHBondContact O-N 3.12Å; L1261-R1263 VanDerWaalsContact C-N 3.34Å; R1263-R1266 PolarHBondContact O-N 3.13Å; R1263-Q1267 WeakPolarHBondContact O-CG 3.35Å; R1263-Q1267 PolarHBondContact O-N 3.32Å
1264L80.5Confident78.2Confident37 Ų3766.3 Ų66.319%0.19431%0.313CS..Hα-helixtrans-63.8-41177.8-175.362.9000111.4D1260 L1261 R1266 Q1267 I1268 R1311 C1312D1260-L1264 WeakPolarHBondContact O-CB 3.48Å; D1260-L1264 PolarHBondContact O-N 3.47Å; L1261-L1264 PolarHBondContact O-N 3.26Å; L1264-R1266 PolarHBondContact O-N 3.46Å; L1264-Q1267 PolarHBondContact O-N 3.04Å; L1264-I1268 HydrophobicContact CG-CD1 4.5Å; L1264-I1268 WeakPolarHBondContact O-CG1 3.49Å; L1264-I1268 PolarHBondContact O-N 2.95Å; L1264-R1311 HydrophobicContact CD2-CB 4.36Å; L1264-R1311 HydrophobicContact CD2-CG 3.97Å; L1264-C1312 VanDerWaalsContact CD2-SG 3.56Å
1265T80.6Confident76.5Confident6 Ų667.8 Ų67.84%0.03732%0.323CS..Hα-helixtrans-63.2-39.9176.1-55.40000111.7L1261 G1269 I1375 L1376 L1379L1261-T1265 WeakPolarHBondContact O-CB 3.12Å; L1261-T1265 PolarHBondContact O-N 3.43Å; L1261-T1265 PolarHBondContact O-OG1 2.9Å; T1265-G1269 PolarHBondContact O-N 3.41Å; T1265-I1375 HydrophobicContact CG2-CB 4.26Å; T1265-I1375 HydrophobicContact CG2-CG2 3.6Å; T1265-L1376 HydrophobicContact CG2-CD1 4.45Å; T1265-L1379 HydrophobicContact CG2-CD1 4.09Å
1266R81.8Confident74.7Confident196 Ų19673.7 Ų73.774%0.7435%0.349SS*.Hα-helixtrans-63.5-40.4171.7-75.8178.2177.6-173.1-0.5112.6S1262 R1263 L1264 G1269 L1270S1262-R1266 WeakPolarHBondContact O-CG 3.43Å; S1262-R1266 PolarHBondContact O-N 3.11Å; R1263-R1266 PolarHBondContact O-N 3.13Å; L1264-R1266 PolarHBondContact O-N 3.46Å; R1266-G1269 PolarHBondContact O-N 3.25Å; R1266-L1270 WeakPolarHBondContact O-CG 3.03Å; R1266-L1270 PolarHBondContact O-N 3.3Å
1267Q78.7Confident72.7Confident105 Ų10578.3 Ų78.349%0.49137%0.368SS..Hα-helixtrans-64.1-42.6177.6-74.4176.5-32.200112.5R1263 L1264 L1270 S1271R1263-Q1267 WeakPolarHBondContact O-CG 3.35Å; R1263-Q1267 PolarHBondContact O-N 3.32Å; L1264-Q1267 PolarHBondContact O-N 3.04Å; Q1267-L1270 PolarHBondContact O-N 3.32Å; Q1267-S1271 PolarHBondContact O-N 3.49Å
1268I78.2Confident70.6Confident9 Ų980.4 Ų80.45%0.04639%0.389CS..Hα-helixtrans-60.5-47.8173.5-65.1167.2000109.9L1264 L1270 S1271 M1272 G1308 F1309 C1312 L1379L1264-I1268 HydrophobicContact CG-CD1 4.5Å; L1264-I1268 WeakPolarHBondContact O-CG1 3.49Å; L1264-I1268 PolarHBondContact O-N 2.95Å; I1268-L1270 PolarHBondContact O-N 2.91Å; I1268-S1271 PolarHBondContact O-N 3.03Å; I1268-S1271 PolarHBondContact O-OG 2.72Å; I1268-M1272 HydrophobicContact CG2-SD 4.43Å; I1268-M1272 PolarHBondContact O-N 3.42Å; I1268-G1308 VanDerWaalsContact CD1-C 3.46Å; I1268-F1309 HydrophobicContact CG2-CE1 4.01Å; I1268-F1309 HydrophobicContact CG2-CE2 4.32Å; I1268-F1309 HydrophobicContact CG2-CZ 3.91Å; I1268-C1312 WeakPolarHBondContact CD1-SG 3.43Å; I1268-L1379 HydrophobicContact CG2-CD1 4.45Å
1269G77Confident68.5Low12 Ų1287.4 Ų87.412%0.12443%0.427CS..Hα-helixtrans-53.1-53.3175.700000112.8T1265 R1266 S1271 M1272 Y1273T1265-G1269 PolarHBondContact O-N 3.41Å; R1266-G1269 PolarHBondContact O-N 3.25Å; G1269-S1271 VanDerWaalsContact C-N 3.32Å; G1269-S1271 PolarHBondContact O-N 2.95Å; G1269-M1272 PolarHBondContact O-N 3.03Å; G1269-M1272 VanDerWaalsContact O-N 3.14Å; G1269-Y1273 WeakPolarHBondContact O-CD2 3.37Å; G1269-Y1273 PolarHBondContact O-N 2.94Å
1270L74.9Confident66.1Low117 Ų11786.8 Ų86.861%0.61344%0.435SS*.Hα-helixtrans-57.5-42.3178.2-71.9168.3000112.6R1266 Q1267 I1268 M1272 Y1273 T1274R1266-L1270 WeakPolarHBondContact O-CG 3.03Å; R1266-L1270 PolarHBondContact O-N 3.3Å; Q1267-L1270 PolarHBondContact O-N 3.32Å; I1268-L1270 PolarHBondContact O-N 2.91Å; L1270-M1272 PolarHBondContact O-N 3.31Å; L1270-Y1273 PolarHBondContact O-N 2.95Å; L1270-T1274 PolarHBondContact O-N 3.28Å; L1270-T1274 VanDerWaalsContact O-N 3.12Å; L1270-T1274 PolarHBondContact O-OG1 3.19Å
1271S70.9Confident63.7Low42 Ų4286.9 Ų86.929%0.29445%0.448SS..Hα-helixtrans-62.2-25.7179.671.60000114Q1267 I1268 G1269 T1274Q1267-S1271 PolarHBondContact O-N 3.49Å; I1268-S1271 PolarHBondContact O-N 3.03Å; I1268-S1271 PolarHBondContact O-OG 2.72Å; G1269-S1271 VanDerWaalsContact C-N 3.32Å; G1269-S1271 PolarHBondContact O-N 2.95Å; S1271-T1274 PolarHBondContact O-OG1 3.3Å
1272M65.9Low61.3Low32 Ų3294.2 Ų94.216%0.15849%0.487CS..Hα-helixtrans-82.9-13.6175.6-65177.864.800113.8I1268 G1269 L1270 S1275 I1305 F1309 L1379 L1382 F1383I1268-M1272 HydrophobicContact CG2-SD 4.43Å; I1268-M1272 PolarHBondContact O-N 3.42Å; G1269-M1272 PolarHBondContact O-N 3.03Å; G1269-M1272 VanDerWaalsContact O-N 3.14Å; L1270-M1272 PolarHBondContact O-N 3.31Å; M1272-S1275 PolarHBondContact O-OG 3.28Å; M1272-I1305 HydrophobicContact CG-CD1 4.4Å; M1272-F1309 HydrophobicContact SD-CZ 4.12Å; M1272-L1379 HydrophobicContact SD-CB 4.43Å; M1272-L1379 HydrophobicContact SD-CD2 4.11Å; M1272-L1382 HydrophobicContact CE-CB 4.01Å; M1272-F1383 HydrophobicContact CE-CB 3.8Å; M1272-F1383 HydrophobicContact CE-CD2 4.26Å
1273Y63.5Low58.9Low167 Ų16799.3 Ų99.366%0.65552%0.52SS*.Hα-helixtrans-92.2-40.9173.3-82.9-90.7000111.8G1269 L1270 S1275 K1276G1269-Y1273 WeakPolarHBondContact O-CD2 3.37Å; G1269-Y1273 PolarHBondContact O-N 2.94Å; L1270-Y1273 PolarHBondContact O-N 2.95Å; Y1273-S1275 PolarHBondContact O-N 3.13Å; Y1273-K1276 PolarHBondContact O-N 3.2Å
1274T55.1Low56.5Low91 Ų9197.3 Ų97.356%0.55853%0.529SS*.THydrogen-bonded Turntrans-60.4-18.6-177.5460000114.5L1270 S1271 K1276L1270-T1274 PolarHBondContact O-N 3.28Å; L1270-T1274 VanDerWaalsContact O-N 3.12Å; L1270-T1274 PolarHBondContact O-OG1 3.19Å; S1271-T1274 PolarHBondContact O-OG1 3.3Å; T1274-K1276 VanDerWaalsContact C-N 3.29Å; T1274-K1276 PolarHBondContact O-N 3.1Å
1275S47.1Very low54.1Low40 Ų40103.1 Ų103.128%0.2856%0.56SS.*THydrogen-bonded Turntrans-77.3-4.7176.661.10000114.7M1272 Y1273M1272-S1275 PolarHBondContact O-OG 3.28Å; Y1273-S1275 PolarHBondContact O-N 3.13Å
1276K46.4Very low52.1Low178 Ų178110 Ų11077%0.77460%0.602SS**SBendtrans-96.4-23-177.9-80.1-169.7171.7-174.80115.7Y1273 T1274Y1273-K1276 PolarHBondContact O-N 3.2Å; T1274-K1276 VanDerWaalsContact C-N 3.29Å; T1274-K1276 PolarHBondContact O-N 3.1Å
1277E40.2Very low49.7Very low158 Ų158107.4 Ų107.474%0.73860%0.602SS**SBendtrans-103.7-8.5-166-63.3-177.6143.500114.5N1279E1277-N1279 PolarHBondContact O-N 3.34Å
1278V43.1Very low47.4Very low119 Ų119108.1 Ų108.172%0.72161%0.614SS**THydrogen-bonded Turntrans-79.4-17.3-171.9-176.90000113.4
1279N38.5Very low45.1Very low149 Ų149116.4 Ų116.480%0.79765%0.653SS**THydrogen-bonded Turntrans-10012.6-170.5-69.44000115E1277E1277-N1279 PolarHBondContact O-N 3.34Å
1280S33.6Very low42.9Very low104 Ų104124.5 Ų124.573%0.72769%0.687SS**  trans-107.164.5-176.363.20000113.8
1281A32.2Very low40.8Very low87 Ų87127.2 Ų127.272%0.71970%0.7SS**SBendtrans-146.112217100000112.7
1282N33.6Very low38.7Very low156 Ų156129.7 Ų129.783%0.83472%0.717SS**  trans54.189.9167.4-65.5-7.2000119.6
1283P32.8Very low36.9Very low132 Ų132135.4 Ų135.486%0.85775%0.749SS**  trans-102.4111.1150.333.8-23.7000111.1
1284S32.1Very low35.4Very low107 Ų107132.1 Ų132.175%0.74875%0.75SS**  trans-151.8140.4166.356.50000112.6
1285N30.9Very low34.5Very low158 Ų158135 Ų13585%0.84576%0.761SS**SBendtrans53.878.7174.4-64.6-0000118.1
1286V36.9Very low33.7Very low151 Ų151139.9 Ų139.992%0.91578%0.782SS**  -143.8140.3115.4-179.40000107.7
1287D31.6Very low33.5Very low141 Ų141135.9 Ų135.975%0.75477%0.765SS**  trans-87.2166.6-176.7-96.9-58.6000114.8
1288T30.8Very low33.8Very low121 Ų121131.5 Ų131.574%0.74275%0.746SS**  trans72.2111.1162.745.30000121.1
1289Q29.7Very low34.3Very low182 Ų182133.6 Ų133.685%0.8575%0.749SS**  trans83.2144.1144.3-63.6-179.3-17.400120.1
1290H31.1Very low35.2Very low182 Ų182131.3 Ų131.384%0.84374%0.736SS**  trans58.185.5-178.1-85.1-81.8000118.4S1292H1290-S1292 PolarHBondContact O-N 3.13Å
1291I30.7Very low36.4Very low174 Ų174130.1 Ų130.189%0.89272%0.719SS**  trans-69.4111.9156.6-61162.4000108.8
1292S28Very low37.9Very low94 Ų94127.5 Ų127.566%0.65770%0.696SS**  trans-172.8166.1157.2-82.40000111H1290H1290-S1292 PolarHBondContact O-N 3.13Å
1293D27.5Very low39.7Very low152 Ų152123.7 Ų123.781%0.81368%0.675SS**  trans75.3155.5162.9-54.8-28.6000120.6
1294S31Very low41.5Very low99 Ų99120.3 Ų120.369%0.69265%0.647SS**  trans80.343.3164.374.40000121.4I1296S1294-I1296 PolarHBondContact O-N 3.42Å
1295I35.9Very low43.5Very low151 Ų151115.8 Ų115.877%0.77461%0.614SS**  trans-76.380.9146.4-55.8-179000108.4F1297I1295-F1297 PolarHBondContact O-N 3.03Å
1296I31.5Very low45.5Very low142 Ų142110.4 Ų110.473%0.72859%0.587SS**  trans-83.9102179-60175.4000109.3S1294 D1298S1294-I1296 PolarHBondContact O-N 3.42Å; I1296-D1298 PolarHBondContact O-N 3.01Å
1297F42.6Very low47.3Very low94 Ų94105.4 Ų105.441%0.41256%0.558SS.*  trans-71.9117.4154.2-97.4-88.6000108.3I1295 E1299I1295-F1297 PolarHBondContact O-N 3.03Å; F1297-E1299 PolarHBondContact O-N 3.19Å
1298D46.9Very low49.5Very low66 Ų6699.4 Ų99.435%0.35353%0.53SS..  trans-56.7125.7171.6167.523000110.5I1296 N1300 Q1301 S1302I1296-D1298 PolarHBondContact O-N 3.01Å; D1298-N1300 PolarHBondContact O-N 2.99Å; D1298-N1300 VanDerWaalsContact O-N 3.14Å; D1298-N1300 WeakPolarHBondContact OD1-CB 3.31Å; D1298-N1300 PolarHBondContact OD1-N 3.34Å; D1298-N1300 PolarHBondContact OD1-ND2 3.16Å; D1298-Q1301 HydrophobicContact CB-CG 4.24Å; D1298-Q1301 WeakPolarHBondContact O-CB 3.39Å; D1298-Q1301 PolarHBondContact O-N 3.09Å; D1298-S1302 PolarHBondContact O-N 2.8Å
1299E53Low51.9Low164 Ų16494.2 Ų94.277%0.76650%0.497SS*.Hα-helixtrans-55-32.6177.9-66.9-173.2122.200111.4F1297 Q1301 S1302 D1303F1297-E1299 PolarHBondContact O-N 3.19Å; E1299-Q1301 PolarHBondContact O-N 3.44Å; E1299-Q1301 VanDerWaalsContact O-N 3.07Å; E1299-S1302 PolarHBondContact O-N 3.09Å; E1299-S1302 PolarHBondContact O-OG 3.2Å; E1299-S1302 VanDerWaalsContact O-OG 3.13Å; E1299-D1303 WeakPolarHBondContact O-CB 3.18Å; E1299-D1303 PolarHBondContact O-N 3.41Å; E1299-D1303 VanDerWaalsContact O-N 3.1Å
1300N57.5Low54.3Low100 Ų10091.5 Ų91.554%0.53548%0.483SS..Hα-helixtrans-68-5.6176.3-57.8-89.7000113.6D1298 K1304D1298-N1300 PolarHBondContact O-N 2.99Å; D1298-N1300 VanDerWaalsContact O-N 3.14Å; D1298-N1300 WeakPolarHBondContact OD1-CB 3.31Å; D1298-N1300 PolarHBondContact OD1-N 3.34Å; D1298-N1300 PolarHBondContact OD1-ND2 3.16Å; N1300-K1304 WeakPolarHBondContact O-CD 3.19Å; N1300-K1304 WeakPolarHBondContact O-CE 3.49Å; N1300-K1304 VanDerWaalsContact O-CG 3.24Å; N1300-K1304 WeakPolarHBondContact O-CG 3.44Å; N1300-K1304 PolarHBondContact O-NZ 2.82Å
1301Q58.2Low56.6Low80 Ų8091.1 Ų91.137%0.37447%0.474SS..Hα-helixtrans-100.6-42.2171.3-61.6-165.926.800112.5D1298 E1299 D1303 K1304 I1305D1298-Q1301 HydrophobicContact CB-CG 4.24Å; D1298-Q1301 WeakPolarHBondContact O-CB 3.39Å; D1298-Q1301 PolarHBondContact O-N 3.09Å; E1299-Q1301 PolarHBondContact O-N 3.44Å; E1299-Q1301 VanDerWaalsContact O-N 3.07Å; Q1301-D1303 VanDerWaalsContact C-N 3.26Å; Q1301-D1303 PolarHBondContact O-N 3.2Å; Q1301-K1304 PolarHBondContact O-N 3.46Å; Q1301-I1305 WeakPolarHBondContact O-CG1 3.25Å; Q1301-I1305 PolarHBondContact O-N 3.19Å
1302S64.5Low59Low32 Ų3282.9 Ų82.922%0.22443%0.431CS..Hα-helixtrans-62.5-36.7176.263.60000111.4D1298 E1299 I1305 T1306D1298-S1302 PolarHBondContact O-N 2.8Å; E1299-S1302 PolarHBondContact O-N 3.09Å; E1299-S1302 PolarHBondContact O-OG 3.2Å; E1299-S1302 VanDerWaalsContact O-OG 3.13Å; S1302-I1305 PolarHBondContact O-N 3.32Å; S1302-T1306 VanDerWaalsContact O-CB 3.24Å; S1302-T1306 WeakPolarHBondContact O-CB 3.48Å; S1302-T1306 PolarHBondContact O-N 3.27Å; S1302-T1306 PolarHBondContact O-OG1 3.32Å
1303D70.3Confident61.6Low75 Ų7582 Ų8240%0.40142%0.416SS..Hα-helixtrans-67.4-38.9176.9-141.530.1000111.9E1299 Q1301 C1307E1299-D1303 WeakPolarHBondContact O-CB 3.18Å; E1299-D1303 PolarHBondContact O-N 3.41Å; E1299-D1303 VanDerWaalsContact O-N 3.1Å; Q1301-D1303 VanDerWaalsContact C-N 3.26Å; Q1301-D1303 PolarHBondContact O-N 3.2Å; D1303-C1307 WeakPolarHBondContact O-CB 3.34Å; D1303-C1307 PolarHBondContact O-N 3.27Å; D1303-C1307 PolarHBondContact O-SG 2.81Å
1304K71.6Confident64.2Low61 Ų6180.7 Ų80.727%0.26541%0.408SS..Hα-helixtrans-63.9-48.1173.2-75174.8-168.3120.60112N1300 Q1301 T1306 C1307 G1308 C1527N1300-K1304 WeakPolarHBondContact O-CD 3.19Å; N1300-K1304 WeakPolarHBondContact O-CE 3.49Å; N1300-K1304 VanDerWaalsContact O-CG 3.24Å; N1300-K1304 WeakPolarHBondContact O-CG 3.44Å; N1300-K1304 PolarHBondContact O-NZ 2.82Å; Q1301-K1304 PolarHBondContact O-N 3.46Å; K1304-T1306 VanDerWaalsContact C-N 3.34Å; K1304-C1307 PolarHBondContact O-N 2.64Å; K1304-G1308 PolarHBondContact O-N 2.95Å; K1304-C1527 VanDerWaalsContact CE-SG 3.52Å; K1304-C1527 PolarHBondContact NZ-SG 3.31Å
1305I73Confident66.6Low13 Ų1378.4 Ų78.47%0.06739%0.386CS..Hα-helixtrans-63.2-43.5179.7-68.6167000109.8M1272 Q1301 S1302 C1307 G1308 F1309 F1383M1272-I1305 HydrophobicContact CG-CD1 4.4Å; Q1301-I1305 WeakPolarHBondContact O-CG1 3.25Å; Q1301-I1305 PolarHBondContact O-N 3.19Å; S1302-I1305 PolarHBondContact O-N 3.32Å; I1305-C1307 PolarHBondContact O-N 2.96Å; I1305-G1308 WeakPolarHBondContact O-CA 3.42Å; I1305-G1308 PolarHBondContact O-N 3.33Å; I1305-G1308 VanDerWaalsContact O-N 3.13Å; I1305-F1309 HydrophobicContact CG2-CD2 3.79Å; I1305-F1309 HydrophobicContact CG2-CE2 3.43Å; I1305-F1309 VanDerWaalsContact CG2-CE2 3.43Å; I1305-F1309 HydrophobicContact CG2-CZ 4.43Å; I1305-F1309 VanDerWaalsContact O-CD2 3.28Å; I1305-F1309 WeakPolarHBondContact O-CD2 3.47Å; I1305-F1309 PolarHBondContact O-N 2.92Å; I1305-F1383 HydrophobicContact CB-CE2 4.02Å; I1305-F1383 HydrophobicContact CB-CZ 4.45Å; I1305-F1383 HydrophobicContact CD1-CE2 4.33Å; I1305-F1383 HydrophobicContact CG2-CD2 3.79Å; I1305-F1383 HydrophobicContact CG2-CE2 3.48Å; I1305-F1383 VanDerWaalsContact CG2-CE2 3.48Å; I1305-F1383 HydrophobicContact CG2-CZ 4.04Å
1306T74.3Confident68.9Low44 Ų4471.3 Ų71.327%0.2735%0.35SS..Hα-helixtrans-61.9-40.3175.1-59.80000112.4S1302 K1304 K1310S1302-T1306 VanDerWaalsContact O-CB 3.24Å; S1302-T1306 WeakPolarHBondContact O-CB 3.48Å; S1302-T1306 PolarHBondContact O-N 3.27Å; S1302-T1306 PolarHBondContact O-OG1 3.32Å; K1304-T1306 VanDerWaalsContact C-N 3.34Å; T1306-K1310 HydrophobicContact CG2-CD 4.45Å; T1306-K1310 WeakPolarHBondContact O-CG 3.44Å; T1306-K1310 PolarHBondContact O-N 2.94Å
1307C73.9Confident71.4Confident46 Ų4668.9 Ų68.931%0.31134%0.339SS..Hα-helixtrans-67.4-35.7173-70.80000112.5D1303 K1304 I1305 K1310 R1311D1303-C1307 WeakPolarHBondContact O-CB 3.34Å; D1303-C1307 PolarHBondContact O-N 3.27Å; D1303-C1307 PolarHBondContact O-SG 2.81Å; K1304-C1307 PolarHBondContact O-N 2.64Å; I1305-C1307 PolarHBondContact O-N 2.96Å; C1307-K1310 PolarHBondContact O-N 3.24Å; C1307-R1311 PolarHBondContact O-N 2.99Å
1308G77Confident73.5Confident15 Ų1566.6 Ų66.616%0.15534%0.335CS..Hα-helixtrans-58.8-51.9171.300000112.1I1268 K1304 I1305 K1310 R1311 C1312I1268-G1308 VanDerWaalsContact CD1-C 3.46Å; K1304-G1308 PolarHBondContact O-N 2.95Å; I1305-G1308 WeakPolarHBondContact O-CA 3.42Å; I1305-G1308 PolarHBondContact O-N 3.33Å; I1305-G1308 VanDerWaalsContact O-N 3.13Å; G1308-K1310 PolarHBondContact O-N 3.29Å; G1308-R1311 PolarHBondContact O-N 2.71Å; G1308-R1311 VanDerWaalsContact O-N 3.16Å; G1308-C1312 PolarHBondContact O-N 3.04Å
1309F81.2Confident75.3Confident12 Ų1263.5 Ų63.55%0.05332%0.318CS..Hα-helixtrans-57.6-46.7175.8-76.6-60.5000112.4I1268 M1272 I1305 R1311 C1312 F1313 L1376 L1379 I1380 F1383I1268-F1309 HydrophobicContact CG2-CE1 4.01Å; I1268-F1309 HydrophobicContact CG2-CE2 4.32Å; I1268-F1309 HydrophobicContact CG2-CZ 3.91Å; M1272-F1309 HydrophobicContact SD-CZ 4.12Å; I1305-F1309 HydrophobicContact CG2-CD2 3.79Å; I1305-F1309 HydrophobicContact CG2-CE2 3.43Å; I1305-F1309 VanDerWaalsContact CG2-CE2 3.43Å; I1305-F1309 HydrophobicContact CG2-CZ 4.43Å; I1305-F1309 VanDerWaalsContact O-CD2 3.28Å; I1305-F1309 WeakPolarHBondContact O-CD2 3.47Å; I1305-F1309 PolarHBondContact O-N 2.92Å; F1309-R1311 VanDerWaalsContact C-N 3.29Å; F1309-R1311 PolarHBondContact O-N 3.02Å; F1309-C1312 PolarHBondContact O-N 3.47Å; F1309-F1313 VanDerWaalsContact O-CD2 3.28Å; F1309-F1313 WeakPolarHBondContact O-CD2 3.36Å; F1309-F1313 PolarHBondContact O-N 2.9Å; F1309-L1376 HydrophobicContact CD1-CD1 3.69Å; F1309-L1376 HydrophobicContact CD1-CG 4.06Å; F1309-L1376 HydrophobicContact CE1-CD1 3.99Å; F1309-L1376 HydrophobicContact CE1-CG 4.4Å; F1309-L1379 HydrophobicContact CE1-CB 3.74Å; F1309-L1379 HydrophobicContact CZ-CB 3.83Å; F1309-I1380 HydrophobicContact CD1-CD1 4.13Å; F1309-I1380 HydrophobicContact CD1-CG1 3.69Å; F1309-I1380 HydrophobicContact CE1-CD1 4.38Å; F1309-I1380 HydrophobicContact CE1-CG1 3.57Å; F1309-I1380 HydrophobicContact CE2-CG1 4.46Å; F1309-I1380 HydrophobicContact CG-CG1 4.23Å; F1309-I1380 HydrophobicContact CZ-CG1 3.98Å; F1309-F1383 HydrophobicContact CE2-CB 4.24Å; F1309-F1383 HydrophobicContact CE2-CD1 4.35Å; F1309-F1383 HydrophobicContact CE2-CD2 4.4Å; F1309-F1383 HydrophobicContact CE2-CG 4.11Å
1310K81.5Confident76.9Confident126 Ų12658.1 Ų58.155%0.54829%0.294SS..Hα-helixtrans-57.2-40.7175.9-74.5169.5-177.8167.30112.2T1306 C1307 G1308 L1314T1306-K1310 HydrophobicContact CG2-CD 4.45Å; T1306-K1310 WeakPolarHBondContact O-CG 3.44Å; T1306-K1310 PolarHBondContact O-N 2.94Å; C1307-K1310 PolarHBondContact O-N 3.24Å; G1308-K1310 PolarHBondContact O-N 3.29Å; K1310-L1314 WeakPolarHBondContact O-CG 3.45Å; K1310-L1314 PolarHBondContact O-N 3.1Å
1311R79.1Confident78.3Confident174 Ų17459.6 Ų59.666%0.65730%0.296SS*.Hα-helixtrans-67.7-42.5177.1-172.1174.5-179.8170.7-0.6112.3L1264 C1307 G1308 F1309 E1315L1264-R1311 HydrophobicContact CD2-CB 4.36Å; L1264-R1311 HydrophobicContact CD2-CG 3.97Å; C1307-R1311 PolarHBondContact O-N 2.99Å; G1308-R1311 PolarHBondContact O-N 2.71Å; G1308-R1311 VanDerWaalsContact O-N 3.16Å; F1309-R1311 VanDerWaalsContact C-N 3.29Å; F1309-R1311 PolarHBondContact O-N 3.02Å; R1311-E1315 PolarHBondContact O-N 3.17Å; R1311-E1315 VanDerWaalsContact O-N 3.15Å
1312C81.3Confident79.5Confident0 Ų056.8 Ų56.80%029%0.287CS..Hα-helixtrans-61.9-41.2175.2-760000112.7L1261 L1264 I1268 G1308 F1309 E1315 V1316 L1376L1261-C1312 HydrophobicContact CD1-CB 4.18Å; L1264-C1312 VanDerWaalsContact CD2-SG 3.56Å; I1268-C1312 WeakPolarHBondContact CD1-SG 3.43Å; G1308-C1312 PolarHBondContact O-N 3.04Å; F1309-C1312 PolarHBondContact O-N 3.47Å; C1312-E1315 PolarHBondContact O-N 3.1Å; C1312-V1316 WeakPolarHBondContact O-CB 3.37Å; C1312-V1316 VanDerWaalsContact O-CG2 3.29Å; C1312-V1316 WeakPolarHBondContact O-CG2 3.49Å; C1312-V1316 PolarHBondContact O-N 3.16Å; C1312-L1376 HydrophobicContact CB-CD1 3.58Å; C1312-L1376 HydrophobicContact CB-CD2 3.68Å; C1312-L1376 HydrophobicContact CB-CG 4.31Å
1313F81.4Confident80.4Confident75 Ų7555.8 Ų55.833%0.32928%0.279SS..Hα-helixtrans-63.6-47.3177.6-82.7-63.7000112.8F1309 E1315 V1316 D1317 L1376 I1380F1309-F1313 VanDerWaalsContact O-CD2 3.28Å; F1309-F1313 WeakPolarHBondContact O-CD2 3.36Å; F1309-F1313 PolarHBondContact O-N 2.9Å; F1313-E1315 PolarHBondContact O-N 3.41Å; F1313-V1316 PolarHBondContact O-N 3.03Å; F1313-D1317 PolarHBondContact O-N 3.35Å; F1313-L1376 HydrophobicContact CD1-CD2 3.92Å; F1313-L1376 HydrophobicContact CD2-CD2 4.03Å; F1313-L1376 HydrophobicContact CE1-CD2 3.85Å; F1313-L1376 HydrophobicContact CE2-CD2 3.99Å; F1313-L1376 HydrophobicContact CG-CD2 4Å; F1313-L1376 HydrophobicContact CZ-CD2 3.9Å; F1313-I1380 HydrophobicContact CE2-CD1 3.41Å; F1313-I1380 VanDerWaalsContact CE2-CD1 3.41Å; F1313-I1380 HydrophobicContact CZ-CD1 3.36Å
1314L81.8Confident81.1Confident125 Ų12557.6 Ų57.665%0.65429%0.285SS*.Hα-helixtrans-59.7-36.5177.5-70.5169.2000112.4K1310 S1318K1310-L1314 WeakPolarHBondContact O-CG 3.45Å; K1310-L1314 PolarHBondContact O-N 3.1Å; L1314-S1318 VanDerWaalsContact O-CB 3.28Å; L1314-S1318 WeakPolarHBondContact O-CB 3.49Å; L1314-S1318 PolarHBondContact O-N 3.31Å
1315E82.7Confident81.6Confident51 Ų5159.9 Ų59.924%0.23830%0.296CS..Hα-helixtrans-73-39.9176.8-167.264.5-171.500111.9R1257 L1261 R1311 C1312 F1313 S1318 L1319R1257-E1315 IonicContact CZ-OE1 2.69Å; R1257-E1315 IonicContact CZ-OE2 2.66Å; R1257-E1315 IonicContact NE-OE1 2.85Å; R1257-E1315 PolarHBondContact NE-OE1 2.75Å; R1257-E1315 IonicContact NE-OE2 3.7Å; R1257-E1315 IonicContact NH2-OE1 3.01Å; R1257-E1315 PolarHBondContact NH2-OE1 3.4Å; R1257-E1315 IonicContact NH2-OE2 3.15Å; R1257-E1315 PolarHBondContact NH2-OE2 3.32Å; L1261-E1315 HydrophobicContact CB-CG 4.37Å; L1261-E1315 HydrophobicContact CD1-CB 4.37Å; L1261-E1315 HydrophobicContact CD1-CG 4.47Å; R1311-E1315 PolarHBondContact O-N 3.17Å; R1311-E1315 VanDerWaalsContact O-N 3.15Å; C1312-E1315 PolarHBondContact O-N 3.1Å; F1313-E1315 PolarHBondContact O-N 3.41Å; E1315-S1318 PolarHBondContact O-N 3.48Å; E1315-L1319 HydrophobicContact CG-CD1 4.02Å; E1315-L1319 WeakPolarHBondContact O-CB 3.27Å; E1315-L1319 WeakPolarHBondContact O-CD1 3.4Å; E1315-L1319 VanDerWaalsContact O-CG 3.23Å; E1315-L1319 WeakPolarHBondContact O-CG 3.3Å; E1315-L1319 PolarHBondContact O-N 3.18Å
1316V83.9Confident82Confident3 Ų359.8 Ų59.82%0.01830%0.296CS..Hα-helixtrans-58.8-48.7172.41640000111.3L1261 C1312 F1313 L1319 N1320 L1369L1261-V1316 HydrophobicContact CD1-CG2 4.01Å; L1261-V1316 HydrophobicContact CD2-CG2 3.58Å; L1261-V1316 HydrophobicContact CG-CG2 4.42Å; C1312-V1316 WeakPolarHBondContact O-CB 3.37Å; C1312-V1316 VanDerWaalsContact O-CG2 3.29Å; C1312-V1316 WeakPolarHBondContact O-CG2 3.49Å; C1312-V1316 PolarHBondContact O-N 3.16Å; F1313-V1316 PolarHBondContact O-N 3.03Å; V1316-L1319 PolarHBondContact O-N 2.94Å; V1316-N1320 WeakPolarHBondContact O-CB 3.47Å; V1316-N1320 PolarHBondContact O-N 3.42Å; V1316-L1369 HydrophobicContact CB-CD1 4.31Å; V1316-L1369 HydrophobicContact CG1-CD1 4.12Å; V1316-L1369 HydrophobicContact CG2-CD1 4.12Å
1317D83.5Confident82.2Confident91 Ų9161.3 Ų61.349%0.48730%0.3SS..Hα-helixtrans-67.4-38.3-178.7-66.7-23.1000111.2F1313 L1319 N1320 F1321F1313-D1317 PolarHBondContact O-N 3.35Å; D1317-L1319 VanDerWaalsContact C-N 3.35Å; D1317-L1319 PolarHBondContact O-N 2.98Å; D1317-N1320 PolarHBondContact O-N 3.46Å; D1317-F1321 PolarHBondContact O-N 2.94Å
1318S85.9Confident82.5Confident46 Ų4661.4 Ų61.432%0.32230%0.301SS..Hα-helixtrans-64.5-36.6173.8179.40000112.9R1257 L1314 E1315 A1322R1257-S1318 PolarHBondContact NH1-OG 3.06Å; R1257-S1318 PolarHBondContact NH2-OG 3.36Å; L1314-S1318 VanDerWaalsContact O-CB 3.28Å; L1314-S1318 WeakPolarHBondContact O-CB 3.49Å; L1314-S1318 PolarHBondContact O-N 3.31Å; E1315-S1318 PolarHBondContact O-N 3.48Å; S1318-A1322 PolarHBondContact O-N 2.87Å
1319L85.6Confident82.4Confident0 Ų064.2 Ų64.20%031%0.31CS..Hα-helixtrans-74.9-37.9177.6-75.3165.3000112.1L1254 R1257 M1258 L1261 E1315 V1316 D1317 A1322 L1323 L1369L1254-L1319 HydrophobicContact CD2-CD2 3.6Å; R1257-L1319 HydrophobicContact CB-CD1 4.41Å; R1257-L1319 HydrophobicContact CB-CD2 3.74Å; M1258-L1319 HydrophobicContact CG-CD1 4.28Å; M1258-L1319 HydrophobicContact CG-CD2 4.47Å; M1258-L1319 HydrophobicContact SD-CD1 3.8Å; L1261-L1319 HydrophobicContact CB-CD1 4.35Å; L1261-L1319 HydrophobicContact CD2-CD1 3.84Å; E1315-L1319 HydrophobicContact CG-CD1 4.02Å; E1315-L1319 WeakPolarHBondContact O-CB 3.27Å; E1315-L1319 WeakPolarHBondContact O-CD1 3.4Å; E1315-L1319 VanDerWaalsContact O-CG 3.23Å; E1315-L1319 WeakPolarHBondContact O-CG 3.3Å; E1315-L1319 PolarHBondContact O-N 3.18Å; V1316-L1319 PolarHBondContact O-N 2.94Å; D1317-L1319 VanDerWaalsContact C-N 3.35Å; D1317-L1319 PolarHBondContact O-N 2.98Å; L1319-A1322 PolarHBondContact O-N 3.32Å; L1319-L1323 WeakPolarHBondContact O-CG 3.4Å; L1319-L1323 PolarHBondContact O-N 3.13Å; L1319-L1369 HydrophobicContact CB-CD1 4.09Å; L1319-L1369 HydrophobicContact CB-CD2 4.26Å
1320N87.6Confident82Confident51 Ų5163.9 Ų63.927%0.27331%0.309SS..Hα-helixtrans-60.9-49.4174.7-166.793.9000110.9V1316 D1317 A1322 L1323 E1324 L1369V1316-N1320 WeakPolarHBondContact O-CB 3.47Å; V1316-N1320 PolarHBondContact O-N 3.42Å; D1317-N1320 PolarHBondContact O-N 3.46Å; N1320-A1322 VanDerWaalsContact C-N 3.34Å; N1320-A1322 PolarHBondContact O-N 3.2Å; N1320-L1323 PolarHBondContact O-N 2.92Å; N1320-E1324 PolarHBondContact ND2-OE1 3.29Å; N1320-E1324 WeakPolarHBondContact O-CG 3.42Å; N1320-E1324 PolarHBondContact O-N 3.49Å; N1320-L1369 HydrophobicContact CB-CD2 3.95Å
1321F85.4Confident81.5Confident132 Ų13262 Ų6258%0.57931%0.305SS*.Hα-helixtrans-58-43.5177.6-178.9-88.5000112.6D1317 E1324 E1325D1317-F1321 PolarHBondContact O-N 2.94Å; F1321-E1324 PolarHBondContact O-N 2.98Å; F1321-E1325 WeakPolarHBondContact O-CB 3.37Å; F1321-E1325 PolarHBondContact O-N 3.48Å
1322A84.4Confident81.1Confident21 Ų2159 Ų5917%0.17430%0.296CS..Hα-helixtrans-71-30.8-178.900000113.4L1254 S1318 L1319 N1320 I1326L1254-A1322 HydrophobicContact CD2-CB 3.82Å; S1318-A1322 PolarHBondContact O-N 2.87Å; L1319-A1322 PolarHBondContact O-N 3.32Å; N1320-A1322 VanDerWaalsContact C-N 3.34Å; N1320-A1322 PolarHBondContact O-N 3.2Å; A1322-I1326 WeakPolarHBondContact O-CG1 3.43Å; A1322-I1326 PolarHBondContact O-N 2.84Å
1323L83.8Confident80Confident11 Ų1160 Ų606%0.05830%0.301CS..Hα-helixtrans-70-44.1170.8-76.6165000111.4L1254 L1319 N1320 E1325 I1326 Q1327 I1362 L1365 L1369L1254-L1323 HydrophobicContact CD1-CD2 4Å; L1254-L1323 HydrophobicContact CD1-CG 4.35Å; L1319-L1323 WeakPolarHBondContact O-CG 3.4Å; L1319-L1323 PolarHBondContact O-N 3.13Å; N1320-L1323 PolarHBondContact O-N 2.92Å; L1323-E1325 VanDerWaalsContact C-N 3.34Å; L1323-E1325 PolarHBondContact O-N 2.64Å; L1323-I1326 PolarHBondContact O-N 3.27Å; L1323-Q1327 WeakPolarHBondContact O-CB 3.43Å; L1323-Q1327 PolarHBondContact O-N 3.12Å; L1323-I1362 HydrophobicContact CD2-CG2 4.3Å; L1323-L1365 HydrophobicContact CD1-CB 4.24Å; L1323-L1365 HydrophobicContact CD2-CB 3.88Å; L1323-L1365 HydrophobicContact CD2-CD1 4.19Å; L1323-L1369 HydrophobicContact CD1-CD2 4Å
1324E83.5Confident78.8Confident112 Ų11259.6 Ų59.652%0.52330%0.302SS..Hα-helixtrans-61.6-39.6175-74.2175.6-179.300112.1N1320 F1321 Q1327 S1328N1320-E1324 PolarHBondContact ND2-OE1 3.29Å; N1320-E1324 WeakPolarHBondContact O-CG 3.42Å; N1320-E1324 PolarHBondContact O-N 3.49Å; F1321-E1324 PolarHBondContact O-N 2.98Å; E1324-Q1327 PolarHBondContact O-N 3.12Å; E1324-S1328 WeakPolarHBondContact O-CB 3.4Å; E1324-S1328 PolarHBondContact O-N 3.32Å
1325E83.5Confident76.6Confident109 Ų10957.4 Ų57.451%0.50930%0.297SS..Hα-helixtrans-60.8-52.9176.4-173.5167.3-148.900111.1F1321 L1323 Q1327 S1328 E1329F1321-E1325 WeakPolarHBondContact O-CB 3.37Å; F1321-E1325 PolarHBondContact O-N 3.48Å; L1323-E1325 VanDerWaalsContact C-N 3.34Å; L1323-E1325 PolarHBondContact O-N 2.64Å; E1325-Q1327 PolarHBondContact O-N 3.41Å; E1325-S1328 WeakPolarHBondContact O-CB 3.26Å; E1325-S1328 PolarHBondContact O-N 3.49Å; E1325-S1328 VanDerWaalsContact O-N 3.12Å; E1325-S1328 PolarHBondContact O-OG 3.39Å; E1325-E1329 WeakPolarHBondContact O-CG 3.43Å; E1325-E1329 PolarHBondContact O-N 3.08Å
1326I80Confident74.6Confident12 Ų1261.9 Ų61.96%0.06232%0.318CS..Hα-helixtrans-61.6-42.8178-67.2173.1000111.7Q1250 L1254 A1322 L1323 S1328 E1329 L1330 I1362Q1250-I1326 HydrophobicContact CB-CD1 3.78Å; L1254-I1326 HydrophobicContact CD1-CD1 3.56Å; A1322-I1326 WeakPolarHBondContact O-CG1 3.43Å; A1322-I1326 PolarHBondContact O-N 2.84Å; L1323-I1326 PolarHBondContact O-N 3.27Å; I1326-S1328 VanDerWaalsContact C-N 3.26Å; I1326-S1328 PolarHBondContact O-N 3.34Å; I1326-E1329 PolarHBondContact O-N 2.81Å; I1326-L1330 HydrophobicContact CG2-CD1 3.94Å; I1326-L1330 PolarHBondContact O-N 3.48Å; I1326-I1362 HydrophobicContact CG2-CD1 3.84Å
1327Q80.2Confident72.7Confident76 Ų7664.3 Ų64.336%0.35533%0.33SS..Hα-helixtrans-65.2-32177.3-165.2171.423.600111.6L1323 E1324 E1325 N1331L1323-Q1327 WeakPolarHBondContact O-CB 3.43Å; L1323-Q1327 PolarHBondContact O-N 3.12Å; E1324-Q1327 PolarHBondContact O-N 3.12Å; E1325-Q1327 PolarHBondContact O-N 3.41Å; Q1327-N1331 WeakPolarHBondContact O-CB 3.28Å; Q1327-N1331 PolarHBondContact O-N 2.86Å; Q1327-N1331 VanDerWaalsContact O-N 3.15Å; Q1327-N1331 PolarHBondContact O-ND2 3.14Å
1328S80.1Confident70.1Confident47 Ų4763.2 Ų63.233%0.32933%0.329SS..Hα-helixtrans-70-36.3173.987.40000113.2E1324 E1325 I1326 K1332E1324-S1328 WeakPolarHBondContact O-CB 3.4Å; E1324-S1328 PolarHBondContact O-N 3.32Å; E1325-S1328 WeakPolarHBondContact O-CB 3.26Å; E1325-S1328 PolarHBondContact O-N 3.49Å; E1325-S1328 VanDerWaalsContact O-N 3.12Å; E1325-S1328 PolarHBondContact O-OG 3.39Å; I1326-S1328 VanDerWaalsContact C-N 3.26Å; I1326-S1328 PolarHBondContact O-N 3.34Å; S1328-K1332 WeakPolarHBondContact O-CE 3.48Å; S1328-K1332 VanDerWaalsContact O-CG 3.29Å; S1328-K1332 WeakPolarHBondContact O-CG 3.39Å; S1328-K1332 PolarHBondContact O-N 2.96Å
1329E74.6Confident67.8Low75 Ų7566.2 Ų66.235%0.3535%0.346SS..Hα-helixtrans-68.3-49.5176.5-66.4-71.688.900110.9W1247 E1325 I1326 N1331 K1332 E1333W1247-E1329 HydrophobicContact CZ2-CB 4.04Å; E1325-E1329 WeakPolarHBondContact O-CG 3.43Å; E1325-E1329 PolarHBondContact O-N 3.08Å; I1326-E1329 PolarHBondContact O-N 2.81Å; E1329-N1331 VanDerWaalsContact C-N 3.26Å; E1329-N1331 PolarHBondContact O-N 3.43Å; E1329-K1332 WeakPolarHBondContact O-CB 3.46Å; E1329-K1332 PolarHBondContact O-N 2.91Å; E1329-K1332 IonicContact OE1-NZ 3.87Å; E1329-K1332 PolarHBondContact OE1-NZ 2.87Å; E1329-E1333 PolarHBondContact O-N 3.29Å
1330L71.6Confident65.5Low5 Ų573.2 Ų73.23%0.02638%0.383CS..Hα-helixtrans-54.4-40.8175-85.5158.7000112.7W1247 I1326 N1334 L1354 L1358 I1362W1247-L1330 HydrophobicContact CD2-CD2 4.47Å; W1247-L1330 HydrophobicContact CD2-CG 4.4Å; W1247-L1330 HydrophobicContact CE3-CD2 3.74Å; W1247-L1330 HydrophobicContact CE3-CG 4.15Å; W1247-L1330 HydrophobicContact CH2-CD2 3.83Å; W1247-L1330 HydrophobicContact CH2-CG 4.08Å; W1247-L1330 HydrophobicContact CZ2-CG 4.34Å; W1247-L1330 HydrophobicContact CZ3-CD2 3.37Å; W1247-L1330 HydrophobicContact CZ3-CG 3.99Å; I1326-L1330 HydrophobicContact CG2-CD1 3.94Å; I1326-L1330 PolarHBondContact O-N 3.48Å; L1330-N1334 WeakPolarHBondContact O-CB 3.37Å; L1330-N1334 PolarHBondContact O-N 3.47Å; L1330-N1334 VanDerWaalsContact O-N 3.12Å; L1330-N1334 PolarHBondContact O-ND2 3.38Å; L1330-N1334 VanDerWaalsContact O-ND2 3.12Å; L1330-L1354 HydrophobicContact CD2-CD1 4.09Å; L1330-L1358 HydrophobicContact CD1-CD2 3.84Å; L1330-I1362 HydrophobicContact CD1-CD1 3.34Å
1331N71.2Confident62.8Low86 Ų8675.6 Ų75.646%0.4640%0.396SS..Hα-helixtrans-69.7-34.5178.2-74.4-21.3000112.7Q1327 E1329 C1335Q1327-N1331 WeakPolarHBondContact O-CB 3.28Å; Q1327-N1331 PolarHBondContact O-N 2.86Å; Q1327-N1331 VanDerWaalsContact O-N 3.15Å; Q1327-N1331 PolarHBondContact O-ND2 3.14Å; E1329-N1331 VanDerWaalsContact C-N 3.26Å; E1329-N1331 PolarHBondContact O-N 3.43Å; N1331-C1335 WeakPolarHBondContact O-CB 3.38Å; N1331-C1335 PolarHBondContact O-N 2.95Å; N1331-C1335 PolarHBondContact O-SG 3.28Å
1332K71Confident60.3Low110 Ų11076 Ų7648%0.47840%0.404SS..Hα-helixtrans-63.9-47.7175.7-69.5161.1-157163.70111.6S1328 E1329 C1335 Q1336S1328-K1332 WeakPolarHBondContact O-CE 3.48Å; S1328-K1332 VanDerWaalsContact O-CG 3.29Å; S1328-K1332 WeakPolarHBondContact O-CG 3.39Å; S1328-K1332 PolarHBondContact O-N 2.96Å; E1329-K1332 WeakPolarHBondContact O-CB 3.46Å; E1329-K1332 PolarHBondContact O-N 2.91Å; E1329-K1332 IonicContact OE1-NZ 3.87Å; E1329-K1332 PolarHBondContact OE1-NZ 2.87Å; K1332-C1335 PolarHBondContact O-N 2.87Å; K1332-Q1336 PolarHBondContact O-N 3.43Å
1333E59.5Low57.8Low21 Ų2181.8 Ų81.810%0.09843%0.432CS..Hα-helixtrans-67.9-43.1-178.3-74.7-178.2-141.400112Q1243 W1247 E1329 C1335 Q1336 I1337Q1243-E1333 PolarHBondContact NE2-OE1 3.09Å; W1247-E1333 HydrophobicContact CH2-CB 4.39Å; W1247-E1333 HydrophobicContact CH2-CG 4.32Å; W1247-E1333 WeakPolarHBondContact CH2-OE1 3.28Å; W1247-E1333 WeakPolarHBondContact CH2-OE2 3.45Å; W1247-E1333 WeakPolarHBondContact CZ2-OE1 3.4Å; E1329-E1333 PolarHBondContact O-N 3.29Å; E1333-C1335 VanDerWaalsContact C-N 3.26Å; E1333-C1335 PolarHBondContact O-N 3Å; E1333-Q1336 PolarHBondContact O-N 3.5Å; E1333-I1337 WeakPolarHBondContact O-CG1 3.44Å; E1333-I1337 PolarHBondContact O-N 3.27Å; E1333-I1337 VanDerWaalsContact O-N 3.1Å
1334N55.4Low55.6Low67 Ų6787.1 Ų87.136%0.35847%0.47SS..Hα-helixtrans-59.1-36.7172.9-77.2-36.2000112.2L1330L1330-N1334 WeakPolarHBondContact O-CB 3.37Å; L1330-N1334 PolarHBondContact O-N 3.47Å; L1330-N1334 VanDerWaalsContact O-N 3.12Å; L1330-N1334 PolarHBondContact O-ND2 3.38Å; L1330-N1334 VanDerWaalsContact O-ND2 3.12Å
1335C35.5Very low53.2Low79 Ų7985.6 Ų85.653%0.53447%0.472SS..Hα-helixtrans-69-43173.4-75.90000112.8N1331 K1332 E1333 I1337 S1338N1331-C1335 WeakPolarHBondContact O-CB 3.38Å; N1331-C1335 PolarHBondContact O-N 2.95Å; N1331-C1335 PolarHBondContact O-SG 3.28Å; K1332-C1335 PolarHBondContact O-N 2.87Å; E1333-C1335 VanDerWaalsContact C-N 3.26Å; E1333-C1335 PolarHBondContact O-N 3Å; C1335-I1337 VanDerWaalsContact C-N 3.3Å; C1335-I1337 PolarHBondContact O-N 3.3Å; C1335-S1338 PolarHBondContact O-N 3.1Å; C1335-S1338 VanDerWaalsContact O-N 3.1Å; C1335-S1338 PolarHBondContact O-OG 2.75Å
1336Q41Very low50.9Low145 Ų14582.1 Ų82.168%0.67846%0.462SS*.Hα-helixtrans-61-36.6178.6-77.8-175.5-47.600112.9K1332 E1333 S1338K1332-Q1336 PolarHBondContact O-N 3.43Å; E1333-Q1336 PolarHBondContact O-N 3.5Å; Q1336-S1338 PolarHBondContact O-N 2.96Å
1337I43Very low49Very low55 Ų5586.6 Ų86.628%0.28249%0.49SS..Hα-helixtrans-63.5-28.8177-66.4164.4000111.9E1333 C1335E1333-I1337 WeakPolarHBondContact O-CG1 3.44Å; E1333-I1337 PolarHBondContact O-N 3.27Å; E1333-I1337 VanDerWaalsContact O-N 3.1Å; C1335-I1337 VanDerWaalsContact C-N 3.3Å; C1335-I1337 PolarHBondContact O-N 3.3Å
1338S30.2Very low47.1Very low67 Ų6785.4 Ų85.447%0.46949%0.485SS..THydrogen-bonded Turntrans-85.5-10.2-173.671.40000116.1C1335 Q1336 N1341C1335-S1338 PolarHBondContact O-N 3.1Å; C1335-S1338 VanDerWaalsContact O-N 3.1Å; C1335-S1338 PolarHBondContact O-OG 2.75Å; Q1336-S1338 PolarHBondContact O-N 2.96Å; S1338-N1341 PolarHBondContact O-ND2 2.88Å
1339V36.6Very low44.9Very low110 Ų11086.2 Ų86.267%0.66749%0.49SS*.THydrogen-bonded Turntrans-93.1-33.3-169.61740000113.3N1341V1339-N1341 VanDerWaalsContact C-N 3.25Å; V1339-N1341 PolarHBondContact O-N 2.89Å
1340N37.6Very low43Very low146 Ų14687.5 Ų87.578%0.78150%0.5SS*.  trans-85.754.2-177.8-72.2-2.4000112.7N1342N1340-N1342 VanDerWaalsContact C-N 3.34Å; N1340-N1342 PolarHBondContact O-N 3.14Å
1341N30.9Very low41.6Very low101 Ų10188.3 Ų88.354%0.5451%0.505SS..  trans-85.25.2-170.9-102.1-47000115.9S1338 V1339S1338-N1341 PolarHBondContact O-ND2 2.88Å; V1339-N1341 VanDerWaalsContact C-N 3.25Å; V1339-N1341 PolarHBondContact O-N 2.89Å
1342N32Very low40.4Very low142 Ų14287.4 Ų87.476%0.75950%0.499SS*.  trans-104.6146.4176.1-67.2-8.4000110.9N1340N1340-N1342 VanDerWaalsContact C-N 3.34Å; N1340-N1342 PolarHBondContact O-N 3.14Å
1343N33.5Very low39.2Very low142 Ų14287.4 Ų87.476%0.75951%0.513SS*.SBendtrans82.3157.1179.2-54.3-13.4000116.6S1345N1343-S1345 VanDerWaalsContact C-N 3.29Å; N1343-S1345 PolarHBondContact O-N 3.41Å; N1343-S1345 VanDerWaalsContact O-N 3.11Å
1344S36.2Very low38.8Very low122 Ų12288.3 Ų88.385%0.85352%0.518SS*.THydrogen-bonded Turntrans-76.92-153.849.70000116.9A1346S1344-A1346 VanDerWaalsContact C-N 3.27Å; S1344-A1346 PolarHBondContact O-N 2.89Å
1345S34.2Very low39Very low80 Ų8088.6 Ų88.656%0.55952%0.52SS*.THydrogen-bonded Turntrans-75.8-8.4177.150.40000114.3N1343 T1347 I1348N1343-S1345 VanDerWaalsContact C-N 3.29Å; N1343-S1345 PolarHBondContact O-N 3.41Å; N1343-S1345 VanDerWaalsContact O-N 3.11Å; S1345-T1347 PolarHBondContact O-N 2.98Å; S1345-I1348 PolarHBondContact O-N 3.29Å
1346A34.3Very low40.3Very low36 Ų3687.2 Ų87.230%0.29852%0.519SS..Hα-helixtrans-53.4-28.2-172.500000115.8S1344 I1348 C1349 N1350S1344-A1346 VanDerWaalsContact C-N 3.27Å; S1344-A1346 PolarHBondContact O-N 2.89Å; A1346-I1348 PolarHBondContact O-N 3.21Å; A1346-I1348 VanDerWaalsContact O-N 3.15Å; A1346-C1349 PolarHBondContact O-N 2.97Å; A1346-N1350 PolarHBondContact O-N 3.44Å
1347T39.6Very low41.6Very low106 Ų10686.4 Ų86.465%0.6551%0.513SS*.Hα-helixtrans-62.7-21.3-177.7-45.80000113.8S1345 T1351S1345-T1347 PolarHBondContact O-N 2.98Å; T1347-T1351 WeakPolarHBondContact O-CG2 3.34Å
1348I40.3Very low42.8Very low52 Ų5284.3 Ų84.327%0.26750%0.503SS..Hα-helixtrans-96.9-43178.7-66.5176.1000111.3I1117 T1233 I1237 S1345 A1346 T1351I1117-I1348 HydrophobicContact CD1-CG2 3.93Å; T1233-I1348 HydrophobicContact CG2-CG2 4.19Å; I1237-I1348 HydrophobicContact CD1-CG2 4.34Å; S1345-I1348 PolarHBondContact O-N 3.29Å; A1346-I1348 PolarHBondContact O-N 3.21Å; A1346-I1348 VanDerWaalsContact O-N 3.15Å; I1348-T1351 WeakPolarHBondContact O-CB 3.33Å; I1348-T1351 WeakPolarHBondContact O-CG2 3.41Å; I1348-T1351 PolarHBondContact O-N 2.99Å; I1348-T1351 PolarHBondContact O-OG1 2.96Å
1349C34.2Very low44.8Very low63 Ų6384.7 Ų84.743%0.42650%0.499SS..Hα-helixtrans-69.3-37.2-175-63.50000113.1A1346 T1351A1346-C1349 PolarHBondContact O-N 2.97Å; C1349-T1351 PolarHBondContact O-N 3.3Å
1350N35.5Very low46.8Very low103 Ų10385.9 Ų85.955%0.55150%0.497SS*.THydrogen-bonded Turntrans-71.621.8178.7-72.3-22.3000114.3A1346A1346-N1350 PolarHBondContact O-N 3.44Å
1351T41.6Very low48.6Very low22 Ų2281.1 Ų81.114%0.13547%0.47CS..THydrogen-bonded Turntrans-116.4-10.7-169.8740000115.6K1121 T1347 I1348 C1349K1121-T1351 WeakPolarHBondContact CE-O 3.44Å; T1347-T1351 WeakPolarHBondContact O-CG2 3.34Å; I1348-T1351 WeakPolarHBondContact O-CB 3.33Å; I1348-T1351 WeakPolarHBondContact O-CG2 3.41Å; I1348-T1351 PolarHBondContact O-N 2.99Å; I1348-T1351 PolarHBondContact O-OG1 2.96Å; C1349-T1351 PolarHBondContact O-N 3.3Å
1352I46Very low50.9Low67 Ų6776.4 Ų76.434%0.34445%0.445SS..  trans-11067.1175.7-50.6175.5000108.1I1237 L1354I1237-I1352 HydrophobicContact CG1-CD1 4.3Å; I1237-I1352 HydrophobicContact CG2-CD1 4.33Å; I1352-L1354 PolarHBondContact O-N 2.94Å
1353S45.5Very low53.3Low109 Ų10973.4 Ų73.476%0.76243%0.429SS*.  trans-65.3114162.756.80000107.5D1355S1353-D1355 PolarHBondContact O-N 3.05Å
1354L52.4Low55.7Low40 Ų4072.3 Ų72.321%0.20941%0.414CS..  trans-52.3129.7178.6-89.1157.5000110.2Y1244 W1247 L1330 I1352 G1356Y1244-L1354 HydrophobicContact CD2-CD2 3.64Å; Y1244-L1354 HydrophobicContact CE2-CD2 4.14Å; W1247-L1354 HydrophobicContact CE3-CD2 4.4Å; W1247-L1354 HydrophobicContact CH2-CD1 4.26Å; W1247-L1354 HydrophobicContact CZ3-CD1 3.87Å; W1247-L1354 HydrophobicContact CZ3-CD2 3.77Å; W1247-L1354 HydrophobicContact CZ3-CG 4.49Å; L1330-L1354 HydrophobicContact CD2-CD1 4.09Å; I1352-L1354 PolarHBondContact O-N 2.94Å; L1354-G1356 PolarHBondContact O-N 3.42Å; L1354-G1356 VanDerWaalsContact O-N 3.13Å
1355D59.4Low57.9Low73 Ų7366.5 Ų66.539%0.3937%0.373SS..  trans-56.5118.7-163.4-171.9-7000110.6Y1244 S1353 K1357 L1358Y1244-D1355 HydrophobicContact CE2-CB 4.31Å; Y1244-D1355 WeakPolarHBondContact OH-CB 3.4Å; S1353-D1355 PolarHBondContact O-N 3.05Å; D1355-K1357 PolarHBondContact O-N 3.35Å; D1355-K1357 VanDerWaalsContact OD1-CB 3.25Å; D1355-K1357 WeakPolarHBondContact OD1-CB 3.43Å; D1355-K1357 PolarHBondContact OD1-N 3.11Å; D1355-K1357 VanDerWaalsContact OD1-N 3.09Å; D1355-L1358 WeakPolarHBondContact O-CB 3.26Å; D1355-L1358 PolarHBondContact O-N 3.21Å
1356G61.3Low60.4Low51 Ų5165.6 Ų65.653%0.52637%0.367SS..Hα-helixtrans-57.7-19.5179.800000112.8L1354 L1359 H1360L1354-G1356 PolarHBondContact O-N 3.42Å; L1354-G1356 VanDerWaalsContact O-N 3.13Å; G1356-L1359 PolarHBondContact O-N 2.75Å; G1356-H1360 WeakPolarHBondContact O-CB 3.46Å; G1356-H1360 PolarHBondContact O-N 3.14Å
1357K68.6Low62.8Low128 Ų12866.8 Ų66.856%0.55737%0.374SS*.Hα-helixtrans-60.4-38.8168.6-169.9-172.8174.7-160.80113.4D1355 H1360 E1361D1355-K1357 PolarHBondContact O-N 3.35Å; D1355-K1357 VanDerWaalsContact OD1-CB 3.25Å; D1355-K1357 WeakPolarHBondContact OD1-CB 3.43Å; D1355-K1357 PolarHBondContact OD1-N 3.11Å; D1355-K1357 VanDerWaalsContact OD1-N 3.09Å; K1357-H1360 PolarHBondContact O-N 3.41Å; K1357-E1361 VanDerWaalsContact CE-OE1 3.28Å; K1357-E1361 WeakPolarHBondContact CE-OE1 3.47Å; K1357-E1361 IonicContact NZ-OE1 2.69Å; K1357-E1361 PolarHBondContact O-N 3.22Å
1358L68.8Low64.9Low11 Ų1164.7 Ų64.76%0.05836%0.356CS..Hα-helixtrans-70.7-39.5-179.5-161.6155.2000110.4Y1244 W1247 L1251 L1330 D1355 E1361 I1362Y1244-L1358 HydrophobicContact CD2-CD1 3.89Å; Y1244-L1358 HydrophobicContact CE2-CB 4.47Å; Y1244-L1358 HydrophobicContact CE2-CD1 3.4Å; W1247-L1358 HydrophobicContact CB-CD1 4.5Å; L1251-L1358 HydrophobicContact CD2-CG 4.3Å; L1330-L1358 HydrophobicContact CD1-CD2 3.84Å; D1355-L1358 WeakPolarHBondContact O-CB 3.26Å; D1355-L1358 PolarHBondContact O-N 3.21Å; L1358-E1361 PolarHBondContact O-N 2.94Å; L1358-I1362 HydrophobicContact CD2-CD1 3.76Å; L1358-I1362 HydrophobicContact CD2-CG1 4.42Å; L1358-I1362 WeakPolarHBondContact O-CG1 3.44Å; L1358-I1362 PolarHBondContact O-N 3.46Å; L1358-I1362 VanDerWaalsContact O-N 3.07Å
1359L72.8Confident67.1Low75 Ų7562.5 Ų62.539%0.39335%0.345SS..Hα-helixtrans-59.9-48.5170.2-148.576000110.9G1356 E1361 I1362 D1363G1356-L1359 PolarHBondContact O-N 2.75Å; L1359-E1361 VanDerWaalsContact C-N 3.31Å; L1359-E1361 PolarHBondContact O-N 2.67Å; L1359-I1362 WeakPolarHBondContact O-CA 3.43Å; L1359-I1362 WeakPolarHBondContact O-CB 3.47Å; L1359-I1362 PolarHBondContact O-N 2.93Å; L1359-D1363 PolarHBondContact O-N 3.29Å
1360H77.3Confident69.4Low134 Ų13462.2 Ų62.262%0.6235%0.347SS*.Hα-helixtrans-61.9-33.8177.6-170.2-15000113.1G1356 K1357 R1364G1356-H1360 WeakPolarHBondContact O-CB 3.46Å; G1356-H1360 PolarHBondContact O-N 3.14Å; K1357-H1360 PolarHBondContact O-N 3.41Å; H1360-R1364 WeakPolarHBondContact O-CB 3.14Å; H1360-R1364 PolarHBondContact O-N 3.49Å
1361E77Confident71.7Confident46 Ų4661.8 Ų61.822%0.21534%0.344CS..Hα-helixtrans-72.8-30.6173.6-77.3-169.1-135.500112.8L1251 Q1255 K1357 L1358 L1359 L1365L1251-E1361 HydrophobicContact CD2-CB 3.87Å; Q1255-E1361 PolarHBondContact NE2-OE2 3.09Å; K1357-E1361 VanDerWaalsContact CE-OE1 3.28Å; K1357-E1361 WeakPolarHBondContact CE-OE1 3.47Å; K1357-E1361 IonicContact NZ-OE1 2.69Å; K1357-E1361 PolarHBondContact O-N 3.22Å; L1358-E1361 PolarHBondContact O-N 2.94Å; L1359-E1361 VanDerWaalsContact C-N 3.31Å; L1359-E1361 PolarHBondContact O-N 2.67Å; E1361-L1365 WeakPolarHBondContact O-CG 3.16Å; E1361-L1365 PolarHBondContact O-N 3.03Å
1362I79.4Confident73.6Confident2 Ų261 Ų611%0.0134%0.339CS..Hα-helixtrans-66.7-46.4169.2-69.7168.6000110.4L1251 L1323 I1326 L1330 L1358 L1359 R1364 L1365 S1366L1251-I1362 HydrophobicContact CD1-CG1 3.83Å; L1323-I1362 HydrophobicContact CD2-CG2 4.3Å; I1326-I1362 HydrophobicContact CG2-CD1 3.84Å; L1330-I1362 HydrophobicContact CD1-CD1 3.34Å; L1358-I1362 HydrophobicContact CD2-CD1 3.76Å; L1358-I1362 HydrophobicContact CD2-CG1 4.42Å; L1358-I1362 WeakPolarHBondContact O-CG1 3.44Å; L1358-I1362 PolarHBondContact O-N 3.46Å; L1358-I1362 VanDerWaalsContact O-N 3.07Å; L1359-I1362 WeakPolarHBondContact O-CA 3.43Å; L1359-I1362 WeakPolarHBondContact O-CB 3.47Å; L1359-I1362 PolarHBondContact O-N 2.93Å; I1362-R1364 VanDerWaalsContact C-N 3.28Å; I1362-R1364 PolarHBondContact O-N 3.4Å; I1362-L1365 PolarHBondContact O-N 3.42Å; I1362-L1365 VanDerWaalsContact O-N 3.12Å; I1362-S1366 WeakPolarHBondContact O-CB 3.23Å; I1362-S1366 PolarHBondContact O-N 3.16Å
1363D80.5Confident75.4Confident80 Ų8063.4 Ų63.443%0.42834%0.344SS..Hα-helixtrans-61.9-36.4176.4-66.6-35.7000111.9L1359 S1367L1359-D1363 PolarHBondContact O-N 3.29Å; D1363-S1367 WeakPolarHBondContact O-CB 3.38Å; D1363-S1367 PolarHBondContact O-N 3Å; D1363-S1367 PolarHBondContact O-OG 2.84Å
1364R84.5Confident77.3Confident118 Ų11861.2 Ų61.245%0.44533%0.328SS..Hα-helixtrans-65-40.9173.2-169.6-176.470.4135.7-2112.2H1360 I1362 S1367 Q1368H1360-R1364 WeakPolarHBondContact O-CB 3.14Å; H1360-R1364 PolarHBondContact O-N 3.49Å; I1362-R1364 VanDerWaalsContact C-N 3.28Å; I1362-R1364 PolarHBondContact O-N 3.4Å; R1364-S1367 WeakPolarHBondContact CA-OG 3.14Å; R1364-S1367 PolarHBondContact O-OG 3.31Å; R1364-S1367 VanDerWaalsContact O-OG 3.07Å; R1364-Q1368 WeakPolarHBondContact O-CB 3.13Å; R1364-Q1368 PolarHBondContact O-N 3.24Å
1365L83.5Confident78.8Confident0 Ų062.7 Ų62.70%034%0.336CS..Hα-helixtrans-69-42.6176.1-76.9166.2000111.8L1251 L1254 Q1255 M1258 L1323 E1361 I1362 Q1368 L1369L1251-L1365 HydrophobicContact CD1-CD1 3.54Å; L1251-L1365 HydrophobicContact CG-CD1 4.23Å; L1254-L1365 HydrophobicContact CB-CD1 4.12Å; Q1255-L1365 HydrophobicContact CG-CD1 4.21Å; Q1255-L1365 HydrophobicContact CG-CD2 3.84Å; Q1255-L1365 HydrophobicContact CG-CG 4.38Å; M1258-L1365 HydrophobicContact CB-CD2 4.13Å; M1258-L1365 HydrophobicContact CG-CD2 3.78Å; L1323-L1365 HydrophobicContact CD1-CB 4.24Å; L1323-L1365 HydrophobicContact CD2-CB 3.88Å; L1323-L1365 HydrophobicContact CD2-CD1 4.19Å; E1361-L1365 WeakPolarHBondContact O-CG 3.16Å; E1361-L1365 PolarHBondContact O-N 3.03Å; I1362-L1365 PolarHBondContact O-N 3.42Å; I1362-L1365 VanDerWaalsContact O-N 3.12Å; L1365-Q1368 PolarHBondContact O-N 2.87Å; L1365-L1369 WeakPolarHBondContact O-CB 3.31Å; L1365-L1369 PolarHBondContact O-N 2.91Å
1366S85.5Confident79.9Confident62 Ų6259.2 Ų59.243%0.43432%0.317SS..Hα-helixtrans-60.5-47.4176.5-177.90000111.9I1362 L1369 A1370I1362-S1366 WeakPolarHBondContact O-CB 3.23Å; I1362-S1366 PolarHBondContact O-N 3.16Å; S1366-L1369 WeakPolarHBondContact O-CB 3.45Å; S1366-L1369 PolarHBondContact O-N 3.18Å; S1366-A1370 PolarHBondContact O-N 3.08Å
1367S85.7Confident80.9Confident61 Ų6160.8 Ų60.843%0.42731%0.311SS..Hα-helixtrans-65.2-39.6175.350.90000112.9D1363 R1364 L1369 A1370 I1371D1363-S1367 WeakPolarHBondContact O-CB 3.38Å; D1363-S1367 PolarHBondContact O-N 3Å; D1363-S1367 PolarHBondContact O-OG 2.84Å; R1364-S1367 WeakPolarHBondContact CA-OG 3.14Å; R1364-S1367 PolarHBondContact O-OG 3.31Å; R1364-S1367 VanDerWaalsContact O-OG 3.07Å; S1367-L1369 VanDerWaalsContact C-N 3.33Å; S1367-L1369 PolarHBondContact O-N 3.22Å; S1367-A1370 PolarHBondContact O-N 3.32Å; S1367-I1371 WeakPolarHBondContact O-CG1 3.45Å; S1367-I1371 PolarHBondContact O-N 3.03Å
1368Q83.4Confident81.6Confident61 Ų6163.4 Ų63.429%0.28532%0.317SS..Hα-helixtrans-65.6-34.8173.6-168.7-172.8-1900112.2M1258 R1364 L1365 I1371 N1372M1258-Q1368 VanDerWaalsContact CE-C 3.42Å; M1258-Q1368 HydrophobicContact CE-CB 3.7Å; M1258-Q1368 HydrophobicContact CE-CG 3.45Å; M1258-Q1368 VanDerWaalsContact CE-CG 3.45Å; R1364-Q1368 WeakPolarHBondContact O-CB 3.13Å; R1364-Q1368 PolarHBondContact O-N 3.24Å; L1365-Q1368 PolarHBondContact O-N 2.87Å; Q1368-I1371 PolarHBondContact O-N 3.08Å; Q1368-N1372 PolarHBondContact O-N 3.38Å
1369L85.9Confident82.1Confident6 Ų663.8 Ų63.83%0.03132%0.319CS..Hα-helixtrans-67.2-42174.3-176.363.4000111.4M1258 L1261 V1316 L1319 N1320 L1323 L1365 S1366 S1367 I1371 N1372 R1373M1258-L1369 HydrophobicContact CE-CB 4.14Å; M1258-L1369 HydrophobicContact SD-CB 4.01Å; M1258-L1369 HydrophobicContact SD-CD1 3.78Å; M1258-L1369 HydrophobicContact SD-CG 4.47Å; L1261-L1369 HydrophobicContact CD2-CD1 3.89Å; V1316-L1369 HydrophobicContact CB-CD1 4.31Å; V1316-L1369 HydrophobicContact CG1-CD1 4.12Å; V1316-L1369 HydrophobicContact CG2-CD1 4.12Å; L1319-L1369 HydrophobicContact CB-CD1 4.09Å; L1319-L1369 HydrophobicContact CB-CD2 4.26Å; N1320-L1369 HydrophobicContact CB-CD2 3.95Å; L1323-L1369 HydrophobicContact CD1-CD2 4Å; L1365-L1369 WeakPolarHBondContact O-CB 3.31Å; L1365-L1369 PolarHBondContact O-N 2.91Å; S1366-L1369 WeakPolarHBondContact O-CB 3.45Å; S1366-L1369 PolarHBondContact O-N 3.18Å; S1367-L1369 VanDerWaalsContact C-N 3.33Å; S1367-L1369 PolarHBondContact O-N 3.22Å; L1369-I1371 VanDerWaalsContact C-N 3.34Å; L1369-I1371 PolarHBondContact O-N 3.38Å; L1369-N1372 PolarHBondContact O-N 3.02Å; L1369-R1373 WeakPolarHBondContact O-CB 3.47Å; L1369-R1373 PolarHBondContact O-N 3.32Å
1370A83.2Confident82.4Confident57 Ų5761.8 Ų61.847%0.47131%0.309SS..Hα-helixtrans-61.4-40.2172.700000112.2S1366 S1367 R1373 S1374S1366-A1370 PolarHBondContact O-N 3.08Å; S1367-A1370 PolarHBondContact O-N 3.32Å; A1370-R1373 PolarHBondContact O-N 3.18Å; A1370-S1374 WeakPolarHBondContact O-CB 3.37Å; A1370-S1374 PolarHBondContact O-N 2.83Å
1371I84.1Confident82.5Confident94 Ų9463.2 Ų63.248%0.48231%0.309SS..Hα-helixtrans-61.1-53.3173.3-70.4164.6000110.5S1367 Q1368 L1369 R1373 S1374 I1375S1367-I1371 WeakPolarHBondContact O-CG1 3.45Å; S1367-I1371 PolarHBondContact O-N 3.03Å; Q1368-I1371 PolarHBondContact O-N 3.08Å; L1369-I1371 VanDerWaalsContact C-N 3.34Å; L1369-I1371 PolarHBondContact O-N 3.38Å; I1371-R1373 VanDerWaalsContact C-N 3.28Å; I1371-R1373 PolarHBondContact O-N 3.48Å; I1371-S1374 PolarHBondContact O-N 3.4Å; I1371-S1374 VanDerWaalsContact O-N 3.08Å; I1371-S1374 PolarHBondContact O-OG 3Å; I1371-I1375 HydrophobicContact CG2-CD1 3.79Å; I1371-I1375 HydrophobicContact CG2-CG1 4.46Å; I1371-I1375 WeakPolarHBondContact O-CG1 3.41Å; I1371-I1375 PolarHBondContact O-N 3.01Å
1372N81.3Confident82.5Confident7 Ų764.9 Ų64.94%0.03732%0.319CS..Hα-helixtrans-55.1-43.3176.9-80.9-17.3000111.7M1258 L1261 S1262 Q1368 L1369 S1374 I1375 L1376M1258-N1372 VanDerWaalsContact CE-ND2 3.28Å; M1258-N1372 WeakPolarHBondContact CE-ND2 3.48Å; L1261-N1372 HydrophobicContact CD2-CB 4.06Å; L1261-N1372 WeakPolarHBondContact CD2-ND2 3.44Å; L1261-N1372 HydrophobicContact CG-CB 4.34Å; S1262-N1372 VanDerWaalsContact OG-CG 3.29Å; S1262-N1372 PolarHBondContact OG-ND2 2.94Å; S1262-N1372 PolarHBondContact OG-OD1 2.97Å; Q1368-N1372 PolarHBondContact O-N 3.38Å; L1369-N1372 PolarHBondContact O-N 3.02Å; N1372-S1374 PolarHBondContact O-N 3.24Å; N1372-I1375 PolarHBondContact O-N 2.93Å; N1372-L1376 WeakPolarHBondContact O-CB 3.35Å; N1372-L1376 PolarHBondContact O-N 2.77Å
1373R83.8Confident82.2Confident116 Ų11666.4 Ų66.444%0.43833%0.325SS..Hα-helixtrans-61.8-41.2176.4-171.5176.5-174.6166.54.2112.5L1369 A1370 I1371 L1376 Q1377L1369-R1373 WeakPolarHBondContact O-CB 3.47Å; L1369-R1373 PolarHBondContact O-N 3.32Å; A1370-R1373 PolarHBondContact O-N 3.18Å; I1371-R1373 VanDerWaalsContact C-N 3.28Å; I1371-R1373 PolarHBondContact O-N 3.48Å; R1373-L1376 PolarHBondContact O-N 3.42Å; R1373-Q1377 WeakPolarHBondContact O-CG 3.48Å; R1373-Q1377 PolarHBondContact O-N 3.44Å
1374S85.2Confident81.9Confident63 Ų6368 Ų6844%0.44133%0.33SS..Hα-helixtrans-69.1-37.4177.676.70000112.9A1370 I1371 N1372 Q1377 R1378A1370-S1374 WeakPolarHBondContact O-CB 3.37Å; A1370-S1374 PolarHBondContact O-N 2.83Å; I1371-S1374 PolarHBondContact O-N 3.4Å; I1371-S1374 VanDerWaalsContact O-N 3.08Å; I1371-S1374 PolarHBondContact O-OG 3Å; N1372-S1374 PolarHBondContact O-N 3.24Å; S1374-Q1377 PolarHBondContact O-N 2.94Å; S1374-R1378 PolarHBondContact O-N 3.19Å
1375I82.9Confident81.2Confident71 Ų7165.1 Ų65.136%0.36433%0.328SS..Hα-helixtrans-64.9-45.2174-65166.8000109.6T1265 I1371 N1372 Q1377 R1378 L1379T1265-I1375 HydrophobicContact CG2-CB 4.26Å; T1265-I1375 HydrophobicContact CG2-CG2 3.6Å; I1371-I1375 HydrophobicContact CG2-CD1 3.79Å; I1371-I1375 HydrophobicContact CG2-CG1 4.46Å; I1371-I1375 WeakPolarHBondContact O-CG1 3.41Å; I1371-I1375 PolarHBondContact O-N 3.01Å; N1372-I1375 PolarHBondContact O-N 2.93Å; I1375-Q1377 PolarHBondContact O-N 3.11Å; I1375-R1378 PolarHBondContact O-N 3.24Å; I1375-R1378 VanDerWaalsContact O-N 3.11Å; I1375-L1379 HydrophobicContact CG2-CD1 4.06Å; I1375-L1379 HydrophobicContact CG2-CG 4.41Å; I1375-L1379 WeakPolarHBondContact O-CG 3.48Å; I1375-L1379 PolarHBondContact O-N 3.15Å
1376L82.9Confident80.1Confident1 Ų168.1 Ų68.11%0.00535%0.349CS..Hα-helixtrans-60.4-44.6177.9-157.172.8000111.4T1265 F1309 C1312 F1313 N1372 R1373 R1378 L1379 I1380T1265-L1376 HydrophobicContact CG2-CD1 4.45Å; F1309-L1376 HydrophobicContact CD1-CD1 3.69Å; F1309-L1376 HydrophobicContact CD1-CG 4.06Å; F1309-L1376 HydrophobicContact CE1-CD1 3.99Å; F1309-L1376 HydrophobicContact CE1-CG 4.4Å; C1312-L1376 HydrophobicContact CB-CD1 3.58Å; C1312-L1376 HydrophobicContact CB-CD2 3.68Å; C1312-L1376 HydrophobicContact CB-CG 4.31Å; F1313-L1376 HydrophobicContact CD1-CD2 3.92Å; F1313-L1376 HydrophobicContact CD2-CD2 4.03Å; F1313-L1376 HydrophobicContact CE1-CD2 3.85Å; F1313-L1376 HydrophobicContact CE2-CD2 3.99Å; F1313-L1376 HydrophobicContact CG-CD2 4Å; F1313-L1376 HydrophobicContact CZ-CD2 3.9Å; N1372-L1376 WeakPolarHBondContact O-CB 3.35Å; N1372-L1376 PolarHBondContact O-N 2.77Å; R1373-L1376 PolarHBondContact O-N 3.42Å; L1376-R1378 VanDerWaalsContact C-N 3.33Å; L1376-R1378 PolarHBondContact O-N 3.23Å; L1376-L1379 PolarHBondContact O-N 3.02Å; L1376-I1380 HydrophobicContact CG-CD1 4.37Å; L1376-I1380 WeakPolarHBondContact O-CD1 3.21Å; L1376-I1380 VanDerWaalsContact O-CG1 3.25Å; L1376-I1380 WeakPolarHBondContact O-CG1 3.41Å; L1376-I1380 PolarHBondContact O-N 3.26Å
1377Q82.4Confident78.5Confident83 Ų8369.5 Ų69.539%0.38835%0.348SS..Hα-helixtrans-60.9-37.4173.2-74.7178.1-7.600113.2R1373 S1374 I1375 I1380 R1381R1373-Q1377 WeakPolarHBondContact O-CG 3.48Å; R1373-Q1377 PolarHBondContact O-N 3.44Å; S1374-Q1377 PolarHBondContact O-N 2.94Å; I1375-Q1377 PolarHBondContact O-N 3.11Å; Q1377-I1380 PolarHBondContact O-N 2.91Å; Q1377-R1381 WeakPolarHBondContact O-CG 3.48Å; Q1377-R1381 PolarHBondContact O-N 2.97Å; Q1377-R1381 VanDerWaalsContact O-N 3.1Å
1378R82.7Confident76.8Confident184 Ų18469.8 Ų69.869%0.69435%0.35SS*.Hα-helixtrans-70.4-39.4177.3-168.8173-176.1165.80.2112.1S1374 I1375 L1376 R1381 L1382S1374-R1378 PolarHBondContact O-N 3.19Å; I1375-R1378 PolarHBondContact O-N 3.24Å; I1375-R1378 VanDerWaalsContact O-N 3.11Å; L1376-R1378 VanDerWaalsContact C-N 3.33Å; L1376-R1378 PolarHBondContact O-N 3.23Å; R1378-R1381 PolarHBondContact O-N 3.19Å; R1378-L1382 WeakPolarHBondContact O-CG 3.41Å; R1378-L1382 PolarHBondContact O-N 3.47Å; R1378-L1382 VanDerWaalsContact O-N 3.12Å
1379L80Confident74.7Confident18 Ų1872.8 Ų72.89%0.09437%0.368CS..Hα-helixtrans-64.3-39.4173.2-71.7171.7000111.7T1265 I1268 M1272 F1309 I1375 L1376 L1382 F1383T1265-L1379 HydrophobicContact CG2-CD1 4.09Å; I1268-L1379 HydrophobicContact CG2-CD1 4.45Å; M1272-L1379 HydrophobicContact SD-CB 4.43Å; M1272-L1379 HydrophobicContact SD-CD2 4.11Å; F1309-L1379 HydrophobicContact CE1-CB 3.74Å; F1309-L1379 HydrophobicContact CZ-CB 3.83Å; I1375-L1379 HydrophobicContact CG2-CD1 4.06Å; I1375-L1379 HydrophobicContact CG2-CG 4.41Å; I1375-L1379 WeakPolarHBondContact O-CG 3.48Å; I1375-L1379 PolarHBondContact O-N 3.15Å; L1376-L1379 PolarHBondContact O-N 3.02Å; L1379-L1382 WeakPolarHBondContact O-CB 3.37Å; L1379-L1382 PolarHBondContact O-N 3.26Å; L1379-F1383 WeakPolarHBondContact O-CB 3.44Å; L1379-F1383 PolarHBondContact O-N 3.24Å
1380I80.2Confident72.3Confident33 Ų3379.7 Ų79.717%0.16941%0.405CS..Hα-helixtrans-62.9-46.7175.4-69.5160.5000111F1309 F1313 L1376 Q1377 L1382 F1383 E1384F1309-I1380 HydrophobicContact CD1-CD1 4.13Å; F1309-I1380 HydrophobicContact CD1-CG1 3.69Å; F1309-I1380 HydrophobicContact CE1-CD1 4.38Å; F1309-I1380 HydrophobicContact CE1-CG1 3.57Å; F1309-I1380 HydrophobicContact CE2-CG1 4.46Å; F1309-I1380 HydrophobicContact CG-CG1 4.23Å; F1309-I1380 HydrophobicContact CZ-CG1 3.98Å; F1313-I1380 HydrophobicContact CE2-CD1 3.41Å; F1313-I1380 VanDerWaalsContact CE2-CD1 3.41Å; F1313-I1380 HydrophobicContact CZ-CD1 3.36Å; L1376-I1380 HydrophobicContact CG-CD1 4.37Å; L1376-I1380 WeakPolarHBondContact O-CD1 3.21Å; L1376-I1380 VanDerWaalsContact O-CG1 3.25Å; L1376-I1380 WeakPolarHBondContact O-CG1 3.41Å; L1376-I1380 PolarHBondContact O-N 3.26Å; Q1377-I1380 PolarHBondContact O-N 2.91Å; I1380-L1382 PolarHBondContact O-N 3.43Å; I1380-F1383 WeakPolarHBondContact O-CB 3.41Å; I1380-F1383 PolarHBondContact O-N 2.69Å; I1380-F1383 VanDerWaalsContact O-N 3.08Å; I1380-E1384 HydrophobicContact CG2-CG 4.18Å; I1380-E1384 WeakPolarHBondContact O-CB 3.35Å; I1380-E1384 WeakPolarHBondContact O-CG 3.3Å; I1380-E1384 PolarHBondContact O-N 3.42Å
1381R78.1Confident69.7Low165 Ų16581.6 Ų81.662%0.62342%0.415SS*.Hα-helixtrans-59.4-35.7175.2-70.8176.1-171.5147.95.1112.7Q1377 R1378 S1385Q1377-R1381 WeakPolarHBondContact O-CG 3.48Å; Q1377-R1381 PolarHBondContact O-N 2.97Å; Q1377-R1381 VanDerWaalsContact O-N 3.1Å; R1378-R1381 PolarHBondContact O-N 3.19Å; R1381-S1385 WeakPolarHBondContact O-CB 3.47Å; R1381-S1385 PolarHBondContact O-N 3.02Å; R1381-S1385 PolarHBondContact O-OG 3.15Å; R1381-S1385 VanDerWaalsContact O-OG 3.14Å
1382L76.6Confident67.1Low81 Ų8184.5 Ų84.542%0.42443%0.43SS..Hα-helixtrans-67-42.3174.6-71.9167.5000111.6M1272 R1378 L1379 I1380 S1385 S1386M1272-L1382 HydrophobicContact CE-CB 4.01Å; R1378-L1382 WeakPolarHBondContact O-CG 3.41Å; R1378-L1382 PolarHBondContact O-N 3.47Å; R1378-L1382 VanDerWaalsContact O-N 3.12Å; L1379-L1382 WeakPolarHBondContact O-CB 3.37Å; L1379-L1382 PolarHBondContact O-N 3.26Å; I1380-L1382 PolarHBondContact O-N 3.43Å; L1382-S1385 WeakPolarHBondContact CA-OG 3.41Å; L1382-S1385 PolarHBondContact O-N 2.91Å; L1382-S1385 PolarHBondContact O-OG 3.37Å; L1382-S1386 PolarHBondContact O-N 3.03Å; L1382-S1386 VanDerWaalsContact O-N 3.07Å; L1382-S1386 PolarHBondContact O-OG 2.93Å
1383F74.3Confident64.7Low34 Ų3489.8 Ų89.815%0.14947%0.465CS..Hα-helixtrans-63.9-46.9175.6-170.4-109.2000111.8M1272 I1305 F1309 L1379 I1380 S1385 S1386 H1387M1272-F1383 HydrophobicContact CE-CB 3.8Å; M1272-F1383 HydrophobicContact CE-CD2 4.26Å; I1305-F1383 HydrophobicContact CB-CE2 4.02Å; I1305-F1383 HydrophobicContact CB-CZ 4.45Å; I1305-F1383 HydrophobicContact CD1-CE2 4.33Å; I1305-F1383 HydrophobicContact CG2-CD2 3.79Å; I1305-F1383 HydrophobicContact CG2-CE2 3.48Å; I1305-F1383 VanDerWaalsContact CG2-CE2 3.48Å; I1305-F1383 HydrophobicContact CG2-CZ 4.04Å; F1309-F1383 HydrophobicContact CE2-CB 4.24Å; F1309-F1383 HydrophobicContact CE2-CD1 4.35Å; F1309-F1383 HydrophobicContact CE2-CD2 4.4Å; F1309-F1383 HydrophobicContact CE2-CG 4.11Å; L1379-F1383 WeakPolarHBondContact O-CB 3.44Å; L1379-F1383 PolarHBondContact O-N 3.24Å; I1380-F1383 WeakPolarHBondContact O-CB 3.41Å; I1380-F1383 PolarHBondContact O-N 2.69Å; I1380-F1383 VanDerWaalsContact O-N 3.08Å; F1383-S1385 PolarHBondContact O-N 3.26Å; F1383-S1386 WeakPolarHBondContact CA-OG 3.37Å; F1383-S1386 PolarHBondContact O-N 2.92Å; F1383-S1386 PolarHBondContact O-OG 3.35Å; F1383-S1386 VanDerWaalsContact O-OG 3.05Å; F1383-H1387 AromaticContact CD1-CD2 3.87Å; F1383-H1387 AromaticContact CD2-NE2 3.89Å; F1383-H1387 AromaticContact CE1-CD2 3.72Å; F1383-H1387 AromaticContact CE1-NE2 3.71Å; F1383-H1387 AromaticContact CE2-CD2 3.98Å; F1383-H1387 AromaticContact CE2-NE2 3.35Å; F1383-H1387 WeakPolarHBondContact CE2-NE2 3.25Å; F1383-H1387 AromaticContact CZ-CD2 3.78Å; F1383-H1387 AromaticContact CZ-NE2 3.26Å; F1383-H1387 VanDerWaalsContact CZ-NE2 3.26Å; F1383-H1387 WeakPolarHBondContact CZ-NE2 3.17Å; F1383-H1387 PolarHBondContact O-CD2 2.79Å; F1383-H1387 VanDerWaalsContact O-CD2 3.27Å; F1383-H1387 PolarHBondContact O-N 2.73Å; F1383-H1387 VanDerWaalsContact O-N 3.09Å
1384E73.5Confident62.1Low114 Ų11491.3 Ų91.353%0.53348%0.477SS..Hα-helixtrans-59.2-46.2173.4-69.8169.5159.200111.3I1380 S1386 H1387 S1388I1380-E1384 HydrophobicContact CG2-CG 4.18Å; I1380-E1384 WeakPolarHBondContact O-CB 3.35Å; I1380-E1384 WeakPolarHBondContact O-CG 3.3Å; I1380-E1384 PolarHBondContact O-N 3.42Å; E1384-S1386 PolarHBondContact O-N 3.01Å; E1384-H1387 PolarHBondContact O-N 3.47Å; E1384-H1387 VanDerWaalsContact O-N 3.17Å; E1384-S1388 WeakPolarHBondContact O-CB 3.3Å; E1384-S1388 PolarHBondContact O-N 2.96Å; E1384-S1388 PolarHBondContact O-OG 3.44Å
1385S70.4Confident59.5Low57 Ų5795.8 Ų95.840%0.39949%0.491SS..Hα-helixtrans-68.8-16.5179.173.30000115.1R1381 L1382 F1383 S1388 N1389R1381-S1385 WeakPolarHBondContact O-CB 3.47Å; R1381-S1385 PolarHBondContact O-N 3.02Å; R1381-S1385 PolarHBondContact O-OG 3.15Å; R1381-S1385 VanDerWaalsContact O-OG 3.14Å; L1382-S1385 WeakPolarHBondContact CA-OG 3.41Å; L1382-S1385 PolarHBondContact O-N 2.91Å; L1382-S1385 PolarHBondContact O-OG 3.37Å; F1383-S1385 PolarHBondContact O-N 3.26Å; S1385-S1388 WeakPolarHBondContact CA-OG 3.49Å; S1385-S1388 PolarHBondContact O-OG 3.33Å; S1385-N1389 PolarHBondContact O-ND2 3.28Å
1386S59.4Low57Low63 Ų63100.1 Ų100.144%0.44151%0.509SS..Hα-helixtrans-93.3-21.6173.638.50000112.4L1382 F1383 E1384L1382-S1386 PolarHBondContact O-N 3.03Å; L1382-S1386 VanDerWaalsContact O-N 3.07Å; L1382-S1386 PolarHBondContact O-OG 2.93Å; F1383-S1386 WeakPolarHBondContact CA-OG 3.37Å; F1383-S1386 PolarHBondContact O-N 2.92Å; F1383-S1386 PolarHBondContact O-OG 3.35Å; F1383-S1386 VanDerWaalsContact O-OG 3.05Å; E1384-S1386 PolarHBondContact O-N 3.01Å
1387H52.8Low54.6Low91 Ų91106.3 Ų106.342%0.42154%0.542SS..Hα-helixtrans-88.4-24.3170.2-72.4-53.3000114.1F1383 E1384 N1389F1383-H1387 AromaticContact CD1-CD2 3.87Å; F1383-H1387 AromaticContact CD2-NE2 3.89Å; F1383-H1387 AromaticContact CE1-CD2 3.72Å; F1383-H1387 AromaticContact CE1-NE2 3.71Å; F1383-H1387 AromaticContact CE2-CD2 3.98Å; F1383-H1387 AromaticContact CE2-NE2 3.35Å; F1383-H1387 WeakPolarHBondContact CE2-NE2 3.25Å; F1383-H1387 AromaticContact CZ-CD2 3.78Å; F1383-H1387 AromaticContact CZ-NE2 3.26Å; F1383-H1387 VanDerWaalsContact CZ-NE2 3.26Å; F1383-H1387 WeakPolarHBondContact CZ-NE2 3.17Å; F1383-H1387 PolarHBondContact O-CD2 2.79Å; F1383-H1387 VanDerWaalsContact O-CD2 3.27Å; F1383-H1387 PolarHBondContact O-N 2.73Å; F1383-H1387 VanDerWaalsContact O-N 3.09Å; E1384-H1387 PolarHBondContact O-N 3.47Å; E1384-H1387 VanDerWaalsContact O-N 3.17Å; H1387-N1389 VanDerWaalsContact C-N 3.26Å; H1387-N1389 PolarHBondContact O-N 3.05Å
1388S48.7Very low52Low66 Ų66108.6 Ų108.646%0.46256%0.557SS.*G310 helixtrans-69.3-15.2-177.359.10000115.5E1384 S1385 N1390E1384-S1388 WeakPolarHBondContact O-CB 3.3Å; E1384-S1388 PolarHBondContact O-N 2.96Å; E1384-S1388 PolarHBondContact O-OG 3.44Å; S1385-S1388 WeakPolarHBondContact CA-OG 3.49Å; S1385-S1388 PolarHBondContact O-OG 3.33Å; S1388-N1390 VanDerWaalsContact C-N 3.32Å; S1388-N1390 PolarHBondContact O-N 3.11Å
1389N39.9Very low49.6Very low124 Ų124107 Ų10766%0.66356%0.562SS**G310 helixtrans-83.9-4.4-168.9-62.9-15.1000114.2S1385 H1387S1385-N1389 PolarHBondContact O-ND2 3.28Å; H1387-N1389 VanDerWaalsContact C-N 3.26Å; H1387-N1389 PolarHBondContact O-N 3.05Å
1390N35.2Very low47.1Very low152 Ų152113.5 Ų113.581%0.81359%0.592SS**G310 helixtrans-100.819.3-177.8-73.52.3000114.1S1388S1388-N1390 VanDerWaalsContact C-N 3.32Å; S1388-N1390 PolarHBondContact O-N 3.11Å
1391S28.9Very low44.9Very low96 Ų96120.8 Ų120.867%0.67162%0.619SS**  trans-124.672.9173.964.10000111.9
1392L29Very low42.6Very low155 Ų155119.3 Ų119.381%0.81262%0.623SS**  trans-78.8122.8173.5-16174.9000110
1393P30.8Very low40.3Very low119 Ų119120.4 Ų120.477%0.77363%0.633SS**  trans-83137.3-173.632-34.4000112.4
1394H30.2Very low38Very low147 Ų147125.7 Ų125.768%0.68166%0.662SS**  trans-123.9116.9176-110.8-82000111.5
1395H30.1Very low36.1Very low158 Ų158125.4 Ų125.473%0.73167%0.673SS**  trans66144.7173.8-51.7-73.8000114.8
1396Q30.1Very low34.2Very low161 Ų161129.2 Ų129.275%0.75269%0.688SS**  cis-164164.310.8-136.2168.4-2800110.7
1397L32.7Very low32.7Very low132 Ų132134 Ų13469%0.69170%0.703SS**  trans68.490.1156.4-68.3153.4000119.6
1398D28.8Very low31.6Very low130 Ų130135.7 Ų135.770%0.69572%0.715SS**  52.6148.6110.3-47.1-22000123.2
1399N32.7Very low30.9Very low150 Ų150141.4 Ų141.480%0.80274%0.735SS**  trans83.6109.4179.2-45.2-66.1000114.4
1400E27.6Very low30.5Very low155 Ų155142.3 Ų142.372%0.72474%0.739SS**  cis93.4148.945.2-166.9175-114.400112.7
1401Y33Very low30.2Very low186 Ų186143 Ų14373%0.72974%0.737SS**  trans77.3113.2-166.9-65.9-94.4000114.9
1402L29.1Very low30.3Very low135 Ų135145.1 Ų145.171%0.70775%0.746SS**  75.2137.467.6-8780.3000113.9
1403T28.8Very low30.4Very low104 Ų104142.7 Ų142.764%0.63874%0.742SS**  cis-168.5178.1-21.122.70000108.6
1404D27.4Very low30.3Very low144 Ų144144.3 Ų144.377%0.7774%0.743SS**  trans82.6150.4148.6-57.1-46.1000122.6
1405S32.5Very low30.3Very low108 Ų108143.4 Ų143.476%0.75575%0.747SS**  trans58.7110.3172.9-1300000117.6
1406I31.6Very low30.2Very low138 Ų138142.2 Ų142.271%0.70875%0.746SS**  cis71.7130.827.6-46.1171000114
1407E27.5Very low30.1Very low162 Ų162139.9 Ų139.976%0.75775%0.745SS**  trans88.8133.8155.5-97.1170.1147.900124.1
1408N28.2Very low29.9Very low128 Ų128139.8 Ų139.868%0.68475%0.745SS**  trans90141151.8-64.8-43.5000122.4
1409Q35.7Very low30Very low186 Ų186141.1 Ų141.187%0.86975%0.745SS**  trans64.397.5179.5-55.1-178.219.500114.3
1410L29.9Very low30Very low143 Ų143137.8 Ų137.875%0.74973%0.733SS**  cis67.2123.617.9-100.5169.5000116.4
1411E30.3Very low30.3Very low165 Ų165134.4 Ų134.477%0.77172%0.723SS**  trans82.1152.9153.5-85.1169-161.400123.9
1412T29.9Very low30.3Very low141 Ų141131.1 Ų131.187%0.86572%0.718SS**  trans69.5126.8-178.470.50000116.9
1413S30.8Very low30.5Very low105 Ų105130.1 Ų130.173%0.73471%0.709SS**  cis-135.3116.3-6.356.90000111.7
1414I29.2Very low30.8Very low153 Ų153131.2 Ų131.279%0.78571%0.707SS**  trans-79.7131164.4-63.7166.5000107.6
1415V31.3Very low31.1Very low128 Ų128130.8 Ų130.878%0.77670%0.701SS**  trans-119.4123.2162.1179.90000106.6P1417V1415-P1417 VanDerWaalsContact O-CD 3.27Å; V1415-P1417 WeakPolarHBondContact O-CD 3.35Å
1416N26.9Very low31.3Very low132 Ų132130.6 Ų130.671%0.70669%0.69SS**PPolyproline II helixtrans-71.4125.4-167.1-62-36.2000112.3
1417P28.1Very low31.3Very low113 Ų113128.9 Ų128.973%0.73468%0.683SS**PPolyproline II helixtrans-75.1135.6137.533-29.3000108.3V1415 K1419V1415-P1417 VanDerWaalsContact O-CD 3.27Å; V1415-P1417 WeakPolarHBondContact O-CD 3.35Å; P1417-K1419 PolarHBondContact O-N 3.19Å
1418D29.2Very low31.6Very low130 Ų130128.5 Ų128.570%0.69568%0.681SS**PPolyproline II helixtrans-63.4125.8179.3-90.2-48.5000111.5S1420D1418-S1420 PolarHBondContact O-N 3.44Å; D1418-S1420 VanDerWaalsContact O-N 3.09Å
1419K31.2Very low31.9Very low158 Ų158128.3 Ų128.369%0.68768%0.684SS**Hα-helixtrans-65.4-14.2-173-101.5-174.6170.2-169.20114.9P1417P1417-K1419 PolarHBondContact O-N 3.19Å
1420S32.3Very low31.8Very low79 Ų79129 Ų12955%0.55268%0.68SS**Hα-helixtrans-68.3-35.3-174.652.60000114D1418 Q1424D1418-S1420 PolarHBondContact O-N 3.44Å; D1418-S1420 VanDerWaalsContact O-N 3.09Å; S1420-Q1424 WeakPolarHBondContact O-CG 3.43Å
1421T32.7Very low31.8Very low84 Ų84127.2 Ų127.252%0.51568%0.675SS.*Hα-helixtrans-83.4-33.7-171.1-13.80000113.2Q1425T1421-Q1425 PolarHBondContact O-N 3.47Å
1422L33.8Very low31.8Very low117 Ų117127.3 Ų127.361%0.61368%0.681SS**Hα-helixtrans-75.8-37.3-177.5-15377.9000112Q1424 Q1425 I1426L1422-Q1424 VanDerWaalsContact C-N 3.28Å; L1422-Q1424 PolarHBondContact O-N 2.84Å; L1422-Q1425 PolarHBondContact O-N 3.18Å; L1422-I1426 HydrophobicContact CD2-CD1 4.37Å; L1422-I1426 HydrophobicContact CG-CD1 4.09Å; L1422-I1426 WeakPolarHBondContact O-CG1 3.44Å; L1422-I1426 PolarHBondContact O-N 3.11Å
1423E33.2Very low31.8Very low114 Ų114129.5 Ų129.553%0.53368%0.681SS.*Hα-helixtrans-74.9-14.4177.5-69179.3-175.400112.8N1427E1423-N1427 PolarHBondContact O-ND2 3.01Å
1424Q34.9Very low31.8Very low127 Ų127133.3 Ų133.359%0.59369%0.687SS**Hα-helixtrans-79.8-50.8167.1-73.6-176.5-48.800111.7S1420 L1422 I1426 N1427 E1428S1420-Q1424 WeakPolarHBondContact O-CG 3.43Å; L1422-Q1424 VanDerWaalsContact C-N 3.28Å; L1422-Q1424 PolarHBondContact O-N 2.84Å; Q1424-I1426 PolarHBondContact O-N 3.15Å; Q1424-N1427 PolarHBondContact O-N 3.27Å; Q1424-E1428 PolarHBondContact O-N 3.23Å
1425Q33.9Very low31.8Very low135 Ų135132.9 Ų132.963%0.63169%0.686SS**Hα-helixtrans-66.9-20.1-177.4-69.8-172.3-14.200114.6T1421 L1422T1421-Q1425 PolarHBondContact O-N 3.47Å; L1422-Q1425 PolarHBondContact O-N 3.18Å
1426I37Very low31.9Very low104 Ų104136 Ų13653%0.53369%0.689SS.*THydrogen-bonded Turntrans-82.2-26.5173.8-69.1170.8000112.1L1422 Q1424L1422-I1426 HydrophobicContact CD2-CD1 4.37Å; L1422-I1426 HydrophobicContact CG-CD1 4.09Å; L1422-I1426 WeakPolarHBondContact O-CG1 3.44Å; L1422-I1426 PolarHBondContact O-N 3.11Å; Q1424-I1426 PolarHBondContact O-N 3.15Å
1427N31.9Very low32Very low103 Ų103136.3 Ų136.355%0.55169%0.686SS**THydrogen-bonded Turntrans-90.6-31.6-176.2-79.9-49.9000113.9E1423 Q1424 V1429 Y1430E1423-N1427 PolarHBondContact O-ND2 3.01Å; Q1424-N1427 PolarHBondContact O-N 3.27Å; N1427-V1429 PolarHBondContact O-N 3.37Å; N1427-V1429 VanDerWaalsContact O-N 3.12Å; N1427-Y1430 PolarHBondContact O-N 3.37Å
1428E33.5Very low32.1Very low153 Ų153142.7 Ų142.772%0.71570%0.696SS**THydrogen-bonded Turntrans-66.7-11.9-179.8-70.5-175142.400114.6Q1424Q1424-E1428 PolarHBondContact O-N 3.23Å
1429V34.3Very low32.1Very low124 Ų124143.7 Ų143.775%0.75269%0.694SS**THydrogen-bonded Turntrans-95.1-13179.8-175.40000112.8N1427N1427-V1429 PolarHBondContact O-N 3.37Å; N1427-V1429 VanDerWaalsContact O-N 3.12Å
1430Y32.5Very low32Very low201 Ų201141.1 Ų141.179%0.78870%0.696SS**THydrogen-bonded Turntrans-102.7-6.9-176.5-96.5-81.5000114.8N1427 N1432N1427-Y1430 PolarHBondContact O-N 3.37Å; Y1430-N1432 PolarHBondContact O-N 3.16Å
1431T30.3Very low31.9Very low106 Ų106143.1 Ų143.165%0.6570%0.704SS**THydrogen-bonded Turntrans-91.475.4-174.752.90000113.1
1432N29.8Very low31.8Very low167 Ų167147.6 Ų147.689%0.89372%0.72SS**THydrogen-bonded Turntrans-155.512.6161.1-107.9-30.4000116.2Y1430Y1430-N1432 PolarHBondContact O-N 3.16Å
1433E30.2Very low31.6Very low186 Ų186148.8 Ų148.887%0.86973%0.726SS**  trans-104.5107.7166.1-70.8-164.9150.400110.6
1434H30.7Very low31.5Very low185 Ų185151.9 Ų151.986%0.85674%0.74SS**  trans-151.2139.3167.6-116.6-80.4000111.5
1435L30.2Very low31.3Very low145 Ų145151.5 Ų151.576%0.75974%0.743SS**  trans100.894.8175.3-60.9164.1000115.7
1436F32.4Very low31.2Very low194 Ų194153.8 Ų153.885%0.85175%0.753SS**  -154.5151.370.6-117.2-86.6000113.6
1437E29.5Very low30.9Very low137 Ų137157 Ų15764%0.6477%0.766SS**  trans-77.4153.3172.6-66.9-178.493.800112.1K1439E1437-K1439 IonicContact OE1-NZ 2.81Å; E1437-K1439 PolarHBondContact OE1-NZ 3.14Å
1438R29.5Very low31Very low247 Ų247161.1 Ų161.193%0.93278%0.782SS**  -155.6121.1120.3-115.4176.1-176.9170.21.5114.7
1439K29.1Very low31Very low152 Ų152162.8 Ų162.866%0.66179%0.789SS**  trans-70.1163.6148.2-53.7168.3-176.4110.80107.1E1437E1437-K1439 IonicContact OE1-NZ 2.81Å; E1437-K1439 PolarHBondContact OE1-NZ 3.14Å
1440S30Very low31Very low104 Ų104162 Ų16273%0.72779%0.787SS**  cis-173.2152.915.78.80000111.2
1441V29.7Very low31.1Very low120 Ų120159.2 Ų159.273%0.72779%0.79SS**  trans84.3138.1132.41670000122.3
1442E30.7Very low31Very low179 Ų179157.5 Ų157.584%0.83679%0.794SS**  trans78.9147.6156.5-89.3151.9-166.800123.5
1443N29.2Very low31.1Very low141 Ų141155.9 Ų155.975%0.75479%0.789SS**  trans-104.3156.6-175.6-40.4-74000109.8
1444H31.8Very low31Very low179 Ų179152.9 Ų152.983%0.82979%0.789SS**  -167.8153.5111.5-107.8-62.9000112.3
1445D30.2Very low31Very low120 Ų120150.2 Ų150.264%0.64279%0.786SS**  trans-61.5140.9167.8-47.7-99.3000111.5
1446H33.1Very low30.9Very low182 Ų182149.1 Ų149.184%0.84379%0.79SS**  -178.9169.9100.1-89.7-54.4000112.3
1447Q31Very low30.8Very low172 Ų172145.7 Ų145.780%0.80479%0.786SS**  trans-71.7144.7-176-57.7156.2-2500112.1
1448Q33.1Very low30.8Very low189 Ų189146.1 Ų146.188%0.88380%0.797SS**  -173.6172.9114.2-99.6169.623.700113.3
1449H32.4Very low30.9Very low188 Ų188142.9 Ų142.987%0.8779%0.793SS**  trans-86.2166-162.6-102.1-105000115.1
1450P36.1Very low31.2Very low108 Ų108145.2 Ų145.270%0.70180%0.803SS**  trans-94.3163.5-163.937.6-36.8000115
1451V32.9Very low31.5Very low143 Ų143146.5 Ų146.587%0.86781%0.807SS**  trans-132.5126.9156179.40000107.7
1452G28.7Very low31.7Very low70 Ų70145.3 Ų145.372%0.72280%0.801SS**  trans-93.3148.5179.800000113.1
1453V31.7Very low32.4Very low132 Ų132140.1 Ų140.180%0.879%0.785SS**  trans-134121.1162.5178.60000108.1
1454S28.1Very low33.2Very low124 Ų124140 Ų14087%0.86778%0.783SS**  trans-89.1124.3176-50.80000110.4
1455T31.8Very low33.6Very low129 Ų129140 Ų14079%0.79178%0.777SS**  trans-128.9124.3163.141.30000109.8
1456S27.1Very low34.3Very low121 Ų121136.4 Ų136.485%0.84676%0.761SS**  trans-88.1121.2-17653.90000111.6
1457T30.8Very low35.2Very low123 Ų123131.2 Ų131.276%0.75575%0.746SS**  trans-122.8127.9162.645.10000109.9E1459T1457-E1459 PolarHBondContact O-N 3.42Å; T1457-E1459 VanDerWaalsContact O-N 3.1Å
1458T29.9Very low36.3Very low145 Ų145127.2 Ų127.289%0.8973%0.729SS**  trans-77.592.4-173.650.10000111.9
1459E31Very low37Very low180 Ų180120.7 Ų120.784%0.84170%0.703SS**PPolyproline II helixtrans-91.2122.8168-63.5-159.4136.600110.6T1457 T1461T1457-E1459 PolarHBondContact O-N 3.42Å; T1457-E1459 VanDerWaalsContact O-N 3.1Å; E1459-T1461 PolarHBondContact O-N 3.18Å
1460K35.9Very low38Very low201 Ų201116.7 Ų116.787%0.87469%0.688SS**PPolyproline II helixtrans-75119.6176.9-66.9177.7-179.91770108.5
1461T35.7Very low39Very low130 Ų130116.7 Ų116.780%0.79868%0.682SS**PPolyproline II helixtrans-53.8122.9171.644.30000110E1459 S1463E1459-T1461 PolarHBondContact O-N 3.18Å; T1461-S1463 PolarHBondContact O-N 3.31Å
1462P35.2Very low39.6Very low95 Ų95113.1 Ų113.162%0.61766%0.658SS**PPolyproline II helixtrans-63.9126.8175.426.7-32.8000108.3
1463S45Very low40.9Very low71 Ų71116.9 Ų116.950%0.49766%0.656SS.*PPolyproline II helixtrans-61.8154.9176.463.40000110.2T1461 Y1465 S1466 S1467T1461-S1463 PolarHBondContact O-N 3.31Å; S1463-Y1465 PolarHBondContact O-N 3.39Å; S1463-Y1465 WeakPolarHBondContact OG-CB 3.49Å; S1463-S1466 WeakPolarHBondContact O-CA 3.47Å; S1463-S1466 VanDerWaalsContact O-CB 3.29Å; S1463-S1466 WeakPolarHBondContact O-CB 3.36Å; S1463-S1466 PolarHBondContact O-N 2.76Å; S1463-S1466 PolarHBondContact OG-N 3.11Å; S1463-S1467 PolarHBondContact O-N 2.79Å
1464I45.1Very low42Very low138 Ų138121.1 Ų121.171%0.70866%0.658SS**Hα-helixtrans-52.5-33.7173.3-62.7169.2000110.4S1466 S1467 I1468I1464-S1466 PolarHBondContact O-N 2.87Å; I1464-S1467 PolarHBondContact O-N 3.42Å; I1464-I1468 HydrophobicContact CG2-CD1 3.82Å; I1464-I1468 HydrophobicContact CG2-CG1 4.42Å; I1464-I1468 WeakPolarHBondContact O-CG1 3.5Å; I1464-I1468 PolarHBondContact O-N 2.88Å
1465Y41.3Very low43.1Very low179 Ų179120.6 Ų120.670%0.70264%0.644SS**Hα-helixtrans-58.6-40.5171.9-132.9-85.4000113.6S1463 I1468 C1469S1463-Y1465 PolarHBondContact O-N 3.39Å; S1463-Y1465 WeakPolarHBondContact OG-CB 3.49Å; Y1465-I1468 PolarHBondContact O-N 3.35Å; Y1465-C1469 VanDerWaalsContact O-CB 3.3Å; Y1465-C1469 WeakPolarHBondContact O-CB 3.48Å; Y1465-C1469 PolarHBondContact O-N 3.23Å; Y1465-C1469 PolarHBondContact O-SG 3.33Å
1466S45.4Very low43.7Very low45 Ų45118.8 Ų118.832%0.31563%0.629SS.*Hα-helixtrans-64.8-43.7175.7-176.90000111.7S1463 I1464 C1469 N1470S1463-S1466 WeakPolarHBondContact O-CA 3.47Å; S1463-S1466 VanDerWaalsContact O-CB 3.29Å; S1463-S1466 WeakPolarHBondContact O-CB 3.36Å; S1463-S1466 PolarHBondContact O-N 2.76Å; S1463-S1466 PolarHBondContact OG-N 3.11Å; I1464-S1466 PolarHBondContact O-N 2.87Å; S1466-C1469 PolarHBondContact O-N 3.34Å; S1466-N1470 WeakPolarHBondContact O-CB 3.34Å; S1466-N1470 VanDerWaalsContact O-CG 3.31Å; S1466-N1470 PolarHBondContact O-N 3.37Å; S1466-N1470 PolarHBondContact O-ND2 2.9Å; S1466-N1470 VanDerWaalsContact O-ND2 3.12Å
1467S50.7Low44.2Very low73 Ų73118.8 Ų118.851%0.5163%0.626SS.*Hα-helixtrans-63.8-41.3175.5-63.40000112.1S1463 I1464 L1471S1463-S1467 PolarHBondContact O-N 2.79Å; I1464-S1467 PolarHBondContact O-N 3.42Å; S1467-L1471 WeakPolarHBondContact O-CB 3.42Å; S1467-L1471 PolarHBondContact O-N 3.14Å
1468I54.5Low44.8Very low87 Ų87116.3 Ų116.345%0.44661%0.614SS.*Hα-helixtrans-65.8-45.4175.7-69.2170.1000111.2I1464 Y1465 N1470 L1471 L1472I1464-I1468 HydrophobicContact CG2-CD1 3.82Å; I1464-I1468 HydrophobicContact CG2-CG1 4.42Å; I1464-I1468 WeakPolarHBondContact O-CG1 3.5Å; I1464-I1468 PolarHBondContact O-N 2.88Å; Y1465-I1468 PolarHBondContact O-N 3.35Å; I1468-N1470 PolarHBondContact O-N 3.06Å; I1468-L1471 PolarHBondContact O-N 3.32Å; I1468-L1472 HydrophobicContact CG2-CD1 3.85Å; I1468-L1472 HydrophobicContact CG2-CG 4.49Å; I1468-L1472 WeakPolarHBondContact O-CB 3.14Å; I1468-L1472 WeakPolarHBondContact O-CG 3.38Å; I1468-L1472 PolarHBondContact O-N 3.42Å
1469C46.8Very low45.4Very low52 Ų52116 Ų11635%0.35161%0.612SS.*Hα-helixtrans-64-39.1176.9-74.70000112.6Y1465 S1466 L1472 H1473Y1465-C1469 VanDerWaalsContact O-CB 3.3Å; Y1465-C1469 WeakPolarHBondContact O-CB 3.48Å; Y1465-C1469 PolarHBondContact O-N 3.23Å; Y1465-C1469 PolarHBondContact O-SG 3.33Å; S1466-C1469 PolarHBondContact O-N 3.34Å; C1469-L1472 PolarHBondContact O-N 2.98Å; C1469-H1473 WeakPolarHBondContact O-CB 3.35Å; C1469-H1473 PolarHBondContact O-N 3.41Å
1470N55.3Low46.1Very low104 Ų104114.2 Ų114.256%0.55661%0.608SS**Hα-helixtrans-68.6-36.4174.9-76.2-37000112.1S1466 I1468 R1474S1466-N1470 WeakPolarHBondContact O-CB 3.34Å; S1466-N1470 VanDerWaalsContact O-CG 3.31Å; S1466-N1470 PolarHBondContact O-N 3.37Å; S1466-N1470 PolarHBondContact O-ND2 2.9Å; S1466-N1470 VanDerWaalsContact O-ND2 3.12Å; I1468-N1470 PolarHBondContact O-N 3.06Å; N1470-R1474 VanDerWaalsContact O-CB 3.28Å; N1470-R1474 WeakPolarHBondContact O-CB 3.45Å; N1470-R1474 PolarHBondContact O-N 2.9Å; N1470-R1474 VanDerWaalsContact O-N 3.08Å
1471L55.4Low46.5Very low109 Ų109106.5 Ų106.557%0.57158%0.58SS**Hα-helixtrans-64.3-45.4173.2-167.670.7000111S1467 I1468 R1474 I1475S1467-L1471 WeakPolarHBondContact O-CB 3.42Å; S1467-L1471 PolarHBondContact O-N 3.14Å; I1468-L1471 PolarHBondContact O-N 3.32Å; L1471-R1474 PolarHBondContact O-N 3.05Å; L1471-I1475 HydrophobicContact CG-CD1 4.14Å; L1471-I1475 WeakPolarHBondContact O-CD1 3.43Å; L1471-I1475 VanDerWaalsContact O-CG1 3.31Å; L1471-I1475 WeakPolarHBondContact O-CG1 3.17Å; L1471-I1475 PolarHBondContact O-N 3.46Å; L1471-I1475 VanDerWaalsContact O-N 3.17Å
1472L47.1Very low47.1Very low68 Ų68107.4 Ų107.436%0.35658%0.575SS.*Hα-helixtrans-63.9-45.3176.6-72.8166.5000112.5I1468 C1469 R1474 I1475 L1476 F1485I1468-L1472 HydrophobicContact CG2-CD1 3.85Å; I1468-L1472 HydrophobicContact CG2-CG 4.49Å; I1468-L1472 WeakPolarHBondContact O-CB 3.14Å; I1468-L1472 WeakPolarHBondContact O-CG 3.38Å; I1468-L1472 PolarHBondContact O-N 3.42Å; C1469-L1472 PolarHBondContact O-N 2.98Å; L1472-R1474 PolarHBondContact O-N 3.48Å; L1472-I1475 PolarHBondContact O-N 3.39Å; L1472-I1475 VanDerWaalsContact O-N 3.11Å; L1472-L1476 PolarHBondContact O-N 3.19Å; L1472-F1485 HydrophobicContact CD1-CZ 4.23Å
1473H55.7Low47.6Very low148 Ų148108.8 Ų108.869%0.68558%0.577SS**Hα-helixtrans-61.5-28.7174.9-101.1-67.1000113.2C1469C1469-H1473 WeakPolarHBondContact O-CB 3.35Å; C1469-H1473 PolarHBondContact O-N 3.41Å
1474R53.2Low47.9Very low221 Ų221113.9 Ų113.983%0.83459%0.586SS**Hα-helixtrans-80-20.4177.2-165172.9-173.6175.60.4113.2N1470 L1471 L1472N1470-R1474 VanDerWaalsContact O-CB 3.28Å; N1470-R1474 WeakPolarHBondContact O-CB 3.45Å; N1470-R1474 PolarHBondContact O-N 2.9Å; N1470-R1474 VanDerWaalsContact O-N 3.08Å; L1471-R1474 PolarHBondContact O-N 3.05Å; L1472-R1474 PolarHBondContact O-N 3.48Å
1475I52.1Low48.2Very low114 Ų114111.7 Ų111.759%0.58557%0.572SS**Hα-helixtrans-91.6-31178-66.7164.7000111.7L1471 L1472 P1477L1471-I1475 HydrophobicContact CG-CD1 4.14Å; L1471-I1475 WeakPolarHBondContact O-CD1 3.43Å; L1471-I1475 VanDerWaalsContact O-CG1 3.31Å; L1471-I1475 WeakPolarHBondContact O-CG1 3.17Å; L1471-I1475 PolarHBondContact O-N 3.46Å; L1471-I1475 VanDerWaalsContact O-N 3.17Å; L1472-I1475 PolarHBondContact O-N 3.39Å; L1472-I1475 VanDerWaalsContact O-N 3.11Å; I1475-P1477 WeakPolarHBondContact O-CD 3.29Å
1476L44.9Very low49.5Very low91 Ų91108.4 Ų108.448%0.47657%0.565SS.*  trans-12375.3-174.7-77.9157.7000113.3L1472 S1478L1472-L1476 PolarHBondContact O-N 3.19Å; L1476-S1478 VanDerWaalsContact C-N 3.29Å; L1476-S1478 PolarHBondContact O-N 3.41Å
1477P37.2Very low50.6Low120 Ų120111.9 Ų111.978%0.77958%0.58SS**  trans-8164.5178.135.2-37000112.6I1475I1475-P1477 WeakPolarHBondContact O-CD 3.29Å
1478S43.1Very low51.6Low72 Ų72113.5 Ų113.550%0.50358%0.582SS.*  trans-145.7137.1168.274.20000113.4L1476 N1480 S1481L1476-S1478 VanDerWaalsContact C-N 3.29Å; L1476-S1478 PolarHBondContact O-N 3.41Å; S1478-N1480 PolarHBondContact O-N 3.44Å; S1478-S1481 WeakPolarHBondContact O-CB 3.33Å; S1478-S1481 PolarHBondContact O-OG 3.33Å
1479T43.2Very low52.6Low137 Ų137113.1 Ų113.184%0.8458%0.58SS**THydrogen-bonded Turntrans-82-9.2-167.340.90000115.3S1481T1479-S1481 VanDerWaalsContact C-N 3.34Å
1480N46.2Very low54Low144 Ų144113.6 Ų113.677%0.7758%0.584SS**THydrogen-bonded Turntrans-90.44.8174.1-74.3-10.8000113.4S1478 Q1482S1478-N1480 PolarHBondContact O-N 3.44Å; N1480-Q1482 PolarHBondContact O-N 3.48Å
1481S43.9Very low55.3Low39 Ų39110.1 Ų110.127%0.27357%0.573SS.*Hα-helixtrans-71.7-21.7-171.252.80000115.1S1478 T1479 N1483 Y1484 F1485S1478-S1481 WeakPolarHBondContact O-CB 3.33Å; S1478-S1481 PolarHBondContact O-OG 3.33Å; T1479-S1481 VanDerWaalsContact C-N 3.34Å; S1481-N1483 PolarHBondContact O-N 2.82Å; S1481-Y1484 PolarHBondContact O-N 3.29Å; S1481-F1485 WeakPolarHBondContact O-CB 3.42Å; S1481-F1485 PolarHBondContact O-N 3.29Å
1482Q47Very low56.4Low148 Ų148111.8 Ų111.869%0.69258%0.576SS**Hα-helixtrans-59.5-43.8-172.6-72.8-174.6-19.600113.9N1480 F1485 I1486N1480-Q1482 PolarHBondContact O-N 3.48Å; Q1482-F1485 PolarHBondContact O-N 3.42Å; Q1482-I1486 WeakPolarHBondContact O-CG1 3.29Å; Q1482-I1486 PolarHBondContact O-N 3.33Å
1483N46.3Very low58Low124 Ų124112.9 Ų112.966%0.66358%0.581SS**Hα-helixtrans-66.7-39.5178.1-71.9-4.7000111.8S1481 F1485 I1486 L1487S1481-N1483 PolarHBondContact O-N 2.82Å; N1483-F1485 VanDerWaalsContact C-N 3.33Å; N1483-I1486 PolarHBondContact O-N 3.11Å; N1483-L1487 WeakPolarHBondContact O-CB 3.21Å; N1483-L1487 PolarHBondContact O-N 3.46Å
1484Y50.9Low59.2Low178 Ų178112.5 Ų112.570%0.69858%0.578SS**Hα-helixtrans-65.1-36.4173.2-96.7-84.3000112.2S1481 L1487 L1488S1481-Y1484 PolarHBondContact O-N 3.29Å; Y1484-L1487 PolarHBondContact O-N 2.96Å; Y1484-L1488 WeakPolarHBondContact O-CB 3.42Å; Y1484-L1488 PolarHBondContact O-N 3.4Å
1485F51.5Low60.5Low92 Ų92107 Ų10740%0.40456%0.564SS.*Hα-helixtrans-70.5-38.4178.9-162.1-109.8000111.9L1472 S1481 Q1482 N1483 L1488 I1489L1472-F1485 HydrophobicContact CD1-CZ 4.23Å; S1481-F1485 WeakPolarHBondContact O-CB 3.42Å; S1481-F1485 PolarHBondContact O-N 3.29Å; Q1482-F1485 PolarHBondContact O-N 3.42Å; N1483-F1485 VanDerWaalsContact C-N 3.33Å; F1485-L1488 PolarHBondContact O-N 3.11Å; F1485-I1489 HydrophobicContact CD1-CD1 3.66Å; F1485-I1489 HydrophobicContact CE1-CD1 3.41Å; F1485-I1489 VanDerWaalsContact CE1-CD1 3.41Å; F1485-I1489 HydrophobicContact CE1-CG1 4.45Å; F1485-I1489 HydrophobicContact CG-CD1 4.44Å; F1485-I1489 HydrophobicContact CZ-CD1 4Å; F1485-I1489 WeakPolarHBondContact O-CB 3.3Å; F1485-I1489 WeakPolarHBondContact O-CG1 3.33Å; F1485-I1489 PolarHBondContact O-N 3.41Å
1486I69Low61.9Low110 Ų110103.7 Ų103.756%0.56455%0.554SS**Hα-helixtrans-63.8-44170.7-67.6165.6000110.4Q1482 N1483 I1489 S1490Q1482-I1486 WeakPolarHBondContact O-CG1 3.29Å; Q1482-I1486 PolarHBondContact O-N 3.33Å; N1483-I1486 PolarHBondContact O-N 3.11Å; I1486-I1489 PolarHBondContact O-N 3.23Å; I1486-S1490 WeakPolarHBondContact O-CB 3.46Å; I1486-S1490 PolarHBondContact O-N 3.04Å; I1486-S1490 PolarHBondContact O-OG 3.19Å; I1486-S1490 VanDerWaalsContact O-OG 3.11Å
1487L68.5Low63.5Low118 Ų118107.9 Ų107.962%0.61857%0.565SS**Hα-helixtrans-60.9-45.2174.6-103.2161.1000112.2N1483 Y1484 S1490 G1491N1483-L1487 WeakPolarHBondContact O-CB 3.21Å; N1483-L1487 PolarHBondContact O-N 3.46Å; Y1484-L1487 PolarHBondContact O-N 2.96Å; L1487-S1490 WeakPolarHBondContact CA-OG 3.33Å; L1487-S1490 PolarHBondContact O-N 2.94Å; L1487-S1490 PolarHBondContact O-OG 3.37Å; L1487-G1491 PolarHBondContact O-N 3.08Å
1488L71.1Confident65.5Low107 Ų107105.7 Ų105.756%0.5655%0.546SS*.Hα-helixtrans-63.3-43.8176.8-110.5163.9000112.4Y1484 F1485 G1491 F1492Y1484-L1488 WeakPolarHBondContact O-CB 3.42Å; Y1484-L1488 PolarHBondContact O-N 3.4Å; F1485-L1488 PolarHBondContact O-N 3.11Å; L1488-G1491 PolarHBondContact O-N 2.92Å; L1488-F1492 HydrophobicContact CD2-CD2 4.31Å; L1488-F1492 WeakPolarHBondContact O-CB 3.31Å; L1488-F1492 PolarHBondContact O-N 3.43Å
1489I75.4Confident67.1Low79 Ų79105.2 Ų105.241%0.40554%0.543SS..Hα-helixtrans-66.4-44.2176.6-74.6174.4000110.8F1485 I1486 G1491 F1492 I1493F1485-I1489 HydrophobicContact CD1-CD1 3.66Å; F1485-I1489 HydrophobicContact CE1-CD1 3.41Å; F1485-I1489 VanDerWaalsContact CE1-CD1 3.41Å; F1485-I1489 HydrophobicContact CE1-CG1 4.45Å; F1485-I1489 HydrophobicContact CG-CD1 4.44Å; F1485-I1489 HydrophobicContact CZ-CD1 4Å; F1485-I1489 WeakPolarHBondContact O-CB 3.3Å; F1485-I1489 WeakPolarHBondContact O-CG1 3.33Å; F1485-I1489 PolarHBondContact O-N 3.41Å; I1486-I1489 PolarHBondContact O-N 3.23Å; I1489-G1491 VanDerWaalsContact C-N 3.33Å; I1489-G1491 PolarHBondContact O-N 3.16Å; I1489-F1492 PolarHBondContact O-N 3.29Å; I1489-I1493 HydrophobicContact CG2-CD1 3.64Å; I1489-I1493 HydrophobicContact CG2-CG1 4.33Å; I1489-I1493 WeakPolarHBondContact O-CB 3.24Å; I1489-I1493 VanDerWaalsContact O-CG1 3.27Å; I1489-I1493 WeakPolarHBondContact O-CG1 3.49Å; I1489-I1493 PolarHBondContact O-N 3.22Å
1490S76.3Confident68.6Low62 Ų62102.6 Ų102.643%0.43453%0.529SS..Hα-helixtrans-64.6-37.5177.168.20000112.1I1486 L1487 I1493 F1494I1486-S1490 WeakPolarHBondContact O-CB 3.46Å; I1486-S1490 PolarHBondContact O-N 3.04Å; I1486-S1490 PolarHBondContact O-OG 3.19Å; I1486-S1490 VanDerWaalsContact O-OG 3.11Å; L1487-S1490 WeakPolarHBondContact CA-OG 3.33Å; L1487-S1490 PolarHBondContact O-N 2.94Å; L1487-S1490 PolarHBondContact O-OG 3.37Å; S1490-I1493 PolarHBondContact O-N 3.35Å; S1490-F1494 WeakPolarHBondContact O-CB 3.03Å; S1490-F1494 PolarHBondContact O-N 2.85Å
1491G83.7Confident70.1Confident31 Ų31102.1 Ų102.132%0.3252%0.518SS..Hα-helixtrans-64.8-42.2171.300000113.1L1487 L1488 I1489 F1494 L1495L1487-G1491 PolarHBondContact O-N 3.08Å; L1488-G1491 PolarHBondContact O-N 2.92Å; I1489-G1491 VanDerWaalsContact C-N 3.33Å; I1489-G1491 PolarHBondContact O-N 3.16Å; G1491-F1494 PolarHBondContact O-N 3.08Å; G1491-L1495 WeakPolarHBondContact O-CB 3.43Å; G1491-L1495 WeakPolarHBondContact O-CG 3.49Å; G1491-L1495 PolarHBondContact O-N 3.06Å
1492F78.6Confident71.7Confident145 Ų145104.3 Ų104.364%0.63653%0.526SS*.Hα-helixtrans-66.6-39.2175-113.8-85.2000112.5L1488 I1489 L1495 A1496L1488-F1492 HydrophobicContact CD2-CD2 4.31Å; L1488-F1492 WeakPolarHBondContact O-CB 3.31Å; L1488-F1492 PolarHBondContact O-N 3.43Å; I1489-F1492 PolarHBondContact O-N 3.29Å; F1492-L1495 PolarHBondContact O-N 3.41Å; F1492-A1496 VanDerWaalsContact O-CB 3.25Å; F1492-A1496 WeakPolarHBondContact O-CB 3.46Å; F1492-A1496 PolarHBondContact O-N 3.49Å
1493I80.8Confident73Confident90 Ų90102.2 Ų102.246%0.46252%0.518SS..Hα-helixtrans-65.6-42.1174.2-70.7169.2000110I1489 S1490 A1496 Y1497I1489-I1493 HydrophobicContact CG2-CD1 3.64Å; I1489-I1493 HydrophobicContact CG2-CG1 4.33Å; I1489-I1493 WeakPolarHBondContact O-CB 3.24Å; I1489-I1493 VanDerWaalsContact O-CG1 3.27Å; I1489-I1493 WeakPolarHBondContact O-CG1 3.49Å; I1489-I1493 PolarHBondContact O-N 3.22Å; S1490-I1493 PolarHBondContact O-N 3.35Å; I1493-A1496 PolarHBondContact O-N 3.32Å; I1493-Y1497 HydrophobicContact CG2-CD2 3.79Å; I1493-Y1497 HydrophobicContact CG2-CE2 3.99Å; I1493-Y1497 WeakPolarHBondContact O-CD2 3.44Å; I1493-Y1497 PolarHBondContact O-N 2.85Å
1494F80.9Confident74.2Confident141 Ų14198 Ų9862%0.61850%0.504SS*.Hα-helixtrans-63.2-44.8175.2-176.3-97.9000111.9S1490 G1491 A1496 Y1497 L1498S1490-F1494 WeakPolarHBondContact O-CB 3.03Å; S1490-F1494 PolarHBondContact O-N 2.85Å; G1491-F1494 PolarHBondContact O-N 3.08Å; F1494-A1496 VanDerWaalsContact C-N 3.33Å; F1494-A1496 PolarHBondContact O-N 2.78Å; F1494-Y1497 PolarHBondContact O-N 3.41Å; F1494-L1498 HydrophobicContact CE1-CD2 4.31Å; F1494-L1498 VanDerWaalsContact O-CB 3.24Å; F1494-L1498 WeakPolarHBondContact O-CB 3.44Å; F1494-L1498 PolarHBondContact O-N 3.15Å
1495L80.9Confident74.9Confident104 Ų10497 Ų9755%0.54550%0.5SS..Hα-helixtrans-64.6-34.9174-75.7166.2000112.5G1491 F1492 S1499G1491-L1495 WeakPolarHBondContact O-CB 3.43Å; G1491-L1495 WeakPolarHBondContact O-CG 3.49Å; G1491-L1495 PolarHBondContact O-N 3.06Å; F1492-L1495 PolarHBondContact O-N 3.41Å; L1495-S1499 VanDerWaalsContact O-CB 3.25Å; L1495-S1499 WeakPolarHBondContact O-CB 3.27Å; L1495-S1499 PolarHBondContact O-N 3.08Å; L1495-S1499 PolarHBondContact O-OG 3.09Å
1496A79.7Confident75.3Confident46 Ų4697.4 Ų97.438%0.3851%0.505SS..Hα-helixtrans-67.3-44.817300000111.6F1492 I1493 F1494 S1499 C1500F1492-A1496 VanDerWaalsContact O-CB 3.25Å; F1492-A1496 WeakPolarHBondContact O-CB 3.46Å; F1492-A1496 PolarHBondContact O-N 3.49Å; I1493-A1496 PolarHBondContact O-N 3.32Å; F1494-A1496 VanDerWaalsContact C-N 3.33Å; F1494-A1496 PolarHBondContact O-N 2.78Å; A1496-S1499 WeakPolarHBondContact CA-OG 3.44Å; A1496-S1499 PolarHBondContact O-OG 2.97Å; A1496-S1499 VanDerWaalsContact O-OG 3.14Å; A1496-C1500 WeakPolarHBondContact O-CB 3.32Å; A1496-C1500 PolarHBondContact O-N 3.19Å; A1496-C1500 PolarHBondContact O-SG 3.19Å
1497Y79.3Confident74.8Confident179 Ų17996.5 Ų96.570%0.70250%0.501SS*.Hα-helixtrans-65.6-40.6174.4-92.9-78.6000112.5I1493 F1494 C1500 Y1501I1493-Y1497 HydrophobicContact CG2-CD2 3.79Å; I1493-Y1497 HydrophobicContact CG2-CE2 3.99Å; I1493-Y1497 WeakPolarHBondContact O-CD2 3.44Å; I1493-Y1497 PolarHBondContact O-N 2.85Å; F1494-Y1497 PolarHBondContact O-N 3.41Å; Y1497-C1500 PolarHBondContact O-N 2.86Å; Y1497-Y1501 VanDerWaalsContact O-CB 3.28Å; Y1497-Y1501 WeakPolarHBondContact O-CB 3.44Å; Y1497-Y1501 PolarHBondContact O-N 3.05Å
1498L78.9Confident73.9Confident74 Ų7493.3 Ų93.339%0.38749%0.491SS..Hα-helixtrans-66.7-44.8177.7-175.664.2000111.2F1494 Y1501 I1502F1494-L1498 HydrophobicContact CE1-CD2 4.31Å; F1494-L1498 VanDerWaalsContact O-CB 3.24Å; F1494-L1498 WeakPolarHBondContact O-CB 3.44Å; F1494-L1498 PolarHBondContact O-N 3.15Å; L1498-Y1501 PolarHBondContact O-N 3.04Å; L1498-I1502 HydrophobicContact CD1-CD1 4.38Å; L1498-I1502 HydrophobicContact CG-CD1 4.08Å; L1498-I1502 WeakPolarHBondContact O-CB 3.49Å; L1498-I1502 VanDerWaalsContact O-CG1 3.26Å; L1498-I1502 WeakPolarHBondContact O-CG1 3.42Å; L1498-I1502 PolarHBondContact O-N 2.57Å
1499S76.5Confident72.6Confident62 Ų6292.4 Ų92.443%0.43449%0.493SS..Hα-helixtrans-67-38.3175.1570000112.1L1495 A1496 I1502 L1503L1495-S1499 VanDerWaalsContact O-CB 3.25Å; L1495-S1499 WeakPolarHBondContact O-CB 3.27Å; L1495-S1499 PolarHBondContact O-N 3.08Å; L1495-S1499 PolarHBondContact O-OG 3.09Å; A1496-S1499 WeakPolarHBondContact CA-OG 3.44Å; A1496-S1499 PolarHBondContact O-OG 2.97Å; A1496-S1499 VanDerWaalsContact O-OG 3.14Å; S1499-I1502 PolarHBondContact O-N 3.37Å; S1499-L1503 WeakPolarHBondContact O-CB 3.43Å; S1499-L1503 PolarHBondContact O-N 3.08Å
1500C74.8Confident71Confident82 Ų8293.8 Ų93.855%0.55450%0.501SS*.Hα-helixtrans-66-34.6171.1-76.90000113.2A1496 Y1497 L1503 G1504A1496-C1500 WeakPolarHBondContact O-CB 3.32Å; A1496-C1500 PolarHBondContact O-N 3.19Å; A1496-C1500 PolarHBondContact O-SG 3.19Å; Y1497-C1500 PolarHBondContact O-N 2.86Å; C1500-L1503 PolarHBondContact O-N 3.1Å; C1500-G1504 PolarHBondContact O-N 3.17Å
1501Y77.7Confident69.3Low133 Ų13396.9 Ų96.952%0.52251%0.513SS..Hα-helixtrans-68.1-43.1173.8176.8-105.4000111.4Y1497 L1498 G1504 R1505Y1497-Y1501 VanDerWaalsContact O-CB 3.28Å; Y1497-Y1501 WeakPolarHBondContact O-CB 3.44Å; Y1497-Y1501 PolarHBondContact O-N 3.05Å; L1498-Y1501 PolarHBondContact O-N 3.04Å; Y1501-G1504 PolarHBondContact O-N 3.19Å; Y1501-R1505 HydrophobicContact CE1-CG 4.3Å; Y1501-R1505 HydrophobicContact CE2-CG 4.33Å; Y1501-R1505 WeakPolarHBondContact O-CB 3.27Å; Y1501-R1505 WeakPolarHBondContact O-CG 3.47Å; Y1501-R1505 PolarHBondContact O-N 2.95Å; Y1501-R1505 PolarHBondContact OH-NE 2.81Å; Y1501-R1505 VanDerWaalsContact OH-NE 3.12Å; Y1501-R1505 PolarHBondContact OH-NH2 3.19Å
1502I78.3Confident67.2Low86 Ų86100.7 Ų100.744%0.44152%0.519SS..Hα-helixtrans-63.4-43.8173.1-69164.9000110.5L1498 S1499 R1505 L1506L1498-I1502 HydrophobicContact CD1-CD1 4.38Å; L1498-I1502 HydrophobicContact CG-CD1 4.08Å; L1498-I1502 WeakPolarHBondContact O-CB 3.49Å; L1498-I1502 VanDerWaalsContact O-CG1 3.26Å; L1498-I1502 WeakPolarHBondContact O-CG1 3.42Å; L1498-I1502 PolarHBondContact O-N 2.57Å; S1499-I1502 PolarHBondContact O-N 3.37Å; I1502-R1505 PolarHBondContact O-N 3.22Å; I1502-L1506 HydrophobicContact CG2-CD1 3.88Å; I1502-L1506 WeakPolarHBondContact O-CB 3.3Å; I1502-L1506 VanDerWaalsContact O-CG 3.31Å; I1502-L1506 WeakPolarHBondContact O-CG 3.37Å; I1502-L1506 PolarHBondContact O-N 3.38Å
1503L73.6Confident65Low103 Ų10398.3 Ų98.354%0.53952%0.52SS..Hα-helixtrans-63.9-40.2174.8-126.373.5000111.8S1499 C1500 L1506 L1507S1499-L1503 WeakPolarHBondContact O-CB 3.43Å; S1499-L1503 PolarHBondContact O-N 3.08Å; C1500-L1503 PolarHBondContact O-N 3.1Å; L1503-L1506 PolarHBondContact O-N 3.2Å; L1503-L1507 VanDerWaalsContact O-CB 3.25Å; L1503-L1507 WeakPolarHBondContact O-CB 3.29Å; L1503-L1507 WeakPolarHBondContact O-CD1 3.43Å; L1503-L1507 WeakPolarHBondContact O-CG 3.38Å; L1503-L1507 PolarHBondContact O-N 2.87Å
1504G72.3Confident62.8Low36 Ų36104 Ų10437%0.37154%0.535SS..Hα-helixtrans-63.2-46.8176.800000112C1500 Y1501 L1507 A1508C1500-G1504 PolarHBondContact O-N 3.17Å; Y1501-G1504 PolarHBondContact O-N 3.19Å; G1504-L1507 PolarHBondContact O-N 3.26Å; G1504-A1508 WeakPolarHBondContact O-CB 3.36Å; G1504-A1508 PolarHBondContact O-N 3.41Å
1505R65.8Low60.5Low158 Ų158108.8 Ų108.860%0.59655%0.549SS*.Hα-helixtrans-60.3-44.1171.7-74.6-76.2-170.6168-0.4111.6Y1501 I1502 A1508 C1509Y1501-R1505 HydrophobicContact CE1-CG 4.3Å; Y1501-R1505 HydrophobicContact CE2-CG 4.33Å; Y1501-R1505 WeakPolarHBondContact O-CB 3.27Å; Y1501-R1505 WeakPolarHBondContact O-CG 3.47Å; Y1501-R1505 PolarHBondContact O-N 2.95Å; Y1501-R1505 PolarHBondContact OH-NE 2.81Å; Y1501-R1505 VanDerWaalsContact OH-NE 3.12Å; Y1501-R1505 PolarHBondContact OH-NH2 3.19Å; I1502-R1505 PolarHBondContact O-N 3.22Å; R1505-A1508 PolarHBondContact O-N 3.44Å; R1505-C1509 PolarHBondContact O-N 2.96Å; R1505-C1509 PolarHBondContact O-SG 3.05Å
1506L59.7Low58.2Low100 Ų100109.3 Ų109.352%0.52456%0.559SS.*Hα-helixtrans-65-39.7176.9-79.1167.1000113I1502 L1503 C1509 N1510I1502-L1506 HydrophobicContact CG2-CD1 3.88Å; I1502-L1506 WeakPolarHBondContact O-CB 3.3Å; I1502-L1506 VanDerWaalsContact O-CG 3.31Å; I1502-L1506 WeakPolarHBondContact O-CG 3.37Å; I1502-L1506 PolarHBondContact O-N 3.38Å; L1503-L1506 PolarHBondContact O-N 3.2Å; L1506-C1509 PolarHBondContact O-N 3.42Å; L1506-N1510 WeakPolarHBondContact O-CB 3.47Å; L1506-N1510 PolarHBondContact O-N 3.41Å
1507L58.9Low56.1Low91 Ų91112.9 Ų112.948%0.47658%0.578SS.*Hα-helixtrans-69.7-41.1177.2-76164.5000111.3L1503 G1504 C1509 N1510 N1511L1503-L1507 VanDerWaalsContact O-CB 3.25Å; L1503-L1507 WeakPolarHBondContact O-CB 3.29Å; L1503-L1507 WeakPolarHBondContact O-CD1 3.43Å; L1503-L1507 WeakPolarHBondContact O-CG 3.38Å; L1503-L1507 PolarHBondContact O-N 2.87Å; G1504-L1507 PolarHBondContact O-N 3.26Å; L1507-C1509 VanDerWaalsContact C-N 3.31Å; L1507-C1509 PolarHBondContact O-N 3.33Å; L1507-N1510 PolarHBondContact O-N 2.87Å; L1507-N1510 VanDerWaalsContact O-N 3.15Å; L1507-N1511 WeakPolarHBondContact O-CB 3.38Å; L1507-N1511 PolarHBondContact O-N 2.61Å; L1507-N1511 PolarHBondContact O-ND2 2.89Å; L1507-N1511 PolarHBondContact O-OD1 2.99Å
1508A49.4Very low54Low50 Ų50108.3 Ų108.341%0.41357%0.572SS.*Hα-helixtrans-57.5-44.1170.800000111.5G1504 R1505 Y1512G1504-A1508 WeakPolarHBondContact O-CB 3.36Å; G1504-A1508 PolarHBondContact O-N 3.41Å; R1505-A1508 PolarHBondContact O-N 3.44Å; A1508-Y1512 VanDerWaalsContact O-CD2 3.25Å; A1508-Y1512 WeakPolarHBondContact O-CD2 2.99Å
1509C43.3Very low51.7Low88 Ų88109.2 Ų109.260%0.59559%0.585SS**Hα-helixtrans-65.6-36.4174-68.70000113.5R1505 L1506 L1507R1505-C1509 PolarHBondContact O-N 2.96Å; R1505-C1509 PolarHBondContact O-SG 3.05Å; L1506-C1509 PolarHBondContact O-N 3.42Å; L1507-C1509 VanDerWaalsContact C-N 3.31Å; L1507-C1509 PolarHBondContact O-N 3.33Å
1510N42.4Very low49.3Very low108 Ų108113.3 Ų113.358%0.57860%0.602SS**Hα-helixtrans-74-33.8179.9-117.8-33.7000113.2L1506 L1507 Y1512 S1513L1506-N1510 WeakPolarHBondContact O-CB 3.47Å; L1506-N1510 PolarHBondContact O-N 3.41Å; L1507-N1510 PolarHBondContact O-N 2.87Å; L1507-N1510 VanDerWaalsContact O-N 3.15Å; N1510-Y1512 PolarHBondContact O-N 3.13Å; N1510-S1513 PolarHBondContact O-N 2.8Å
1511N39.8Very low47.1Very low127 Ų127115.3 Ų115.368%0.67961%0.612SS**Hα-helixtrans-66.6-21-177-73.8-12.2000113.1L1507 S1513L1507-N1511 WeakPolarHBondContact O-CB 3.38Å; L1507-N1511 PolarHBondContact O-N 2.61Å; L1507-N1511 PolarHBondContact O-ND2 2.89Å; L1507-N1511 PolarHBondContact O-OD1 2.99Å; N1511-S1513 PolarHBondContact O-N 2.83Å
1512Y38.8Very low44.9Very low112 Ų112114.4 Ų114.444%0.43962%0.62SS.*THydrogen-bonded Turntrans-77.86.2174.2-74.9-61.4000115.1R110 A1508 N1510R110-Y1512 HydrophobicContact CG-CD1 3.8Å; R110-Y1512 HydrophobicContact CG-CE1 3.7Å; R110-Y1512 VanDerWaalsContact NE-CD1 3.27Å; A1508-Y1512 VanDerWaalsContact O-CD2 3.25Å; A1508-Y1512 WeakPolarHBondContact O-CD2 2.99Å; N1510-Y1512 PolarHBondContact O-N 3.13Å
1513S33.8Very low42.5Very low94 Ų94113.4 Ų113.466%0.65762%0.621SS**THydrogen-bonded Turntrans-147.154.9-178.1-81.40000115.8N1510 N1511N1510-S1513 PolarHBondContact O-N 2.8Å; N1511-S1513 PolarHBondContact O-N 2.83Å
1514R35.3Very low40.5Very low209 Ų209111 Ų11179%0.78961%0.612SS**  trans-154.2102.9160.4-112.6164.4-161.3-170.26.2115.2
1515R31.5Very low38.7Very low242 Ų242117 Ų11791%0.91364%0.635SS**PPolyproline II helixtrans-81.8149.8141.8-116.7-170.4170.8169.8-1.5107.9
1516P32.1Very low37.1Very low115 Ų115120.1 Ų120.175%0.74765%0.647SS**PPolyproline II helixtrans-79141.2-168.130.9-34.2000112.7
1517P37.1Very low35.6Very low121 Ų121119.1 Ų119.179%0.78665%0.648SS**PPolyproline II helixtrans-75.2135.4165.331.5-32.4000110.5
1518S34.3Very low34.3Very low83 Ų83124.1 Ų124.158%0.5867%0.666SS**PPolyproline II helixtrans-76.9132.7-177.253.20000113.4
1519S29.6Very low33.5Very low93 Ų93131.2 Ų131.265%0.6569%0.688SS**SBendtrans62.2127.5162.671.80000118.9
1520N27.5Very low32.8Very low148 Ų148132.3 Ų132.379%0.79170%0.696SS**SBendtrans73.6135.8161.9-54.4-28.2000118.3
1521T28Very low32.2Very low125 Ų125134.8 Ų134.877%0.76771%0.709SS**  trans59.878.9172.555.10000118.2
1522V32.2Very low31.8Very low114 Ų114135.2 Ų135.269%0.69171%0.711SS**  -154.688.1126.5-178.50000109.3
1523S27.4Very low31.5Very low65 Ų65136.5 Ų136.546%0.45573%0.726SS.*  trans-99.289.8167.237.50000109.5
1524S32.2Very low31.2Very low51 Ų51138.8 Ų138.836%0.35773%0.73SS.*SBendtrans-162.7-40173.1-8.60000116.2
1525L34.9Very low31.1Very low164 Ų164136.4 Ų136.486%0.85973%0.733SS**SBendtrans-107.919.5-163.8-88.6163.2000115.5
1526R30.1Very low31.2Very low222 Ų222129.5 Ų129.584%0.83872%0.722SS**  trans-103.913.6-172.8-145.5-177.2-163.7173.84.5115.1
1527C28.5Very low31.3Very low80 Ų80131 Ų13154%0.54172%0.724SS.*  trans-114.245.8-162.3-59.70000114.8K1304K1304-C1527 VanDerWaalsContact CE-SG 3.52Å; K1304-C1527 PolarHBondContact NZ-SG 3.31Å
1528F32.7Very low31.2Very low195 Ų195131.6 Ų131.686%0.85572%0.72SS**SBendtrans-136.3-22168.2-94.8-77.6000115.2
1529F31.8Very low31.2Very low200 Ų200133.6 Ų133.688%0.87772%0.724SS**SBendtrans-142.890.8176.3-68.9-79.4000111.4
1530S30Very low31.4Very low111 Ų111136.8 Ų136.878%0.77673%0.734SS**  trans-173100.5164178.80000109.5
1531L28.7Very low31.7Very low159 Ų159135.1 Ų135.183%0.83273%0.725SS**  trans-131.1136.7173.8-131.6154.1000108.2
1532N31.1Very low31.9Very low136 Ų136136.2 Ų136.273%0.72773%0.727SS**SBendtrans79.2130.2-179.7-61.4-15.2000119.5
1533N32.1Very low32Very low140 Ų140135.3 Ų135.375%0.74972%0.721SS**  trans85.466.8148.5-59-1.2000121.2
1534N28.5Very low32.2Very low142 Ų142141.3 Ų141.376%0.75974%0.742SS**  36.3143.2112.4-561.2000122.6
1535N33Very low32.1Very low158 Ų158142.2 Ų142.285%0.84576%0.759SS**  trans75.3140.9164.5-52.7-9.2000116.7
1536S33.2Very low32Very low97 Ų97138.9 Ų138.968%0.67876%0.755SS**  cis-165.8151.7-16.247.20000111.6
1537D35.3Very low31.9Very low147 Ų147134.5 Ų134.579%0.78675%0.754SS**  trans63.597.2149.8-53.5-4.8000123.3
1538D34.4Very low32.2Very low134 Ų134136.8 Ų136.872%0.71777%0.765SS**  66.3126112.8-86.730.6000127.3
1539N33.5Very low32.2Very low124 Ų124137.5 Ų137.566%0.66377%0.768SS**  trans69.2112.2137.8-58.2-34.4000123.2
1540N33.5Very low32.3Very low161 Ų161130.9 Ų130.986%0.86176%0.757SS**  -177.1162.192.9-97.5-73.4000114.3
1541D34.9Very low32.6Very low112 Ų112137.3 Ų137.360%0.59976%0.764SS**  trans-91.6157.2-169.6-69.5-63.5000116.6
1542N32.3Very low32.8Very low149 Ų149135.2 Ų135.280%0.79776%0.761SS**  169.297.4109.6-90-72.3000115.6
1543V34.4Very low33.1Very low95 Ų95132.6 Ų132.658%0.57675%0.752SS**  29.3125.4112.1-177.10000116.7
1544Q31.5Very low33.5Very low191 Ų191132.5 Ų132.589%0.89375%0.751SS**  cis-175.9158.747.8-148.1150.733.900115.6
1545G30.1Very low34Very low70 Ų70132.3 Ų132.372%0.72275%0.745SS**  trans101.7124.3157.100000115.8
1546A31.4Very low34.2Very low93 Ų93133.7 Ų133.777%0.76974%0.738SS**  cis105133.635.700000111.8
1547T29.2Very low34.6Very low131 Ų131134.6 Ų134.680%0.80474%0.736SS**  cis-169.2125.3-7.924.40000110.8
1548T34.7Very low34.7Very low127 Ų127137 Ų13778%0.77973%0.734SS**  trans-163.3158157.7150000109.5
1549F31.8Very low34.9Very low210 Ų210135.3 Ų135.392%0.92172%0.724SS**  trans-135.5122.9-175-102.4-92.2000112.1
1550G34.3Very low35.1Very low62 Ų62131.5 Ų131.564%0.63971%0.707SS**PPolyproline II helixtrans-82.6165.417400000114.3
1551R37.4Very low35.2Very low245 Ų245130 Ų13093%0.92570%0.699SS**PPolyproline II helixtrans-82.2158.4175-71.8179.1174174-1.7111.4
1552C33.2Very low35.5Very low115 Ų115130.4 Ų130.478%0.77770%0.7SS**PPolyproline II helixtrans-93.4132.4172.7-166.10000110.1L1554C1552-L1554 PolarHBondContact O-N 3.06Å
1553P36.1Very low35.9Very low81 Ų81128.3 Ų128.353%0.52669%0.688SS.*  trans-82.697-177.131.9-34.1000111.9
1554L39.8Very low36.1Very low139 Ų139129.6 Ų129.673%0.72869%0.692SS**  trans-146.497.7166.7-103.9165.4000108.5C1552C1552-L1554 PolarHBondContact O-N 3.06Å
1555E40.5Very low36.2Very low137 Ų137130.6 Ų130.664%0.6469%0.689SS**  trans-65.8138.2176.4-63.6170.9132.500110.3D1557E1555-D1557 PolarHBondContact O-N 2.93Å
1556R36Very low36.3Very low187 Ų187132.7 Ų132.771%0.70669%0.688SS**THydrogen-bonded Turntrans-68.7-27.7177.1-80.9180165.3163.2-5.1112.4R1558 L1559 S1560R1556-R1558 VanDerWaalsContact C-N 3.26Å; R1556-R1558 PolarHBondContact O-N 3.42Å; R1556-L1559 PolarHBondContact O-N 3.22Å; R1556-S1560 PolarHBondContact O-N 2.9Å
1557D41.3Very low36.3Very low117 Ų117136.4 Ų136.463%0.62669%0.694SS**Hα-helixtrans-79.6-10.2-161-46.3-26.3000112.8E1555 S1560 N1561E1555-D1557 PolarHBondContact O-N 2.93Å; D1557-S1560 PolarHBondContact O-OG 2.79Å; D1557-S1560 VanDerWaalsContact O-OG 3.14Å; D1557-N1561 PolarHBondContact O-OD1 2.72Å
1558R38.8Very low36.6Very low198 Ų198134.1 Ų134.175%0.74770%0.697SS**Hα-helixtrans-92.4-3170.1-53.8-17080.9165.75.5113.4R1556R1556-R1558 VanDerWaalsContact C-N 3.26Å; R1556-R1558 PolarHBondContact O-N 3.42Å
1559L37.5Very low36.5Very low98 Ų98132.9 Ų132.951%0.51370%0.7SS.*Hα-helixtrans-106.6-27.2178.1-103.5163000113.3R1556 I1563R1556-L1559 PolarHBondContact O-N 3.22Å; L1559-I1563 WeakPolarHBondContact O-CG1 3.29Å
1560S37.4Very low36.8Very low44 Ų44131.4 Ų131.431%0.30870%0.696SS.*Hα-helixtrans-57.6-48.3167.241.70000111.5R1556 D1557 I1562 I1563 D1564R1556-S1560 PolarHBondContact O-N 2.9Å; D1557-S1560 PolarHBondContact O-OG 2.79Å; D1557-S1560 VanDerWaalsContact O-OG 3.14Å; S1560-I1562 PolarHBondContact O-N 2.83Å; S1560-I1563 PolarHBondContact O-N 3.09Å; S1560-D1564 PolarHBondContact O-N 2.78Å
1561N37Very low37.3Very low129 Ų129134.3 Ų134.369%0.6970%0.703SS**THydrogen-bonded Turntrans-68.1-1.4-173.1-59.312.3000114.4D1557D1557-N1561 PolarHBondContact O-OD1 2.72Å
1562I40.3Very low37.1Very low120 Ų120137 Ų13762%0.61572%0.715SS**THydrogen-bonded Turntrans-104.9-14.2174.3-64.8175.2000111.2S1560S1560-I1562 PolarHBondContact O-N 2.83Å
1563I41.1Very low37.3Very low105 Ų105138.1 Ų138.154%0.53871%0.712SS.*THydrogen-bonded Turntrans-113.4-22.9-168-63.5176.4000112.7L1559 S1560 Y1565L1559-I1563 WeakPolarHBondContact O-CG1 3.29Å; S1560-I1563 PolarHBondContact O-N 3.09Å; I1563-Y1565 PolarHBondContact O-N 3.36Å
1564D38.8Very low37.3Very low123 Ų123141.1 Ų141.166%0.65872%0.722SS**  trans-73.731.7-178.2-71.2-37000115.4S1560 T1566S1560-D1564 PolarHBondContact O-N 2.78Å; D1564-T1566 PolarHBondContact O-N 3.41Å; D1564-T1566 VanDerWaalsContact O-N 3.11Å
1565Y32.8Very low37.2Very low212 Ų212141.2 Ų141.283%0.83172%0.722SS**  trans-7980.7169-86.9-80.9000111.3I1563I1563-Y1565 PolarHBondContact O-N 3.36Å
1566T33.6Very low37Very low114 Ų114141.4 Ų141.470%0.69973%0.726SS**  trans-134.6119.2171.755.50000114.5D1564D1564-T1566 PolarHBondContact O-N 3.41Å; D1564-T1566 VanDerWaalsContact O-N 3.11Å
1567N30.8Very low37.1Very low170 Ų170138.6 Ų138.691%0.90973%0.728SS**SBendtrans53.489156.8-59.7-11.2000118.3
1568G34.4Very low36.8Very low83 Ų83140 Ų14086%0.85674%0.735SS**  trans178.6-58.4160.600000115.7
1569A33.1Very low36.6Very low102 Ų102135.9 Ų135.984%0.84373%0.734SS**PPolyproline II helixtrans-86.3142.9-169.700000113.8
1570Q38.8Very low36.6Very low178 Ų178138.8 Ų138.883%0.83275%0.751SS**PPolyproline II helixtrans-79.5144.7162.4-73.1-175-36.800110.1
1571P44.3Very low36.5Very low123 Ų123146.7 Ų146.780%0.79979%0.788SS**PPolyproline II helixtrans-79.8141.6172.532.8-33.3000111.7
1572Y33.1Very low36.5Very low301 Ų301148.3 Ų148.3100%1.1880%0.796SS**  trans-118.80155.8-102.3-79.1000108

Retrieved 1,572 of 1,572 residues in 1633.4 ms (Link to these results)