A0A077YXN8_TRITR Loading...

Girdin

AlphaFold DB , UniProt , Accession A0A077YXN8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,503 aa.

>A0A077YXN8_TRITR|A0A077YXN8
MPTSADMTDEEMKKVLLLLLGCVVQSDRREEFINQIKSLDTATQQSLANEIRKITNEGKIVLSVSDWQHSSENGNVELLVEHLSSVIEERDKYARNLLEMSQEHESVSSNTASLCNGYASHRKLPDGQQQQQDYREGSAERHAVIELAECKAQLRRSRQEVEEKSEMINLYRDDIAERDATLAKMRQENFELTKSLRLFKEYRDEVDVLRERTIRYAQLEADCEKYKEKLSELDFLKSRVEELREENHVLLETKGLLDDQVASLRHRLGLNNDREADIIRLQGRVADLEQQVLLERRRVQQLLEENSRLEKESFEQQNRSAVCSTSASNDRSTEGERTDRDNVDRSVSNLCDQLNESISAKLLRLEFDNRKLKEMLQNCSIFSESDAKLYDLNVSSPTSQPFSLLNELKDGKECDVASDRLREMKQRECELAESLADAEMRNRSLSRKLAETEDECQKIREQLQSMQSAAAAQPTAAELDKLVDELRTANLEACSRNAVLLEEINQKELDLKKTKAKLEEQEAEKFSVEAQLSCAVREHNMALQESEKLRNALQTADNEIERVTCEMERYQKQCTQLASVRKQNDALDAANAELKNEKKNLSQQVEFQERKIAALSEDLILEKQRSSIVDQLSADMLTCANEFKLTEGISNDAEQQDVRVSFWNLIGHFKSKMSDLTASCNLKDHLLELSRLEASEKFADESSNRNNVSMEELKAQNQSLLMENKRILEEVQLLQSRNEKSQDALNATQGSIDEKIRQQIRELKLVMSYTGLPKLFVFKNSVRHADNVNAELQVNMRSLQLKYDVIKADNAEMQRQCETWERAVTEANECFEDLRKQHHLLLKDHEQLQALHEQLSSDYDHLRANVQSLKSQLRQAKQDCSNCANRLEQVTSENRSLTRMSAQWEQENNEKGRDYKLFVALQNDHGALKRMHTSLQTRYEEICREKGMLQQENRRLRSELNGGELKVTQALVKLENAEDQRRRLELDVIKLEHKCETLDRLNGTLVEERHALIRQLDGLLAQNHEVLSKAFMDKEHFHSEEKELQEKVNQLKRQKEKLEEKIMEQYKIMESPKRKERQAFMKRAAKAFIPRASLRKTKSRPLESSAEDSTVSADESGFHTNSGCDGTSGKINSTLHDSGRFVDRWPKMPKMGLSPLLSSRKAHTLSASGGGSFSGDGSTFPRLSAFQMSLRHDLQAPSSSVAVEEKVADVLHCTDATSGDDSSPTVFVQPSDEGEGKIVPTKWIANSASSRTTSSSQSSDAVCIATELPGPPRDVVSLSGSERAIDVPGEPPVKSPPPYESLSMQYGAISPLKPLVNGAGSFPLGSSVRPAMKKLPPPYPGKPMMHTIGHSFAHWRPPSPIPTVHPTGSLASPSSYDLPKASTPKPDDSSSSATTSSSALANLHPGNNSLVSSEPSSHSSGSAPLVKGSRENIVAAESITPVKQRTVSTRREPVFSFYDNVDCTKQNGDARPSDSSNEETLTEALRECKAEQENAVWFEYGCV
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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
1M33.5Very low46.4Very low213 Ų213117.5 Ų117.5100%1.04967%0.668SS**  0100.70-61.4-56.8-173.700106.8T3M1-T3 HydrophobicContact SD-CG2 3.75Å
2P40.2Very low47.2Very low123 Ų123117.1 Ų117.180%0.79966%0.658SS**  -110.2134.486.932.8-32.2000111.4S4P2-S4 PolarHBondContact O-N 3.32Å
3T38.8Very low48Very low117 Ų117115.7 Ų115.772%0.71864%0.641SS**  trans-7685.6170.4470000108.5M1 A5M1-T3 HydrophobicContact SD-CG2 3.75Å; T3-A5 PolarHBondContact O-N 3.34Å
4S42.2Very low48.8Very low100 Ų100115.4 Ų115.470%0.69963%0.63SS**  trans-84.893.5160.352.60000106.7P2 D6P2-S4 PolarHBondContact O-N 3.32Å; S4-D6 PolarHBondContact O-N 3.22Å
5A45.4Very low49.8Very low93 Ų93114.1 Ų114.177%0.76963%0.627SS**  trans-68.327.3177.400000113.5T3T3-A5 PolarHBondContact O-N 3.34Å
6D45.2Very low50.5Low129 Ų129113.3 Ų113.369%0.6962%0.62SS**  trans-113.955175.6-59.9-30000107.8S4 T8S4-D6 PolarHBondContact O-N 3.22Å; D6-T8 PolarHBondContact O-N 3.36Å
7M45.1Very low51.1Low113 Ų113110.2 Ų110.256%0.55760%0.603SS**  trans-63.390.8145-82.8-74.387.200104.2D9 E11M7-D9 PolarHBondContact O-N 3.07Å; M7-E11 WeakPolarHBondContact CE-OE2 3.45Å; M7-E11 HydrophobicContact SD-CB 4.31Å
8T53.6Low51.5Low70 Ų70111.1 Ų111.143%0.42961%0.606SS.*  trans-48.5140.2-174.153.50000107.2D6 E10 E11 M12D6-T8 PolarHBondContact O-N 3.36Å; T8-E10 CarbonylContact O-C 3.42Å; T8-E10 PolarHBondContact O-N 3.4Å; T8-E11 PolarHBondContact O-N 2.97Å; T8-M12 PolarHBondContact O-N 3.31Å
9D53.2Low51.9Low110 Ų110111.4 Ų111.459%0.58861%0.606SS**Hα-helixtrans-47.1-22178-164.949.8000112.1M7 K13M7-D9 PolarHBondContact O-N 3.07Å; D9-K13 WeakPolarHBondContact O-CB 3.35Å; D9-K13 WeakPolarHBondContact O-CD 3.45Å; D9-K13 WeakPolarHBondContact O-CG 3.38Å; D9-K13 PolarHBondContact O-N 3.24Å; D9-K13 VanDerWaalsContact O-N 3.12Å; D9-K13 WeakPolarHBondContact OD2-CE 3.36Å; D9-K13 IonicContact OD2-NZ 2.78Å; D9-K13 PolarHBondContact OD2-NZ 3.46Å
10E56.7Low52.4Low130 Ų130108.1 Ų108.161%0.60759%0.588SS**Hα-helixtrans-67.9-45169.5-65.7-163.3176.900116.2T8 M12 K13 K14T8-E10 CarbonylContact O-C 3.42Å; T8-E10 PolarHBondContact O-N 3.4Å; E10-M12 VanDerWaalsContact C-N 3.32Å; E10-K13 WeakPolarHBondContact O-CB 3.36Å; E10-K13 PolarHBondContact O-N 3.09Å; E10-K14 WeakPolarHBondContact O-CG 3.43Å; E10-K14 PolarHBondContact O-N 3.31Å
11E56.9Low52.7Low95 Ų95104.5 Ų104.544%0.44458%0.576SS.*Hα-helixtrans-67.6-37.7179.1-73.2-161.4-170.800111.1M7 T8 K13 K14 V15M7-E11 WeakPolarHBondContact CE-OE2 3.45Å; M7-E11 HydrophobicContact SD-CB 4.31Å; T8-E11 PolarHBondContact O-N 2.97Å; E11-K13 VanDerWaalsContact C-N 3.32Å; E11-K13 PolarHBondContact O-N 3.44Å; E11-K14 PolarHBondContact O-N 2.61Å; E11-V15 WeakPolarHBondContact O-CG2 3.48Å; E11-V15 PolarHBondContact O-N 3.21Å
12M55.6Low53.8Low112 Ų11297.8 Ų97.855%0.55255%0.55SS*.Hα-helixtrans-64.4-38173.1-156.7177.7-53.800111.5T8 E10 V15 L16T8-M12 PolarHBondContact O-N 3.31Å; E10-M12 VanDerWaalsContact C-N 3.32Å; M12-V15 PolarHBondContact O-N 2.81Å; M12-L16 PolarHBondContact O-N 3.36Å
13K57.1Low54.8Low99 Ų9992.8 Ų92.843%0.4352%0.517SS..Hα-helixtrans-62.7-44.4171-80168.2-170.51580112.4D9 E10 E11 V15 L16 L17D9-K13 WeakPolarHBondContact O-CB 3.35Å; D9-K13 WeakPolarHBondContact O-CD 3.45Å; D9-K13 WeakPolarHBondContact O-CG 3.38Å; D9-K13 PolarHBondContact O-N 3.24Å; D9-K13 VanDerWaalsContact O-N 3.12Å; D9-K13 WeakPolarHBondContact OD2-CE 3.36Å; D9-K13 IonicContact OD2-NZ 2.78Å; D9-K13 PolarHBondContact OD2-NZ 3.46Å; E10-K13 WeakPolarHBondContact O-CB 3.36Å; E10-K13 PolarHBondContact O-N 3.09Å; E11-K13 VanDerWaalsContact C-N 3.32Å; E11-K13 PolarHBondContact O-N 3.44Å; K13-V15 VanDerWaalsContact C-N 3.35Å; K13-V15 PolarHBondContact O-N 2.88Å; K13-L16 PolarHBondContact O-N 3.33Å; K13-L17 VanDerWaalsContact O-CB 3.31Å; K13-L17 WeakPolarHBondContact O-CB 3.45Å; K13-L17 PolarHBondContact O-N 2.9Å
14K60.2Low55.8Low111 Ų11191.3 Ų91.348%0.48351%0.507SS..Hα-helixtrans-61.8-41.4177.2-72.8177.8-176.5-1780111.9E10 E11 L17 L18E10-K14 WeakPolarHBondContact O-CG 3.43Å; E10-K14 PolarHBondContact O-N 3.31Å; E11-K14 PolarHBondContact O-N 2.61Å; K14-L17 WeakPolarHBondContact O-CB 3.32Å; K14-L17 PolarHBondContact O-N 3.22Å; K14-L18 WeakPolarHBondContact O-CB 3.47Å; K14-L18 PolarHBondContact O-N 3.01Å
15V62.8Low56.6Low97 Ų9794.8 Ų94.859%0.58851%0.513SS*.Hα-helixtrans-66.3-42.9175174.10000111.2E11 M12 K13 L17 L18 L19E11-V15 WeakPolarHBondContact O-CG2 3.48Å; E11-V15 PolarHBondContact O-N 3.21Å; M12-V15 PolarHBondContact O-N 2.81Å; K13-V15 VanDerWaalsContact C-N 3.35Å; K13-V15 PolarHBondContact O-N 2.88Å; V15-L17 VanDerWaalsContact C-N 3.28Å; V15-L17 PolarHBondContact O-N 2.85Å; V15-L18 PolarHBondContact O-N 3.2Å; V15-L19 WeakPolarHBondContact O-CB 3.44Å; V15-L19 PolarHBondContact O-N 3.46Å
16L61.8Low57.4Low100 Ų10092.2 Ų92.252%0.52449%0.489SS..Hα-helixtrans-60.8-39173.2-113.590000111.9M12 K13 L19 L20M12-L16 PolarHBondContact O-N 3.36Å; K13-L16 PolarHBondContact O-N 3.33Å; L16-L19 PolarHBondContact O-N 3.27Å; L16-L20 VanDerWaalsContact O-CB 3.3Å; L16-L20 WeakPolarHBondContact O-CB 3.5Å; L16-L20 PolarHBondContact O-N 2.87Å
17L59.7Low58.3Low62 Ų6294.4 Ų94.433%0.32550%0.501SS..Hα-helixtrans-67.2-43.3179.4-156.479.8000111.5K13 K14 V15 L20 G21 I54 I60K13-L17 VanDerWaalsContact O-CB 3.31Å; K13-L17 WeakPolarHBondContact O-CB 3.45Å; K13-L17 PolarHBondContact O-N 2.9Å; K14-L17 WeakPolarHBondContact O-CB 3.32Å; K14-L17 PolarHBondContact O-N 3.22Å; V15-L17 VanDerWaalsContact C-N 3.28Å; V15-L17 PolarHBondContact O-N 2.85Å; L17-L20 PolarHBondContact O-N 3.41Å; L17-G21 PolarHBondContact O-N 3Å; L17-I54 HydrophobicContact CD1-CD1 3.54Å; L17-I54 HydrophobicContact CD1-CG1 4.02Å; L17-I54 HydrophobicContact CD1-CG2 3.94Å; L17-I60 HydrophobicContact CD1-CD1 4.35Å; L17-I60 HydrophobicContact CD1-CG2 4.42Å; L17-I60 HydrophobicContact CD2-CG2 4.01Å
18L59.2Low59.2Low126 Ų12696.9 Ų96.966%0.6650%0.504SS*.Hα-helixtrans-63.7-44.2174.8-17466000110.7K14 V15 L20 G21 C22K14-L18 WeakPolarHBondContact O-CB 3.47Å; K14-L18 PolarHBondContact O-N 3.01Å; V15-L18 PolarHBondContact O-N 3.2Å; L18-L20 PolarHBondContact O-N 3.25Å; L18-G21 PolarHBondContact O-N 3.3Å; L18-C22 PolarHBondContact O-N 3.07Å; L18-C22 PolarHBondContact O-SG 3.37Å
19L59.5Low59.7Low116 Ų116100.4 Ų100.461%0.60751%0.509SS*.Hα-helixtrans-63.1-42.4177-160.174.3000111.1V15 L16 C22 V23V15-L19 WeakPolarHBondContact O-CB 3.44Å; V15-L19 PolarHBondContact O-N 3.46Å; L16-L19 PolarHBondContact O-N 3.27Å; L19-C22 PolarHBondContact O-N 3.47Å; L19-V23 WeakPolarHBondContact O-CB 3.44Å; L19-V23 WeakPolarHBondContact O-CG2 3.44Å; L19-V23 PolarHBondContact O-N 2.9Å
20L60.6Low60.4Low45 Ų45102.5 Ų102.524%0.23652%0.515CS..Hα-helixtrans-65.6-39.5176.3-170.270000111.8L16 L17 L18 V23 V24 I51L16-L20 VanDerWaalsContact O-CB 3.3Å; L16-L20 WeakPolarHBondContact O-CB 3.5Å; L16-L20 PolarHBondContact O-N 2.87Å; L17-L20 PolarHBondContact O-N 3.41Å; L18-L20 PolarHBondContact O-N 3.25Å; L20-V23 WeakPolarHBondContact O-CB 3.41Å; L20-V23 PolarHBondContact O-N 3.29Å; L20-V24 WeakPolarHBondContact O-CG2 3.36Å; L20-V24 PolarHBondContact O-N 3.44Å; L20-I51 HydrophobicContact CD1-CD1 4.4Å; L20-I51 HydrophobicContact CD1-CG1 4.48Å; L20-I51 HydrophobicContact CD2-CG1 3.93Å
21G59.7Low60.9Low34 Ų34101.2 Ų101.235%0.35151%0.509SS..Hα-helixtrans-60.8-45.7173.200000112.2L17 L18 V23 V24 Q25L17-G21 PolarHBondContact O-N 3Å; L18-G21 PolarHBondContact O-N 3.3Å; G21-V23 VanDerWaalsContact C-N 3.33Å; G21-V23 PolarHBondContact O-N 3.1Å; G21-V24 PolarHBondContact O-N 3.24Å; G21-Q25 PolarHBondContact O-N 2.99Å
22C55.8Low61.3Low72 Ų72100 Ų10049%0.48650%0.503SS..Hα-helixtrans-62-39.2173.1-66.90000112L18 L19 S26L18-C22 PolarHBondContact O-N 3.07Å; L18-C22 PolarHBondContact O-SG 3.37Å; L19-C22 PolarHBondContact O-N 3.47Å; C22-S26 WeakPolarHBondContact O-CB 3.32Å; C22-S26 PolarHBondContact O-N 3.49Å; C22-S26 PolarHBondContact O-OG 3.04Å
23V61.6Low62Low18 Ų1897.5 Ų97.511%0.10949%0.491CS..Hα-helixtrans-64.3-41.6177.3165.30000111.9L19 L20 G21 S26 F32L19-V23 WeakPolarHBondContact O-CB 3.44Å; L19-V23 WeakPolarHBondContact O-CG2 3.44Å; L19-V23 PolarHBondContact O-N 2.9Å; L20-V23 WeakPolarHBondContact O-CB 3.41Å; L20-V23 PolarHBondContact O-N 3.29Å; G21-V23 VanDerWaalsContact C-N 3.33Å; G21-V23 PolarHBondContact O-N 3.1Å; V23-S26 PolarHBondContact O-OG 3.28Å; V23-F32 HydrophobicContact CB-CB 4.46Å; V23-F32 HydrophobicContact CB-CD2 4.18Å; V23-F32 HydrophobicContact CB-CG 4.22Å; V23-F32 HydrophobicContact CG1-CB 3.42Å; V23-F32 VanDerWaalsContact CG1-CB 3.42Å; V23-F32 HydrophobicContact CG1-CD1 4.45Å; V23-F32 HydrophobicContact CG1-CD2 3.81Å; V23-F32 HydrophobicContact CG1-CG 3.66Å; V23-F32 HydrophobicContact CG2-CB 4.23Å; V23-F32 HydrophobicContact CG2-CD1 3.69Å; V23-F32 HydrophobicContact CG2-CD2 3.83Å; V23-F32 HydrophobicContact CG2-CE1 3.9Å; V23-F32 HydrophobicContact CG2-CE2 4.02Å; V23-F32 HydrophobicContact CG2-CG 3.65Å; V23-F32 HydrophobicContact CG2-CZ 4.05Å
24V60.4Low62.7Low86 Ų8697.4 Ų97.452%0.52150%0.495SS..Hα-helixtrans-73.1-34.1-179.5174.70000112.2L20 G21L20-V24 WeakPolarHBondContact O-CG2 3.36Å; L20-V24 PolarHBondContact O-N 3.44Å; G21-V24 PolarHBondContact O-N 3.24Å
25Q58.4Low63.1Low173 Ų17397.6 Ų97.681%0.80850%0.498SS*.Hα-helixtrans-91.2-11.5-179.9-67.9-175.5-0.300114.5G21G21-Q25 PolarHBondContact O-N 2.99Å
26S61.9Low63.3Low39 Ų3995.4 Ų95.427%0.27348%0.482SS..SBendtrans-78.3144.3176.771.70000112.5C22 V23 R28 R29C22-S26 WeakPolarHBondContact O-CB 3.32Å; C22-S26 PolarHBondContact O-N 3.49Å; C22-S26 PolarHBondContact O-OG 3.04Å; V23-S26 PolarHBondContact O-OG 3.28Å; S26-R28 PolarHBondContact O-N 3.46Å; S26-R29 PolarHBondContact O-N 3.44Å
27D64.1Low63.7Low175 Ų17597.5 Ų97.594%0.93649%0.487SS*.THydrogen-bonded Turntrans-60.9-11174.7-60.2-30.3000113.4
28R63.5Low64.5Low165 Ų16599 Ų9962%0.62350%0.503SS*.THydrogen-bonded Turntrans-99.219.2179.8-60.2-170.8-179.8-157.73.7114S26 E30 E31 F32S26-R28 PolarHBondContact O-N 3.46Å; R28-E30 PolarHBondContact O-N 3.04Å; R28-E31 IonicContact NH1-OE2 2.61Å; R28-E31 WeakPolarHBondContact O-CB 3.4Å; R28-E31 PolarHBondContact O-N 2.94Å; R28-F32 HydrophobicContact CB-CE2 4.41Å; R28-F32 WeakPolarHBondContact O-CD2 3.03Å
29R65.5Low65.1Low144 Ų14497 Ų9754%0.54349%0.493SS..Hα-helixtrans-44.8-39.2179.2174.7178.8169.8-176.1-1.7114.1S26 E31 F32 I33S26-R29 PolarHBondContact O-N 3.44Å; R29-E31 PolarHBondContact O-N 2.91Å; R29-F32 PolarHBondContact O-N 3.48Å; R29-I33 HydrophobicContact CG-CD1 3.78Å; R29-I33 HydrophobicContact CG-CG1 4.45Å; R29-I33 WeakPolarHBondContact O-CG1 3.41Å; R29-I33 PolarHBondContact O-N 3.38Å; R29-I33 VanDerWaalsContact O-N 3.1Å
30E66.4Low65.9Low154 Ų15497.2 Ų97.272%0.7249%0.494SS*.Hα-helixtrans-65.1-35.8179.4-70.7-168.2164.100113.5R28 F32 I33 N34R28-E30 PolarHBondContact O-N 3.04Å; E30-F32 PolarHBondContact O-N 3.24Å; E30-I33 PolarHBondContact O-N 2.8Å; E30-N34 WeakPolarHBondContact O-CB 3.48Å; E30-N34 VanDerWaalsContact O-CG 3.24Å; E30-N34 PolarHBondContact O-N 3.39Å; E30-N34 PolarHBondContact O-ND2 3.08Å
31E69.2Low66.4Low102 Ų10299.6 Ų99.648%0.47751%0.511SS..Hα-helixtrans-63.8-42.6178.3-68.1-173.2164.400111R28 R29 N34 Q35R28-E31 IonicContact NH1-OE2 2.61Å; R28-E31 WeakPolarHBondContact O-CB 3.4Å; R28-E31 PolarHBondContact O-N 2.94Å; R29-E31 PolarHBondContact O-N 2.91Å; E31-N34 PolarHBondContact O-N 3.33Å; E31-Q35 PolarHBondContact O-N 3.1Å
32F64.6Low67.1Low69 Ų69101.2 Ų101.230%0.30352%0.521SS..Hα-helixtrans-69.1-39177.7-67.2-71.1000112.5V23 R28 R29 E30 N34 Q35 I36V23-F32 HydrophobicContact CB-CB 4.46Å; V23-F32 HydrophobicContact CB-CD2 4.18Å; V23-F32 HydrophobicContact CB-CG 4.22Å; V23-F32 HydrophobicContact CG1-CB 3.42Å; V23-F32 VanDerWaalsContact CG1-CB 3.42Å; V23-F32 HydrophobicContact CG1-CD1 4.45Å; V23-F32 HydrophobicContact CG1-CD2 3.81Å; V23-F32 HydrophobicContact CG1-CG 3.66Å; V23-F32 HydrophobicContact CG2-CB 4.23Å; V23-F32 HydrophobicContact CG2-CD1 3.69Å; V23-F32 HydrophobicContact CG2-CD2 3.83Å; V23-F32 HydrophobicContact CG2-CE1 3.9Å; V23-F32 HydrophobicContact CG2-CE2 4.02Å; V23-F32 HydrophobicContact CG2-CG 3.65Å; V23-F32 HydrophobicContact CG2-CZ 4.05Å; R28-F32 HydrophobicContact CB-CE2 4.41Å; R28-F32 WeakPolarHBondContact O-CD2 3.03Å; R29-F32 PolarHBondContact O-N 3.48Å; E30-F32 PolarHBondContact O-N 3.24Å; F32-N34 PolarHBondContact O-N 3.43Å; F32-Q35 PolarHBondContact O-N 3.28Å; F32-I36 WeakPolarHBondContact O-CB 3.43Å; F32-I36 VanDerWaalsContact O-CG1 3.26Å; F32-I36 WeakPolarHBondContact O-CG1 3.48Å; F32-I36 PolarHBondContact O-N 2.99Å
33I69.8Low67.7Low61 Ų61100.9 Ų100.931%0.31352%0.516SS..Hα-helixtrans-61.3-39.3173.6-67.7168.7000110.1R29 E30 I36 K37R29-I33 HydrophobicContact CG-CD1 3.78Å; R29-I33 HydrophobicContact CG-CG1 4.45Å; R29-I33 WeakPolarHBondContact O-CG1 3.41Å; R29-I33 PolarHBondContact O-N 3.38Å; R29-I33 VanDerWaalsContact O-N 3.1Å; E30-I33 PolarHBondContact O-N 2.8Å; I33-I36 PolarHBondContact O-N 3.47Å; I33-K37 HydrophobicContact CG2-CD 4.16Å; I33-K37 WeakPolarHBondContact O-CB 3.16Å; I33-K37 VanDerWaalsContact O-CG 3.26Å; I33-K37 WeakPolarHBondContact O-CG 3.46Å; I33-K37 PolarHBondContact O-N 3.48Å
34N71.4Confident67.8Low97 Ų97102.7 Ų102.752%0.51952%0.524SS..Hα-helixtrans-68.4-38.8176.3-70.2-25.8000112.4E30 E31 F32 K37 S38E30-N34 WeakPolarHBondContact O-CB 3.48Å; E30-N34 VanDerWaalsContact O-CG 3.24Å; E30-N34 PolarHBondContact O-N 3.39Å; E30-N34 PolarHBondContact O-ND2 3.08Å; E31-N34 PolarHBondContact O-N 3.33Å; F32-N34 PolarHBondContact O-N 3.43Å; N34-K37 PolarHBondContact O-N 3.19Å; N34-S38 PolarHBondContact O-N 3.4Å
35Q68.2Low67.9Low114 Ų114104.9 Ų104.953%0.53353%0.528SS..Hα-helixtrans-63.9-43.9172.3-76-178.75.200111.8E31 F32 K37 S38 L39E31-Q35 PolarHBondContact O-N 3.1Å; F32-Q35 PolarHBondContact O-N 3.28Å; Q35-K37 VanDerWaalsContact C-N 3.3Å; Q35-K37 PolarHBondContact O-N 3.27Å; Q35-S38 WeakPolarHBondContact O-CB 3.46Å; Q35-S38 PolarHBondContact O-N 3.1Å; Q35-S38 PolarHBondContact O-OG 3.42Å; Q35-L39 PolarHBondContact O-N 3.1Å
36I68.6Low68.3Low51 Ų51100.3 Ų100.326%0.26252%0.516SS..Hα-helixtrans-61.6-41.8175.3-66.3165.5000110F32 I33 S38 L39 Q44 L47F32-I36 WeakPolarHBondContact O-CB 3.43Å; F32-I36 VanDerWaalsContact O-CG1 3.26Å; F32-I36 WeakPolarHBondContact O-CG1 3.48Å; F32-I36 PolarHBondContact O-N 2.99Å; I33-I36 PolarHBondContact O-N 3.47Å; I36-S38 PolarHBondContact O-N 3.45Å; I36-L39 WeakPolarHBondContact O-CB 3.3Å; I36-L39 PolarHBondContact O-N 3.1Å; I36-L39 VanDerWaalsContact O-N 3.15Å; I36-Q44 VanDerWaalsContact O-CG 3.25Å; I36-Q44 WeakPolarHBondContact O-CG 3.43Å; I36-Q44 PolarHBondContact O-NE2 2.83Å; I36-L47 HydrophobicContact CD1-CD2 4.16Å; I36-L47 HydrophobicContact CG1-CD2 4.26Å; I36-L47 HydrophobicContact CG2-CD2 4.48Å
37K70.3Confident68.5Low144 Ų144101 Ų10163%0.62652%0.516SS*.Hα-helixtrans-63.7-21.5174.5-77.9176.9-179.4177.70114.1I33 N34 Q35 Q44I33-K37 HydrophobicContact CG2-CD 4.16Å; I33-K37 WeakPolarHBondContact O-CB 3.16Å; I33-K37 VanDerWaalsContact O-CG 3.26Å; I33-K37 WeakPolarHBondContact O-CG 3.46Å; I33-K37 PolarHBondContact O-N 3.48Å; N34-K37 PolarHBondContact O-N 3.19Å; Q35-K37 VanDerWaalsContact C-N 3.3Å; Q35-K37 PolarHBondContact O-N 3.27Å; K37-Q44 PolarHBondContact O-NE2 3.44Å
38S75.2Confident68.6Low95 Ų9594.9 Ų94.966%0.66449%0.489SS*.Hα-helixtrans-87.4-12.3176.175.60000114.2N34 Q35 I36N34-S38 PolarHBondContact O-N 3.4Å; Q35-S38 WeakPolarHBondContact O-CB 3.46Å; Q35-S38 PolarHBondContact O-N 3.1Å; Q35-S38 PolarHBondContact O-OG 3.42Å; I36-S38 PolarHBondContact O-N 3.45Å
39L72.9Confident68.8Low83 Ų8390.5 Ų90.544%0.43548%0.478SS..SBendtrans-74.6155.4176.4-71167.3000111.6Q35 I36 Q44Q35-L39 PolarHBondContact O-N 3.1Å; I36-L39 WeakPolarHBondContact O-CB 3.3Å; I36-L39 PolarHBondContact O-N 3.1Å; I36-L39 VanDerWaalsContact O-N 3.15Å; L39-Q44 HydrophobicContact CB-CG 4.24Å; L39-Q44 VanDerWaalsContact O-CD 3.26Å; L39-Q44 WeakPolarHBondContact O-CG 3.4Å; L39-Q44 PolarHBondContact O-NE2 3.38Å
40D76.2Confident68.7Low121 Ų12186.5 Ų86.565%0.64747%0.466SS*.  trans-55.2147.1-179.8-134.5-11000112A42 T43 Q44D40-A42 PolarHBondContact O-N 3.25Å; D40-A42 VanDerWaalsContact O-N 3.1Å; D40-T43 WeakPolarHBondContact CB-OG1 3.48Å; D40-T43 PolarHBondContact N-OG1 3.24Å; D40-T43 PolarHBondContact O-N 3.04Å; D40-T43 PolarHBondContact O-OG1 3.09Å; D40-Q44 PolarHBondContact O-N 3.02Å
41T71.7Confident68.6Low95 Ų9582 Ų8258%0.58345%0.446SS*.Hα-helixtrans-60.9-29.5-174.647.70000112.8Q45T41-Q45 WeakPolarHBondContact O-CB 3.5Å; T41-Q45 VanDerWaalsContact O-CG 3.26Å; T41-Q45 WeakPolarHBondContact O-CG 3.49Å; T41-Q45 PolarHBondContact O-N 3.36Å
42A72.9Confident68.3Low67 Ų6783.4 Ų83.455%0.55445%0.447SS*.Hα-helixtrans-70.1-42175.300000112.1D40 Q45 S46D40-A42 PolarHBondContact O-N 3.25Å; D40-A42 VanDerWaalsContact O-N 3.1Å; A42-Q45 PolarHBondContact O-N 2.98Å; A42-S46 WeakPolarHBondContact O-CB 3.38Å; A42-S46 PolarHBondContact O-N 3.25Å
43T69.1Low68.1Low65 Ų6584.6 Ų84.640%0.39945%0.452SS..Hα-helixtrans-73.2-35.6176.644.70000111.3D40 S46 L47D40-T43 WeakPolarHBondContact CB-OG1 3.48Å; D40-T43 PolarHBondContact N-OG1 3.24Å; D40-T43 PolarHBondContact O-N 3.04Å; D40-T43 PolarHBondContact O-OG1 3.09Å; T43-S46 PolarHBondContact O-N 3.38Å; T43-L47 WeakPolarHBondContact O-CB 3.48Å; T43-L47 PolarHBondContact O-N 3.21Å
44Q62.9Low67.3Low57 Ų5783.2 Ų83.227%0.26645%0.445SS..Hα-helixtrans-60.1-44.6168.7-78.1178.9-4.200112.4I36 K37 L39 D40 S46 L47 A48I36-Q44 VanDerWaalsContact O-CG 3.25Å; I36-Q44 WeakPolarHBondContact O-CG 3.43Å; I36-Q44 PolarHBondContact O-NE2 2.83Å; K37-Q44 PolarHBondContact O-NE2 3.44Å; L39-Q44 HydrophobicContact CB-CG 4.24Å; L39-Q44 VanDerWaalsContact O-CD 3.26Å; L39-Q44 WeakPolarHBondContact O-CG 3.4Å; L39-Q44 PolarHBondContact O-NE2 3.38Å; D40-Q44 PolarHBondContact O-N 3.02Å; Q44-S46 VanDerWaalsContact C-N 3.33Å; Q44-L47 PolarHBondContact O-N 3.12Å; Q44-A48 WeakPolarHBondContact O-CB 3.3Å; Q44-A48 PolarHBondContact O-N 3.45Å
45Q63.1Low66.7Low131 Ų13182.2 Ų82.261%0.61244%0.443SS*.Hα-helixtrans-65.6-37.9175.5-79179.17.200111.6T41 A42 A48 N49T41-Q45 WeakPolarHBondContact O-CB 3.5Å; T41-Q45 VanDerWaalsContact O-CG 3.26Å; T41-Q45 WeakPolarHBondContact O-CG 3.49Å; T41-Q45 PolarHBondContact O-N 3.36Å; A42-Q45 PolarHBondContact O-N 2.98Å; Q45-A48 PolarHBondContact O-N 3.49Å; Q45-N49 WeakPolarHBondContact O-CB 3.48Å; Q45-N49 PolarHBondContact O-N 3.27Å; Q45-N49 PolarHBondContact O-ND2 3.02Å
46S67.5Low66.1Low78 Ų7882.9 Ų82.955%0.54545%0.45SS..Hα-helixtrans-65.6-45.8175.5-156.50000111.3A42 T43 Q44 N49 E50A42-S46 WeakPolarHBondContact O-CB 3.38Å; A42-S46 PolarHBondContact O-N 3.25Å; T43-S46 PolarHBondContact O-N 3.38Å; Q44-S46 VanDerWaalsContact C-N 3.33Å; S46-N49 PolarHBondContact O-N 2.99Å; S46-E50 PolarHBondContact O-N 3.41Å
47L65.4Low65.2Low54 Ų5485.7 Ų85.728%0.28346%0.462SS..Hα-helixtrans-63.5-44.9175-119.4106.6000111.2I36 T43 Q44 N49 E50 I51I36-L47 HydrophobicContact CD1-CD2 4.16Å; I36-L47 HydrophobicContact CG1-CD2 4.26Å; I36-L47 HydrophobicContact CG2-CD2 4.48Å; T43-L47 WeakPolarHBondContact O-CB 3.48Å; T43-L47 PolarHBondContact O-N 3.21Å; Q44-L47 PolarHBondContact O-N 3.12Å; L47-N49 VanDerWaalsContact C-N 3.33Å; L47-N49 PolarHBondContact O-N 3.06Å; L47-E50 PolarHBondContact O-N 3.19Å; L47-I51 HydrophobicContact CD2-CD1 4.28Å; L47-I51 WeakPolarHBondContact O-CB 3.46Å; L47-I51 WeakPolarHBondContact O-CG1 3.48Å; L47-I51 PolarHBondContact O-N 3.3Å
48A66.2Low64.2Low45 Ų4580.1 Ų80.137%0.37245%0.445SS..Hα-helixtrans-66-35.8178.800000111.7Q44 Q45 R52Q44-A48 WeakPolarHBondContact O-CB 3.3Å; Q44-A48 PolarHBondContact O-N 3.45Å; Q45-A48 PolarHBondContact O-N 3.49Å; A48-R52 WeakPolarHBondContact O-CB 3.46Å; A48-R52 PolarHBondContact O-N 3.5Å
49N67.1Low63Low73 Ų7382.8 Ų82.839%0.3945%0.445SS..Hα-helixtrans-66.8-39.7172.8-78.2-11.3000111.4Q45 S46 L47 R52 K53Q45-N49 WeakPolarHBondContact O-CB 3.48Å; Q45-N49 PolarHBondContact O-N 3.27Å; Q45-N49 PolarHBondContact O-ND2 3.02Å; S46-N49 PolarHBondContact O-N 2.99Å; L47-N49 VanDerWaalsContact C-N 3.33Å; L47-N49 PolarHBondContact O-N 3.06Å; N49-R52 PolarHBondContact O-N 3.08Å; N49-R52 PolarHBondContact OD1-NH2 3.04Å; N49-K53 WeakPolarHBondContact O-CG 3.5Å; N49-K53 PolarHBondContact O-N 3.03Å
50E63.8Low62Low60 Ų6083 Ų8328%0.2845%0.446SS..Hα-helixtrans-71.9-41.1178.5-139.160-16900111.7S46 L47 R52 K53 I54S46-E50 PolarHBondContact O-N 3.41Å; L47-E50 PolarHBondContact O-N 3.19Å; E50-R52 VanDerWaalsContact C-N 3.29Å; E50-R52 PolarHBondContact O-N 3.48Å; E50-K53 PolarHBondContact O-N 3.28Å; E50-K53 IonicContact OE1-NZ 2.89Å; E50-K53 IonicContact OE2-NZ 3.88Å; E50-K53 PolarHBondContact OE2-NZ 2.9Å; E50-I54 VanDerWaalsContact O-CD1 3.26Å; E50-I54 WeakPolarHBondContact O-CD1 3.44Å; E50-I54 WeakPolarHBondContact O-CG1 3.47Å; E50-I54 PolarHBondContact O-N 3.36Å
51I64.1Low60.7Low59 Ų5981.5 Ų81.530%0.30344%0.44SS..Hα-helixtrans-58.7-42.2169.6-66.5164.9000110.4L20 L47 I54 T55L20-I51 HydrophobicContact CD1-CD1 4.4Å; L20-I51 HydrophobicContact CD1-CG1 4.48Å; L20-I51 HydrophobicContact CD2-CG1 3.93Å; L47-I51 HydrophobicContact CD2-CD1 4.28Å; L47-I51 WeakPolarHBondContact O-CB 3.46Å; L47-I51 WeakPolarHBondContact O-CG1 3.48Å; L47-I51 PolarHBondContact O-N 3.3Å; I51-I54 PolarHBondContact O-N 3.01Å; I51-T55 HydrophobicContact CG2-CG2 4.49Å; I51-T55 WeakPolarHBondContact O-CB 3.48Å; I51-T55 PolarHBondContact O-N 3.42Å; I51-T55 PolarHBondContact O-OG1 3.44Å
52R63.2Low59.7Low133 Ų13380.7 Ų80.750%0.50243%0.432SS..Hα-helixtrans-68.3-37.1179-160.7-167.5-31.2-166.18.5112.2A48 N49 E50 I54 T55 N56A48-R52 WeakPolarHBondContact O-CB 3.46Å; A48-R52 PolarHBondContact O-N 3.5Å; N49-R52 PolarHBondContact O-N 3.08Å; N49-R52 PolarHBondContact OD1-NH2 3.04Å; E50-R52 VanDerWaalsContact C-N 3.29Å; E50-R52 PolarHBondContact O-N 3.48Å; R52-I54 VanDerWaalsContact C-N 3.35Å; R52-T55 WeakPolarHBondContact CA-OG1 3.37Å; R52-T55 PolarHBondContact O-N 3.34Å; R52-T55 PolarHBondContact O-OG1 3.34Å; R52-N56 VanDerWaalsContact O-CB 3.27Å; R52-N56 WeakPolarHBondContact O-CB 3.35Å; R52-N56 PolarHBondContact O-N 3.36Å
53K61.5Low58.7Low94 Ų9480.1 Ų80.141%0.40942%0.424SS..Hα-helixtrans-61.2-46.7170.6-74.7179.2-166.5156.20110.2N49 E50 T55 E57N49-K53 WeakPolarHBondContact O-CG 3.5Å; N49-K53 PolarHBondContact O-N 3.03Å; E50-K53 PolarHBondContact O-N 3.28Å; E50-K53 IonicContact OE1-NZ 2.89Å; E50-K53 IonicContact OE2-NZ 3.88Å; E50-K53 PolarHBondContact OE2-NZ 2.9Å; K53-T55 VanDerWaalsContact C-N 3.26Å; K53-T55 PolarHBondContact O-N 3.05Å; K53-E57 WeakPolarHBondContact O-CA 3.49Å; K53-E57 WeakPolarHBondContact O-CB 3.33Å; K53-E57 WeakPolarHBondContact O-CG 3.26Å; K53-E57 PolarHBondContact O-N 3.26Å
54I53Low57.9Low32 Ų3282.6 Ų82.616%0.16444%0.439CS..Hα-helixtrans-66.5-26.5-179.3-62.5157.6000112.8L17 E50 I51 R52 I60 V61L17-I54 HydrophobicContact CD1-CD1 3.54Å; L17-I54 HydrophobicContact CD1-CG1 4.02Å; L17-I54 HydrophobicContact CD1-CG2 3.94Å; E50-I54 VanDerWaalsContact O-CD1 3.26Å; E50-I54 WeakPolarHBondContact O-CD1 3.44Å; E50-I54 WeakPolarHBondContact O-CG1 3.47Å; E50-I54 PolarHBondContact O-N 3.36Å; I51-I54 PolarHBondContact O-N 3.01Å; R52-I54 VanDerWaalsContact C-N 3.35Å; I54-I60 HydrophobicContact CB-CD1 4.46Å; I54-I60 HydrophobicContact CG1-CD1 4.08Å; I54-I60 HydrophobicContact CG2-CB 3.99Å; I54-I60 HydrophobicContact CG2-CD1 4.08Å; I54-I60 HydrophobicContact CG2-CG2 3.94Å; I54-V61 HydrophobicContact CG2-CG2 4.44Å
55T57.4Low57.4Low76 Ų7683.5 Ų83.547%0.46645%0.451SS..Hα-helixtrans-97.4-32.8-178.944.40000114.7I51 R52 K53I51-T55 HydrophobicContact CG2-CG2 4.49Å; I51-T55 WeakPolarHBondContact O-CB 3.48Å; I51-T55 PolarHBondContact O-N 3.42Å; I51-T55 PolarHBondContact O-OG1 3.44Å; R52-T55 WeakPolarHBondContact CA-OG1 3.37Å; R52-T55 PolarHBondContact O-N 3.34Å; R52-T55 PolarHBondContact O-OG1 3.34Å; K53-T55 VanDerWaalsContact C-N 3.26Å; K53-T55 PolarHBondContact O-N 3.05Å
56N55.9Low56.9Low127 Ų12781.6 Ų81.668%0.67945%0.445SS*.Hα-helixtrans-97.7-27.9179-72.91.1000113.1R52 G58R52-N56 VanDerWaalsContact O-CB 3.27Å; R52-N56 WeakPolarHBondContact O-CB 3.35Å; R52-N56 PolarHBondContact O-N 3.36Å; N56-G58 PolarHBondContact O-N 3.03Å
57E49.1Very low56.1Low110 Ų11084.5 Ų84.551%0.51445%0.445SS..SBendtrans-76.6103.9160.3-55174.8-176.300104.2K53 K59K53-E57 WeakPolarHBondContact O-CA 3.49Å; K53-E57 WeakPolarHBondContact O-CB 3.33Å; K53-E57 WeakPolarHBondContact O-CG 3.26Å; K53-E57 PolarHBondContact O-N 3.26Å; E57-K59 PolarHBondContact O-N 3.43Å
58G50.8Low55.4Low27 Ų2789.7 Ų89.728%0.27847%0.467SS..THydrogen-bonded Turntrans-62.325.6177.800000114.1N56N56-G58 PolarHBondContact O-N 3.03Å
59K49.6Very low54.4Low151 Ų15195.3 Ų95.366%0.65749%0.486SS*.THydrogen-bonded Turntrans-87.1-10.2-178.7-85.5-171176.3-175.20114.7E57 H82E57-K59 PolarHBondContact O-N 3.43Å; K59-H82 WeakPolarHBondContact CA-CE1 3.49Å; K59-H82 PolarHBondContact O-CE1 3.02Å; K59-H82 PolarHBondContact O-NE2 3.5Å; K59-H82 VanDerWaalsContact O-NE2 3.16Å
60I52.2Low53.3Low89 Ų8994 Ų9446%0.45648%0.482SS..SBendtrans-130.4-30.6-176.9-60.5172.9000112.3L17 I54L17-I60 HydrophobicContact CD1-CD1 4.35Å; L17-I60 HydrophobicContact CD1-CG2 4.42Å; L17-I60 HydrophobicContact CD2-CG2 4.01Å; I54-I60 HydrophobicContact CB-CD1 4.46Å; I54-I60 HydrophobicContact CG1-CD1 4.08Å; I54-I60 HydrophobicContact CG2-CB 3.99Å; I54-I60 HydrophobicContact CG2-CD1 4.08Å; I54-I60 HydrophobicContact CG2-CG2 3.94Å
61V48.4Very low52.7Low88 Ų8896.8 Ų96.853%0.53351%0.508SS..  trans-126.6102.2-177.8-173.40000110.4I54I54-V61 HydrophobicContact CG2-CG2 4.44Å
62L51.3Low51.9Low79 Ų79102.3 Ų102.341%0.41453%0.533SS..  trans-86.5112.1169.7-76.2160.7000109.1V64 L79L62-V64 PolarHBondContact O-N 3.09Å; L62-L79 HydrophobicContact CD1-CD1 4.21Å; L62-L79 HydrophobicContact CD2-CD1 3.97Å
63S51.6Low51Low55 Ų55102 Ų10239%0.38554%0.541SS..  trans-74.2123.3170.5-176.50000109.4S65 D66S63-S65 PolarHBondContact O-N 2.93Å; S63-D66 PolarHBondContact O-N 3.22Å
64V52.2Low50.6Low117 Ų117100.7 Ų100.771%0.70955%0.554SS**THydrogen-bonded Turntrans-54.2-26176.4176.70000111.7L62 D66 W67L62-V64 PolarHBondContact O-N 3.09Å; V64-D66 VanDerWaalsContact C-N 3.29Å; V64-D66 PolarHBondContact O-N 3.16Å; V64-W67 WeakPolarHBondContact O-CB 3.46Å; V64-W67 PolarHBondContact O-N 3.45Å
65S52.3Low50.7Low75 Ų75103 Ų10352%0.52457%0.567SS.*Hα-helixtrans-63.9-29.1176.7-540000113.8S63 W67 Q68S63-S65 PolarHBondContact O-N 2.93Å; S65-W67 PolarHBondContact O-N 3.36Å; S65-Q68 PolarHBondContact O-N 2.89Å
66D52.9Low50.7Low91 Ų91103.3 Ų103.349%0.48757%0.568SS.*Hα-helixtrans-72.4-18.7-179.7-63.2-32.8000112.3S63 V64S63-D66 PolarHBondContact O-N 3.22Å; V64-D66 VanDerWaalsContact C-N 3.29Å; V64-D66 PolarHBondContact O-N 3.16Å
67W50.8Low51Low140 Ų140104.9 Ų104.953%0.5357%0.571SS.*Hα-helixtrans-72.6-31.9175.1-61.164000112V64 S65 H69 L79V64-W67 WeakPolarHBondContact O-CB 3.46Å; V64-W67 PolarHBondContact O-N 3.45Å; S65-W67 PolarHBondContact O-N 3.36Å; W67-H69 VanDerWaalsContact C-N 3.32Å; W67-H69 PolarHBondContact O-N 3.5Å; W67-L79 HydrophobicContact CE3-CD2 4.29Å; W67-L79 HydrophobicContact CH2-CD1 3.95Å; W67-L79 HydrophobicContact CH2-CD2 4.04Å; W67-L79 HydrophobicContact CZ2-CD1 3.71Å; W67-L79 HydrophobicContact CZ2-CD2 4.36Å; W67-L79 HydrophobicContact CZ3-CD2 4Å
68Q50.3Low51.7Low162 Ų162104.1 Ų104.176%0.75757%0.57SS**Hα-helixtrans-79.8-14-175.4-102.9179.1-15.300113.4S65S65-Q68 PolarHBondContact O-N 2.89Å
69H46.1Very low52.3Low164 Ų164104.8 Ų104.876%0.75957%0.567SS**SBendtrans-124.511.8-175.1-63.9-28.7000114.6W67 S71W67-H69 VanDerWaalsContact C-N 3.32Å; W67-H69 PolarHBondContact O-N 3.5Å; H69-S71 PolarHBondContact O-N 2.92Å
70S43.3Very low53.2Low44 Ų44101.6 Ų101.631%0.30856%0.56SS.*THydrogen-bonded Turntrans-78.419.2-175.9740000115.7E72S70-E72 PolarHBondContact O-N 3.26Å
71S49.9Very low54.1Low119 Ų119104 Ų10483%0.83257%0.569SS**THydrogen-bonded Turntrans-71.8-12.1179.2-163.30000113.6H69H69-S71 PolarHBondContact O-N 2.92Å
72E48.7Very low54.9Low176 Ų176101.1 Ų101.182%0.82255%0.55SS**SBendtrans-132.4-13.5-172-70.9-171.8156.800116.8S70S70-E72 PolarHBondContact O-N 3.26Å
73N44.5Very low55.8Low126 Ų126101.6 Ų101.667%0.67455%0.553SS**SBendtrans-126.9142.2-178.7-66.8-26.4000111.2N75N73-N75 PolarHBondContact O-N 3.36Å
74G51.8Low57Low66 Ų66101.7 Ų101.768%0.6855%0.553SS**SBendtrans-57.432.9-170.200000118.9V76G74-V76 VanDerWaalsContact C-N 3.26Å; G74-V76 PolarHBondContact O-N 3.1Å
75N55.6Low58.3Low82 Ų8298.8 Ų98.844%0.43954%0.538SS..Hα-helixtrans-73.3-15.2173.4-71.5-3.8000112.9N73 E77 L79N73-N75 PolarHBondContact O-N 3.36Å; N75-E77 VanDerWaalsContact C-N 3.34Å; N75-L79 VanDerWaalsContact O-CB 3.29Å; N75-L79 WeakPolarHBondContact O-CB 3.39Å; N75-L79 PolarHBondContact O-N 3.06Å
76V58.4Low59.4Low81 Ų8199 Ų9949%0.49154%0.536SS..Hα-helixtrans-66-38.8177-175.90000110.9G74 L79 V80G74-V76 VanDerWaalsContact C-N 3.26Å; G74-V76 PolarHBondContact O-N 3.1Å; V76-L79 PolarHBondContact O-N 3.35Å; V76-V80 HydrophobicContact CG1-CG2 4.39Å; V76-V80 VanDerWaalsContact O-CG2 3.3Å; V76-V80 WeakPolarHBondContact O-CG2 3.46Å; V76-V80 PolarHBondContact O-N 3.44Å
77E62.1Low60.5Low160 Ų16098.2 Ų98.275%0.74853%0.531SS*.Hα-helixtrans-66.2-44.9178.8-129.1170.6-166.500111.1N75 L79 V80 E81N75-E77 VanDerWaalsContact C-N 3.34Å; E77-L79 VanDerWaalsContact C-N 3.3Å; E77-L79 PolarHBondContact O-N 3.13Å; E77-V80 PolarHBondContact O-N 3.4Å; E77-E81 PolarHBondContact O-N 2.99Å
78L62.8Low62Low94 Ų9498 Ų9849%0.49254%0.536SS..Hα-helixtrans-61.9-38.9174.6-157.283.8000111.5H82L78-H82 WeakPolarHBondContact O-CB 3.24Å; L78-H82 PolarHBondContact O-N 3.41Å
79L63Low63.4Low41 Ų4195 Ų9522%0.21552%0.522CS..Hα-helixtrans-67.4-40.1177.5-176.766.1000112.1L62 W67 N75 V76 E77 H82 L83L62-L79 HydrophobicContact CD1-CD1 4.21Å; L62-L79 HydrophobicContact CD2-CD1 3.97Å; W67-L79 HydrophobicContact CE3-CD2 4.29Å; W67-L79 HydrophobicContact CH2-CD1 3.95Å; W67-L79 HydrophobicContact CH2-CD2 4.04Å; W67-L79 HydrophobicContact CZ2-CD1 3.71Å; W67-L79 HydrophobicContact CZ2-CD2 4.36Å; W67-L79 HydrophobicContact CZ3-CD2 4Å; N75-L79 VanDerWaalsContact O-CB 3.29Å; N75-L79 WeakPolarHBondContact O-CB 3.39Å; N75-L79 PolarHBondContact O-N 3.06Å; V76-L79 PolarHBondContact O-N 3.35Å; E77-L79 VanDerWaalsContact C-N 3.3Å; E77-L79 PolarHBondContact O-N 3.13Å; L79-H82 WeakPolarHBondContact O-CB 3.4Å; L79-H82 PolarHBondContact O-N 3.05Å; L79-L83 HydrophobicContact CD1-CD1 4.28Å; L79-L83 HydrophobicContact CG-CD1 4.43Å; L79-L83 PolarHBondContact O-N 2.93Å
80V68.3Low65.1Low85 Ų8594.7 Ų94.752%0.51551%0.514SS..Hα-helixtrans-67.5-42.2176.5171.10000111V76 E77 H82 L83 S84V76-V80 HydrophobicContact CG1-CG2 4.39Å; V76-V80 VanDerWaalsContact O-CG2 3.3Å; V76-V80 WeakPolarHBondContact O-CG2 3.46Å; V76-V80 PolarHBondContact O-N 3.44Å; E77-V80 PolarHBondContact O-N 3.4Å; V80-H82 PolarHBondContact O-N 2.93Å; V80-L83 PolarHBondContact O-N 3.48Å; V80-S84 WeakPolarHBondContact O-CB 3.31Å; V80-S84 PolarHBondContact O-N 3.06Å; V80-S84 PolarHBondContact O-OG 3.38Å
81E71.2Confident67.1Low138 Ų13895.2 Ų95.265%0.64551%0.514SS*.Hα-helixtrans-58.8-40.5170.7-99.2-171.6157.100110.9E77 S84 S85E77-E81 PolarHBondContact O-N 2.99Å; E81-S84 PolarHBondContact O-N 2.94Å; E81-S85 PolarHBondContact O-N 3.13Å
82H66.7Low68.6Low29 Ų2995.7 Ų95.713%0.13450%0.501CS..Hα-helixtrans-66.5-48.2179.1-140.769.2000112.8K59 L78 L79 V80 S84 S85 V86K59-H82 WeakPolarHBondContact CA-CE1 3.49Å; K59-H82 PolarHBondContact O-CE1 3.02Å; K59-H82 PolarHBondContact O-NE2 3.5Å; K59-H82 VanDerWaalsContact O-NE2 3.16Å; L78-H82 WeakPolarHBondContact O-CB 3.24Å; L78-H82 PolarHBondContact O-N 3.41Å; L79-H82 WeakPolarHBondContact O-CB 3.4Å; L79-H82 PolarHBondContact O-N 3.05Å; V80-H82 PolarHBondContact O-N 2.93Å; H82-S84 PolarHBondContact O-N 3.37Å; H82-S85 PolarHBondContact O-N 3.1Å; H82-V86 WeakPolarHBondContact O-CG2 3.43Å; H82-V86 PolarHBondContact O-N 3.33Å
83L69.4Low70.2Confident89 Ų8993.6 Ų93.647%0.46649%0.486SS..Hα-helixtrans-57.9-42.3175.1-117.585.2000110.6L79 V80 V86 I87L79-L83 HydrophobicContact CD1-CD1 4.28Å; L79-L83 HydrophobicContact CG-CD1 4.43Å; L79-L83 PolarHBondContact O-N 2.93Å; V80-L83 PolarHBondContact O-N 3.48Å; L83-V86 PolarHBondContact O-N 3.45Å; L83-I87 WeakPolarHBondContact O-CB 3.29Å; L83-I87 WeakPolarHBondContact O-CD1 3.28Å; L83-I87 WeakPolarHBondContact O-CG1 3.4Å; L83-I87 PolarHBondContact O-N 3.39Å
84S77.8Confident71.9Confident56 Ų5690.3 Ų90.339%0.39248%0.476SS..Hα-helixtrans-62.7-45.5178.3-55.70000111.2V80 E81 H82 V86 I87 E88V80-S84 WeakPolarHBondContact O-CB 3.31Å; V80-S84 PolarHBondContact O-N 3.06Å; V80-S84 PolarHBondContact O-OG 3.38Å; E81-S84 PolarHBondContact O-N 2.94Å; H82-S84 PolarHBondContact O-N 3.37Å; S84-V86 PolarHBondContact O-N 3.25Å; S84-I87 PolarHBondContact O-N 3.42Å; S84-E88 WeakPolarHBondContact O-CG 3.35Å; S84-E88 PolarHBondContact O-N 3.28Å
85S78.2Confident73.1Confident56 Ų5694 Ų9439%0.39247%0.47SS..Hα-helixtrans-62.2-40.7175.9-172.80000112.8E81 H82 E88 E89E81-S85 PolarHBondContact O-N 3.13Å; H82-S85 PolarHBondContact O-N 3.1Å; S85-E88 PolarHBondContact O-N 2.67Å; S85-E89 PolarHBondContact O-N 3.1Å
86V75Confident74.2Confident79 Ų7993.8 Ų93.848%0.47947%0.469SS..Hα-helixtrans-69.1-37.2178.3172.20000111.3H82 L83 S84 E89 R90H82-V86 WeakPolarHBondContact O-CG2 3.43Å; H82-V86 PolarHBondContact O-N 3.33Å; L83-V86 PolarHBondContact O-N 3.45Å; S84-V86 PolarHBondContact O-N 3.25Å; V86-E89 PolarHBondContact O-N 3.07Å; V86-R90 WeakPolarHBondContact O-CB 3.46Å; V86-R90 PolarHBondContact O-N 3.1Å
87I77.9Confident75Confident75 Ų7595.9 Ų95.939%0.38548%0.477SS..Hα-helixtrans-64.8-44.4173.6-69.3163.3000110L83 S84 E89 R90 D91L83-I87 WeakPolarHBondContact O-CB 3.29Å; L83-I87 WeakPolarHBondContact O-CD1 3.28Å; L83-I87 WeakPolarHBondContact O-CG1 3.4Å; L83-I87 PolarHBondContact O-N 3.39Å; S84-I87 PolarHBondContact O-N 3.42Å; I87-E89 PolarHBondContact O-N 3.18Å; I87-R90 WeakPolarHBondContact O-CB 3.28Å; I87-R90 PolarHBondContact O-N 3.06Å; I87-D91 WeakPolarHBondContact O-CB 3.41Å; I87-D91 PolarHBondContact O-N 3.12Å
88E80.4Confident75.7Confident136 Ų13693.4 Ų93.464%0.63647%0.468SS*.Hα-helixtrans-61.5-42175.8-76.8-176.817900112.5S84 S85 D91 K92S84-E88 WeakPolarHBondContact O-CG 3.35Å; S84-E88 PolarHBondContact O-N 3.28Å; S85-E88 PolarHBondContact O-N 2.67Å; E88-D91 PolarHBondContact O-N 3.4Å; E88-K92 WeakPolarHBondContact O-CB 3.49Å; E88-K92 PolarHBondContact O-N 3.31Å
89E81.1Confident76.2Confident100 Ų10094.3 Ų94.347%0.46747%0.469SS..Hα-helixtrans-63.7-46.4174.2-78.2-160166.300111.8S85 V86 I87 D91 K92 Y93S85-E89 PolarHBondContact O-N 3.1Å; V86-E89 PolarHBondContact O-N 3.07Å; I87-E89 PolarHBondContact O-N 3.18Å; E89-D91 VanDerWaalsContact C-N 3.27Å; E89-D91 PolarHBondContact O-N 3.39Å; E89-K92 WeakPolarHBondContact O-CB 3.39Å; E89-K92 PolarHBondContact O-N 3.5Å; E89-K92 VanDerWaalsContact O-N 3.13Å; E89-Y93 HydrophobicContact CB-CD2 4.43Å; E89-Y93 HydrophobicContact CB-CE2 4.15Å; E89-Y93 WeakPolarHBondContact O-CD2 3.48Å; E89-Y93 PolarHBondContact O-N 3.09Å
90R81.7Confident76.4Confident156 Ų15697.7 Ų97.759%0.58949%0.486SS*.Hα-helixtrans-55.8-45.6175.4-176.3-159.171.4168.6-0.7110.7V86 I87 K92 Y93 A94V86-R90 WeakPolarHBondContact O-CB 3.46Å; V86-R90 PolarHBondContact O-N 3.1Å; I87-R90 WeakPolarHBondContact O-CB 3.28Å; I87-R90 PolarHBondContact O-N 3.06Å; R90-K92 VanDerWaalsContact C-N 3.3Å; R90-K92 PolarHBondContact O-N 3.48Å; R90-Y93 PolarHBondContact O-N 2.68Å; R90-A94 WeakPolarHBondContact O-CB 3.36Å; R90-A94 PolarHBondContact O-N 2.82Å
91D83.9Confident76.4Confident56 Ų5696.5 Ų96.530%0.29948%0.481SS..Hα-helixtrans-70-31.2-178.9-67.9-5000111.4I87 E88 E89 R95I87-D91 WeakPolarHBondContact O-CB 3.41Å; I87-D91 PolarHBondContact O-N 3.12Å; E88-D91 PolarHBondContact O-N 3.4Å; E89-D91 VanDerWaalsContact C-N 3.27Å; E89-D91 PolarHBondContact O-N 3.39Å; D91-R95 WeakPolarHBondContact O-CB 3.36Å; D91-R95 PolarHBondContact O-N 3.16Å
92K83.4Confident76.1Confident129 Ų12995 Ų9556%0.56147%0.474SS*.Hα-helixtrans-68-44.3171.5-161.3179.5-176.1-177.20111.7E88 E89 R90 R95 N96E88-K92 WeakPolarHBondContact O-CB 3.49Å; E88-K92 PolarHBondContact O-N 3.31Å; E89-K92 WeakPolarHBondContact O-CB 3.39Å; E89-K92 PolarHBondContact O-N 3.5Å; E89-K92 VanDerWaalsContact O-N 3.13Å; R90-K92 VanDerWaalsContact C-N 3.3Å; R90-K92 PolarHBondContact O-N 3.48Å; K92-R95 PolarHBondContact O-N 3.36Å; K92-N96 PolarHBondContact O-N 2.91Å; K92-N96 PolarHBondContact O-OD1 3.02Å
93Y81.7Confident75.9Confident132 Ų13298.9 Ų98.952%0.51849%0.492SS..Hα-helixtrans-65.4-40.2174.3-69.9-59.9000111.9E89 R90 N96 L97E89-Y93 HydrophobicContact CB-CD2 4.43Å; E89-Y93 HydrophobicContact CB-CE2 4.15Å; E89-Y93 WeakPolarHBondContact O-CD2 3.48Å; E89-Y93 PolarHBondContact O-N 3.09Å; R90-Y93 PolarHBondContact O-N 2.68Å; Y93-N96 PolarHBondContact O-N 3.4Å; Y93-L97 WeakPolarHBondContact O-CB 3.38Å; Y93-L97 PolarHBondContact O-N 3.47Å
94A79.5Confident75.1Confident56 Ų56101.4 Ų101.446%0.46350%0.501SS..Hα-helixtrans-63.2-41.8175.500000111.6R90 L97 L98R90-A94 WeakPolarHBondContact O-CB 3.36Å; R90-A94 PolarHBondContact O-N 2.82Å; A94-L97 PolarHBondContact O-N 3.47Å; A94-L98 WeakPolarHBondContact O-CB 3.49Å; A94-L98 PolarHBondContact O-N 3.2Å
95R76.4Confident73.8Confident143 Ų143105.1 Ų105.154%0.5451%0.513SS..Hα-helixtrans-61.2-49172.2-97.3178.9-80.9105.8-0112D91 K92 L97 L98 E99D91-R95 WeakPolarHBondContact O-CB 3.36Å; D91-R95 PolarHBondContact O-N 3.16Å; K92-R95 PolarHBondContact O-N 3.36Å; R95-L97 VanDerWaalsContact C-N 3.28Å; R95-L97 PolarHBondContact O-N 2.87Å; R95-L98 WeakPolarHBondContact O-CB 3.21Å; R95-L98 PolarHBondContact O-N 3.05Å; R95-L98 VanDerWaalsContact O-N 3.14Å; R95-E99 WeakPolarHBondContact O-CB 3.49Å; R95-E99 PolarHBondContact O-N 3.09Å
96N80Confident72.4Confident79 Ų79105.3 Ų105.342%0.42251%0.514SS..Hα-helixtrans-61.9-36.5177-75.419.8000112K92 Y93 L98 E99 M100K92-N96 PolarHBondContact O-N 2.91Å; K92-N96 PolarHBondContact O-OD1 3.02Å; Y93-N96 PolarHBondContact O-N 3.4Å; N96-L98 VanDerWaalsContact C-N 3.35Å; N96-E99 PolarHBondContact O-N 3.29Å; N96-M100 VanDerWaalsContact O-CB 3.26Å; N96-M100 WeakPolarHBondContact O-CB 3.35Å; N96-M100 WeakPolarHBondContact O-CG 3.46Å; N96-M100 PolarHBondContact O-N 3.47Å
97L74.8Confident71.1Confident125 Ų125106.2 Ų106.265%0.65452%0.52SS*.Hα-helixtrans-66.5-39.8176-145.990.8000111.1Y93 A94 R95 S101Y93-L97 WeakPolarHBondContact O-CB 3.38Å; Y93-L97 PolarHBondContact O-N 3.47Å; A94-L97 PolarHBondContact O-N 3.47Å; R95-L97 VanDerWaalsContact C-N 3.28Å; R95-L97 PolarHBondContact O-N 2.87Å; L97-S101 VanDerWaalsContact O-CB 3.3Å; L97-S101 WeakPolarHBondContact O-CB 3.37Å; L97-S101 PolarHBondContact O-N 3.23Å; L97-S101 PolarHBondContact O-OG 3.28Å
98L75.7Confident69.5Low107 Ų107106.2 Ų106.256%0.5653%0.526SS*.Hα-helixtrans-65.8-43.4175.6-158.189000110.8A94 R95 N96 S101 Q102A94-L98 WeakPolarHBondContact O-CB 3.49Å; A94-L98 PolarHBondContact O-N 3.2Å; R95-L98 WeakPolarHBondContact O-CB 3.21Å; R95-L98 PolarHBondContact O-N 3.05Å; R95-L98 VanDerWaalsContact O-N 3.14Å; N96-L98 VanDerWaalsContact C-N 3.35Å; L98-S101 CarbonylContact O-C 3.5Å; L98-S101 WeakPolarHBondContact O-CB 3.38Å; L98-S101 PolarHBondContact O-N 2.94Å; L98-Q102 WeakPolarHBondContact O-CB 3.37Å; L98-Q102 VanDerWaalsContact O-CG 3.28Å; L98-Q102 WeakPolarHBondContact O-CG 3.39Å; L98-Q102 PolarHBondContact O-N 3.14Å
99E74.4Confident67.8Low113 Ų113103.5 Ų103.553%0.52852%0.522SS..Hα-helixtrans-65-45.4178.1-152.7169.1-148.900110.6R95 N96 S101 Q102 E103R95-E99 WeakPolarHBondContact O-CB 3.49Å; R95-E99 PolarHBondContact O-N 3.09Å; N96-E99 PolarHBondContact O-N 3.29Å; E99-S101 VanDerWaalsContact C-N 3.3Å; E99-S101 PolarHBondContact O-N 3.17Å; E99-Q102 CarbonylContact O-C 3.58Å; E99-Q102 PolarHBondContact O-N 3.49Å; E99-E103 WeakPolarHBondContact O-CB 3.34Å; E99-E103 WeakPolarHBondContact O-CG 3.43Å; E99-E103 PolarHBondContact O-N 3.46Å
100M67.3Low65.8Low112 Ų112105.4 Ų105.455%0.55254%0.536SS*.Hα-helixtrans-60.1-37170.6-75.5-78-54.600112.7N96 E103 H104N96-M100 VanDerWaalsContact O-CB 3.26Å; N96-M100 WeakPolarHBondContact O-CB 3.35Å; N96-M100 WeakPolarHBondContact O-CG 3.46Å; N96-M100 PolarHBondContact O-N 3.47Å; M100-E103 PolarHBondContact O-N 3.22Å; M100-H104 WeakPolarHBondContact O-CB 3.28Å; M100-H104 PolarHBondContact O-N 3.05Å
101S68.2Low63.7Low61 Ų61102.2 Ų102.243%0.42753%0.534SS..Hα-helixtrans-69.9-38.2176.4-57.30000111.3L97 L98 E99 H104 E105L97-S101 VanDerWaalsContact O-CB 3.3Å; L97-S101 WeakPolarHBondContact O-CB 3.37Å; L97-S101 PolarHBondContact O-N 3.23Å; L97-S101 PolarHBondContact O-OG 3.28Å; L98-S101 CarbonylContact O-C 3.5Å; L98-S101 WeakPolarHBondContact O-CB 3.38Å; L98-S101 PolarHBondContact O-N 2.94Å; E99-S101 VanDerWaalsContact C-N 3.3Å; E99-S101 PolarHBondContact O-N 3.17Å; S101-H104 PolarHBondContact O-N 3.03Å; S101-E105 PolarHBondContact O-N 2.91Å
102Q64.6Low61.5Low106 Ų106103.5 Ų103.550%0.49555%0.552SS.*Hα-helixtrans-70.2-34.8173.7-72.4174.412.600112L98 E99 E105 S106L98-Q102 WeakPolarHBondContact O-CB 3.37Å; L98-Q102 VanDerWaalsContact O-CG 3.28Å; L98-Q102 WeakPolarHBondContact O-CG 3.39Å; L98-Q102 PolarHBondContact O-N 3.14Å; E99-Q102 CarbonylContact O-C 3.58Å; E99-Q102 PolarHBondContact O-N 3.49Å; Q102-E105 PolarHBondContact O-N 3.04Å; Q102-S106 WeakPolarHBondContact O-CB 3.41Å; Q102-S106 PolarHBondContact O-N 3.38Å; Q102-S106 PolarHBondContact O-OG 3.12Å
103E61.8Low59.2Low111 Ų111102.5 Ų102.552%0.51956%0.561SS.*Hα-helixtrans-65.6-40.9169.7-74.7-174178.600110.8E99 M100 E105 S106 V107E99-E103 WeakPolarHBondContact O-CB 3.34Å; E99-E103 WeakPolarHBondContact O-CG 3.43Å; E99-E103 PolarHBondContact O-N 3.46Å; M100-E103 PolarHBondContact O-N 3.22Å; E103-E105 VanDerWaalsContact C-N 3.35Å; E103-E105 PolarHBondContact O-N 2.79Å; E103-S106 WeakPolarHBondContact CA-OG 3.31Å; E103-S106 PolarHBondContact O-N 3.09Å; E103-S106 PolarHBondContact O-OG 2.97Å; E103-V107 WeakPolarHBondContact O-CG2 3.28Å; E103-V107 PolarHBondContact O-N 3.48Å
104H53.6Low56.8Low141 Ų141104.1 Ų104.165%0.65358%0.578SS**Hα-helixtrans-65.6-37.2173.2-121.5-76.1000112.4M100 S101 S108M100-H104 WeakPolarHBondContact O-CB 3.28Å; M100-H104 PolarHBondContact O-N 3.05Å; S101-H104 PolarHBondContact O-N 3.03Å; H104-S108 WeakPolarHBondContact O-CB 3.44Å; H104-S108 PolarHBondContact O-N 3.46Å
105E49.6Very low54.6Low135 Ų135106.7 Ų106.763%0.63159%0.591SS**Hα-helixtrans-70.9-35173.3-83-16915800112.5S101 Q102 E103 S108 S109S101-E105 PolarHBondContact O-N 2.91Å; Q102-E105 PolarHBondContact O-N 3.04Å; E103-E105 VanDerWaalsContact C-N 3.35Å; E103-E105 PolarHBondContact O-N 2.79Å; E105-S108 PolarHBondContact O-N 3.01Å; E105-S109 VanDerWaalsContact O-CB 3.23Å; E105-S109 WeakPolarHBondContact O-CB 3.19Å; E105-S109 PolarHBondContact O-N 3.33Å; E105-S109 PolarHBondContact O-OG 3.16Å
106S49Very low52.3Low60 Ų60107.9 Ų107.942%0.4261%0.608SS.*Hα-helixtrans-74.6-32.2176.859.10000112.4Q102 E103 N110Q102-S106 WeakPolarHBondContact O-CB 3.41Å; Q102-S106 PolarHBondContact O-N 3.38Å; Q102-S106 PolarHBondContact O-OG 3.12Å; E103-S106 WeakPolarHBondContact CA-OG 3.31Å; E103-S106 PolarHBondContact O-N 3.09Å; E103-S106 PolarHBondContact O-OG 2.97Å; S106-N110 PolarHBondContact O-N 3.4Å
107V48.2Very low49.9Very low98 Ų98106.9 Ų106.959%0.59462%0.617SS**Hα-helixtrans-73.2-35.3169178.60000111.3E103 N110E103-V107 WeakPolarHBondContact O-CG2 3.28Å; E103-V107 PolarHBondContact O-N 3.48Å; V107-N110 PolarHBondContact O-N 3.29Å
108S44.9Very low48Very low74 Ų74112.3 Ų112.352%0.51763%0.63SS.*Hα-helixtrans-68.3-37173.6-156.80000111.8H104 E105 N110 T111 A112H104-S108 WeakPolarHBondContact O-CB 3.44Å; H104-S108 PolarHBondContact O-N 3.46Å; E105-S108 PolarHBondContact O-N 3.01Å; S108-N110 PolarHBondContact O-N 2.87Å; S108-T111 PolarHBondContact O-N 3.2Å; S108-T111 VanDerWaalsContact O-N 3.1Å; S108-T111 PolarHBondContact O-OG1 3.49Å; S108-A112 PolarHBondContact O-N 3.01Å
109S43.1Very low45.9Very low80 Ų80112.2 Ų112.256%0.55965%0.645SS**Hα-helixtrans-65.4-27176.2-60.60000112.7E105 T111E105-S109 VanDerWaalsContact O-CB 3.23Å; E105-S109 WeakPolarHBondContact O-CB 3.19Å; E105-S109 PolarHBondContact O-N 3.33Å; E105-S109 PolarHBondContact O-OG 3.16Å; S109-T111 VanDerWaalsContact C-N 3.34Å
110N39.5Very low43.9Very low140 Ų140112.5 Ų112.575%0.74966%0.659SS**THydrogen-bonded Turntrans-82-5.4175.3-76-18.4000114.5S106 V107 S108S106-N110 PolarHBondContact O-N 3.4Å; V107-N110 PolarHBondContact O-N 3.29Å; S108-N110 PolarHBondContact O-N 2.87Å
111T39Very low42Very low89 Ų89114.6 Ų114.655%0.54667%0.668SS.*THydrogen-bonded Turntrans-109.5-10.2174.659.60000114.2S108 S109 S113S108-T111 PolarHBondContact O-N 3.2Å; S108-T111 VanDerWaalsContact O-N 3.1Å; S108-T111 PolarHBondContact O-OG1 3.49Å; S109-T111 VanDerWaalsContact C-N 3.34Å; T111-S113 VanDerWaalsContact C-N 3.31Å; T111-S113 PolarHBondContact O-N 3.28Å
112A37.5Very low40.1Very low83 Ų83121.8 Ų121.869%0.68669%0.685SS**THydrogen-bonded Turntrans-76.4-11.4176.700000114.5S108S108-A112 PolarHBondContact O-N 3.01Å
113S34Very low38.4Very low108 Ų108126.8 Ų126.876%0.75571%0.705SS**THydrogen-bonded Turntrans-1004.1-176.7-153.90000115.6T111T111-S113 VanDerWaalsContact C-N 3.31Å; T111-S113 PolarHBondContact O-N 3.28Å
114L32.8Very low36.7Very low165 Ų165129.4 Ų129.486%0.86472%0.722SS**SBendtrans-130.946.8173.4-76170.5000112
115C31.6Very low35.9Very low110 Ų110127.7 Ų127.774%0.74372%0.724SS**  trans-133.835.3171.3-540000112.2
116N29.9Very low34.9Very low168 Ų168129 Ų12990%0.89874%0.735SS**SBendtrans-112.7110.7168.9-130.227.2000108.7
117G29Very low33.9Very low58 Ų58129.3 Ų129.360%0.59875%0.748SS**  trans99.957.5152.700000118.6
118Y33.7Very low33.2Very low239 Ų239132.5 Ų132.594%0.93776%0.756SS**  trans-136.651.7148.9-62.2-73.1000111.9S120Y118-S120 VanDerWaalsContact C-N 3.3Å; Y118-S120 PolarHBondContact O-N 2.88Å
119A33Very low32.5Very low106 Ų106136.6 Ų136.688%0.87677%0.767SS**  trans-88.769.8158.500000108.9
120S31Very low32Very low118 Ų118140 Ų14083%0.82577%0.774SS**  trans-98.4107164.5-1180000109.1Y118Y118-S120 VanDerWaalsContact C-N 3.3Å; Y118-S120 PolarHBondContact O-N 2.88Å
121H29Very low31.6Very low157 Ų157141.6 Ų141.673%0.72778%0.777SS**  trans-55.7132.1169.2-98.1-63.5000111.8
122R27.1Very low31.2Very low212 Ų212145.9 Ų145.980%0.879%0.791SS**  trans52.8109.7140.2-57.7-177.7-153.9-133.63.8117.6
123K29.1Very low31Very low211 Ų211148.6 Ų148.692%0.91779%0.794SS**  -165.8100120.1-99.4168.1-170.8-173.60109.8
124L26.8Very low31.1Very low165 Ų165154.6 Ų154.686%0.86480%0.802SS**  trans-63.9160.4140.8-78.1145.8000107.9
125P35.6Very low31.7Very low106 Ų106157.8 Ų157.869%0.68880%0.802SS**  cis-143.7175.623.640.3-19.9000117.2
126D29.4Very low32.2Very low162 Ų162160.4 Ų160.487%0.86680%0.804SS**  trans58.4113.1145.5-71.4-17.1000121.6
127G28.6Very low33.1Very low67 Ų67154.1 Ų154.169%0.69178%0.779SS**  trans171.683156.700000115.9
128Q32.8Very low34.5Very low165 Ų165154.7 Ų154.777%0.77177%0.773SS**  trans85.1121142.7-54.7178.2-45.800119.3
129Q31.1Very low35.6Very low160 Ų160146.7 Ų146.775%0.74876%0.757SS**  trans69.9136.4137-71.4164.1-10.500116.1
130Q32.2Very low36.9Very low150 Ų150148.3 Ų148.370%0.70175%0.746SS**  cis-171.1113.67.8-146.1148.5-15.100102.6
131Q29.7Very low38.6Very low174 Ų174151.7 Ų151.781%0.81374%0.741SS**  57.982.6107.3-156.7174.436.500115.4
132Q32.1Very low40.5Very low179 Ų179149.2 Ų149.284%0.83673%0.729SS**  trans159.7123.8156.7-95.2167-12.800104.9
133D33.6Very low42.6Very low141 Ų141141.3 Ų141.375%0.75471%0.709SS**  cis-149.8128.135.2-82.6-50.8000111R135D133-R135 PolarHBondContact O-N 3.38Å
134Y35.9Very low45Very low233 Ų233135.7 Ų135.791%0.91469%0.692SS**THydrogen-bonded Turntrans-75.796163.9-74.4-94.6000108.5
135R44.3Very low47.4Very low232 Ų232132.2 Ų132.288%0.87567%0.674SS**THydrogen-bonded Turntrans-165-17.3155.8-106.5156.4-164.6-156.14.3115.9D133D133-R135 PolarHBondContact O-N 3.38Å
136E42.1Very low49.4Very low166 Ų166132.9 Ų132.978%0.77667%0.667SS**THydrogen-bonded Turntrans-88.4-19.4-179.4-70.5-179.5162.400114.4S138 A139 E140E136-S138 PolarHBondContact O-N 3.45Å; E136-S138 VanDerWaalsContact O-N 3.14Å; E136-A139 PolarHBondContact O-N 3.33Å; E136-E140 PolarHBondContact O-N 3.28Å
137G50.1Low51.7Low36 Ų36129.8 Ų129.837%0.37165%0.65SS.*Hα-helixtrans-69.2-11.7-179.800000115.6R141G137-R141 VanDerWaalsContact O-CB 3.31Å; G137-R141 WeakPolarHBondContact O-CB 3.27Å; G137-R141 WeakPolarHBondContact O-CD 3.43Å; G137-R141 WeakPolarHBondContact O-CG 3.32Å; G137-R141 PolarHBondContact O-N 3.44Å
138S56.5Low54.4Low70 Ų70129.1 Ų129.149%0.4964%0.639SS.*Hα-helixtrans-76.7-52.6173.2-173.60000110.5E136 E140 R141 H142E136-S138 PolarHBondContact O-N 3.45Å; E136-S138 VanDerWaalsContact O-N 3.14Å; S138-E140 VanDerWaalsContact C-N 3.26Å; S138-E140 PolarHBondContact O-N 2.98Å; S138-R141 PolarHBondContact O-N 3.18Å; S138-H142 PolarHBondContact O-N 2.72Å; S138-H142 PolarHBondContact O-ND1 3.02Å; S138-H142 PolarHBondContact OG-CE1 2.59Å; S138-H142 PolarHBondContact OG-ND1 3.18Å
139A57.4Low57.1Low71 Ų71126.5 Ų126.559%0.58763%0.626SS**Hα-helixtrans-60.3-39.6-179.900000111.3E136 H142 A143E136-A139 PolarHBondContact O-N 3.33Å; A139-H142 PolarHBondContact O-N 2.92Å; A139-A143 VanDerWaalsContact O-CB 3.29Å; A139-A143 WeakPolarHBondContact O-CB 3.42Å; A139-A143 PolarHBondContact O-N 3.4Å
140E60.8Low59.4Low140 Ų140122.6 Ų122.665%0.65462%0.616SS**Hα-helixtrans-68.9-38.6178.3-144.9168.4-155.500112.4E136 S138 V144E136-E140 PolarHBondContact O-N 3.28Å; S138-E140 VanDerWaalsContact C-N 3.26Å; S138-E140 PolarHBondContact O-N 2.98Å; E140-V144 WeakPolarHBondContact O-CB 3.41Å; E140-V144 WeakPolarHBondContact O-CG2 3.18Å; E140-V144 PolarHBondContact O-N 2.96Å
141R66.8Low62.1Low188 Ų188120.7 Ų120.771%0.70961%0.605SS**Hα-helixtrans-66.5-40.2171.9-74.9175.8-163.5-166.95.5112.4G137 S138 V144 I145G137-R141 VanDerWaalsContact O-CB 3.31Å; G137-R141 WeakPolarHBondContact O-CB 3.27Å; G137-R141 WeakPolarHBondContact O-CD 3.43Å; G137-R141 WeakPolarHBondContact O-CG 3.32Å; G137-R141 PolarHBondContact O-N 3.44Å; S138-R141 PolarHBondContact O-N 3.18Å; R141-V144 PolarHBondContact O-N 2.88Å; R141-I145 WeakPolarHBondContact O-CB 3.36Å; R141-I145 WeakPolarHBondContact O-CD1 3.28Å; R141-I145 WeakPolarHBondContact O-CG1 3.47Å; R141-I145 PolarHBondContact O-N 3.47Å
142H68.4Low65Low106 Ų106114.2 Ų114.249%0.49158%0.582SS.*Hα-helixtrans-65.2-46175.6-72.682.1000110.5S138 A139 V144 I145 E146S138-H142 PolarHBondContact O-N 2.72Å; S138-H142 PolarHBondContact O-ND1 3.02Å; S138-H142 PolarHBondContact OG-CE1 2.59Å; S138-H142 PolarHBondContact OG-ND1 3.18Å; A139-H142 PolarHBondContact O-N 2.92Å; H142-V144 VanDerWaalsContact C-N 3.3Å; H142-V144 PolarHBondContact O-N 3.3Å; H142-I145 CarbonylContact O-C 3.6Å; H142-I145 PolarHBondContact O-N 2.93Å; H142-I145 VanDerWaalsContact O-N 3.11Å; H142-E146 WeakPolarHBondContact O-CB 3.36Å; H142-E146 WeakPolarHBondContact O-CG 3.48Å; H142-E146 PolarHBondContact O-N 3.36Å
143A71.3Confident67.8Low45 Ų45110.5 Ų110.537%0.37256%0.564SS.*Hα-helixtrans-59.8-39.5175.300000111.9A139 L147A139-A143 VanDerWaalsContact O-CB 3.29Å; A139-A143 WeakPolarHBondContact O-CB 3.42Å; A139-A143 PolarHBondContact O-N 3.4Å; A143-L147 VanDerWaalsContact O-CB 3.25Å; A143-L147 WeakPolarHBondContact O-CB 3.09Å; A143-L147 PolarHBondContact O-N 2.87Å
144V79.4Confident70.6Confident94 Ų94108.1 Ų108.157%0.5755%0.551SS**Hα-helixtrans-67.3-39.3174.6169.20000111.9E140 R141 H142 A148E140-V144 WeakPolarHBondContact O-CB 3.41Å; E140-V144 WeakPolarHBondContact O-CG2 3.18Å; E140-V144 PolarHBondContact O-N 2.96Å; R141-V144 PolarHBondContact O-N 2.88Å; H142-V144 VanDerWaalsContact C-N 3.3Å; H142-V144 PolarHBondContact O-N 3.3Å; V144-A148 VanDerWaalsContact O-CB 3.23Å; V144-A148 WeakPolarHBondContact O-CB 3.3Å; V144-A148 PolarHBondContact O-N 2.78Å
145I78.4Confident73.2Confident92 Ų92104.8 Ų104.847%0.47254%0.537SS..Hα-helixtrans-67.2-46175.8-69.3162.8000110.4R141 H142 A148 E149R141-I145 WeakPolarHBondContact O-CB 3.36Å; R141-I145 WeakPolarHBondContact O-CD1 3.28Å; R141-I145 WeakPolarHBondContact O-CG1 3.47Å; R141-I145 PolarHBondContact O-N 3.47Å; H142-I145 CarbonylContact O-C 3.6Å; H142-I145 PolarHBondContact O-N 2.93Å; H142-I145 VanDerWaalsContact O-N 3.11Å; I145-A148 CarbonylContact O-C 3.6Å; I145-A148 WeakPolarHBondContact O-CA 3.31Å; I145-A148 WeakPolarHBondContact O-CB 3.26Å; I145-A148 PolarHBondContact O-N 2.82Å; I145-A148 VanDerWaalsContact O-N 3.08Å; I145-E149 HydrophobicContact CG2-CG 4.42Å; I145-E149 WeakPolarHBondContact O-CB 3.21Å; I145-E149 WeakPolarHBondContact O-CG 3.2Å; I145-E149 PolarHBondContact O-N 3.24Å
146E77.6Confident75.6Confident119 Ų119100.4 Ų100.456%0.55652%0.52SS*.Hα-helixtrans-62.1-43175-72.5176.3-174.800111.2H142 A148 E149 C150H142-E146 WeakPolarHBondContact O-CB 3.36Å; H142-E146 WeakPolarHBondContact O-CG 3.48Å; H142-E146 PolarHBondContact O-N 3.36Å; E146-A148 VanDerWaalsContact C-N 3.28Å; E146-A148 PolarHBondContact O-N 3.13Å; E146-E149 PolarHBondContact O-N 3.04Å; E146-C150 VanDerWaalsContact O-CB 3.29Å; E146-C150 WeakPolarHBondContact O-CB 3.25Å; E146-C150 PolarHBondContact O-N 3.37Å; E146-C150 PolarHBondContact O-SG 3.31Å
147L76Confident77.9Confident97 Ų9795.4 Ų95.451%0.50850%0.503SS..Hα-helixtrans-61.5-37.1171.6-109.1149.6000111.9A143 K151A143-L147 VanDerWaalsContact O-CB 3.25Å; A143-L147 WeakPolarHBondContact O-CB 3.09Å; A143-L147 PolarHBondContact O-N 2.87Å; L147-K151 VanDerWaalsContact O-CB 3.24Å; L147-K151 WeakPolarHBondContact O-CB 3.22Å; L147-K151 WeakPolarHBondContact O-CG 3.24Å; L147-K151 PolarHBondContact O-N 3.12Å
148A86.9Confident80Confident54 Ų54100.9 Ų100.945%0.44651%0.513SS..Hα-helixtrans-70.8-39.9176.400000111.8V144 I145 E146 K151 A152V144-A148 VanDerWaalsContact O-CB 3.23Å; V144-A148 WeakPolarHBondContact O-CB 3.3Å; V144-A148 PolarHBondContact O-N 2.78Å; I145-A148 CarbonylContact O-C 3.6Å; I145-A148 WeakPolarHBondContact O-CA 3.31Å; I145-A148 WeakPolarHBondContact O-CB 3.26Å; I145-A148 PolarHBondContact O-N 2.82Å; I145-A148 VanDerWaalsContact O-N 3.08Å; E146-A148 VanDerWaalsContact C-N 3.28Å; E146-A148 PolarHBondContact O-N 3.13Å; A148-K151 CarbonylContact O-C 3.6Å; A148-K151 PolarHBondContact O-N 3.03Å; A148-A152 VanDerWaalsContact O-CB 3.26Å; A148-A152 WeakPolarHBondContact O-CB 3.32Å; A148-A152 PolarHBondContact O-N 2.98Å
149E88.1Confident81.8Confident110 Ų110102.6 Ų102.651%0.51451%0.513SS..Hα-helixtrans-66.1-46174.6-78.1-175.3174.300111.5I145 E146 K151 A152 Q153I145-E149 HydrophobicContact CG2-CG 4.42Å; I145-E149 WeakPolarHBondContact O-CB 3.21Å; I145-E149 WeakPolarHBondContact O-CG 3.2Å; I145-E149 PolarHBondContact O-N 3.24Å; E146-E149 PolarHBondContact O-N 3.04Å; E149-K151 VanDerWaalsContact C-N 3.35Å; E149-K151 PolarHBondContact O-N 3.46Å; E149-A152 CarbonylContact O-C 3.42Å; E149-A152 WeakPolarHBondContact O-CB 3.32Å; E149-A152 PolarHBondContact O-N 3.26Å; E149-A152 VanDerWaalsContact O-N 3.1Å; E149-Q153 WeakPolarHBondContact O-CB 3.46Å; E149-Q153 WeakPolarHBondContact O-CG 3.37Å; E149-Q153 PolarHBondContact O-N 2.95Å
150C79.4Confident83.5Confident77 Ų77103.9 Ų103.952%0.5251%0.507SS..Hα-helixtrans-60-43.6172.6-74.30000111.1E146 A152 Q153 L154E146-C150 VanDerWaalsContact O-CB 3.29Å; E146-C150 WeakPolarHBondContact O-CB 3.25Å; E146-C150 PolarHBondContact O-N 3.37Å; E146-C150 PolarHBondContact O-SG 3.31Å; C150-A152 VanDerWaalsContact C-N 3.32Å; C150-A152 PolarHBondContact O-N 2.91Å; C150-Q153 PolarHBondContact O-N 3.44Å; C150-L154 VanDerWaalsContact O-CB 3.27Å; C150-L154 WeakPolarHBondContact O-CB 3.18Å; C150-L154 PolarHBondContact O-N 3.48Å
151K89Confident85Confident111 Ų111101.9 Ų101.948%0.48350%0.504SS..Hα-helixtrans-66.1-32.7173.8-76.9173.8-179.3175.40112.4L147 A148 E149 R155L147-K151 VanDerWaalsContact O-CB 3.24Å; L147-K151 WeakPolarHBondContact O-CB 3.22Å; L147-K151 WeakPolarHBondContact O-CG 3.24Å; L147-K151 PolarHBondContact O-N 3.12Å; A148-K151 CarbonylContact O-C 3.6Å; A148-K151 PolarHBondContact O-N 3.03Å; E149-K151 VanDerWaalsContact C-N 3.35Å; E149-K151 PolarHBondContact O-N 3.46Å; K151-R155 VanDerWaalsContact O-CG 3.31Å; K151-R155 WeakPolarHBondContact O-CG 3.38Å; K151-R155 PolarHBondContact O-N 3.06Å; K151-R155 PolarHBondContact O-NH1 3.49Å
152A90.3Very high86.4Confident38 Ų3898.3 Ų98.331%0.31450%0.495SS..Hα-helixtrans-73.7-41.6176.400000111.6A148 E149 C150 R155 R156A148-A152 VanDerWaalsContact O-CB 3.26Å; A148-A152 WeakPolarHBondContact O-CB 3.32Å; A148-A152 PolarHBondContact O-N 2.98Å; E149-A152 CarbonylContact O-C 3.42Å; E149-A152 WeakPolarHBondContact O-CB 3.32Å; E149-A152 PolarHBondContact O-N 3.26Å; E149-A152 VanDerWaalsContact O-N 3.1Å; C150-A152 VanDerWaalsContact C-N 3.32Å; C150-A152 PolarHBondContact O-N 2.91Å; A152-R155 PolarHBondContact O-N 3.42Å; A152-R156 WeakPolarHBondContact O-CG 3.43Å; A152-R156 PolarHBondContact O-N 3.44Å
153Q91.9Very high87.7Confident100 Ų10097.7 Ų97.747%0.46749%0.493SS..Hα-helixtrans-61.3-44.4170.6-76171.9-1.700111E149 C150 R155 R156 S157E149-Q153 WeakPolarHBondContact O-CB 3.46Å; E149-Q153 WeakPolarHBondContact O-CG 3.37Å; E149-Q153 PolarHBondContact O-N 2.95Å; C150-Q153 PolarHBondContact O-N 3.44Å; Q153-R155 VanDerWaalsContact C-N 3.31Å; Q153-R155 PolarHBondContact O-N 2.91Å; Q153-R156 PolarHBondContact O-N 3.47Å; Q153-R156 VanDerWaalsContact O-N 3.11Å; Q153-S157 PolarHBondContact O-N 3.03Å; Q153-S157 PolarHBondContact O-OG 3.4Å
154L91.2Very high88.7Confident91 Ų91101.8 Ų101.848%0.47650%0.502SS..Hα-helixtrans-60.5-40175.2-173.566.2000112C150 R158C150-L154 VanDerWaalsContact O-CB 3.27Å; C150-L154 WeakPolarHBondContact O-CB 3.18Å; C150-L154 PolarHBondContact O-N 3.48Å; L154-R158 WeakPolarHBondContact O-CB 3.45Å; L154-R158 WeakPolarHBondContact O-CG 3.38Å; L154-R158 PolarHBondContact O-N 3.4Å
155R91.9Very high89.4Confident164 Ų16499.7 Ų99.762%0.61949%0.492SS*.Hα-helixtrans-64.6-42.1172.9-75.3-178.7-168.198.8-6.3112.2K151 A152 Q153 R158 Q159K151-R155 VanDerWaalsContact O-CG 3.31Å; K151-R155 WeakPolarHBondContact O-CG 3.38Å; K151-R155 PolarHBondContact O-N 3.06Å; K151-R155 PolarHBondContact O-NH1 3.49Å; A152-R155 PolarHBondContact O-N 3.42Å; Q153-R155 VanDerWaalsContact C-N 3.31Å; Q153-R155 PolarHBondContact O-N 2.91Å; R155-R158 PolarHBondContact O-N 2.9Å; R155-Q159 WeakPolarHBondContact O-CB 3.38Å; R155-Q159 PolarHBondContact O-N 3.11Å
156R93.5Very high90.3Very high139 Ų139101.2 Ų101.253%0.52550%0.497SS..Hα-helixtrans-63.7-48.2176.2-76.4-173.4-70.4-152.1-2.4112.1A152 Q153 R158 Q159 E160A152-R156 WeakPolarHBondContact O-CG 3.43Å; A152-R156 PolarHBondContact O-N 3.44Å; Q153-R156 PolarHBondContact O-N 3.47Å; Q153-R156 VanDerWaalsContact O-N 3.11Å; R156-R158 VanDerWaalsContact C-N 3.3Å; R156-R158 PolarHBondContact O-N 3.18Å; R156-Q159 CarbonylContact O-C 3.6Å; R156-Q159 WeakPolarHBondContact O-CB 3.46Å; R156-Q159 PolarHBondContact O-N 2.85Å; R156-Q159 VanDerWaalsContact O-N 3.17Å; R156-E160 WeakPolarHBondContact O-CG 3.4Å; R156-E160 PolarHBondContact O-N 2.91Å
157S90.6Very high91.1Very high61 Ų6199.7 Ų99.743%0.42749%0.491SS..Hα-helixtrans-63.9-35.5177.1-58.40000112.1Q153 E160 V161Q153-S157 PolarHBondContact O-N 3.03Å; Q153-S157 PolarHBondContact O-OG 3.4Å; S157-E160 PolarHBondContact O-N 2.89Å; S157-V161 WeakPolarHBondContact O-CB 3.46Å; S157-V161 WeakPolarHBondContact O-CG2 3.47Å; S157-V161 PolarHBondContact O-N 3.14Å
158R93.8Very high92Very high152 Ų15299 Ų9957%0.57449%0.487SS*.Hα-helixtrans-63.3-46.7171.4-76.7175.5-176.9-164.7-0.5111.7L154 R155 R156 E160 V161 E162L154-R158 WeakPolarHBondContact O-CB 3.45Å; L154-R158 WeakPolarHBondContact O-CG 3.38Å; L154-R158 PolarHBondContact O-N 3.4Å; R155-R158 PolarHBondContact O-N 2.9Å; R156-R158 VanDerWaalsContact C-N 3.3Å; R156-R158 PolarHBondContact O-N 3.18Å; R158-E160 PolarHBondContact O-N 3.42Å; R158-V161 PolarHBondContact O-N 3.38Å; R158-E162 WeakPolarHBondContact O-CB 3.12Å; R158-E162 WeakPolarHBondContact O-CG 3.47Å; R158-E162 PolarHBondContact O-N 3.04Å
159Q95.1Very high92.3Very high105 Ų105100 Ų10049%0.49149%0.485SS..Hα-helixtrans-60.5-44175.4-174.7-175.8-15.600111.7R155 R156 V161 E162 E163R155-Q159 WeakPolarHBondContact O-CB 3.38Å; R155-Q159 PolarHBondContact O-N 3.11Å; R156-Q159 CarbonylContact O-C 3.6Å; R156-Q159 WeakPolarHBondContact O-CB 3.46Å; R156-Q159 PolarHBondContact O-N 2.85Å; R156-Q159 VanDerWaalsContact O-N 3.17Å; Q159-V161 VanDerWaalsContact C-N 3.33Å; Q159-V161 PolarHBondContact O-N 3.36Å; Q159-E162 PolarHBondContact O-N 2.91Å; Q159-E163 HydrophobicContact CG-CG 4.47Å; Q159-E163 WeakPolarHBondContact CG-OE1 3.33Å; Q159-E163 PolarHBondContact NE2-OE1 3.41Å; Q159-E163 WeakPolarHBondContact O-CB 3.22Å; Q159-E163 WeakPolarHBondContact O-CG 3.39Å; Q159-E163 PolarHBondContact O-N 2.92Å
160E94.1Very high92.7Very high99 Ų9999.4 Ų99.446%0.46348%0.484SS..Hα-helixtrans-64.1-35.5176.1-73.8174.7-16400112.6R156 S157 R158 K164R156-E160 WeakPolarHBondContact O-CG 3.4Å; R156-E160 PolarHBondContact O-N 2.91Å; S157-E160 PolarHBondContact O-N 2.89Å; R158-E160 PolarHBondContact O-N 3.42Å; E160-K164 VanDerWaalsContact O-CB 3.31Å; E160-K164 WeakPolarHBondContact O-CB 3.47Å; E160-K164 WeakPolarHBondContact O-CG 3.24Å; E160-K164 PolarHBondContact O-N 3.31Å
161V92.2Very high93.4Very high97 Ų97102.2 Ų102.259%0.58849%0.485SS*.Hα-helixtrans-69.7-41.2174.2168.50000110.6S157 R158 Q159 K164 S165S157-V161 WeakPolarHBondContact O-CB 3.46Å; S157-V161 WeakPolarHBondContact O-CG2 3.47Å; S157-V161 PolarHBondContact O-N 3.14Å; R158-V161 PolarHBondContact O-N 3.38Å; Q159-V161 VanDerWaalsContact C-N 3.33Å; Q159-V161 PolarHBondContact O-N 3.36Å; V161-K164 PolarHBondContact O-N 3.36Å; V161-S165 VanDerWaalsContact O-CB 3.3Å; V161-S165 WeakPolarHBondContact O-CB 3.18Å; V161-S165 PolarHBondContact O-N 2.82Å
162E95Very high93.7Very high113 Ų113104.4 Ų104.453%0.52849%0.49SS..Hα-helixtrans-61.9-49.8174.5-75.6165.4-165.900110.8R158 Q159 K164 S165 E166R158-E162 WeakPolarHBondContact O-CB 3.12Å; R158-E162 WeakPolarHBondContact O-CG 3.47Å; R158-E162 PolarHBondContact O-N 3.04Å; Q159-E162 PolarHBondContact O-N 2.91Å; E162-K164 PolarHBondContact O-N 3.48Å; E162-S165 WeakPolarHBondContact CA-OG 2.97Å; E162-S165 CarbonylContact O-C 3.55Å; E162-S165 WeakPolarHBondContact O-CA 3.45Å; E162-S165 WeakPolarHBondContact O-CB 3.19Å; E162-S165 PolarHBondContact O-N 3.03Å; E162-S165 PolarHBondContact O-OG 2.77Å; E162-E166 WeakPolarHBondContact O-CG 3.26Å; E162-E166 PolarHBondContact O-N 3.37Å
163E95.3Very high94Very high93 Ų93107.6 Ų107.644%0.43550%0.502SS..Hα-helixtrans-59.3-44175.6-73.1171.9-170.500112Q159 S165 E166 M167Q159-E163 HydrophobicContact CG-CG 4.47Å; Q159-E163 WeakPolarHBondContact CG-OE1 3.33Å; Q159-E163 PolarHBondContact NE2-OE1 3.41Å; Q159-E163 WeakPolarHBondContact O-CB 3.22Å; Q159-E163 WeakPolarHBondContact O-CG 3.39Å; Q159-E163 PolarHBondContact O-N 2.92Å; E163-S165 VanDerWaalsContact C-N 3.31Å; E163-S165 PolarHBondContact O-N 2.86Å; E163-E166 PolarHBondContact O-N 2.8Å; E163-M167 VanDerWaalsContact O-CG 3.31Å; E163-M167 WeakPolarHBondContact O-CG 3.38Å; E163-M167 PolarHBondContact O-N 3.46Å
164K93.4Very high94.2Very high131 Ų131106.6 Ų106.657%0.5750%0.5SS*.Hα-helixtrans-64.1-36.9174.1-75.9171.9-176.3167.90111.8E160 V161 E162 M167 I168E160-K164 VanDerWaalsContact O-CB 3.31Å; E160-K164 WeakPolarHBondContact O-CB 3.47Å; E160-K164 WeakPolarHBondContact O-CG 3.24Å; E160-K164 PolarHBondContact O-N 3.31Å; V161-K164 PolarHBondContact O-N 3.36Å; E162-K164 PolarHBondContact O-N 3.48Å; K164-M167 PolarHBondContact O-N 2.97Å; K164-I168 WeakPolarHBondContact O-CB 3.39Å; K164-I168 WeakPolarHBondContact O-CD1 3.32Å; K164-I168 WeakPolarHBondContact O-CG1 3.29Å; K164-I168 PolarHBondContact O-N 3.41Å
165S94.2Very high94.3Very high51 Ų51107.1 Ų107.136%0.35750%0.502SS..Hα-helixtrans-67.1-38.917779.20000111.9V161 E162 E163 I168 N169V161-S165 VanDerWaalsContact O-CB 3.3Å; V161-S165 WeakPolarHBondContact O-CB 3.18Å; V161-S165 PolarHBondContact O-N 2.82Å; E162-S165 WeakPolarHBondContact CA-OG 2.97Å; E162-S165 CarbonylContact O-C 3.55Å; E162-S165 WeakPolarHBondContact O-CA 3.45Å; E162-S165 WeakPolarHBondContact O-CB 3.19Å; E162-S165 PolarHBondContact O-N 3.03Å; E162-S165 PolarHBondContact O-OG 2.77Å; E163-S165 VanDerWaalsContact C-N 3.31Å; E163-S165 PolarHBondContact O-N 2.86Å; S165-I168 PolarHBondContact O-N 3.41Å; S165-N169 VanDerWaalsContact O-CG 3.24Å; S165-N169 PolarHBondContact O-N 3.16Å; S165-N169 PolarHBondContact O-ND2 2.8Å
166E96.3Very high94.5Very high124 Ų124102 Ų10258%0.57950%0.495SS*.Hα-helixtrans-64.7-45.8173.1-71177.2-178.100111.1E162 E163 I168 N169 L170E162-E166 WeakPolarHBondContact O-CG 3.26Å; E162-E166 PolarHBondContact O-N 3.37Å; E163-E166 PolarHBondContact O-N 2.8Å; E166-I168 VanDerWaalsContact C-N 3.34Å; E166-I168 PolarHBondContact O-N 2.82Å; E166-N169 PolarHBondContact O-N 2.82Å; E166-N169 VanDerWaalsContact O-N 3.13Å; E166-L170 WeakPolarHBondContact O-CG 3.33Å; E166-L170 PolarHBondContact O-N 2.82Å
167M95.4Very high94.6Very high86 Ų86100.4 Ų100.442%0.42449%0.493SS..Hα-helixtrans-60.5-41.3174.9-72-56.8-5300112.5E163 K164 N169 L170 Y171E163-M167 VanDerWaalsContact O-CG 3.31Å; E163-M167 WeakPolarHBondContact O-CG 3.38Å; E163-M167 PolarHBondContact O-N 3.46Å; K164-M167 PolarHBondContact O-N 2.97Å; M167-N169 VanDerWaalsContact C-N 3.31Å; M167-N169 PolarHBondContact O-N 3.03Å; M167-L170 PolarHBondContact O-N 2.77Å; M167-L170 HydrophobicContact SD-CD1 4.12Å; M167-Y171 HydrophobicContact CB-CE2 4.46Å; M167-Y171 HydrophobicContact CE-CE2 3.92Å; M167-Y171 WeakPolarHBondContact O-CD2 3.32Å; M167-Y171 PolarHBondContact O-N 2.81Å
168I93.5Very high94.8Very high84 Ų84104.4 Ų104.443%0.43150%0.499SS..Hα-helixtrans-62.5-40174.9-72.8164.9000110.9K164 S165 E166 Y171 R172K164-I168 WeakPolarHBondContact O-CB 3.39Å; K164-I168 WeakPolarHBondContact O-CD1 3.32Å; K164-I168 WeakPolarHBondContact O-CG1 3.29Å; K164-I168 PolarHBondContact O-N 3.41Å; S165-I168 PolarHBondContact O-N 3.41Å; E166-I168 VanDerWaalsContact C-N 3.34Å; E166-I168 PolarHBondContact O-N 2.82Å; I168-Y171 PolarHBondContact O-N 2.86Å; I168-R172 VanDerWaalsContact O-CG 3.29Å; I168-R172 WeakPolarHBondContact O-CG 3.44Å; I168-R172 PolarHBondContact O-N 3.06Å
169N94.4Very high94.9Very high75 Ų75101.6 Ų101.640%0.40150%0.496SS..Hα-helixtrans-67.4-42.2177.1-68.7-28.3000111.8S165 E166 M167 Y171 R172 D173S165-N169 VanDerWaalsContact O-CG 3.24Å; S165-N169 PolarHBondContact O-N 3.16Å; S165-N169 PolarHBondContact O-ND2 2.8Å; E166-N169 PolarHBondContact O-N 2.82Å; E166-N169 VanDerWaalsContact O-N 3.13Å; M167-N169 VanDerWaalsContact C-N 3.31Å; M167-N169 PolarHBondContact O-N 3.03Å; N169-Y171 VanDerWaalsContact C-N 3.34Å; N169-Y171 PolarHBondContact O-N 3.41Å; N169-R172 WeakPolarHBondContact O-CB 3.33Å; N169-R172 PolarHBondContact O-N 3.49Å; N169-R172 VanDerWaalsContact O-N 3.1Å; N169-R172 PolarHBondContact OD1-NH1 3.36Å; N169-D173 PolarHBondContact O-N 3.34Å
170L96.5Very high95Very high96 Ų9699 Ų9950%0.50349%0.492SS..Hα-helixtrans-58.5-44.4173.1-69.7174000111.8E166 M167 R172 D173 D174E166-L170 WeakPolarHBondContact O-CG 3.33Å; E166-L170 PolarHBondContact O-N 2.82Å; M167-L170 PolarHBondContact O-N 2.77Å; M167-L170 HydrophobicContact SD-CD1 4.12Å; L170-R172 VanDerWaalsContact C-N 3.32Å; L170-R172 PolarHBondContact O-N 2.84Å; L170-D173 PolarHBondContact O-N 2.75Å; L170-D174 WeakPolarHBondContact O-CB 3.2Å; L170-D174 PolarHBondContact O-N 2.77Å
171Y93.6Very high95.1Very high137 Ų13796.8 Ų96.854%0.53749%0.485SS..Hα-helixtrans-66.3-33.3175.5-68.6-48.7000113M167 I168 N169 I175M167-Y171 HydrophobicContact CB-CE2 4.46Å; M167-Y171 HydrophobicContact CE-CE2 3.92Å; M167-Y171 WeakPolarHBondContact O-CD2 3.32Å; M167-Y171 PolarHBondContact O-N 2.81Å; I168-Y171 PolarHBondContact O-N 2.86Å; N169-Y171 VanDerWaalsContact C-N 3.34Å; N169-Y171 PolarHBondContact O-N 3.41Å; Y171-I175 WeakPolarHBondContact O-CB 3.3Å; Y171-I175 WeakPolarHBondContact O-CD1 3.42Å; Y171-I175 WeakPolarHBondContact O-CG1 3.49Å; Y171-I175 PolarHBondContact O-N 3Å
172R96.1Very high95.2Very high156 Ų15696.3 Ų96.359%0.58948%0.479SS*.Hα-helixtrans-65.2-41.7173.3-75.8169.8175.3171.4-3.2111.4I168 N169 L170 I175 A176I168-R172 VanDerWaalsContact O-CG 3.29Å; I168-R172 WeakPolarHBondContact O-CG 3.44Å; I168-R172 PolarHBondContact O-N 3.06Å; N169-R172 WeakPolarHBondContact O-CB 3.33Å; N169-R172 PolarHBondContact O-N 3.49Å; N169-R172 VanDerWaalsContact O-N 3.1Å; N169-R172 PolarHBondContact OD1-NH1 3.36Å; L170-R172 VanDerWaalsContact C-N 3.32Å; L170-R172 PolarHBondContact O-N 2.84Å; R172-I175 PolarHBondContact O-N 3.44Å; R172-A176 WeakPolarHBondContact O-CB 3.4Å; R172-A176 PolarHBondContact O-N 3.47Å
173D96.1Very high95.2Very high106 Ų10693.5 Ų93.557%0.56748%0.475SS*.Hα-helixtrans-66.9-43.2176.9-68-18.3000111.3N169 L170 I175 A176 E177N169-D173 PolarHBondContact O-N 3.34Å; L170-D173 PolarHBondContact O-N 2.75Å; D173-I175 PolarHBondContact O-N 2.72Å; D173-A176 PolarHBondContact O-N 2.76Å; D173-E177 PolarHBondContact O-N 3.38Å
174D95.6Very high95.3Very high78 Ų7895.4 Ų95.442%0.41748%0.482SS..Hα-helixtrans-60.4-42.5174.3-79-14.8000112L170 E177 R178L170-D174 WeakPolarHBondContact O-CB 3.2Å; L170-D174 PolarHBondContact O-N 2.77Å; D174-E177 PolarHBondContact O-N 3.36Å; D174-R178 WeakPolarHBondContact O-CB 3.43Å; D174-R178 WeakPolarHBondContact O-CG 3.31Å; D174-R178 PolarHBondContact O-N 2.97Å
175I93.4Very high95.4Very high102 Ų10294.7 Ų94.752%0.52348%0.482SS..Hα-helixtrans-63.8-45.4175.3-71.1164.7000109.9Y171 R172 D173 E177 R178 D179Y171-I175 WeakPolarHBondContact O-CB 3.3Å; Y171-I175 WeakPolarHBondContact O-CD1 3.42Å; Y171-I175 WeakPolarHBondContact O-CG1 3.49Å; Y171-I175 PolarHBondContact O-N 3Å; R172-I175 PolarHBondContact O-N 3.44Å; D173-I175 PolarHBondContact O-N 2.72Å; I175-E177 VanDerWaalsContact C-N 3.33Å; I175-E177 PolarHBondContact O-N 3.4Å; I175-R178 PolarHBondContact O-N 2.93Å; I175-D179 WeakPolarHBondContact O-CB 3.2Å; I175-D179 PolarHBondContact O-N 2.77Å
176A95.9Very high95.5Very high56 Ų56100.9 Ų100.946%0.46350%0.497SS..Hα-helixtrans-62.3-38.4177.900000112.3R172 D173 D179 A180R172-A176 WeakPolarHBondContact O-CB 3.4Å; R172-A176 PolarHBondContact O-N 3.47Å; D173-A176 PolarHBondContact O-N 2.76Å; A176-D179 PolarHBondContact O-N 3.09Å; A176-A180 WeakPolarHBondContact O-CB 3.4Å; A176-A180 PolarHBondContact O-N 3.35Å
177E96.7Very high95.4Very high107 Ų107100.9 Ų100.950%0.550%0.498SS..Hα-helixtrans-64.6-47173.6-168.6-165150.500111.1D173 D174 I175 D179 A180 T181D173-E177 PolarHBondContact O-N 3.38Å; D174-E177 PolarHBondContact O-N 3.36Å; I175-E177 VanDerWaalsContact C-N 3.33Å; I175-E177 PolarHBondContact O-N 3.4Å; E177-D179 VanDerWaalsContact C-N 3.32Å; E177-D179 PolarHBondContact O-N 3.23Å; E177-A180 WeakPolarHBondContact O-CB 3.23Å; E177-A180 PolarHBondContact O-N 2.76Å; E177-A180 VanDerWaalsContact O-N 3.17Å; E177-T181 WeakPolarHBondContact O-CG2 3.43Å; E177-T181 PolarHBondContact O-N 2.84Å
178R94.5Very high95.5Very high144 Ų144102 Ų10254%0.54350%0.502SS..Hα-helixtrans-58.3-44.5176.2-72.7-76.612368.46.5111D174 I175 A180 T181 L182D174-R178 WeakPolarHBondContact O-CB 3.43Å; D174-R178 WeakPolarHBondContact O-CG 3.31Å; D174-R178 PolarHBondContact O-N 2.97Å; I175-R178 PolarHBondContact O-N 2.93Å; R178-A180 VanDerWaalsContact C-N 3.35Å; R178-A180 PolarHBondContact O-N 2.79Å; R178-T181 PolarHBondContact O-N 2.72Å; R178-T181 PolarHBondContact O-OG1 2.92Å; R178-L182 WeakPolarHBondContact O-CG 3.46Å; R178-L182 PolarHBondContact O-N 3.46Å
179D96.3Very high95.4Very high94 Ų94103 Ų10350%0.50351%0.508SS..Hα-helixtrans-62.9-40176.2-76.9-25.8000112.2I175 A176 E177 T181 L182 A183I175-D179 WeakPolarHBondContact O-CB 3.2Å; I175-D179 PolarHBondContact O-N 2.77Å; A176-D179 PolarHBondContact O-N 3.09Å; E177-D179 VanDerWaalsContact C-N 3.32Å; E177-D179 PolarHBondContact O-N 3.23Å; D179-T181 PolarHBondContact O-N 3.36Å; D179-L182 PolarHBondContact O-N 2.7Å; D179-A183 WeakPolarHBondContact O-CB 3.37Å; D179-A183 PolarHBondContact O-N 3.02Å
180A96.6Very high95.4Very high49 Ų49105.6 Ų105.641%0.40552%0.516SS..Hα-helixtrans-63.5-39.6173.800000112.3A176 E177 R178 A183 K184A176-A180 WeakPolarHBondContact O-CB 3.4Å; A176-A180 PolarHBondContact O-N 3.35Å; E177-A180 WeakPolarHBondContact O-CB 3.23Å; E177-A180 PolarHBondContact O-N 2.76Å; E177-A180 VanDerWaalsContact O-N 3.17Å; R178-A180 VanDerWaalsContact C-N 3.35Å; R178-A180 PolarHBondContact O-N 2.79Å; A180-A183 PolarHBondContact O-N 2.78Å; A180-K184 WeakPolarHBondContact O-CG 3.47Å; A180-K184 PolarHBondContact O-N 3.04Å
181T96.1Very high95.4Very high54 Ų54105.2 Ų105.233%0.33151%0.511SS..Hα-helixtrans-67.8-41.3174.863.60000112.2E177 R178 D179 A183 K184 M185E177-T181 WeakPolarHBondContact O-CG2 3.43Å; E177-T181 PolarHBondContact O-N 2.84Å; R178-T181 PolarHBondContact O-N 2.72Å; R178-T181 PolarHBondContact O-OG1 2.92Å; D179-T181 PolarHBondContact O-N 3.36Å; T181-A183 VanDerWaalsContact C-N 3.32Å; T181-A183 PolarHBondContact O-N 3.4Å; T181-K184 PolarHBondContact O-N 2.82Å; T181-M185 WeakPolarHBondContact O-CG 3.33Å; T181-M185 PolarHBondContact O-N 3.13Å
182L93.1Very high95.5Very high86 Ų86103.9 Ų103.945%0.4551%0.513SS..Hα-helixtrans-62.9-39175-75.1173.5000111.7R178 D179 M185 R186R178-L182 WeakPolarHBondContact O-CG 3.46Å; R178-L182 PolarHBondContact O-N 3.46Å; D179-L182 PolarHBondContact O-N 2.7Å; L182-M185 PolarHBondContact O-N 3.07Å; L182-R186 WeakPolarHBondContact O-CB 3.43Å; L182-R186 VanDerWaalsContact O-CG 3.23Å; L182-R186 WeakPolarHBondContact O-CG 3.31Å; L182-R186 PolarHBondContact O-N 2.78Å
183A96.1Very high95.4Very high54 Ų5498.9 Ų98.945%0.44650%0.5SS..Hα-helixtrans-61.9-44.217400000111.8D179 A180 T181 R186 Q187D179-A183 WeakPolarHBondContact O-CB 3.37Å; D179-A183 PolarHBondContact O-N 3.02Å; A180-A183 PolarHBondContact O-N 2.78Å; T181-A183 VanDerWaalsContact C-N 3.32Å; T181-A183 PolarHBondContact O-N 3.4Å; A183-R186 PolarHBondContact O-N 2.76Å; A183-Q187 PolarHBondContact O-N 3.12Å
184K97Very high95.4Very high133 Ų13398.8 Ų98.858%0.57849%0.494SS*.Hα-helixtrans-60.8-48.5174.6-72.5174.9-177.5177.20112.1A180 T181 R186 Q187 E188A180-K184 WeakPolarHBondContact O-CG 3.47Å; A180-K184 PolarHBondContact O-N 3.04Å; T181-K184 PolarHBondContact O-N 2.82Å; K184-R186 VanDerWaalsContact C-N 3.3Å; K184-R186 PolarHBondContact O-N 3.31Å; K184-Q187 WeakPolarHBondContact O-CB 3.22Å; K184-Q187 PolarHBondContact O-N 3.44Å; K184-Q187 VanDerWaalsContact O-N 3.13Å; K184-E188 WeakPolarHBondContact O-CG 3.27Å; K184-E188 PolarHBondContact O-N 2.81Å
185M95.2Very high95.3Very high116 Ų11696.8 Ų96.857%0.57149%0.487SS*.Hα-helixtrans-62-37.2177.7-65.6-57-62.700112.1T181 L182 E188 N189T181-M185 WeakPolarHBondContact O-CG 3.33Å; T181-M185 PolarHBondContact O-N 3.13Å; L182-M185 PolarHBondContact O-N 3.07Å; M185-E188 PolarHBondContact O-N 3.28Å; M185-N189 VanDerWaalsContact O-CB 3.27Å; M185-N189 WeakPolarHBondContact O-CB 3.25Å; M185-N189 PolarHBondContact O-N 2.82Å
186R96.3Very high95.4Very high181 Ų18197.1 Ų97.168%0.68349%0.489SS*.Hα-helixtrans-64.7-41.5174-76.2170.9178163.31.5111.8L182 A183 K184 N189 F190L182-R186 WeakPolarHBondContact O-CB 3.43Å; L182-R186 VanDerWaalsContact O-CG 3.23Å; L182-R186 WeakPolarHBondContact O-CG 3.31Å; L182-R186 PolarHBondContact O-N 2.78Å; A183-R186 PolarHBondContact O-N 2.76Å; K184-R186 VanDerWaalsContact C-N 3.3Å; K184-R186 PolarHBondContact O-N 3.31Å; R186-N189 PolarHBondContact O-N 3.38Å; R186-F190 PolarHBondContact O-N 2.96Å
187Q95.4Very high95.3Very high125 Ų125101.6 Ų101.658%0.58449%0.494SS*.Hα-helixtrans-64.6-45.7175.2-175.7179.11.700111.6A183 K184 N189 F190 E191A183-Q187 PolarHBondContact O-N 3.12Å; K184-Q187 WeakPolarHBondContact O-CB 3.22Å; K184-Q187 PolarHBondContact O-N 3.44Å; K184-Q187 VanDerWaalsContact O-N 3.13Å; Q187-N189 VanDerWaalsContact C-N 3.32Å; Q187-N189 PolarHBondContact O-N 2.89Å; Q187-F190 WeakPolarHBondContact O-CB 3.36Å; Q187-F190 PolarHBondContact O-N 3.36Å; Q187-E191 PolarHBondContact O-N 2.82Å
188E96.2Very high95.3Very high110 Ų11099.9 Ų99.951%0.51449%0.488SS..Hα-helixtrans-61.2-40.7175.2-72.2175.9-172.900111.8K184 M185 F190 E191 L192K184-E188 WeakPolarHBondContact O-CG 3.27Å; K184-E188 PolarHBondContact O-N 2.81Å; M185-E188 PolarHBondContact O-N 3.28Å; E188-F190 VanDerWaalsContact C-N 3.32Å; E188-F190 PolarHBondContact O-N 3.3Å; E188-E191 PolarHBondContact O-N 3.19Å; E188-L192 WeakPolarHBondContact O-CB 3.29Å; E188-L192 VanDerWaalsContact O-CG 3.32Å; E188-L192 WeakPolarHBondContact O-CG 3.14Å; E188-L192 PolarHBondContact O-N 3.08Å
189N92.4Very high95.3Very high104 Ų10499.3 Ų99.356%0.55649%0.489SS*.Hα-helixtrans-64.3-37.9175.6-161.5-37.3000111.7M185 R186 Q187 L192 T193M185-N189 VanDerWaalsContact O-CB 3.27Å; M185-N189 WeakPolarHBondContact O-CB 3.25Å; M185-N189 PolarHBondContact O-N 2.82Å; R186-N189 PolarHBondContact O-N 3.38Å; Q187-N189 VanDerWaalsContact C-N 3.32Å; Q187-N189 PolarHBondContact O-N 2.89Å; N189-L192 PolarHBondContact O-N 3.1Å; N189-T193 WeakPolarHBondContact O-CB 3.27Å; N189-T193 PolarHBondContact O-N 3.47Å; N189-T193 PolarHBondContact O-OG1 2.87Å
190F94Very high95.2Very high129 Ų129101.7 Ų101.757%0.56650%0.495SS*.Hα-helixtrans-62.9-44.8172.7-179.1-97000112R186 Q187 E188 T193 K194R186-F190 PolarHBondContact O-N 2.96Å; Q187-F190 WeakPolarHBondContact O-CB 3.36Å; Q187-F190 PolarHBondContact O-N 3.36Å; E188-F190 VanDerWaalsContact C-N 3.32Å; E188-F190 PolarHBondContact O-N 3.3Å; F190-T193 PolarHBondContact O-N 2.93Å; F190-K194 WeakPolarHBondContact O-CB 3.12Å; F190-K194 PolarHBondContact O-N 2.97Å
191E96.5Very high95.1Very high88 Ų88104.9 Ų104.941%0.41150%0.502SS..Hα-helixtrans-67.9-37.8176.8-67.9-59.115400112.8Q187 E188 T193 K194 S195Q187-E191 PolarHBondContact O-N 2.82Å; E188-E191 PolarHBondContact O-N 3.19Å; E191-T193 VanDerWaalsContact C-N 3.33Å; E191-K194 PolarHBondContact O-N 3.05Å; E191-S195 WeakPolarHBondContact O-CB 3.47Å; E191-S195 PolarHBondContact O-N 3.35Å; E191-S195 PolarHBondContact O-OG 3.17Å; E191-S195 VanDerWaalsContact O-OG 3.09Å
192L95.3Very high95Very high110 Ų110109 Ų10958%0.57651%0.512SS*.Hα-helixtrans-64.1-39.2171.7-72.7176.1000111.3E188 N189 S195 L196E188-L192 WeakPolarHBondContact O-CB 3.29Å; E188-L192 VanDerWaalsContact O-CG 3.32Å; E188-L192 WeakPolarHBondContact O-CG 3.14Å; E188-L192 PolarHBondContact O-N 3.08Å; N189-L192 PolarHBondContact O-N 3.1Å; L192-S195 WeakPolarHBondContact CA-OG 3.49Å; L192-S195 PolarHBondContact O-N 3.47Å; L192-S195 PolarHBondContact O-OG 2.79Å; L192-L196 WeakPolarHBondContact O-CB 3.31Å; L192-L196 VanDerWaalsContact O-CG 3.27Å; L192-L196 WeakPolarHBondContact O-CG 3.42Å; L192-L196 PolarHBondContact O-N 2.85Å
193T95Very high95.1Very high50 Ų50113.6 Ų113.631%0.30752%0.524SS..Hα-helixtrans-66.1-40.8174.8-610000111.5N189 F190 E191 L196 R197N189-T193 WeakPolarHBondContact O-CB 3.27Å; N189-T193 PolarHBondContact O-N 3.47Å; N189-T193 PolarHBondContact O-OG1 2.87Å; F190-T193 PolarHBondContact O-N 2.93Å; E191-T193 VanDerWaalsContact C-N 3.33Å; T193-L196 PolarHBondContact O-N 3.23Å; T193-R197 WeakPolarHBondContact O-CG 3.42Å; T193-R197 PolarHBondContact O-N 3.36Å; T193-R197 VanDerWaalsContact O-N 3.11Å
194K95.8Very high95Very high104 Ų104115.9 Ų115.945%0.45253%0.528SS..Hα-helixtrans-63.5-47.2174.9-178.1-175.7174.5-171.40111.4F190 E191 L196 R197 L198F190-K194 WeakPolarHBondContact O-CB 3.12Å; F190-K194 PolarHBondContact O-N 2.97Å; E191-K194 PolarHBondContact O-N 3.05Å; K194-L196 VanDerWaalsContact C-N 3.35Å; K194-L196 PolarHBondContact O-N 2.88Å; K194-R197 WeakPolarHBondContact O-CB 3.34Å; K194-R197 PolarHBondContact O-N 3.49Å; K194-L198 WeakPolarHBondContact O-CG 3.47Å; K194-L198 PolarHBondContact O-N 2.84Å
195S93.8Very high94.9Very high37 Ų37114.8 Ų114.826%0.25953%0.525SS..Hα-helixtrans-64-37.9176.660.60000112.1E191 L192 R197 L198 F199E191-S195 WeakPolarHBondContact O-CB 3.47Å; E191-S195 PolarHBondContact O-N 3.35Å; E191-S195 PolarHBondContact O-OG 3.17Å; E191-S195 VanDerWaalsContact O-OG 3.09Å; L192-S195 WeakPolarHBondContact CA-OG 3.49Å; L192-S195 PolarHBondContact O-N 3.47Å; L192-S195 PolarHBondContact O-OG 2.79Å; S195-R197 VanDerWaalsContact C-N 3.31Å; S195-R197 PolarHBondContact O-N 2.87Å; S195-L198 PolarHBondContact O-N 3.41Å; S195-F199 WeakPolarHBondContact O-CD2 3.32Å; S195-F199 PolarHBondContact O-N 3.32Å
196L94.2Very high94.8Very high108 Ų108112.4 Ų112.457%0.56552%0.517SS*.Hα-helixtrans-61-36172.6-78.3172.3000113.1L192 T193 K194 K200L192-L196 WeakPolarHBondContact O-CB 3.31Å; L192-L196 VanDerWaalsContact O-CG 3.27Å; L192-L196 WeakPolarHBondContact O-CG 3.42Å; L192-L196 PolarHBondContact O-N 2.85Å; T193-L196 PolarHBondContact O-N 3.23Å; K194-L196 VanDerWaalsContact C-N 3.35Å; K194-L196 PolarHBondContact O-N 2.88Å; L196-K200 WeakPolarHBondContact O-CG 3.15Å; L196-K200 PolarHBondContact O-N 3.11Å; L196-K200 VanDerWaalsContact O-N 3.12Å
197R95Very high94.7Very high151 Ų151107.3 Ų107.357%0.5750%0.504SS*.Hα-helixtrans-66.3-46.8173-68.7174.6-170.6159.93.4111T193 K194 S195 F199 K200 E201T193-R197 WeakPolarHBondContact O-CG 3.42Å; T193-R197 PolarHBondContact O-N 3.36Å; T193-R197 VanDerWaalsContact O-N 3.11Å; K194-R197 WeakPolarHBondContact O-CB 3.34Å; K194-R197 PolarHBondContact O-N 3.49Å; S195-R197 VanDerWaalsContact C-N 3.31Å; S195-R197 PolarHBondContact O-N 2.87Å; R197-F199 VanDerWaalsContact C-N 3.32Å; R197-F199 PolarHBondContact O-N 2.81Å; R197-K200 WeakPolarHBondContact O-CB 3.25Å; R197-K200 PolarHBondContact O-N 2.87Å; R197-E201 WeakPolarHBondContact O-CG 3.36Å; R197-E201 PolarHBondContact O-N 2.9Å
198L95.6Very high94.7Very high71 Ų71106 Ų10637%0.37250%0.504SS..Hα-helixtrans-60.3-39.9175.3-66171.5000112.2K194 S195 K200 E201 Y202K194-L198 WeakPolarHBondContact O-CG 3.47Å; K194-L198 PolarHBondContact O-N 2.84Å; S195-L198 PolarHBondContact O-N 3.41Å; L198-K200 VanDerWaalsContact C-N 3.31Å; L198-K200 PolarHBondContact O-N 2.99Å; L198-E201 PolarHBondContact O-N 2.86Å; L198-Y202 HydrophobicContact CB-CE2 4.34Å; L198-Y202 WeakPolarHBondContact O-CD2 3.21Å; L198-Y202 PolarHBondContact O-N 3.43Å
199F95Very high94.6Very high132 Ų132105.2 Ų105.258%0.57950%0.503SS*.Hα-helixtrans-64.1-33174.6-80.4-61.9000113S195 R197 R203S195-F199 WeakPolarHBondContact O-CD2 3.32Å; S195-F199 PolarHBondContact O-N 3.32Å; R197-F199 VanDerWaalsContact C-N 3.32Å; R197-F199 PolarHBondContact O-N 2.81Å; F199-R203 WeakPolarHBondContact O-CG 3.42Å; F199-R203 PolarHBondContact O-N 2.84Å
200K95.1Very high94.8Very high143 Ų143107.1 Ų107.162%0.62250%0.502SS*.Hα-helixtrans-68.7-46.3172.6-73.3177.4179.9-175.30110.8L196 R197 L198 Y202 R203 D204L196-K200 WeakPolarHBondContact O-CG 3.15Å; L196-K200 PolarHBondContact O-N 3.11Å; L196-K200 VanDerWaalsContact O-N 3.12Å; R197-K200 WeakPolarHBondContact O-CB 3.25Å; R197-K200 PolarHBondContact O-N 2.87Å; L198-K200 VanDerWaalsContact C-N 3.31Å; L198-K200 PolarHBondContact O-N 2.99Å; K200-Y202 VanDerWaalsContact C-N 3.29Å; K200-Y202 PolarHBondContact O-N 3.33Å; K200-R203 WeakPolarHBondContact O-CA 3.31Å; K200-R203 WeakPolarHBondContact O-CB 3.36Å; K200-R203 PolarHBondContact O-N 3.44Å; K200-D204 VanDerWaalsContact O-CG 3.27Å; K200-D204 PolarHBondContact O-N 3.24Å
201E94.6Very high94.8Very high116 Ų116106 Ų10654%0.54250%0.498SS..Hα-helixtrans-57.5-42.4174.8-67.8166.8-161.100111.5R197 L198 R203 D204 E205R197-E201 WeakPolarHBondContact O-CG 3.36Å; R197-E201 PolarHBondContact O-N 2.9Å; L198-E201 PolarHBondContact O-N 2.86Å; E201-R203 PolarHBondContact O-N 3.3Å; E201-D204 PolarHBondContact O-N 3.47Å; E201-E205 WeakPolarHBondContact O-CB 3.35Å; E201-E205 PolarHBondContact O-N 2.83Å
202Y94.1Very high94.7Very high140 Ų140108.4 Ų108.455%0.54950%0.504SS..Hα-helixtrans-66-34.4173.5-71.4-48.7000113.5L198 K200 V206L198-Y202 HydrophobicContact CB-CE2 4.34Å; L198-Y202 WeakPolarHBondContact O-CD2 3.21Å; L198-Y202 PolarHBondContact O-N 3.43Å; K200-Y202 VanDerWaalsContact C-N 3.29Å; K200-Y202 PolarHBondContact O-N 3.33Å; Y202-V206 WeakPolarHBondContact O-CB 3.09Å; Y202-V206 VanDerWaalsContact O-CG2 3.22Å; Y202-V206 WeakPolarHBondContact O-CG2 3.36Å; Y202-V206 PolarHBondContact O-N 2.86Å
203R94.7Very high94.7Very high184 Ų184107.6 Ų107.669%0.69450%0.504SS*.Hα-helixtrans-66.9-44.7173.8-80.5-172-179.9-136.42.6111.2F199 K200 E201 E205 V206 D207F199-R203 WeakPolarHBondContact O-CG 3.42Å; F199-R203 PolarHBondContact O-N 2.84Å; K200-R203 WeakPolarHBondContact O-CA 3.31Å; K200-R203 WeakPolarHBondContact O-CB 3.36Å; K200-R203 PolarHBondContact O-N 3.44Å; E201-R203 PolarHBondContact O-N 3.3Å; R203-E205 VanDerWaalsContact C-N 3.3Å; R203-E205 PolarHBondContact O-N 3.1Å; R203-V206 PolarHBondContact O-N 3.47Å; R203-D207 PolarHBondContact O-N 3.07Å
204D93.7Very high94.7Very high101 Ų101109 Ų10954%0.5451%0.509SS..Hα-helixtrans-61.5-41.5176.9-62.2-20.7000110.4K200 E201 D207 V208K200-D204 VanDerWaalsContact O-CG 3.27Å; K200-D204 PolarHBondContact O-N 3.24Å; E201-D204 PolarHBondContact O-N 3.47Å; D204-D207 PolarHBondContact O-N 3Å; D204-V208 VanDerWaalsContact O-CG2 3.3Å; D204-V208 WeakPolarHBondContact O-CG2 3.41Å; D204-V208 PolarHBondContact O-N 3.43Å
205E95Very high94.7Very high110 Ų110111.6 Ų111.651%0.51452%0.515SS..Hα-helixtrans-62-44.7173.8-174.5174.8-162.500112E201 R203 D207 V208 L209E201-E205 WeakPolarHBondContact O-CB 3.35Å; E201-E205 PolarHBondContact O-N 2.83Å; R203-E205 VanDerWaalsContact C-N 3.3Å; R203-E205 PolarHBondContact O-N 3.1Å; E205-D207 VanDerWaalsContact C-N 3.31Å; E205-D207 PolarHBondContact O-N 2.84Å; E205-V208 PolarHBondContact O-N 2.85Å; E205-L209 HydrophobicContact CG-CD1 4.37Å; E205-L209 WeakPolarHBondContact O-CB 3.44Å; E205-L209 VanDerWaalsContact O-CG 3.28Å; E205-L209 WeakPolarHBondContact O-CG 3.32Å; E205-L209 PolarHBondContact O-N 3.23Å
206V93.5Very high94.8Very high67 Ų67115 Ų11541%0.40652%0.523SS..Hα-helixtrans-61.8-38.9175.7167.10000111.6Y202 R203 L209 R210Y202-V206 WeakPolarHBondContact O-CB 3.09Å; Y202-V206 VanDerWaalsContact O-CG2 3.22Å; Y202-V206 WeakPolarHBondContact O-CG2 3.36Å; Y202-V206 PolarHBondContact O-N 2.86Å; R203-V206 PolarHBondContact O-N 3.47Å; V206-L209 PolarHBondContact O-N 3.36Å; V206-R210 VanDerWaalsContact O-CG 3.28Å; V206-R210 WeakPolarHBondContact O-CG 3.38Å; V206-R210 PolarHBondContact O-N 2.93Å
207D94.8Very high94.8Very high74 Ų74112.4 Ų112.440%0.39652%0.517SS..Hα-helixtrans-70.9-38.9178.4-70.8-24.7000111.8R203 D204 E205 L209 R210 E211R203-D207 PolarHBondContact O-N 3.07Å; D204-D207 PolarHBondContact O-N 3Å; E205-D207 VanDerWaalsContact C-N 3.31Å; E205-D207 PolarHBondContact O-N 2.84Å; D207-L209 VanDerWaalsContact C-N 3.32Å; D207-L209 PolarHBondContact O-N 3.24Å; D207-R210 PolarHBondContact O-N 2.86Å; D207-R210 IonicContact OD1-CZ 2.99Å; D207-R210 IonicContact OD1-NH1 3.21Å; D207-R210 PolarHBondContact OD1-NH1 2.92Å; D207-E211 PolarHBondContact O-N 3.32Å
208V94.7Very high94.9Very high98 Ų98110.7 Ų110.759%0.59452%0.516SS*.Hα-helixtrans-60.2-42.1170.1170.20000111.2D204 E205 R212D204-V208 VanDerWaalsContact O-CG2 3.3Å; D204-V208 WeakPolarHBondContact O-CG2 3.41Å; D204-V208 PolarHBondContact O-N 3.43Å; E205-V208 PolarHBondContact O-N 2.85Å; V208-R212 WeakPolarHBondContact O-CB 3.34Å; V208-R212 PolarHBondContact O-N 2.93Å
209L93.3Very high94.8Very high93 Ų93112.1 Ų112.149%0.48752%0.523SS..Hα-helixtrans-65.9-40.5176.6-70.9175.2000112E205 V206 D207 R212 T213E205-L209 HydrophobicContact CG-CD1 4.37Å; E205-L209 WeakPolarHBondContact O-CB 3.44Å; E205-L209 VanDerWaalsContact O-CG 3.28Å; E205-L209 WeakPolarHBondContact O-CG 3.32Å; E205-L209 PolarHBondContact O-N 3.23Å; V206-L209 PolarHBondContact O-N 3.36Å; D207-L209 VanDerWaalsContact C-N 3.32Å; D207-L209 PolarHBondContact O-N 3.24Å; L209-R212 PolarHBondContact O-N 3.34Å; L209-T213 PolarHBondContact O-N 3.28Å; L209-T213 PolarHBondContact O-OG1 3.1Å
210R96.4Very high94.9Very high144 Ų144112 Ų11254%0.54352%0.524SS..Hα-helixtrans-60.9-47.6175-74.6166.2178168.9-2.9112V206 D207 R212 T213 I214V206-R210 VanDerWaalsContact O-CG 3.28Å; V206-R210 WeakPolarHBondContact O-CG 3.38Å; V206-R210 PolarHBondContact O-N 2.93Å; D207-R210 PolarHBondContact O-N 2.86Å; D207-R210 IonicContact OD1-CZ 2.99Å; D207-R210 IonicContact OD1-NH1 3.21Å; D207-R210 PolarHBondContact OD1-NH1 2.92Å; R210-R212 VanDerWaalsContact C-N 3.29Å; R210-R212 PolarHBondContact O-N 3.46Å; R210-T213 WeakPolarHBondContact O-CB 3.31Å; R210-T213 PolarHBondContact O-N 2.87Å; R210-I214 WeakPolarHBondContact O-CG1 3.44Å; R210-I214 PolarHBondContact O-N 3.14Å
211E94Very high94.9Very high104 Ų104106.9 Ų106.949%0.48651%0.509SS..Hα-helixtrans-60.9-40.1175.4-76.4-61.5140.900111.6D207 I214 R215D207-E211 PolarHBondContact O-N 3.32Å; E211-I214 PolarHBondContact O-N 3.42Å; E211-R215 VanDerWaalsContact O-CG 3.31Å; E211-R215 WeakPolarHBondContact O-CG 3.38Å; E211-R215 PolarHBondContact O-N 3.43Å
212R95.2Very high94.9Very high140 Ų140104.5 Ų104.553%0.52850%0.5SS..Hα-helixtrans-64.6-39.7174.7-176.9169.8175.2166.2-8.3112V208 L209 R210 R215 Y216V208-R212 WeakPolarHBondContact O-CB 3.34Å; V208-R212 PolarHBondContact O-N 2.93Å; L209-R212 PolarHBondContact O-N 3.34Å; R210-R212 VanDerWaalsContact C-N 3.29Å; R210-R212 PolarHBondContact O-N 3.46Å; R212-R215 PolarHBondContact O-N 3.07Å; R212-Y216 HydrophobicContact CG-CD2 3.81Å; R212-Y216 HydrophobicContact CG-CE2 3.38Å; R212-Y216 VanDerWaalsContact CZ-OH 3.25Å; R212-Y216 VanDerWaalsContact NE-CE2 3.28Å; R212-Y216 PolarHBondContact NE-OH 2.94Å; R212-Y216 PolarHBondContact NH2-OH 3.4Å; R212-Y216 WeakPolarHBondContact O-CD2 3.48Å; R212-Y216 PolarHBondContact O-N 3.36Å
213T95.4Very high94.7Very high93 Ų93101.1 Ų101.157%0.57150%0.496SS*.Hα-helixtrans-63.8-42.2174-59.60000111.9L209 R210 Y216 A217L209-T213 PolarHBondContact O-N 3.28Å; L209-T213 PolarHBondContact O-OG1 3.1Å; R210-T213 WeakPolarHBondContact O-CB 3.31Å; R210-T213 PolarHBondContact O-N 2.87Å; T213-Y216 PolarHBondContact O-N 3.36Å; T213-A217 PolarHBondContact O-N 3.13Å
214I94.8Very high94.8Very high80 Ų8098 Ų9841%0.4149%0.489SS..Hα-helixtrans-62.5-44.4175.7-66.8165.2000110.5R210 E211 Y216 A217 Q218R210-I214 WeakPolarHBondContact O-CG1 3.44Å; R210-I214 PolarHBondContact O-N 3.14Å; E211-I214 PolarHBondContact O-N 3.42Å; I214-Y216 VanDerWaalsContact C-N 3.34Å; I214-Y216 PolarHBondContact O-N 2.79Å; I214-A217 PolarHBondContact O-N 2.75Å; I214-Q218 WeakPolarHBondContact O-CG 3.32Å; I214-Q218 PolarHBondContact O-N 3.23Å
215R96.5Very high94.9Very high157 Ų15798.4 Ų98.459%0.59249%0.486SS*.Hα-helixtrans-61.6-40.5175.3-71.4176-166.7-178.24.2112.2E211 R212 Q218 L219E211-R215 VanDerWaalsContact O-CG 3.31Å; E211-R215 WeakPolarHBondContact O-CG 3.38Å; E211-R215 PolarHBondContact O-N 3.43Å; R212-R215 PolarHBondContact O-N 3.07Å; R215-Q218 PolarHBondContact O-N 3.21Å; R215-L219 WeakPolarHBondContact O-CG 3.45Å; R215-L219 PolarHBondContact O-N 2.87Å
216Y95.7Very high94.8Very high110 Ų110100.7 Ų100.743%0.43149%0.491SS..Hα-helixtrans-63.1-45174.6-76.2-50.3000112.2R212 T213 I214 Q218 L219 E220R212-Y216 HydrophobicContact CG-CD2 3.81Å; R212-Y216 HydrophobicContact CG-CE2 3.38Å; R212-Y216 VanDerWaalsContact CZ-OH 3.25Å; R212-Y216 VanDerWaalsContact NE-CE2 3.28Å; R212-Y216 PolarHBondContact NE-OH 2.94Å; R212-Y216 PolarHBondContact NH2-OH 3.4Å; R212-Y216 WeakPolarHBondContact O-CD2 3.48Å; R212-Y216 PolarHBondContact O-N 3.36Å; T213-Y216 PolarHBondContact O-N 3.36Å; I214-Y216 VanDerWaalsContact C-N 3.34Å; I214-Y216 PolarHBondContact O-N 2.79Å; Y216-Q218 VanDerWaalsContact C-N 3.29Å; Y216-Q218 PolarHBondContact O-N 2.83Å; Y216-L219 PolarHBondContact O-N 3.16Å; Y216-E220 WeakPolarHBondContact O-CB 3.47Å; Y216-E220 WeakPolarHBondContact O-CG 3.29Å; Y216-E220 PolarHBondContact O-N 3.29Å
217A94.5Very high95Very high52 Ų52104.3 Ų104.343%0.4350%0.502SS..Hα-helixtrans-61.1-36.9176.100000112.5T213 I214 E220 A221T213-A217 PolarHBondContact O-N 3.13Å; I214-A217 PolarHBondContact O-N 2.75Å; A217-E220 PolarHBondContact O-N 2.9Å; A217-A221 WeakPolarHBondContact O-CB 3.29Å; A217-A221 PolarHBondContact O-N 2.86Å
218Q96.5Very high95Very high116 Ų116106.5 Ų106.554%0.54251%0.509SS..Hα-helixtrans-66.3-45.7173.9-72172.8-2.300112.1I214 R215 Y216 E220 A221 D222I214-Q218 WeakPolarHBondContact O-CG 3.32Å; I214-Q218 PolarHBondContact O-N 3.23Å; R215-Q218 PolarHBondContact O-N 3.21Å; Y216-Q218 VanDerWaalsContact C-N 3.29Å; Y216-Q218 PolarHBondContact O-N 2.83Å; Q218-E220 VanDerWaalsContact C-N 3.3Å; Q218-E220 PolarHBondContact O-N 3.46Å; Q218-A221 PolarHBondContact O-N 3.19Å; Q218-D222 PolarHBondContact O-N 2.89Å
219L94.3Very high95.1Very high101 Ų101107.2 Ų107.253%0.52951%0.505SS..Hα-helixtrans-63.4-36.7176.1-72.4171.5000111.8R215 Y216 D222 C223R215-L219 WeakPolarHBondContact O-CG 3.45Å; R215-L219 PolarHBondContact O-N 2.87Å; Y216-L219 PolarHBondContact O-N 3.16Å; L219-D222 PolarHBondContact O-N 2.81Å; L219-C223 WeakPolarHBondContact O-CB 3.42Å; L219-C223 PolarHBondContact O-N 3.26Å; L219-C223 PolarHBondContact O-SG 2.93Å
220E96.1Very high95.1Very high128 Ų128107.4 Ų107.460%0.59851%0.505SS*.Hα-helixtrans-63.6-47.6173.6-76.3174.8172.600111.3Y216 A217 Q218 D222 C223 E224Y216-E220 WeakPolarHBondContact O-CB 3.47Å; Y216-E220 WeakPolarHBondContact O-CG 3.29Å; Y216-E220 PolarHBondContact O-N 3.29Å; A217-E220 PolarHBondContact O-N 2.9Å; Q218-E220 VanDerWaalsContact C-N 3.3Å; Q218-E220 PolarHBondContact O-N 3.46Å; E220-D222 VanDerWaalsContact C-N 3.32Å; E220-D222 PolarHBondContact O-N 3.37Å; E220-C223 WeakPolarHBondContact O-CB 3.45Å; E220-C223 PolarHBondContact O-N 2.8Å; E220-E224 WeakPolarHBondContact O-CG 3.45Å; E220-E224 PolarHBondContact O-N 3.05Å
221A95Very high95.1Very high37 Ų37103.9 Ų103.931%0.30650%0.503SS..Hα-helixtrans-62.2-37.8176.600000112.5A217 Q218 E224 K225A217-A221 WeakPolarHBondContact O-CB 3.29Å; A217-A221 PolarHBondContact O-N 2.86Å; Q218-A221 PolarHBondContact O-N 3.19Å; A221-E224 PolarHBondContact O-N 2.87Å; A221-K225 WeakPolarHBondContact O-CG 3.38Å; A221-K225 PolarHBondContact O-N 3.36Å
222D94.7Very high95.2Very high66 Ų66104.7 Ų104.735%0.35351%0.507SS..Hα-helixtrans-71-37.7175-71.3-18.5000111.8Q218 L219 E220 E224 K225 Y226Q218-D222 PolarHBondContact O-N 2.89Å; L219-D222 PolarHBondContact O-N 2.81Å; E220-D222 VanDerWaalsContact C-N 3.32Å; E220-D222 PolarHBondContact O-N 3.37Å; D222-E224 VanDerWaalsContact C-N 3.28Å; D222-E224 PolarHBondContact O-N 3.45Å; D222-K225 PolarHBondContact O-N 2.82Å; D222-K225 IonicContact OD1-NZ 3.99Å; D222-K225 PolarHBondContact OD1-NZ 3.36Å; D222-Y226 HydrophobicContact CB-CE2 4.39Å; D222-Y226 WeakPolarHBondContact O-CD2 3.4Å; D222-Y226 PolarHBondContact O-N 2.92Å
223C90.8Very high95.1Very high69 Ų69102.6 Ų102.647%0.46651%0.505SS..Hα-helixtrans-60.4-37.1170.8-71.90000112L219 E220 Y226 K227L219-C223 WeakPolarHBondContact O-CB 3.42Å; L219-C223 PolarHBondContact O-N 3.26Å; L219-C223 PolarHBondContact O-SG 2.93Å; E220-C223 WeakPolarHBondContact O-CB 3.45Å; E220-C223 PolarHBondContact O-N 2.8Å; C223-Y226 PolarHBondContact O-N 2.88Å; C223-K227 VanDerWaalsContact O-CG 3.25Å; C223-K227 WeakPolarHBondContact O-CG 3.46Å; C223-K227 PolarHBondContact O-N 3.25Å
224E96.3Very high95Very high119 Ų119101.5 Ų101.556%0.55650%0.496SS*.Hα-helixtrans-65.4-47.4173.7-72.8177.317100111.6E220 A221 D222 Y226 K227 E228E220-E224 WeakPolarHBondContact O-CG 3.45Å; E220-E224 PolarHBondContact O-N 3.05Å; A221-E224 PolarHBondContact O-N 2.87Å; D222-E224 VanDerWaalsContact C-N 3.28Å; D222-E224 PolarHBondContact O-N 3.45Å; E224-Y226 VanDerWaalsContact C-N 3.28Å; E224-Y226 PolarHBondContact O-N 3.45Å; E224-K227 WeakPolarHBondContact O-CB 3.21Å; E224-K227 PolarHBondContact O-N 3.36Å; E224-E228 WeakPolarHBondContact O-CG 3.18Å; E224-E228 PolarHBondContact O-N 2.94Å
225K96.4Very high95.1Very high108 Ų108104.6 Ų104.647%0.4751%0.507SS..Hα-helixtrans-58.1-39.4174.3-67.3170.3-161.1157.20112.4A221 D222 E228 K229A221-K225 WeakPolarHBondContact O-CG 3.38Å; A221-K225 PolarHBondContact O-N 3.36Å; D222-K225 PolarHBondContact O-N 2.82Å; D222-K225 IonicContact OD1-NZ 3.99Å; D222-K225 PolarHBondContact OD1-NZ 3.36Å; K225-E228 PolarHBondContact O-N 3.2Å; K225-K229 WeakPolarHBondContact O-CB 3.33Å; K225-K229 VanDerWaalsContact O-CG 3.29Å; K225-K229 WeakPolarHBondContact O-CG 3.13Å; K225-K229 PolarHBondContact O-N 2.92Å
226Y93.2Very high95Very high158 Ų158101.8 Ų101.862%0.6250%0.503SS*.Hα-helixtrans-69.9-34.6176.4-72.4-58.1000112.4D222 C223 E224 K229 L230D222-Y226 HydrophobicContact CB-CE2 4.39Å; D222-Y226 WeakPolarHBondContact O-CD2 3.4Å; D222-Y226 PolarHBondContact O-N 2.92Å; C223-Y226 PolarHBondContact O-N 2.88Å; E224-Y226 VanDerWaalsContact C-N 3.28Å; E224-Y226 PolarHBondContact O-N 3.45Å; Y226-K229 HydrophobicContact CD1-CD 4.37Å; Y226-L230 WeakPolarHBondContact O-CB 3.42Å; Y226-L230 PolarHBondContact O-N 3.29Å
227K96.2Very high95Very high144 Ų144101.7 Ų101.763%0.62651%0.505SS*.Hα-helixtrans-64.9-42171.7-73.7168.8-176.7175.10111.7C223 E224 L230 S231C223-K227 VanDerWaalsContact O-CG 3.25Å; C223-K227 WeakPolarHBondContact O-CG 3.46Å; C223-K227 PolarHBondContact O-N 3.25Å; E224-K227 WeakPolarHBondContact O-CB 3.21Å; E224-K227 PolarHBondContact O-N 3.36Å; K227-L230 PolarHBondContact O-N 2.86Å; K227-S231 PolarHBondContact O-N 3.03Å
228E95.2Very high95Very high119 Ų119102 Ų10256%0.55650%0.504SS*.Hα-helixtrans-61.7-49.8174.8-71.7176.6172.400111E224 K225 L230 S231 E232E224-E228 WeakPolarHBondContact O-CG 3.18Å; E224-E228 PolarHBondContact O-N 2.94Å; K225-E228 PolarHBondContact O-N 3.2Å; E228-L230 VanDerWaalsContact C-N 3.26Å; E228-L230 PolarHBondContact O-N 3.16Å; E228-S231 WeakPolarHBondContact O-CA 3.23Å; E228-S231 WeakPolarHBondContact O-CB 3.48Å; E228-S231 PolarHBondContact O-N 3.19Å; E228-S231 PolarHBondContact O-OG 2.7Å; E228-E232 PolarHBondContact O-N 3.04Å
229K96Very high95.1Very high114 Ų114100.8 Ų100.850%0.49649%0.494SS..Hα-helixtrans-58.1-37.2174.7-73174.5-178.6-179.40113K225 Y226 E232 L233K225-K229 WeakPolarHBondContact O-CB 3.33Å; K225-K229 VanDerWaalsContact O-CG 3.29Å; K225-K229 WeakPolarHBondContact O-CG 3.13Å; K225-K229 PolarHBondContact O-N 2.92Å; Y226-K229 HydrophobicContact CD1-CD 4.37Å; K229-E232 PolarHBondContact O-N 2.79Å; K229-L233 WeakPolarHBondContact O-CG 3.31Å; K229-L233 PolarHBondContact O-N 3.5Å
230L94.8Very high95Very high96 Ų9699 Ų9950%0.50349%0.488SS..Hα-helixtrans-65.5-42.8175.3-173.664.8000110.9Y226 K227 E228 E232 L233 D234Y226-L230 WeakPolarHBondContact O-CB 3.42Å; Y226-L230 PolarHBondContact O-N 3.29Å; K227-L230 PolarHBondContact O-N 2.86Å; E228-L230 VanDerWaalsContact C-N 3.26Å; E228-L230 PolarHBondContact O-N 3.16Å; L230-E232 VanDerWaalsContact C-N 3.34Å; L230-E232 PolarHBondContact O-N 2.73Å; L230-L233 PolarHBondContact O-N 3.36Å; L230-D234 PolarHBondContact O-N 3.29Å
231S95.3Very high95Very high70 Ų7097.8 Ų97.849%0.4948%0.482SS..Hα-helixtrans-64.2-36.1175.373.80000113.1K227 E228 D234 F235K227-S231 PolarHBondContact O-N 3.03Å; E228-S231 WeakPolarHBondContact O-CA 3.23Å; E228-S231 WeakPolarHBondContact O-CB 3.48Å; E228-S231 PolarHBondContact O-N 3.19Å; E228-S231 PolarHBondContact O-OG 2.7Å; S231-D234 PolarHBondContact O-N 3.37Å; S231-F235 PolarHBondContact O-N 3.21Å
232E96.9Very high94.9Very high121 Ų121100.8 Ų100.857%0.56549%0.49SS*.Hα-helixtrans-66.5-42.3172.5-70.9176.6-173.800111.8E228 K229 L230 D234 F235 L236E228-E232 PolarHBondContact O-N 3.04Å; K229-E232 PolarHBondContact O-N 2.79Å; L230-E232 VanDerWaalsContact C-N 3.34Å; L230-E232 PolarHBondContact O-N 2.73Å; E232-D234 VanDerWaalsContact C-N 3.31Å; E232-D234 PolarHBondContact O-N 2.72Å; E232-F235 WeakPolarHBondContact O-CB 3.2Å; E232-F235 PolarHBondContact O-N 2.78Å; E232-L236 WeakPolarHBondContact O-CG 3.34Å; E232-L236 PolarHBondContact O-N 3.33Å
233L91.8Very high94.8Very high96 Ų96101 Ų10150%0.50349%0.49SS..Hα-helixtrans-62.2-39.6174.3-78172.5000111.6K229 L230 L236 K237K229-L233 WeakPolarHBondContact O-CG 3.31Å; K229-L233 PolarHBondContact O-N 3.5Å; L230-L233 PolarHBondContact O-N 3.36Å; L233-L236 PolarHBondContact O-N 3.46Å; L233-K237 VanDerWaalsContact O-CG 3.26Å; L233-K237 WeakPolarHBondContact O-CG 3.23Å; L233-K237 PolarHBondContact O-N 2.79Å
234D94.8Very high95Very high71 Ų71105.7 Ų105.738%0.3850%0.498SS..Hα-helixtrans-67.4-38.7176-68-26000111.6L230 S231 E232 K237 S238L230-D234 PolarHBondContact O-N 3.29Å; S231-D234 PolarHBondContact O-N 3.37Å; E232-D234 VanDerWaalsContact C-N 3.31Å; E232-D234 PolarHBondContact O-N 2.72Å; D234-K237 PolarHBondContact O-N 3.2Å; D234-K237 IonicContact OD1-NZ 2.84Å; D234-K237 PolarHBondContact OD1-NZ 2.71Å; D234-S238 PolarHBondContact O-N 2.94Å; D234-S238 PolarHBondContact O-OG 2.84Å
235F95.5Very high94.9Very high145 Ų145105.9 Ų105.964%0.63650%0.499SS*.Hα-helixtrans-60.7-45170.5173.6-97000112.4S231 E232 K237 S238 R239S231-F235 PolarHBondContact O-N 3.21Å; E232-F235 WeakPolarHBondContact O-CB 3.2Å; E232-F235 PolarHBondContact O-N 2.78Å; F235-K237 VanDerWaalsContact C-N 3.35Å; F235-S238 PolarHBondContact O-N 2.85Å; F235-R239 PolarHBondContact O-N 2.9Å
236L95.9Very high94.9Very high98 Ų98105.2 Ų105.251%0.51350%0.498SS..Hα-helixtrans-65.6-36.9177.1-70.5175.3000112E232 L233 R239 V240E232-L236 WeakPolarHBondContact O-CG 3.34Å; E232-L236 PolarHBondContact O-N 3.33Å; L233-L236 PolarHBondContact O-N 3.46Å; L236-R239 PolarHBondContact O-N 3.46Å; L236-V240 VanDerWaalsContact O-CG2 3.31Å; L236-V240 WeakPolarHBondContact O-CG2 3.31Å; L236-V240 PolarHBondContact O-N 2.94Å
237K95.8Very high94.8Very high107 Ų107102.1 Ų102.147%0.46549%0.492SS..Hα-helixtrans-60.7-49.4172.2-73.2171.2-160.2159.50110.9L233 D234 F235 R239 V240 E241L233-K237 VanDerWaalsContact O-CG 3.26Å; L233-K237 WeakPolarHBondContact O-CG 3.23Å; L233-K237 PolarHBondContact O-N 2.79Å; D234-K237 PolarHBondContact O-N 3.2Å; D234-K237 IonicContact OD1-NZ 2.84Å; D234-K237 PolarHBondContact OD1-NZ 2.71Å; F235-K237 VanDerWaalsContact C-N 3.35Å; K237-R239 VanDerWaalsContact C-N 3.27Å; K237-R239 PolarHBondContact O-N 3.35Å; K237-V240 PolarHBondContact O-N 2.88Å; K237-V240 VanDerWaalsContact O-N 3.1Å; K237-E241 WeakPolarHBondContact O-CG 3.14Å; K237-E241 PolarHBondContact O-N 2.86Å
238S94.7Very high94.8Very high59 Ų59100.5 Ų100.541%0.41349%0.486SS..Hα-helixtrans-58.9-39.4175.6-61.40000111.7D234 F235 V240 E241 E242D234-S238 PolarHBondContact O-N 2.94Å; D234-S238 PolarHBondContact O-OG 2.84Å; F235-S238 PolarHBondContact O-N 2.85Å; S238-V240 PolarHBondContact O-N 3.37Å; S238-E241 PolarHBondContact O-N 3.43Å; S238-E242 WeakPolarHBondContact O-CG 3.39Å; S238-E242 PolarHBondContact O-N 2.85Å
239R96.9Very high94.8Very high90 Ų9098.6 Ų98.634%0.3448%0.483SS..Hα-helixtrans-66.7-35.5175.8-175.657-175.8145.86.6113.1F235 L236 K237 E242 L243 E246F235-R239 PolarHBondContact O-N 2.9Å; L236-R239 PolarHBondContact O-N 3.46Å; K237-R239 VanDerWaalsContact C-N 3.27Å; K237-R239 PolarHBondContact O-N 3.35Å; R239-E242 WeakPolarHBondContact CD-OE2 3.36Å; R239-E242 IonicContact CZ-OE2 3.93Å; R239-E242 IonicContact NH1-OE2 2.68Å; R239-E242 PolarHBondContact NH1-OE2 2.84Å; R239-L243 HydrophobicContact CG-CD1 4.45Å; R239-L243 WeakPolarHBondContact O-CB 3.43Å; R239-L243 VanDerWaalsContact O-CG 3.31Å; R239-L243 WeakPolarHBondContact O-CG 3.37Å; R239-L243 PolarHBondContact O-N 3.47Å; R239-E246 IonicContact NH1-OE1 3.81Å; R239-E246 PolarHBondContact NH1-OE1 3.33Å
240V93.4Very high94.7Very high65 Ų6598.3 Ų98.339%0.39449%0.486SS..Hα-helixtrans-70.1-38.4174.8168.70000111.1L236 K237 S238 L243 R244L236-V240 VanDerWaalsContact O-CG2 3.31Å; L236-V240 WeakPolarHBondContact O-CG2 3.31Å; L236-V240 PolarHBondContact O-N 2.94Å; K237-V240 PolarHBondContact O-N 2.88Å; K237-V240 VanDerWaalsContact O-N 3.1Å; S238-V240 PolarHBondContact O-N 3.37Å; V240-L243 PolarHBondContact O-N 3.07Å; V240-R244 VanDerWaalsContact O-CG 3.26Å; V240-R244 WeakPolarHBondContact O-CG 3.32Å; V240-R244 PolarHBondContact O-N 3.27Å
241E95Very high94.6Very high101 Ų10199 Ų9947%0.47249%0.49SS..Hα-helixtrans-60.2-53.8171.7-71.6168.3-17900110.1K237 S238 L243 R244 E245K237-E241 WeakPolarHBondContact O-CG 3.14Å; K237-E241 PolarHBondContact O-N 2.86Å; S238-E241 PolarHBondContact O-N 3.43Å; E241-L243 VanDerWaalsContact C-N 3.29Å; E241-L243 PolarHBondContact O-N 2.95Å; E241-R244 CarbonylContact O-C 3.52Å; E241-R244 WeakPolarHBondContact O-CA 3.41Å; E241-R244 VanDerWaalsContact O-CB 3.32Å; E241-R244 WeakPolarHBondContact O-CB 3.2Å; E241-R244 PolarHBondContact O-N 3.49Å; E241-E245 PolarHBondContact O-N 3.35Å
242E92.4Very high94.6Very high101 Ų101100.8 Ų100.847%0.47249%0.49SS..Hα-helixtrans-50.9-45.9174.8-73.9174.1-176.200112.9S238 R239 R244 E245 E246S238-E242 WeakPolarHBondContact O-CG 3.39Å; S238-E242 PolarHBondContact O-N 2.85Å; R239-E242 WeakPolarHBondContact CD-OE2 3.36Å; R239-E242 IonicContact CZ-OE2 3.93Å; R239-E242 IonicContact NH1-OE2 2.68Å; R239-E242 PolarHBondContact NH1-OE2 2.84Å; E242-R244 VanDerWaalsContact C-N 3.32Å; E242-R244 PolarHBondContact O-N 2.72Å; E242-E245 PolarHBondContact O-N 3.4Å; E242-E246 WeakPolarHBondContact O-CB 3.41Å; E242-E246 WeakPolarHBondContact O-CG 3.27Å; E242-E246 PolarHBondContact O-N 3.43Å
243L93.2Very high94.5Very high69 Ų6997.9 Ų97.936%0.36148%0.481SS..Hα-helixtrans-67.8-28.4177.5-75.3173000113.4R239 V240 E241 N247R239-L243 HydrophobicContact CG-CD1 4.45Å; R239-L243 WeakPolarHBondContact O-CB 3.43Å; R239-L243 VanDerWaalsContact O-CG 3.31Å; R239-L243 WeakPolarHBondContact O-CG 3.37Å; R239-L243 PolarHBondContact O-N 3.47Å; V240-L243 PolarHBondContact O-N 3.07Å; E241-L243 VanDerWaalsContact C-N 3.29Å; E241-L243 PolarHBondContact O-N 2.95Å; L243-N247 WeakPolarHBondContact O-CB 3.27Å; L243-N247 PolarHBondContact O-N 2.82Å; L243-N247 PolarHBondContact O-ND2 2.84Å
244R95.8Very high94.5Very high169 Ų16999 Ų9964%0.63848%0.482SS*.Hα-helixtrans-72.6-42.1172.8-75168.7176.4167.50.4110.7V240 E241 E242 N247 H248V240-R244 VanDerWaalsContact O-CG 3.26Å; V240-R244 WeakPolarHBondContact O-CG 3.32Å; V240-R244 PolarHBondContact O-N 3.27Å; E241-R244 CarbonylContact O-C 3.52Å; E241-R244 WeakPolarHBondContact O-CA 3.41Å; E241-R244 VanDerWaalsContact O-CB 3.32Å; E241-R244 WeakPolarHBondContact O-CB 3.2Å; E241-R244 PolarHBondContact O-N 3.49Å; E242-R244 VanDerWaalsContact C-N 3.32Å; E242-R244 PolarHBondContact O-N 2.72Å; R244-N247 PolarHBondContact O-N 2.89Å; R244-H248 WeakPolarHBondContact O-CB 3.26Å; R244-H248 PolarHBondContact O-N 3.29Å
245E94.9Very high94.5Very high122 Ų12296.9 Ų96.957%0.5748%0.477SS*.Hα-helixtrans-62.3-46171.8-92.782.8-135.900111.7E241 E242 N247 H248 V249E241-E245 PolarHBondContact O-N 3.35Å; E242-E245 PolarHBondContact O-N 3.4Å; E245-N247 VanDerWaalsContact C-N 3.34Å; E245-N247 PolarHBondContact O-N 3.37Å; E245-H248 WeakPolarHBondContact O-CB 3.47Å; E245-H248 PolarHBondContact O-N 2.94Å; E245-H248 VanDerWaalsContact O-N 3.13Å; E245-V249 WeakPolarHBondContact O-CG2 3.5Å; E245-V249 PolarHBondContact O-N 3.4Å
246E94.4Very high94.4Very high94 Ų9495 Ų9544%0.43947%0.473SS..Hα-helixtrans-58.5-44.2175.4-74.7174.3-15700111.4R239 E242 H248 V249 L250R239-E246 IonicContact NH1-OE1 3.81Å; R239-E246 PolarHBondContact NH1-OE1 3.33Å; E242-E246 WeakPolarHBondContact O-CB 3.41Å; E242-E246 WeakPolarHBondContact O-CG 3.27Å; E242-E246 PolarHBondContact O-N 3.43Å; E246-H248 PolarHBondContact O-N 3.36Å; E246-V249 PolarHBondContact O-N 2.95Å; E246-L250 WeakPolarHBondContact O-CG 3.13Å; E246-L250 PolarHBondContact O-N 2.79Å
247N91.6Very high94.3Very high93 Ų9395.3 Ų95.350%0.49748%0.475SS..Hα-helixtrans-64.2-38.1174.5-91.9-66.8000112.8L243 R244 E245 L250 L251L243-N247 WeakPolarHBondContact O-CB 3.27Å; L243-N247 PolarHBondContact O-N 2.82Å; L243-N247 PolarHBondContact O-ND2 2.84Å; R244-N247 PolarHBondContact O-N 2.89Å; E245-N247 VanDerWaalsContact C-N 3.34Å; E245-N247 PolarHBondContact O-N 3.37Å; N247-L250 PolarHBondContact O-N 2.72Å; N247-L251 WeakPolarHBondContact O-CG 3.4Å; N247-L251 PolarHBondContact O-N 3.45Å
248H95.9Very high94.2Very high110 Ų11094.1 Ų94.151%0.50947%0.473SS..Hα-helixtrans-61.3-47.4176.9-174.355.1000110.8R244 E245 E246 L250 L251 E252R244-H248 WeakPolarHBondContact O-CB 3.26Å; R244-H248 PolarHBondContact O-N 3.29Å; E245-H248 WeakPolarHBondContact O-CB 3.47Å; E245-H248 PolarHBondContact O-N 2.94Å; E245-H248 VanDerWaalsContact O-N 3.13Å; E246-H248 PolarHBondContact O-N 3.36Å; H248-L250 VanDerWaalsContact C-N 3.33Å; H248-L250 PolarHBondContact O-N 3.27Å; H248-L251 PolarHBondContact O-N 2.75Å; H248-L251 VanDerWaalsContact O-N 3.15Å; H248-E252 IonicContact CD2-OE1 2.79Å; H248-E252 IonicContact CE1-OE1 3.17Å; H248-E252 IonicContact NE2-OE1 2.77Å; H248-E252 PolarHBondContact NE2-OE1 2.87Å; H248-E252 WeakPolarHBondContact O-CG 3.35Å; H248-E252 PolarHBondContact O-N 3.18Å
249V95Very high94.2Very high79 Ų7996.5 Ų96.548%0.47948%0.482SS..Hα-helixtrans-62.7-38175.3176.20000111.7E245 E246 E252 T253E245-V249 WeakPolarHBondContact O-CG2 3.5Å; E245-V249 PolarHBondContact O-N 3.4Å; E246-V249 PolarHBondContact O-N 2.95Å; V249-E252 PolarHBondContact O-N 2.89Å; V249-T253 HydrophobicContact CG1-CG2 4.41Å; V249-T253 WeakPolarHBondContact O-CG2 3.36Å; V249-T253 PolarHBondContact O-N 3.32Å; V249-T253 PolarHBondContact O-OG1 2.89Å
250L94.5Very high94.2Very high108 Ų10897.8 Ų97.857%0.56549%0.492SS*.Hα-helixtrans-64.8-38.3174.3-73.8173.6000112.4E246 N247 H248 T253 K254E246-L250 WeakPolarHBondContact O-CG 3.13Å; E246-L250 PolarHBondContact O-N 2.79Å; N247-L250 PolarHBondContact O-N 2.72Å; H248-L250 VanDerWaalsContact C-N 3.33Å; H248-L250 PolarHBondContact O-N 3.27Å; L250-T253 WeakPolarHBondContact CA-OG1 3.35Å; L250-T253 PolarHBondContact O-OG1 2.91Å; L250-K254 VanDerWaalsContact O-CB 3.25Å; L250-K254 WeakPolarHBondContact O-CB 3.39Å; L250-K254 PolarHBondContact O-N 3.1Å
251L94.1Very high94.1Very high112 Ų11297.6 Ų97.659%0.58649%0.49SS*.Hα-helixtrans-68.2-39.1174.7-73.1172000112N247 H248 K254 G255N247-L251 WeakPolarHBondContact O-CG 3.4Å; N247-L251 PolarHBondContact O-N 3.45Å; H248-L251 PolarHBondContact O-N 2.75Å; H248-L251 VanDerWaalsContact O-N 3.15Å; L251-K254 PolarHBondContact O-N 3.39Å; L251-G255 PolarHBondContact O-N 3.47Å
252E94.9Very high94Very high106 Ų10695.3 Ų95.350%0.49549%0.489SS..Hα-helixtrans-63.6-46.9173.7-71.2-176.9156.800111.7H248 V249 K254 G255 L256H248-E252 IonicContact CD2-OE1 2.79Å; H248-E252 IonicContact CE1-OE1 3.17Å; H248-E252 IonicContact NE2-OE1 2.77Å; H248-E252 PolarHBondContact NE2-OE1 2.87Å; H248-E252 WeakPolarHBondContact O-CG 3.35Å; H248-E252 PolarHBondContact O-N 3.18Å; V249-E252 PolarHBondContact O-N 2.89Å; E252-K254 PolarHBondContact O-N 3.36Å; E252-G255 PolarHBondContact O-N 3.29Å; E252-G255 VanDerWaalsContact O-N 3.16Å; E252-L256 WeakPolarHBondContact O-CG 3.31Å; E252-L256 PolarHBondContact O-N 2.75Å
253T93.4Very high94.1Very high61 Ų6194.2 Ų94.237%0.37449%0.492SS..Hα-helixtrans-65.2-38.3177.353.70000112.2V249 L250 L256 L257V249-T253 HydrophobicContact CG1-CG2 4.41Å; V249-T253 WeakPolarHBondContact O-CG2 3.36Å; V249-T253 PolarHBondContact O-N 3.32Å; V249-T253 PolarHBondContact O-OG1 2.89Å; L250-T253 WeakPolarHBondContact CA-OG1 3.35Å; L250-T253 PolarHBondContact O-OG1 2.91Å; T253-L256 PolarHBondContact O-N 2.81Å; T253-L257 WeakPolarHBondContact O-CG 3.06Å; T253-L257 PolarHBondContact O-N 3.43Å
254K92.4Very high94.1Very high118 Ų11895.2 Ų95.251%0.51350%0.497SS..Hα-helixtrans-59.9-46.8169.9-174.2-149.6171-164.80110.8L250 L251 E252 L256 L257 D258L250-K254 VanDerWaalsContact O-CB 3.25Å; L250-K254 WeakPolarHBondContact O-CB 3.39Å; L250-K254 PolarHBondContact O-N 3.1Å; L251-K254 PolarHBondContact O-N 3.39Å; E252-K254 PolarHBondContact O-N 3.36Å; K254-L256 VanDerWaalsContact C-N 3.33Å; K254-L256 PolarHBondContact O-N 2.82Å; K254-L257 PolarHBondContact O-N 3.45Å; K254-L257 VanDerWaalsContact O-N 3.11Å; K254-D258 VanDerWaalsContact CE-OD2 3.29Å; K254-D258 WeakPolarHBondContact CE-OD2 3.46Å; K254-D258 IonicContact NZ-OD2 3.41Å; K254-D258 PolarHBondContact O-N 3.33Å
255G94.3Very high94Very high28 Ų2896 Ų9629%0.28950%0.5SS..Hα-helixtrans-57.1-44.7176.400000112.4L251 E252 L257 D258 D259L251-G255 PolarHBondContact O-N 3.47Å; E252-G255 PolarHBondContact O-N 3.29Å; E252-G255 VanDerWaalsContact O-N 3.16Å; G255-L257 VanDerWaalsContact C-N 3.33Å; G255-L257 PolarHBondContact O-N 3.44Å; G255-D258 PolarHBondContact O-N 2.86Å; G255-D259 PolarHBondContact O-N 3.26Å
256L94.9Very high94Very high106 Ų10696.2 Ų96.256%0.55550%0.501SS*.Hα-helixtrans-62.5-37.5175.2-68.7173.8000112.7E252 T253 K254 Q260E252-L256 WeakPolarHBondContact O-CG 3.31Å; E252-L256 PolarHBondContact O-N 2.75Å; T253-L256 PolarHBondContact O-N 2.81Å; K254-L256 VanDerWaalsContact C-N 3.33Å; K254-L256 PolarHBondContact O-N 2.82Å; L256-Q260 VanDerWaalsContact O-CG 3.27Å; L256-Q260 WeakPolarHBondContact O-CG 3.44Å; L256-Q260 PolarHBondContact O-N 3.35Å
257L92.4Very high94.1Very high103 Ų10399 Ų9954%0.53951%0.508SS..Hα-helixtrans-70.2-39.9175-70.5173.2000111.8T253 K254 G255 D259 Q260 V261T253-L257 WeakPolarHBondContact O-CG 3.06Å; T253-L257 PolarHBondContact O-N 3.43Å; K254-L257 PolarHBondContact O-N 3.45Å; K254-L257 VanDerWaalsContact O-N 3.11Å; G255-L257 VanDerWaalsContact C-N 3.33Å; G255-L257 PolarHBondContact O-N 3.44Å; L257-D259 VanDerWaalsContact C-N 3.33Å; L257-Q260 PolarHBondContact O-N 3.04Å; L257-V261 WeakPolarHBondContact O-CB 3.48Å; L257-V261 VanDerWaalsContact O-CG2 3.3Å; L257-V261 WeakPolarHBondContact O-CG2 3.42Å; L257-V261 PolarHBondContact O-N 2.9Å
258D94.1Very high94.1Very high82 Ų8299.5 Ų99.544%0.43951%0.51SS..Hα-helixtrans-62.1-41.5174.9-74-28.6000110.7K254 G255 V261 A262K254-D258 VanDerWaalsContact CE-OD2 3.29Å; K254-D258 WeakPolarHBondContact CE-OD2 3.46Å; K254-D258 IonicContact NZ-OD2 3.41Å; K254-D258 PolarHBondContact O-N 3.33Å; G255-D258 PolarHBondContact O-N 2.86Å; D258-V261 PolarHBondContact O-N 3.16Å; D258-A262 WeakPolarHBondContact O-CB 3.31Å; D258-A262 PolarHBondContact O-N 3.38Å
259D95.2Very high94Very high110 Ų11095.6 Ų95.659%0.58850%0.499SS*.Hα-helixtrans-65-41.1174.1-75-19.4000112.3G255 L257 A262 S263G255-D259 PolarHBondContact O-N 3.26Å; L257-D259 VanDerWaalsContact C-N 3.33Å; D259-A262 PolarHBondContact O-N 3.45Å; D259-S263 WeakPolarHBondContact O-CB 3.5Å; D259-S263 PolarHBondContact O-N 3.45Å
260Q95.8Very high94.1Very high117 Ų11795.7 Ų95.755%0.54750%0.496SS..Hα-helixtrans-62.9-44173.3-75.6176.817.400111.1L256 L257 A262 S263 L264L256-Q260 VanDerWaalsContact O-CG 3.27Å; L256-Q260 WeakPolarHBondContact O-CG 3.44Å; L256-Q260 PolarHBondContact O-N 3.35Å; L257-Q260 PolarHBondContact O-N 3.04Å; Q260-A262 VanDerWaalsContact C-N 3.34Å; Q260-A262 PolarHBondContact O-N 2.92Å; Q260-S263 WeakPolarHBondContact O-CB 3.22Å; Q260-S263 PolarHBondContact O-N 2.88Å; Q260-L264 WeakPolarHBondContact O-CB 3.45Å; Q260-L264 WeakPolarHBondContact O-CG 3.22Å; Q260-L264 PolarHBondContact O-N 2.88Å
261V91.1Very high94Very high61 Ų6193.7 Ų93.737%0.3749%0.487SS..Hα-helixtrans-63.2-41.7175.9169.90000110.7L257 D258 L264 R265L257-V261 WeakPolarHBondContact O-CB 3.48Å; L257-V261 VanDerWaalsContact O-CG2 3.3Å; L257-V261 WeakPolarHBondContact O-CG2 3.42Å; L257-V261 PolarHBondContact O-N 2.9Å; D258-V261 PolarHBondContact O-N 3.16Å; V261-L264 PolarHBondContact O-N 3.05Å; V261-R265 HydrophobicContact CG1-CG 4.41Å; V261-R265 WeakPolarHBondContact O-CB 3.29Å; V261-R265 VanDerWaalsContact O-CG 3.28Å; V261-R265 WeakPolarHBondContact O-CG 3.27Å; V261-R265 PolarHBondContact O-N 3.38Å
262A93.5Very high93.9Very high53 Ų5392.1 Ų92.144%0.43848%0.479SS..Hα-helixtrans-61.7-44174.800000111.7D258 D259 Q260 L264 R265 H266D258-A262 WeakPolarHBondContact O-CB 3.31Å; D258-A262 PolarHBondContact O-N 3.38Å; D259-A262 PolarHBondContact O-N 3.45Å; Q260-A262 VanDerWaalsContact C-N 3.34Å; Q260-A262 PolarHBondContact O-N 2.92Å; A262-L264 PolarHBondContact O-N 2.9Å; A262-R265 PolarHBondContact O-N 3.41Å; A262-H266 WeakPolarHBondContact O-CB 3.35Å; A262-H266 PolarHBondContact O-N 2.91Å
263S95.1Very high93.9Very high78 Ų7891.8 Ų91.855%0.54548%0.48SS..Hα-helixtrans-61.2-42.7174.9-177.90000112.3D259 Q260 H266 R267D259-S263 WeakPolarHBondContact O-CB 3.5Å; D259-S263 PolarHBondContact O-N 3.45Å; Q260-S263 WeakPolarHBondContact O-CB 3.22Å; Q260-S263 PolarHBondContact O-N 2.88Å; S263-H266 PolarHBondContact O-N 2.86Å; S263-R267 WeakPolarHBondContact O-CB 3.19Å; S263-R267 PolarHBondContact O-N 3.35Å
264L93.3Very high93.8Very high89 Ų8996.8 Ų96.847%0.46649%0.492SS..Hα-helixtrans-65.3-41.8175.7-68.7173.7000111.9Q260 V261 A262 R267 L268Q260-L264 WeakPolarHBondContact O-CB 3.45Å; Q260-L264 WeakPolarHBondContact O-CG 3.22Å; Q260-L264 PolarHBondContact O-N 2.88Å; V261-L264 PolarHBondContact O-N 3.05Å; A262-L264 PolarHBondContact O-N 2.9Å; L264-R267 PolarHBondContact O-N 2.89Å; L264-L268 WeakPolarHBondContact O-CB 3.46Å; L264-L268 PolarHBondContact O-N 3.3Å
265R94.4Very high93.9Very high185 Ų18595.6 Ų95.670%0.69849%0.489SS*.Hα-helixtrans-63.1-43.3175-74.6174.2-178.6177.92.9111.6V261 A262 L268 G269V261-R265 HydrophobicContact CG1-CG 4.41Å; V261-R265 WeakPolarHBondContact O-CB 3.29Å; V261-R265 VanDerWaalsContact O-CG 3.28Å; V261-R265 WeakPolarHBondContact O-CG 3.27Å; V261-R265 PolarHBondContact O-N 3.38Å; A262-R265 PolarHBondContact O-N 3.41Å; R265-L268 WeakPolarHBondContact O-CB 3.37Å; R265-L268 PolarHBondContact O-N 3.49Å; R265-G269 PolarHBondContact O-N 2.77Å
266H94Very high93.8Very high128 Ų12896.7 Ų96.759%0.59350%0.495SS*.Hα-helixtrans-61.2-45.1174.6-178.3-75.8000111.4A262 S263 L268 G269 L270A262-H266 WeakPolarHBondContact O-CB 3.35Å; A262-H266 PolarHBondContact O-N 2.91Å; S263-H266 PolarHBondContact O-N 2.86Å; H266-L268 VanDerWaalsContact C-N 3.34Å; H266-L268 PolarHBondContact O-N 3.15Å; H266-G269 PolarHBondContact O-N 2.65Å; H266-L270 PolarHBondContact O-N 2.75Å
267R95.4Very high93.8Very high153 Ų15394.8 Ų94.858%0.57749%0.485SS*.Hα-helixtrans-64.3-36.9176.7-174.7174.458.377.4-1.5112.6S263 L264 N271S263-R267 WeakPolarHBondContact O-CB 3.19Å; S263-R267 PolarHBondContact O-N 3.35Å; L264-R267 PolarHBondContact O-N 2.89Å; R267-N271 PolarHBondContact O-N 3.5Å
268L93.3Very high93.9Very high103 Ų10394 Ų9454%0.53948%0.481SS..Hα-helixtrans-64.3-43.7173.2-168.490.3000110.7L264 R265 H266 L270 N271 N272L264-L268 WeakPolarHBondContact O-CB 3.46Å; L264-L268 PolarHBondContact O-N 3.3Å; R265-L268 WeakPolarHBondContact O-CB 3.37Å; R265-L268 PolarHBondContact O-N 3.49Å; H266-L268 VanDerWaalsContact C-N 3.34Å; H266-L268 PolarHBondContact O-N 3.15Å; L268-L270 PolarHBondContact O-N 3.34Å; L268-N271 WeakPolarHBondContact O-CB 3.32Å; L268-N271 PolarHBondContact O-N 2.98Å; L268-N271 VanDerWaalsContact O-N 3.08Å; L268-N272 VanDerWaalsContact O-CG 3.32Å; L268-N272 PolarHBondContact O-N 3.29Å; L268-N272 PolarHBondContact O-OD1 3.47Å
269G94Very high93.9Very high28 Ų2895.4 Ų95.429%0.28949%0.487SS..Hα-helixtrans-55.9-50.617400000112.3R265 H266 N271 N272 D273R265-G269 PolarHBondContact O-N 2.77Å; H266-G269 PolarHBondContact O-N 2.65Å; G269-N271 PolarHBondContact O-N 3.48Å; G269-N272 WeakPolarHBondContact O-CB 3.37Å; G269-N272 PolarHBondContact O-N 2.87Å; G269-N272 VanDerWaalsContact O-N 3.1Å; G269-D273 PolarHBondContact O-N 3.12Å
270L95.8Very high93.9Very high80 Ų8097.7 Ų97.742%0.41949%0.487SS..Hα-helixtrans-60.3-32.1175-67.9179.8000113.4H266 L268 R274H266-L270 PolarHBondContact O-N 2.75Å; L268-L270 PolarHBondContact O-N 3.34Å; L270-R274 VanDerWaalsContact O-CG 3.29Å; L270-R274 WeakPolarHBondContact O-CG 3.23Å; L270-R274 PolarHBondContact O-N 2.81Å; L270-R274 VanDerWaalsContact O-N 3.16Å
271N92.2Very high93.8Very high67 Ų6797.5 Ų97.536%0.35849%0.49SS..Hα-helixtrans-71.3-41.1175.6-169.462.1000111.2R267 L268 G269 D273 R274 E275R267-N271 PolarHBondContact O-N 3.5Å; L268-N271 WeakPolarHBondContact O-CB 3.32Å; L268-N271 PolarHBondContact O-N 2.98Å; L268-N271 VanDerWaalsContact O-N 3.08Å; G269-N271 PolarHBondContact O-N 3.48Å; N271-D273 VanDerWaalsContact C-N 3.32Å; N271-D273 PolarHBondContact O-N 2.8Å; N271-R274 PolarHBondContact O-N 3.26Å; N271-E275 PolarHBondContact ND2-OE1 3.26Å; N271-E275 WeakPolarHBondContact O-CG 3.44Å; N271-E275 PolarHBondContact O-N 3.29Å
272N92.9Very high94.1Very high79 Ų79100.4 Ų100.442%0.42250%0.499SS..Hα-helixtrans-62.5-39.5174.9-65.7-8.2000111.6L268 G269 R274 E275 A276L268-N272 VanDerWaalsContact O-CG 3.32Å; L268-N272 PolarHBondContact O-N 3.29Å; L268-N272 PolarHBondContact O-OD1 3.47Å; G269-N272 WeakPolarHBondContact O-CB 3.37Å; G269-N272 PolarHBondContact O-N 2.87Å; G269-N272 VanDerWaalsContact O-N 3.1Å; N272-R274 VanDerWaalsContact C-N 3.35Å; N272-E275 PolarHBondContact O-N 3.3Å; N272-A276 WeakPolarHBondContact O-CB 3.34Å; N272-A276 PolarHBondContact O-N 3Å
273D94.9Very high94.1Very high98 Ų9899.4 Ų99.452%0.52449%0.494SS..Hα-helixtrans-62.8-42.8174.9-65.2-25.4000111.2G269 N271 A276 D277G269-D273 PolarHBondContact O-N 3.12Å; N271-D273 VanDerWaalsContact C-N 3.32Å; N271-D273 PolarHBondContact O-N 2.8Å; D273-A276 PolarHBondContact O-N 3.37Å; D273-D277 WeakPolarHBondContact O-CB 3.39Å; D273-D277 VanDerWaalsContact O-CG 3.25Å; D273-D277 PolarHBondContact O-N 3.08Å
274R91.2Very high94.2Very high166 Ų166103 Ų10363%0.62650%0.496SS*.Hα-helixtrans-65.3-38.7174.9-72.9171.8178.2175.50.6112.4L270 N271 N272 D277 I278L270-R274 VanDerWaalsContact O-CG 3.29Å; L270-R274 WeakPolarHBondContact O-CG 3.23Å; L270-R274 PolarHBondContact O-N 2.81Å; L270-R274 VanDerWaalsContact O-N 3.16Å; N271-R274 PolarHBondContact O-N 3.26Å; N272-R274 VanDerWaalsContact C-N 3.35Å; R274-D277 PolarHBondContact O-N 2.9Å; R274-I278 WeakPolarHBondContact O-CB 3.37Å; R274-I278 WeakPolarHBondContact O-CG1 3.28Å; R274-I278 PolarHBondContact O-N 3.46Å
275E93.8Very high94.2Very high94 Ų94102.2 Ų102.244%0.43950%0.495SS..Hα-helixtrans-64.6-42.4174.5-75.5174.2-16800111.2N271 N272 D277 I278 I279N271-E275 PolarHBondContact ND2-OE1 3.26Å; N271-E275 WeakPolarHBondContact O-CG 3.44Å; N271-E275 PolarHBondContact O-N 3.29Å; N272-E275 PolarHBondContact O-N 3.3Å; E275-D277 VanDerWaalsContact C-N 3.33Å; E275-D277 PolarHBondContact O-N 2.84Å; E275-I278 PolarHBondContact O-N 2.81Å; E275-I279 VanDerWaalsContact O-CG1 3.31Å; E275-I279 WeakPolarHBondContact O-CG1 3.43Å; E275-I279 PolarHBondContact O-N 2.88Å
276A93.1Very high94.2Very high51 Ų5195.3 Ų95.342%0.42148%0.477SS..Hα-helixtrans-61.7-41.2173.300000111.8N272 D273 I279 R280N272-A276 WeakPolarHBondContact O-CB 3.34Å; N272-A276 PolarHBondContact O-N 3Å; D273-A276 PolarHBondContact O-N 3.37Å; A276-I279 PolarHBondContact O-N 3.28Å; A276-R280 WeakPolarHBondContact O-CB 3.48Å; A276-R280 PolarHBondContact O-N 2.81Å
277D94.8Very high94.3Very high65 Ų6593.3 Ų93.335%0.34847%0.471SS..Hα-helixtrans-64.9-40.7174.6-73.1-3.7000112.2D273 R274 E275 R280 L281D273-D277 WeakPolarHBondContact O-CB 3.39Å; D273-D277 VanDerWaalsContact O-CG 3.25Å; D273-D277 PolarHBondContact O-N 3.08Å; R274-D277 PolarHBondContact O-N 2.9Å; E275-D277 VanDerWaalsContact C-N 3.33Å; E275-D277 PolarHBondContact O-N 2.84Å; D277-R280 PolarHBondContact O-N 3.37Å; D277-R280 IonicContact OD1-CZ 2.8Å; D277-R280 IonicContact OD1-NH1 3.4Å; D277-R280 PolarHBondContact OD1-NH1 3.37Å; D277-R280 IonicContact OD1-NH2 3.63Å; D277-R280 PolarHBondContact OD1-NH2 3.38Å; D277-R280 IonicContact OD2-NH2 2.65Å; D277-L281 WeakPolarHBondContact O-CB 3.33Å; D277-L281 VanDerWaalsContact O-CG 3.29Å; D277-L281 WeakPolarHBondContact O-CG 3.43Å; D277-L281 PolarHBondContact O-N 2.88Å
278I93.4Very high94.2Very high87 Ų8789.7 Ų89.745%0.44646%0.463SS..Hα-helixtrans-61.2-47.6174.3-73.3163.9000110.3R274 E275 R280 L281 Q282R274-I278 WeakPolarHBondContact O-CB 3.37Å; R274-I278 WeakPolarHBondContact O-CG1 3.28Å; R274-I278 PolarHBondContact O-N 3.46Å; E275-I278 PolarHBondContact O-N 2.81Å; I278-R280 VanDerWaalsContact C-N 3.3Å; I278-R280 PolarHBondContact O-N 3.46Å; I278-L281 PolarHBondContact O-N 3.33Å; I278-Q282 HydrophobicContact CG2-CG 4.24Å; I278-Q282 WeakPolarHBondContact O-CB 3.41Å; I278-Q282 VanDerWaalsContact O-CG 3.23Å; I278-Q282 WeakPolarHBondContact O-CG 3.29Å; I278-Q282 PolarHBondContact O-N 2.82Å
279I94.4Very high94.3Very high112 Ų11290.6 Ų90.657%0.57446%0.464SS*.Hα-helixtrans-61-42.4177.6-68.1165.8000110.3E275 A276 L281 Q282 G283E275-I279 VanDerWaalsContact O-CG1 3.31Å; E275-I279 WeakPolarHBondContact O-CG1 3.43Å; E275-I279 PolarHBondContact O-N 2.88Å; A276-I279 PolarHBondContact O-N 3.28Å; I279-L281 PolarHBondContact O-N 3.13Å; I279-Q282 PolarHBondContact O-N 2.89Å; I279-G283 PolarHBondContact O-N 2.87Å
280R95.8Very high94.3Very high157 Ų15795.1 Ų95.159%0.59248%0.478SS*.Hα-helixtrans-64.1-40.9177.6-171.1173.363.2-124.1-1.1112.2A276 D277 I278 R284A276-R280 WeakPolarHBondContact O-CB 3.48Å; A276-R280 PolarHBondContact O-N 2.81Å; D277-R280 PolarHBondContact O-N 3.37Å; D277-R280 IonicContact OD1-CZ 2.8Å; D277-R280 IonicContact OD1-NH1 3.4Å; D277-R280 PolarHBondContact OD1-NH1 3.37Å; D277-R280 IonicContact OD1-NH2 3.63Å; D277-R280 PolarHBondContact OD1-NH2 3.38Å; D277-R280 IonicContact OD2-NH2 2.65Å; I278-R280 VanDerWaalsContact C-N 3.3Å; I278-R280 PolarHBondContact O-N 3.46Å; R280-R284 PolarHBondContact O-N 3.45Å
281L94.7Very high94.1Very high114 Ų11495.9 Ų95.960%0.59748%0.479SS*.Hα-helixtrans-68.8-41175.3-72.6172.9000111.9D277 I278 I279 G283 R284 V285D277-L281 WeakPolarHBondContact O-CB 3.33Å; D277-L281 VanDerWaalsContact O-CG 3.29Å; D277-L281 WeakPolarHBondContact O-CG 3.43Å; D277-L281 PolarHBondContact O-N 2.88Å; I278-L281 PolarHBondContact O-N 3.33Å; I279-L281 PolarHBondContact O-N 3.13Å; L281-G283 VanDerWaalsContact C-N 3.35Å; L281-R284 PolarHBondContact O-N 3.39Å; L281-V285 WeakPolarHBondContact O-CG2 3.37Å; L281-V285 PolarHBondContact O-N 3.37Å
282Q96.5Very high94.2Very high121 Ų12197 Ų9757%0.56549%0.488SS*.Hα-helixtrans-60.8-43.5174.1-75.4172.6-14.500111.4I278 I279 V285 A286I278-Q282 HydrophobicContact CG2-CG 4.24Å; I278-Q282 WeakPolarHBondContact O-CB 3.41Å; I278-Q282 VanDerWaalsContact O-CG 3.23Å; I278-Q282 WeakPolarHBondContact O-CG 3.29Å; I278-Q282 PolarHBondContact O-N 2.82Å; I279-Q282 PolarHBondContact O-N 2.89Å; Q282-V285 PolarHBondContact O-N 2.81Å; Q282-A286 PolarHBondContact O-N 3.45Å
283G93.8Very high94.3Very high33 Ų3398.3 Ų98.334%0.3449%0.494SS..Hα-helixtrans-59.6-47.2172.900000112.2I279 L281 V285 A286 D287I279-G283 PolarHBondContact O-N 2.87Å; L281-G283 VanDerWaalsContact C-N 3.35Å; G283-V285 VanDerWaalsContact C-N 3.3Å; G283-V285 PolarHBondContact O-N 2.91Å; G283-A286 PolarHBondContact O-N 2.96Å; G283-A286 VanDerWaalsContact O-N 3.15Å; G283-D287 PolarHBondContact O-N 2.84Å
284R96.6Very high94.2Very high152 Ų15298.9 Ų98.957%0.57450%0.497SS*.Hα-helixtrans-60.6-37.8176.3174.86194.2151.56.7112.8R280 L281 L288R280-R284 PolarHBondContact O-N 3.45Å; L281-R284 PolarHBondContact O-N 3.39Å; R284-L288 HydrophobicContact CG-CD1 4.29Å; R284-L288 VanDerWaalsContact O-CG 3.31Å; R284-L288 WeakPolarHBondContact O-CG 3.42Å; R284-L288 PolarHBondContact O-N 3.46Å; R284-L288 VanDerWaalsContact O-N 3.1Å
285V93.5Very high94.3Very high74 Ų7496.8 Ų96.845%0.44849%0.494SS..Hα-helixtrans-65.4-45.7174.8169.90000110.4L281 Q282 G283 D287 L288 E289L281-V285 WeakPolarHBondContact O-CG2 3.37Å; L281-V285 PolarHBondContact O-N 3.37Å; Q282-V285 PolarHBondContact O-N 2.81Å; G283-V285 VanDerWaalsContact C-N 3.3Å; G283-V285 PolarHBondContact O-N 2.91Å; V285-D287 VanDerWaalsContact C-N 3.33Å; V285-D287 PolarHBondContact O-N 2.86Å; V285-L288 PolarHBondContact O-N 3.34Å; V285-E289 HydrophobicContact CG1-CG 4.31Å; V285-E289 WeakPolarHBondContact O-CG 3.42Å; V285-E289 PolarHBondContact O-N 3.36Å
286A95Very high94.3Very high40 Ų40100.4 Ų100.433%0.33150%0.504SS..Hα-helixtrans-60.3-40.5177.200000112.5Q282 G283 E289 Q290Q282-A286 PolarHBondContact O-N 3.45Å; G283-A286 PolarHBondContact O-N 2.96Å; G283-A286 VanDerWaalsContact O-N 3.15Å; A286-E289 PolarHBondContact O-N 2.79Å; A286-Q290 WeakPolarHBondContact O-CG 3.26Å; A286-Q290 PolarHBondContact O-N 3.29Å
287D95.2Very high94.3Very high85 Ų85105.9 Ų105.946%0.45551%0.514SS..Hα-helixtrans-62.9-43.6174.8-67.7-27.1000111.9G283 V285 Q290 Q291G283-D287 PolarHBondContact O-N 2.84Å; V285-D287 VanDerWaalsContact C-N 3.33Å; V285-D287 PolarHBondContact O-N 2.86Å; D287-Q290 PolarHBondContact O-N 3.34Å; D287-Q291 VanDerWaalsContact O-CG 3.31Å; D287-Q291 WeakPolarHBondContact O-CG 3.43Å; D287-Q291 PolarHBondContact O-N 3.25Å
288L93.9Very high94.3Very high78 Ų78111 Ų11141%0.40853%0.528SS..Hα-helixtrans-65.9-38.7176.5-72.9171.5000111.7R284 V285 Q291 V292R284-L288 HydrophobicContact CG-CD1 4.29Å; R284-L288 VanDerWaalsContact O-CG 3.31Å; R284-L288 WeakPolarHBondContact O-CG 3.42Å; R284-L288 PolarHBondContact O-N 3.46Å; R284-L288 VanDerWaalsContact O-N 3.1Å; V285-L288 PolarHBondContact O-N 3.34Å; L288-Q291 PolarHBondContact O-N 3.47Å; L288-V292 VanDerWaalsContact O-CG2 3.31Å; L288-V292 WeakPolarHBondContact O-CG2 3.37Å; L288-V292 PolarHBondContact O-N 3.32Å
289E94.6Very high94.3Very high121 Ų121110.9 Ų110.957%0.56553%0.531SS*.Hα-helixtrans-62.7-43.1174.2-74.3176.7171.100111.4V285 A286 V292 L293V285-E289 HydrophobicContact CG1-CG 4.31Å; V285-E289 WeakPolarHBondContact O-CG 3.42Å; V285-E289 PolarHBondContact O-N 3.36Å; A286-E289 PolarHBondContact O-N 2.79Å; E289-V292 PolarHBondContact O-N 3.22Å; E289-L293 VanDerWaalsContact O-CG 3.31Å; E289-L293 WeakPolarHBondContact O-CG 3.3Å; E289-L293 PolarHBondContact O-N 2.92Å
290Q93.4Very high94.3Very high123 Ų123110.3 Ų110.358%0.57553%0.526SS*.Hα-helixtrans-62.7-41.4173.3-72.5-174.919.500111.9A286 D287 L293 L294A286-Q290 WeakPolarHBondContact O-CG 3.26Å; A286-Q290 PolarHBondContact O-N 3.29Å; D287-Q290 PolarHBondContact O-N 3.34Å; Q290-L293 PolarHBondContact O-N 3.42Å; Q290-L294 WeakPolarHBondContact O-CG 3.39Å; Q290-L294 PolarHBondContact O-N 2.81Å
291Q93.1Very high94.1Very high96 Ų96108.2 Ų108.245%0.44952%0.523SS..Hα-helixtrans-60.7-47174.6-73.8172.112.700111.5D287 L288 L293 L294 E295D287-Q291 VanDerWaalsContact O-CG 3.31Å; D287-Q291 WeakPolarHBondContact O-CG 3.43Å; D287-Q291 PolarHBondContact O-N 3.25Å; L288-Q291 PolarHBondContact O-N 3.47Å; Q291-L293 VanDerWaalsContact C-N 3.3Å; Q291-L293 PolarHBondContact O-N 2.78Å; Q291-L294 PolarHBondContact O-N 3.16Å; Q291-E295 WeakPolarHBondContact O-CB 3.46Å; Q291-E295 WeakPolarHBondContact O-CG 3.29Å; Q291-E295 PolarHBondContact O-N 2.85Å
292V92.7Very high94Very high90 Ų90107 Ų10755%0.54552%0.517SS..Hα-helixtrans-60.9-38.1176.4169.90000111.6L288 E289 R296L288-V292 VanDerWaalsContact O-CG2 3.31Å; L288-V292 WeakPolarHBondContact O-CG2 3.37Å; L288-V292 PolarHBondContact O-N 3.32Å; E289-V292 PolarHBondContact O-N 3.22Å; V292-R296 WeakPolarHBondContact O-CB 3.47Å; V292-R296 PolarHBondContact O-N 3.36Å
293L95.2Very high93.8Very high107 Ų107106.2 Ų106.256%0.5652%0.516SS*.Hα-helixtrans-67-42.7175.2-72.9172000112.5E289 Q290 Q291 R296 R297E289-L293 VanDerWaalsContact O-CG 3.31Å; E289-L293 WeakPolarHBondContact O-CG 3.3Å; E289-L293 PolarHBondContact O-N 2.92Å; Q290-L293 PolarHBondContact O-N 3.42Å; Q291-L293 VanDerWaalsContact C-N 3.3Å; Q291-L293 PolarHBondContact O-N 2.78Å; L293-R296 PolarHBondContact O-N 2.89Å; L293-R297 WeakPolarHBondContact O-CB 3.46Å; L293-R297 PolarHBondContact O-N 3.38Å
294L94.3Very high93.7Very high110 Ų110110 Ų11058%0.57653%0.525SS*.Hα-helixtrans-65.1-43176.2-71.2173.3000111.3Q290 Q291 R297 R298Q290-L294 WeakPolarHBondContact O-CG 3.39Å; Q290-L294 PolarHBondContact O-N 2.81Å; Q291-L294 PolarHBondContact O-N 3.16Å; L294-R297 PolarHBondContact O-N 3.41Å; L294-R298 WeakPolarHBondContact O-CB 3.44Å; L294-R298 PolarHBondContact O-N 2.8Å
295E92.3Very high93.4Very high122 Ų122107.7 Ų107.757%0.5752%0.52SS*.Hα-helixtrans-62.9-44174.1-74.9-179.5-179.600111.6Q291 R297 R298 V299Q291-E295 WeakPolarHBondContact O-CB 3.46Å; Q291-E295 WeakPolarHBondContact O-CG 3.29Å; Q291-E295 PolarHBondContact O-N 2.85Å; E295-R297 VanDerWaalsContact C-N 3.33Å; E295-R297 PolarHBondContact O-N 3.25Å; E295-R298 CarbonylContact O-C 3.58Å; E295-R298 WeakPolarHBondContact O-CB 3.48Å; E295-R298 PolarHBondContact O-N 3.47Å; E295-R298 VanDerWaalsContact O-N 3.14Å; E295-V299 WeakPolarHBondContact O-CG2 3.27Å; E295-V299 PolarHBondContact O-N 2.78Å
296R94Very high92.8Very high171 Ų171108.6 Ų108.665%0.64552%0.523SS*.Hα-helixtrans-60.1-43175.1-176178.1177.3-155.3-1.1111.7V292 L293 R298 V299 Q300V292-R296 WeakPolarHBondContact O-CB 3.47Å; V292-R296 PolarHBondContact O-N 3.36Å; L293-R296 PolarHBondContact O-N 2.89Å; R296-R298 VanDerWaalsContact C-N 3.34Å; R296-V299 PolarHBondContact O-N 2.86Å; R296-Q300 WeakPolarHBondContact O-CB 3.31Å; R296-Q300 PolarHBondContact O-N 3.11Å
297R94Very high92.4Very high166 Ų166109.4 Ų109.463%0.62653%0.526SS*.Hα-helixtrans-63.9-40.2175.1-171.7-178.5-78.9170.8-4.6111.1L293 L294 E295 Q300 Q301L293-R297 WeakPolarHBondContact O-CB 3.46Å; L293-R297 PolarHBondContact O-N 3.38Å; L294-R297 PolarHBondContact O-N 3.41Å; E295-R297 VanDerWaalsContact C-N 3.33Å; E295-R297 PolarHBondContact O-N 3.25Å; R297-Q300 PolarHBondContact O-N 3.22Å; R297-Q301 WeakPolarHBondContact O-CG 3.44Å; R297-Q301 PolarHBondContact O-N 2.85Å
298R94.8Very high92.2Very high172 Ų172112.4 Ų112.465%0.64953%0.531SS*.Hα-helixtrans-64.3-44.8175.8-174.8174.6179.1108.50.6112L294 E295 R296 Q300 Q301 L302L294-R298 WeakPolarHBondContact O-CB 3.44Å; L294-R298 PolarHBondContact O-N 2.8Å; E295-R298 CarbonylContact O-C 3.58Å; E295-R298 WeakPolarHBondContact O-CB 3.48Å; E295-R298 PolarHBondContact O-N 3.47Å; E295-R298 VanDerWaalsContact O-N 3.14Å; R296-R298 VanDerWaalsContact C-N 3.34Å; R298-Q300 VanDerWaalsContact C-N 3.3Å; R298-Q300 PolarHBondContact O-N 2.85Å; R298-Q301 PolarHBondContact O-N 3.22Å; R298-L302 HydrophobicContact CG-CD1 4.33Å; R298-L302 VanDerWaalsContact O-CG 3.31Å; R298-L302 WeakPolarHBondContact O-CG 3.26Å; R298-L302 PolarHBondContact O-N 3.4Å
299V92.7Very high91.8Very high84 Ų84112.3 Ų112.351%0.50953%0.531SS..Hα-helixtrans-61.4-41.8174.6170.40000110.5E295 R296 L302 L303E295-V299 WeakPolarHBondContact O-CG2 3.27Å; E295-V299 PolarHBondContact O-N 2.78Å; R296-V299 PolarHBondContact O-N 2.86Å; V299-L302 PolarHBondContact O-N 2.76Å; V299-L303 HydrophobicContact CG1-CD1 4.05Å; V299-L303 HydrophobicContact CG1-CG 4.38Å; V299-L303 VanDerWaalsContact O-CG 3.32Å; V299-L303 WeakPolarHBondContact O-CG 3.26Å; V299-L303 PolarHBondContact O-N 3.49Å
300Q93.1Very high91.4Very high101 Ų101112.9 Ų112.947%0.47253%0.533SS..Hα-helixtrans-65.3-42.7178.2-171160-12.100112.4R296 R297 R298 L302 L303 E304R296-Q300 WeakPolarHBondContact O-CB 3.31Å; R296-Q300 PolarHBondContact O-N 3.11Å; R297-Q300 PolarHBondContact O-N 3.22Å; R298-Q300 VanDerWaalsContact C-N 3.3Å; R298-Q300 PolarHBondContact O-N 2.85Å; Q300-L302 VanDerWaalsContact C-N 3.34Å; Q300-L302 PolarHBondContact O-N 3.45Å; Q300-L303 PolarHBondContact O-N 3.42Å; Q300-E304 WeakPolarHBondContact O-CG 3.43Å; Q300-E304 PolarHBondContact O-N 3.02Å
301Q93.2Very high90.8Very high112 Ų112113.7 Ų113.752%0.52354%0.535SS..Hα-helixtrans-59.7-43.4172.1-73.8172.6-12.800111.9R297 R298 L303 E304 E305R297-Q301 WeakPolarHBondContact O-CG 3.44Å; R297-Q301 PolarHBondContact O-N 2.85Å; R298-Q301 PolarHBondContact O-N 3.22Å; Q301-L303 VanDerWaalsContact C-N 3.34Å; Q301-L303 PolarHBondContact O-N 3.15Å; Q301-E304 PolarHBondContact O-N 2.89Å; Q301-E305 VanDerWaalsContact O-CB 3.29Å; Q301-E305 WeakPolarHBondContact O-CB 3.32Å; Q301-E305 PolarHBondContact O-N 3.45Å
302L91.6Very high90.3Very high88 Ų88112.4 Ų112.446%0.46153%0.529SS..Hα-helixtrans-65.5-34.3176.6-71.7171.6000112.6R298 V299 Q300 N306R298-L302 HydrophobicContact CG-CD1 4.33Å; R298-L302 VanDerWaalsContact O-CG 3.31Å; R298-L302 WeakPolarHBondContact O-CG 3.26Å; R298-L302 PolarHBondContact O-N 3.4Å; V299-L302 PolarHBondContact O-N 2.76Å; Q300-L302 VanDerWaalsContact C-N 3.34Å; Q300-L302 PolarHBondContact O-N 3.45Å; L302-N306 WeakPolarHBondContact O-CB 3.35Å; L302-N306 PolarHBondContact O-N 2.9Å
303L92.2Very high89.7Confident105 Ų105111.4 Ų111.455%0.5553%0.526SS..Hα-helixtrans-70.4-40.5174.7-74171.4000112.2V299 Q300 Q301 N306 S307V299-L303 HydrophobicContact CG1-CD1 4.05Å; V299-L303 HydrophobicContact CG1-CG 4.38Å; V299-L303 VanDerWaalsContact O-CG 3.32Å; V299-L303 WeakPolarHBondContact O-CG 3.26Å; V299-L303 PolarHBondContact O-N 3.49Å; Q300-L303 PolarHBondContact O-N 3.42Å; Q301-L303 VanDerWaalsContact C-N 3.34Å; Q301-L303 PolarHBondContact O-N 3.15Å; L303-N306 PolarHBondContact O-N 2.94Å; L303-S307 WeakPolarHBondContact O-CB 3.43Å; L303-S307 PolarHBondContact O-N 3.18Å; L303-S307 PolarHBondContact O-OG 2.85Å
304E91.3Very high89Confident114 Ų114112.7 Ų112.753%0.53353%0.527SS..Hα-helixtrans-64.5-42.8174-73.3169.8-166.900111Q300 Q301 S307 R308Q300-E304 WeakPolarHBondContact O-CG 3.43Å; Q300-E304 PolarHBondContact O-N 3.02Å; Q301-E304 PolarHBondContact O-N 2.89Å; E304-S307 PolarHBondContact O-N 2.8Å; E304-R308 WeakPolarHBondContact O-CB 3.5Å; E304-R308 PolarHBondContact O-N 3.38Å
305E90.7Very high88.2Confident102 Ų102112.3 Ų112.348%0.47752%0.523SS..Hα-helixtrans-63.7-46.4174.5-169.9177.4-178.300111.4Q301 S307 R308 L309Q301-E305 VanDerWaalsContact O-CB 3.29Å; Q301-E305 WeakPolarHBondContact O-CB 3.32Å; Q301-E305 PolarHBondContact O-N 3.45Å; E305-S307 VanDerWaalsContact C-N 3.33Å; E305-S307 PolarHBondContact O-N 3.41Å; E305-R308 WeakPolarHBondContact O-CB 3.32Å; E305-R308 PolarHBondContact O-N 3.2Å; E305-R308 VanDerWaalsContact O-N 3.12Å; E305-L309 HydrophobicContact CG-CD1 4.13Å; E305-L309 HydrophobicContact CG-CG 4.46Å; E305-L309 WeakPolarHBondContact O-CB 3.48Å; E305-L309 WeakPolarHBondContact O-CG 3.24Å; E305-L309 PolarHBondContact O-N 2.85Å
306N82.1Confident87.5Confident94 Ų94112.7 Ų112.750%0.50352%0.524SS..Hα-helixtrans-59-43.6173.7-103.1-13.2000111.7L302 L303 R308 L309 E310L302-N306 WeakPolarHBondContact O-CB 3.35Å; L302-N306 PolarHBondContact O-N 2.9Å; L303-N306 PolarHBondContact O-N 2.94Å; N306-R308 VanDerWaalsContact C-N 3.29Å; N306-R308 PolarHBondContact O-N 3.47Å; N306-L309 PolarHBondContact O-N 3.01Å; N306-E310 WeakPolarHBondContact O-CB 3.4Å; N306-E310 VanDerWaalsContact O-CG 3.3Å; N306-E310 WeakPolarHBondContact O-CG 3.25Å; N306-E310 PolarHBondContact O-N 2.89Å
307S85.6Confident86.4Confident57 Ų57110.8 Ų110.840%0.39952%0.523SS..Hα-helixtrans-64.4-35.8176.9-580000111.7L303 E304 E305 K311L303-S307 WeakPolarHBondContact O-CB 3.43Å; L303-S307 PolarHBondContact O-N 3.18Å; L303-S307 PolarHBondContact O-OG 2.85Å; E304-S307 PolarHBondContact O-N 2.8Å; E305-S307 VanDerWaalsContact C-N 3.33Å; E305-S307 PolarHBondContact O-N 3.41Å; S307-K311 WeakPolarHBondContact O-CB 3.36Å; S307-K311 VanDerWaalsContact O-CG 3.25Å; S307-K311 WeakPolarHBondContact O-CG 3.49Å; S307-K311 PolarHBondContact O-N 3.41Å
308R91.9Very high85.3Confident147 Ų147107.3 Ų107.356%0.55552%0.516SS*.Hα-helixtrans-68.3-45.5175.8-161.6-168.199.1-170.7-0.2110.9E304 E305 N306 K311 E312E304-R308 WeakPolarHBondContact O-CB 3.5Å; E304-R308 PolarHBondContact O-N 3.38Å; E305-R308 WeakPolarHBondContact O-CB 3.32Å; E305-R308 PolarHBondContact O-N 3.2Å; E305-R308 VanDerWaalsContact O-N 3.12Å; N306-R308 VanDerWaalsContact C-N 3.29Å; N306-R308 PolarHBondContact O-N 3.47Å; R308-K311 PolarHBondContact O-N 3.24Å; R308-E312 IonicContact CZ-OE1 3.74Å; R308-E312 IonicContact NE-OE1 3.64Å; R308-E312 PolarHBondContact NE-OE1 3.34Å; R308-E312 IonicContact NH2-OE1 2.77Å; R308-E312 PolarHBondContact NH2-OE1 2.86Å; R308-E312 VanDerWaalsContact NH2-OE1 3.17Å; R308-E312 IonicContact NH2-OE2 3.96Å; R308-E312 WeakPolarHBondContact O-CB 3.48Å; R308-E312 WeakPolarHBondContact O-CG 3.3Å; R308-E312 PolarHBondContact O-N 2.92Å
309L85.9Confident84.1Confident77 Ų77107.8 Ų107.840%0.40352%0.518SS..Hα-helixtrans-67.1-37.3177.6-70.3173.8000111.9E305 N306 E312 S313E305-L309 HydrophobicContact CG-CD1 4.13Å; E305-L309 HydrophobicContact CG-CG 4.46Å; E305-L309 WeakPolarHBondContact O-CB 3.48Å; E305-L309 WeakPolarHBondContact O-CG 3.24Å; E305-L309 PolarHBondContact O-N 2.85Å; N306-L309 PolarHBondContact O-N 3.01Å; L309-E312 PolarHBondContact O-N 3.46Å; L309-S313 WeakPolarHBondContact O-CB 3.34Å; L309-S313 PolarHBondContact O-N 2.82Å
310E84.7Confident82.5Confident133 Ų133106.8 Ų106.862%0.62152%0.515SS*.Hα-helixtrans-63.4-42.2172-79177.7-176.100111.2N306 F314N306-E310 WeakPolarHBondContact O-CB 3.4Å; N306-E310 VanDerWaalsContact O-CG 3.3Å; N306-E310 WeakPolarHBondContact O-CG 3.25Å; N306-E310 PolarHBondContact O-N 2.89Å; E310-F314 WeakPolarHBondContact O-CB 3.21Å; E310-F314 PolarHBondContact O-N 2.87Å
311K81.1Confident80.8Confident140 Ų140104.1 Ų104.161%0.60951%0.511SS*.Hα-helixtrans-65.3-45.8173.6-74.5172-174.9177.40112.2S307 R308 S313 F314 E315S307-K311 WeakPolarHBondContact O-CB 3.36Å; S307-K311 VanDerWaalsContact O-CG 3.25Å; S307-K311 WeakPolarHBondContact O-CG 3.49Å; S307-K311 PolarHBondContact O-N 3.41Å; R308-K311 PolarHBondContact O-N 3.24Å; K311-S313 VanDerWaalsContact C-N 3.35Å; K311-F314 PolarHBondContact O-N 2.85Å; K311-E315 VanDerWaalsContact O-CB 3.3Å; K311-E315 WeakPolarHBondContact O-CB 3.47Å; K311-E315 VanDerWaalsContact O-CG 3.31Å; K311-E315 WeakPolarHBondContact O-CG 3.42Å; K311-E315 PolarHBondContact O-N 3.25Å
312E83.4Confident79Confident68 Ų68102.3 Ų102.332%0.31851%0.507SS..Hα-helixtrans-63.3-41.4176.9-79.5175.6-16100111.1R308 L309 E315 Q316R308-E312 IonicContact CZ-OE1 3.74Å; R308-E312 IonicContact NE-OE1 3.64Å; R308-E312 PolarHBondContact NE-OE1 3.34Å; R308-E312 IonicContact NH2-OE1 2.77Å; R308-E312 PolarHBondContact NH2-OE1 2.86Å; R308-E312 VanDerWaalsContact NH2-OE1 3.17Å; R308-E312 IonicContact NH2-OE2 3.96Å; R308-E312 WeakPolarHBondContact O-CB 3.48Å; R308-E312 WeakPolarHBondContact O-CG 3.3Å; R308-E312 PolarHBondContact O-N 2.92Å; L309-E312 PolarHBondContact O-N 3.46Å; E312-E315 PolarHBondContact O-N 2.91Å; E312-Q316 VanDerWaalsContact O-CB 3.26Å; E312-Q316 WeakPolarHBondContact O-CB 3.45Å; E312-Q316 WeakPolarHBondContact O-CG 3.27Å; E312-Q316 PolarHBondContact O-N 3.49Å
313S78.6Confident76.9Confident70 Ų70102.2 Ų102.249%0.4951%0.512SS..Hα-helixtrans-64.7-44175.2-177.60000111.1L309 K311 Q316 Q317L309-S313 WeakPolarHBondContact O-CB 3.34Å; L309-S313 PolarHBondContact O-N 2.82Å; K311-S313 VanDerWaalsContact C-N 3.35Å; S313-Q316 PolarHBondContact O-N 2.89Å; S313-Q317 VanDerWaalsContact O-CB 3.22Å; S313-Q317 WeakPolarHBondContact O-CB 3.47Å; S313-Q317 PolarHBondContact O-N 3.29Å
314F80.6Confident74.7Confident134 Ų134101.1 Ų101.159%0.58851%0.514SS*.Hα-helixtrans-63.7-42.6174.8-175.2-97.1000111.6E310 K311 Q317 N318E310-F314 WeakPolarHBondContact O-CB 3.21Å; E310-F314 PolarHBondContact O-N 2.87Å; K311-F314 PolarHBondContact O-N 2.85Å; F314-Q317 PolarHBondContact O-N 3.46Å; F314-N318 WeakPolarHBondContact O-CB 3.4Å; F314-N318 PolarHBondContact O-N 2.96Å
315E78.9Confident72.7Confident102 Ų10299.7 Ų99.748%0.47751%0.513SS..Hα-helixtrans-67-38.2175.4-78.2-179.8-17000112.2K311 E312 N318 R319K311-E315 VanDerWaalsContact O-CB 3.3Å; K311-E315 WeakPolarHBondContact O-CB 3.47Å; K311-E315 VanDerWaalsContact O-CG 3.31Å; K311-E315 WeakPolarHBondContact O-CG 3.42Å; K311-E315 PolarHBondContact O-N 3.25Å; E312-E315 PolarHBondContact O-N 2.91Å; E315-N318 PolarHBondContact O-N 3.23Å; E315-R319 WeakPolarHBondContact O-CB 3.18Å; E315-R319 VanDerWaalsContact O-CG 3.26Å; E315-R319 WeakPolarHBondContact O-CG 3.41Å; E315-R319 PolarHBondContact O-N 3.08Å
316Q76.2Confident70.6Confident130 Ų13098.7 Ų98.761%0.60752%0.517SS*.Hα-helixtrans-69.2-38.8173.8-75.717815.400111.3E312 S313 N318 S320E312-Q316 VanDerWaalsContact O-CB 3.26Å; E312-Q316 WeakPolarHBondContact O-CB 3.45Å; E312-Q316 WeakPolarHBondContact O-CG 3.27Å; E312-Q316 PolarHBondContact O-N 3.49Å; S313-Q316 PolarHBondContact O-N 2.89Å; Q316-N318 VanDerWaalsContact C-N 3.35Å; Q316-S320 VanDerWaalsContact O-CB 3.24Å; Q316-S320 WeakPolarHBondContact O-CB 3.32Å; Q316-S320 PolarHBondContact O-N 3.39Å; Q316-S320 PolarHBondContact O-OG 2.92Å
317Q72.5Confident68.8Low131 Ų13197.7 Ų97.761%0.61252%0.522SS*.Hα-helixtrans-66.9-38.4173.5-166.2176.211.400110.7S313 F314 S320 A321S313-Q317 VanDerWaalsContact O-CB 3.22Å; S313-Q317 WeakPolarHBondContact O-CB 3.47Å; S313-Q317 PolarHBondContact O-N 3.29Å; F314-Q317 PolarHBondContact O-N 3.46Å; Q317-S320 WeakPolarHBondContact CA-OG 3.43Å; Q317-S320 PolarHBondContact O-OG 3.04Å; Q317-A321 VanDerWaalsContact O-CB 3.27Å; Q317-A321 WeakPolarHBondContact O-CB 3.22Å; Q317-A321 PolarHBondContact O-N 2.99Å
318N71.1Confident66.7Low92 Ų9298.6 Ų98.649%0.49253%0.528SS..Hα-helixtrans-74.1-38.5177-156.529.6000111.6F314 E315 Q316 A321 V322F314-N318 WeakPolarHBondContact O-CB 3.4Å; F314-N318 PolarHBondContact O-N 2.96Å; E315-N318 PolarHBondContact O-N 3.23Å; Q316-N318 VanDerWaalsContact C-N 3.35Å; N318-A321 PolarHBondContact O-N 3.1Å; N318-V322 VanDerWaalsContact O-CB 3.31Å; N318-V322 WeakPolarHBondContact O-CB 3.3Å; N318-V322 WeakPolarHBondContact O-CG2 3.43Å; N318-V322 PolarHBondContact O-N 2.61Å
319R68.4Low64.2Low182 Ų18298.2 Ų98.269%0.68754%0.537SS*.Hα-helixtrans-67-36.9171.8-79.3-178.8178.6160.25.1111.8E315 V322 C323E315-R319 WeakPolarHBondContact O-CB 3.18Å; E315-R319 VanDerWaalsContact O-CG 3.26Å; E315-R319 WeakPolarHBondContact O-CG 3.41Å; E315-R319 PolarHBondContact O-N 3.08Å; R319-V322 PolarHBondContact O-N 3.25Å; R319-C323 WeakPolarHBondContact O-CB 3.37Å; R319-C323 PolarHBondContact O-N 2.74Å
320S59.7Low61.7Low64 Ų64102.1 Ų102.145%0.44856%0.559SS.*Hα-helixtrans-73.2-32.9174.764.50000111.6Q316 Q317 S324Q316-S320 VanDerWaalsContact O-CB 3.24Å; Q316-S320 WeakPolarHBondContact O-CB 3.32Å; Q316-S320 PolarHBondContact O-N 3.39Å; Q316-S320 PolarHBondContact O-OG 2.92Å; Q317-S320 WeakPolarHBondContact CA-OG 3.43Å; Q317-S320 PolarHBondContact O-OG 3.04Å; S320-S324 VanDerWaalsContact O-CB 3.32Å; S320-S324 WeakPolarHBondContact O-CB 3.37Å; S320-S324 PolarHBondContact O-N 2.89Å; S320-S324 PolarHBondContact O-OG 3.29Å
321A56.9Low59.1Low45 Ų45106.4 Ų106.437%0.37257%0.569SS.*Hα-helixtrans-66.4-42.7168.900000111.9Q317 N318 S324 T325Q317-A321 VanDerWaalsContact O-CB 3.27Å; Q317-A321 WeakPolarHBondContact O-CB 3.22Å; Q317-A321 PolarHBondContact O-N 2.99Å; N318-A321 PolarHBondContact O-N 3.1Å; A321-S324 CarbonylContact O-C 3.48Å; A321-S324 WeakPolarHBondContact O-CA 3.38Å; A321-S324 WeakPolarHBondContact O-CB 3.39Å; A321-S324 PolarHBondContact O-N 3.22Å; A321-S324 VanDerWaalsContact O-N 3.16Å; A321-T325 WeakPolarHBondContact O-CG2 3.45Å; A321-T325 PolarHBondContact O-N 2.96Å; A321-T325 PolarHBondContact O-OG1 2.83Å
322V56.5Low56.8Low74 Ų74104.9 Ų104.945%0.44858%0.576SS.*Hα-helixtrans-69.5-33.1176.3170.10000112N318 R319 T325 S326N318-V322 VanDerWaalsContact O-CB 3.31Å; N318-V322 WeakPolarHBondContact O-CB 3.3Å; N318-V322 WeakPolarHBondContact O-CG2 3.43Å; N318-V322 PolarHBondContact O-N 2.61Å; R319-V322 PolarHBondContact O-N 3.25Å; V322-T325 WeakPolarHBondContact CA-OG1 3.48Å; V322-T325 PolarHBondContact O-N 3.48Å; V322-T325 PolarHBondContact O-OG1 3.5Å; V322-S326 VanDerWaalsContact O-CB 3.28Å; V322-S326 WeakPolarHBondContact O-CB 3.24Å; V322-S326 PolarHBondContact O-N 2.88Å; V322-S326 PolarHBondContact O-OG 3.46Å
323C46.3Very low54.5Low85 Ų85108 Ų10857%0.57460%0.6SS**Hα-helixtrans-72.6-33.3170.5-158.80000110.9R319 T325 S326 A327R319-C323 WeakPolarHBondContact O-CB 3.37Å; R319-C323 PolarHBondContact O-N 2.74Å; C323-T325 VanDerWaalsContact C-N 3.34Å; C323-S326 PolarHBondContact O-N 3.24Å; C323-A327 WeakPolarHBondContact O-CB 3.45Å; C323-A327 PolarHBondContact O-N 3.47Å
324S46.9Very low52.2Low82 Ų82114.1 Ų114.157%0.57362%0.621SS**Hα-helixtrans-68.2-31.6170.7-57.50000112.2S320 A321 S328S320-S324 VanDerWaalsContact O-CB 3.32Å; S320-S324 WeakPolarHBondContact O-CB 3.37Å; S320-S324 PolarHBondContact O-N 2.89Å; S320-S324 PolarHBondContact O-OG 3.29Å; A321-S324 CarbonylContact O-C 3.48Å; A321-S324 WeakPolarHBondContact O-CA 3.38Å; A321-S324 WeakPolarHBondContact O-CB 3.39Å; A321-S324 PolarHBondContact O-N 3.22Å; A321-S324 VanDerWaalsContact O-N 3.16Å; S324-S328 PolarHBondContact O-N 3.3Å; S324-S328 PolarHBondContact O-OG 2.83Å
325T48.1Very low49.8Very low84 Ų84110.9 Ų110.952%0.51563%0.626SS.*Hα-helixtrans-81-32.6173.759.20000112.8A321 V322 C323 S328A321-T325 WeakPolarHBondContact O-CG2 3.45Å; A321-T325 PolarHBondContact O-N 2.96Å; A321-T325 PolarHBondContact O-OG1 2.83Å; V322-T325 WeakPolarHBondContact CA-OG1 3.48Å; V322-T325 PolarHBondContact O-N 3.48Å; V322-T325 PolarHBondContact O-OG1 3.5Å; C323-T325 VanDerWaalsContact C-N 3.34Å; T325-S328 WeakPolarHBondContact CA-OG 3.34Å; T325-S328 PolarHBondContact O-N 3.46Å; T325-S328 PolarHBondContact O-OG 2.8Å; T325-S328 VanDerWaalsContact O-OG 3.14Å
326S46.5Very low47.6Very low82 Ų82113.7 Ų113.757%0.57364%0.639SS**Hα-helixtrans-78.5-25.8176.2-54.10000112.1V322 C323 S328V322-S326 VanDerWaalsContact O-CB 3.28Å; V322-S326 WeakPolarHBondContact O-CB 3.24Å; V322-S326 PolarHBondContact O-N 2.88Å; V322-S326 PolarHBondContact O-OG 3.46Å; C323-S326 PolarHBondContact O-N 3.24Å; S326-S328 VanDerWaalsContact C-N 3.34Å
327A44.1Very low45.5Very low72 Ų72117.7 Ų117.760%0.59565%0.648SS**SBendtrans-81.4-10.7171.400000113.5C323C323-A327 WeakPolarHBondContact O-CB 3.45Å; C323-A327 PolarHBondContact O-N 3.47Å
328S41.6Very low43.8Very low76 Ų76117.6 Ų117.653%0.53166%0.657SS.*SBendtrans-95.4-5.3174.143.40000114.3S324 T325 S326S324-S328 PolarHBondContact O-N 3.3Å; S324-S328 PolarHBondContact O-OG 2.83Å; T325-S328 WeakPolarHBondContact CA-OG 3.34Å; T325-S328 PolarHBondContact O-N 3.46Å; T325-S328 PolarHBondContact O-OG 2.8Å; T325-S328 VanDerWaalsContact O-OG 3.14Å; S326-S328 VanDerWaalsContact C-N 3.34Å
329N39.6Very low42.1Very low140 Ų140120.1 Ų120.175%0.74967%0.67SS**SBendtrans-103.71.6-176.1-117.349.5000116.3
330D33.5Very low40.6Very low159 Ų159123.1 Ų123.185%0.8568%0.681SS**  trans-139.269.1163-92.3-34.6000110.3
331R30.8Very low39.6Very low222 Ų222127.6 Ų127.684%0.83870%0.7SS**  trans-94.5102.3151.5-92.5-178.3174.1-125.70.4106.7
332S32.2Very low39Very low109 Ų109131.5 Ų131.576%0.76272%0.715SS**  trans171.295.8147.4-770000109.7
333T35.2Very low38.6Very low133 Ų133134 Ų13482%0.81673%0.73SS**  155.7106.9128.546.50000110.4
334E31.4Very low38.5Very low198 Ų198136.6 Ų136.693%0.92574%0.739SS**  trans60.3132.5147.5-48.5-159172.400118.4
335G30.4Very low38.5Very low67 Ų67141.5 Ų141.569%0.69175%0.745SS**  cis154.6119.417.200000106.8
336E32.3Very low38.7Very low161 Ų161141.7 Ų141.775%0.75275%0.749SS**  trans63.1107.6150.6-56.4-169136.800121.6
337R31.5Very low38.7Very low213 Ų213142.3 Ų142.380%0.80475%0.749SS**  61.8101.6126.7-59.7173.3-175.6-179.63.7117.4
338T37.8Very low39Very low129 Ų129141.5 Ų141.579%0.79174%0.739SS**  -170.3142.5121.821.40000109.2
339D34.2Very low39.6Very low146 Ų146142.2 Ų142.278%0.78174%0.737SS**  trans78.766.7158-48.8-17.4000117.8D341D339-D341 VanDerWaalsContact C-N 3.33Å; D339-D341 PolarHBondContact O-N 2.93Å; D339-D341 VanDerWaalsContact O-N 3.11Å
340R36.7Very low40.1Very low244 Ų244140.5 Ų140.592%0.92173%0.727SS**  trans-54.3100.6136.1-82.1-179.6171-177.3-3.6107.5
341D39.2Very low41.1Very low158 Ų158136.4 Ų136.485%0.84571%0.711SS**  trans177.269.2153.2-86.2-18.2000109.7D339D339-D341 VanDerWaalsContact C-N 3.33Å; D339-D341 PolarHBondContact O-N 2.93Å; D339-D341 VanDerWaalsContact O-N 3.11Å
342N44.9Very low42.4Very low127 Ų127129.6 Ų129.668%0.67969%0.691SS**SBendtrans-156.74.3160.8-142.52.8000116
343V48.3Very low43.7Very low127 Ų127130.8 Ų130.877%0.7768%0.684SS**SBendtrans-87.2-13.2179.9-176.90000112.3
344D43Very low45.2Very low140 Ų140129.2 Ų129.275%0.74967%0.67SS**Hα-helixtrans-84.1-10.1176.2-91.2-21.3000115S348D344-S348 WeakPolarHBondContact O-CB 3.35Å; D344-S348 PolarHBondContact O-N 3.28Å
345R47.5Very low47.3Very low185 Ų185124.4 Ų124.470%0.69865%0.651SS**Hα-helixtrans-78.4-25.4176.3-86.2-175.3164.2-146.3-4.6114.3N349R345-N349 WeakPolarHBondContact O-CB 3.3Å; R345-N349 PolarHBondContact O-N 2.79Å; R345-N349 VanDerWaalsContact O-N 3.1Å; R345-N349 PolarHBondContact O-ND2 3.49Å; R345-N349 PolarHBondContact O-OD1 3.08Å
346S51.3Low49.3Very low87 Ų87127.8 Ų127.861%0.60865%0.649SS**Hα-helixtrans-78.6-31.7179.2179.90000113
347V48.3Very low51.2Low96 Ų96122.6 Ų122.658%0.58263%0.63SS**Hα-helixtrans-90.3-31.6177.7-172.80000110.6L350 C351V347-L350 PolarHBondContact O-N 3.2Å; V347-C351 PolarHBondContact O-N 3.04Å
348S50.5Low53.2Low54 Ų54116.8 Ų116.838%0.37861%0.614SS.*Hα-helixtrans-61-43.4167.8-164.90000111D344 L350 C351 D352D344-S348 WeakPolarHBondContact O-CB 3.35Å; D344-S348 PolarHBondContact O-N 3.28Å; S348-L350 VanDerWaalsContact C-N 3.28Å; S348-L350 PolarHBondContact O-N 2.97Å; S348-C351 CarbonylContact O-C 3.5Å; S348-C351 PolarHBondContact O-N 3.32Å; S348-C351 VanDerWaalsContact O-N 3.16Å; S348-D352 VanDerWaalsContact C-OD2 3.27Å; S348-D352 WeakPolarHBondContact O-CB 3.31Å; S348-D352 PolarHBondContact O-N 2.77Å; S348-D352 PolarHBondContact OG-OD2 3.44Å
349N53.3Low55Low92 Ų92113.2 Ų113.249%0.49260%0.595SS.*Hα-helixtrans-64.1-28.5-179.5-73.50.5000114.4R345 Q353R345-N349 WeakPolarHBondContact O-CB 3.3Å; R345-N349 PolarHBondContact O-N 2.79Å; R345-N349 VanDerWaalsContact O-N 3.1Å; R345-N349 PolarHBondContact O-ND2 3.49Å; R345-N349 PolarHBondContact O-OD1 3.08Å; N349-Q353 VanDerWaalsContact O-CB 3.25Å; N349-Q353 WeakPolarHBondContact O-CB 3.32Å; N349-Q353 WeakPolarHBondContact O-CG 3.19Å; N349-Q353 PolarHBondContact O-N 2.88Å
350L49Very low57Low103 Ų103108.9 Ų108.954%0.53958%0.579SS.*Hα-helixtrans-79.4-40174-86.9165000111.8V347 S348 D352 Q353 L354V347-L350 PolarHBondContact O-N 3.2Å; S348-L350 VanDerWaalsContact C-N 3.28Å; S348-L350 PolarHBondContact O-N 2.97Å; L350-D352 VanDerWaalsContact C-N 3.28Å; L350-Q353 PolarHBondContact O-N 2.78Å; L350-L354 VanDerWaalsContact O-CB 3.32Å; L350-L354 WeakPolarHBondContact O-CB 3.49Å; L350-L354 PolarHBondContact O-N 2.78Å
351C55.2Low59Low74 Ų74104 Ų10450%0.556%0.564SS.*Hα-helixtrans-62.5-38.2171-105.30000111.4V347 S348 N355V347-C351 PolarHBondContact O-N 3.04Å; S348-C351 CarbonylContact O-C 3.5Å; S348-C351 PolarHBondContact O-N 3.32Å; S348-C351 VanDerWaalsContact O-N 3.16Å; C351-N355 WeakPolarHBondContact O-CB 3.28Å; C351-N355 PolarHBondContact O-N 3.31Å
352D59.3Low60.9Low79 Ų79101 Ų10142%0.42255%0.548SS..Hα-helixtrans-71.1-40.8176.5-64-33.7000110S348 L350 N355 E356S348-D352 VanDerWaalsContact C-OD2 3.27Å; S348-D352 WeakPolarHBondContact O-CB 3.31Å; S348-D352 PolarHBondContact O-N 2.77Å; S348-D352 PolarHBondContact OG-OD2 3.44Å; L350-D352 VanDerWaalsContact C-N 3.28Å; D352-N355 PolarHBondContact O-N 3.49Å; D352-E356 WeakPolarHBondContact O-CB 3.47Å; D352-E356 PolarHBondContact O-N 2.92Å
353Q58.5Low62.5Low133 Ų133100.1 Ų100.162%0.62154%0.543SS*.Hα-helixtrans-66.5-38.4172.9-80.1175.7-4.500113.1N349 L350 S357N349-Q353 VanDerWaalsContact O-CB 3.25Å; N349-Q353 WeakPolarHBondContact O-CB 3.32Å; N349-Q353 WeakPolarHBondContact O-CG 3.19Å; N349-Q353 PolarHBondContact O-N 2.88Å; L350-Q353 PolarHBondContact O-N 2.78Å; Q353-S357 VanDerWaalsContact O-CB 3.23Å; Q353-S357 WeakPolarHBondContact O-CB 3.45Å; Q353-S357 PolarHBondContact O-N 2.78Å
354L67Low63.9Low101 Ų101102.5 Ų102.553%0.52954%0.538SS..Hα-helixtrans-69.6-43.2174.5-100.7155.6000111L350 E356 S357 I358L350-L354 VanDerWaalsContact O-CB 3.32Å; L350-L354 WeakPolarHBondContact O-CB 3.49Å; L350-L354 PolarHBondContact O-N 2.78Å; L354-E356 VanDerWaalsContact C-N 3.35Å; L354-S357 PolarHBondContact O-N 3.36Å; L354-I358 HydrophobicContact CD2-CD1 4.29Å; L354-I358 WeakPolarHBondContact O-CB 3.3Å; L354-I358 WeakPolarHBondContact O-CD1 3.35Å; L354-I358 WeakPolarHBondContact O-CG1 3.19Å; L354-I358 PolarHBondContact O-N 2.85Å
355N74.3Confident65.5Low96 Ų96100.9 Ų100.951%0.51353%0.529SS..Hα-helixtrans-65.3-37.5174.1-88.6-0.2000111.5C351 D352 I358 S359C351-N355 WeakPolarHBondContact O-CB 3.28Å; C351-N355 PolarHBondContact O-N 3.31Å; D352-N355 PolarHBondContact O-N 3.49Å; N355-I358 PolarHBondContact O-N 2.8Å; N355-S359 WeakPolarHBondContact O-CA 3.43Å; N355-S359 WeakPolarHBondContact O-CB 3.35Å; N355-S359 PolarHBondContact O-N 2.84Å; N355-S359 PolarHBondContact O-OG 3.28Å
356E73.1Confident66.8Low138 Ų13896.6 Ų96.665%0.64552%0.516SS*.Hα-helixtrans-67.1-41.6175-163.672.6-141.800110.2D352 L354 S359 A360D352-E356 WeakPolarHBondContact O-CB 3.47Å; D352-E356 PolarHBondContact O-N 2.92Å; L354-E356 VanDerWaalsContact C-N 3.35Å; E356-S359 PolarHBondContact O-N 3.28Å; E356-A360 WeakPolarHBondContact O-CB 3.33Å; E356-A360 PolarHBondContact O-N 2.85Å
357S73.4Confident68Low52 Ų5297.6 Ų97.636%0.36451%0.51SS..Hα-helixtrans-65.1-43.1175.1153.30000112.5Q353 L354 K361Q353-S357 VanDerWaalsContact O-CB 3.23Å; Q353-S357 WeakPolarHBondContact O-CB 3.45Å; Q353-S357 PolarHBondContact O-N 2.78Å; L354-S357 PolarHBondContact O-N 3.36Å; S357-K361 WeakPolarHBondContact O-CB 3.35Å; S357-K361 WeakPolarHBondContact O-CG 3.4Å; S357-K361 PolarHBondContact O-N 3.5Å
358I73Confident69.6Low91 Ų9196.2 Ų96.247%0.46750%0.499SS..Hα-helixtrans-69.8-42.9177.3-68.7165.3000109.7L354 N355 K361 L362L354-I358 HydrophobicContact CD2-CD1 4.29Å; L354-I358 WeakPolarHBondContact O-CB 3.3Å; L354-I358 WeakPolarHBondContact O-CD1 3.35Å; L354-I358 WeakPolarHBondContact O-CG1 3.19Å; L354-I358 PolarHBondContact O-N 2.85Å; N355-I358 PolarHBondContact O-N 2.8Å; I358-K361 PolarHBondContact O-N 2.82Å; I358-L362 VanDerWaalsContact O-CB 3.26Å; I358-L362 WeakPolarHBondContact O-CB 3.48Å; I358-L362 PolarHBondContact O-N 3.36Å
359S75.6Confident70.9Confident55 Ų5598 Ų9839%0.38551%0.505SS..Hα-helixtrans-64.4-39.1176.3-60.50000111.4N355 E356 L362 L363N355-S359 WeakPolarHBondContact O-CA 3.43Å; N355-S359 WeakPolarHBondContact O-CB 3.35Å; N355-S359 PolarHBondContact O-N 2.84Å; N355-S359 PolarHBondContact O-OG 3.28Å; E356-S359 PolarHBondContact O-N 3.28Å; S359-L362 PolarHBondContact O-N 2.86Å; S359-L363 VanDerWaalsContact O-CB 3.29Å; S359-L363 WeakPolarHBondContact O-CB 3.35Å; S359-L363 PolarHBondContact O-N 3.32Å
360A74.9Confident72.1Confident54 Ų5499.4 Ų99.445%0.44650%0.503SS..Hα-helixtrans-66.9-40.3174.400000112.2E356 R364E356-A360 WeakPolarHBondContact O-CB 3.33Å; E356-A360 PolarHBondContact O-N 2.85Å; A360-R364 WeakPolarHBondContact O-CB 3.33Å; A360-R364 PolarHBondContact O-N 3.3Å
361K78.9Confident73.5Confident142 Ų142100.1 Ų100.162%0.61750%0.502SS*.Hα-helixtrans-66.8-39.8172.7-78.2-179.8179.2177.90112.2S357 I358 R364 L365S357-K361 WeakPolarHBondContact O-CB 3.35Å; S357-K361 WeakPolarHBondContact O-CG 3.4Å; S357-K361 PolarHBondContact O-N 3.5Å; I358-K361 PolarHBondContact O-N 2.82Å; K361-R364 PolarHBondContact O-N 2.87Å; K361-L365 WeakPolarHBondContact O-CB 3.2Å; K361-L365 WeakPolarHBondContact O-CG 3.38Å; K361-L365 PolarHBondContact O-N 3.42Å
362L78.9Confident74Confident96 Ų96101.2 Ų101.250%0.50350%0.502SS..Hα-helixtrans-64.3-47.1175.9-171.670.7000110.3I358 S359 R364 L365 E366I358-L362 VanDerWaalsContact O-CB 3.26Å; I358-L362 WeakPolarHBondContact O-CB 3.48Å; I358-L362 PolarHBondContact O-N 3.36Å; S359-L362 PolarHBondContact O-N 2.86Å; L362-R364 VanDerWaalsContact C-N 3.31Å; L362-R364 PolarHBondContact O-N 2.99Å; L362-L365 CarbonylContact O-C 3.59Å; L362-L365 PolarHBondContact O-N 3.29Å; L362-E366 VanDerWaalsContact O-CB 3.3Å; L362-E366 WeakPolarHBondContact O-CB 3.45Å; L362-E366 VanDerWaalsContact O-CG 3.27Å; L362-E366 WeakPolarHBondContact O-CG 3.45Å; L362-E366 PolarHBondContact O-N 3.37Å
363L79.1Confident74.5Confident108 Ų108104.4 Ų104.457%0.56551%0.512SS*.Hα-helixtrans-59.6-37.9173.8-93.2152.8000112.7S359 F367S359-L363 VanDerWaalsContact O-CB 3.29Å; S359-L363 WeakPolarHBondContact O-CB 3.35Å; S359-L363 PolarHBondContact O-N 3.32Å; L363-F367 WeakPolarHBondContact O-CB 3.49Å; L363-F367 PolarHBondContact O-N 3.43Å
364R78.4Confident75.1Confident176 Ų176103.6 Ų103.666%0.66451%0.508SS*.Hα-helixtrans-67.1-47.2175.7-165.371.8175.5-154.8-1111.4A360 K361 L362 E366 F367 D368A360-R364 WeakPolarHBondContact O-CB 3.33Å; A360-R364 PolarHBondContact O-N 3.3Å; K361-R364 PolarHBondContact O-N 2.87Å; L362-R364 VanDerWaalsContact C-N 3.31Å; L362-R364 PolarHBondContact O-N 2.99Å; R364-E366 VanDerWaalsContact C-N 3.3Å; R364-E366 PolarHBondContact O-N 2.86Å; R364-F367 PolarHBondContact O-N 2.78Å; R364-D368 WeakPolarHBondContact O-CB 3.34Å; R364-D368 PolarHBondContact O-N 3.37Å
365L75.3Confident74.9Confident107 Ų107104.2 Ų104.256%0.5651%0.51SS*.Hα-helixtrans-67.4-30.2176.3-73.4172000112.4K361 L362 N369K361-L365 WeakPolarHBondContact O-CB 3.2Å; K361-L365 WeakPolarHBondContact O-CG 3.38Å; K361-L365 PolarHBondContact O-N 3.42Å; L362-L365 CarbonylContact O-C 3.59Å; L362-L365 PolarHBondContact O-N 3.29Å; L365-N369 WeakPolarHBondContact O-CB 3.47Å; L365-N369 PolarHBondContact O-N 2.84Å; L365-N369 PolarHBondContact O-ND2 3.48Å
366E76.3Confident74.2Confident95 Ų95105.1 Ų105.144%0.44451%0.514SS..Hα-helixtrans-72.1-37.6171.7-78.9179.3176.300111.8L362 R364 R370L362-E366 VanDerWaalsContact O-CB 3.3Å; L362-E366 WeakPolarHBondContact O-CB 3.45Å; L362-E366 VanDerWaalsContact O-CG 3.27Å; L362-E366 WeakPolarHBondContact O-CG 3.45Å; L362-E366 PolarHBondContact O-N 3.37Å; R364-E366 VanDerWaalsContact C-N 3.3Å; R364-E366 PolarHBondContact O-N 2.86Å; E366-R370 WeakPolarHBondContact O-CB 3.43Å; E366-R370 PolarHBondContact O-N 3.32Å
367F76.4Confident73.6Confident107 Ų107104.7 Ų104.747%0.46951%0.512SS..Hα-helixtrans-64.8-45.3172.1-173.3-87.8000110.9L363 R364 R370 K371L363-F367 WeakPolarHBondContact O-CB 3.49Å; L363-F367 PolarHBondContact O-N 3.43Å; R364-F367 PolarHBondContact O-N 2.78Å; F367-R370 PolarHBondContact O-N 2.83Å; F367-K371 HydrophobicContact CE1-CD 4.48Å; F367-K371 WeakPolarHBondContact O-CB 3.22Å; F367-K371 PolarHBondContact O-N 3.4Å
368D80.8Confident72.7Confident67 Ų67107.3 Ų107.336%0.35852%0.522SS..Hα-helixtrans-69-38.2177.6-67.9-21.7000111.5R364 K371 L372R364-D368 WeakPolarHBondContact O-CB 3.34Å; R364-D368 PolarHBondContact O-N 3.37Å; D368-K371 PolarHBondContact O-N 3.06Å; D368-L372 WeakPolarHBondContact O-CB 3.34Å; D368-L372 VanDerWaalsContact O-CG 3.31Å; D368-L372 WeakPolarHBondContact O-CG 3.29Å; D368-L372 PolarHBondContact O-N 3.48Å
369N78.5Confident71.5Confident92 Ų92107.3 Ų107.349%0.49253%0.529SS..Hα-helixtrans-67.3-36.1171.9-100.9-53.5000112.5L365 K373L365-N369 WeakPolarHBondContact O-CB 3.47Å; L365-N369 PolarHBondContact O-N 2.84Å; L365-N369 PolarHBondContact O-ND2 3.48Å; N369-K373 WeakPolarHBondContact O-CB 3.42Å; N369-K373 VanDerWaalsContact O-CG 3.3Å; N369-K373 WeakPolarHBondContact O-CG 3.35Å; N369-K373 PolarHBondContact O-N 3.39Å
370R79.2Confident69.9Low122 Ų122108 Ų10846%0.4653%0.534SS..Hα-helixtrans-65.9-44174-164.8-175.5-32.7100.49109.7E366 F367 K373 E374E366-R370 WeakPolarHBondContact O-CB 3.43Å; E366-R370 PolarHBondContact O-N 3.32Å; F367-R370 PolarHBondContact O-N 2.83Å; R370-K373 CarbonylContact O-C 3.57Å; R370-K373 PolarHBondContact O-N 2.85Å; R370-E374 WeakPolarHBondContact O-CB 3.31Å; R370-E374 PolarHBondContact O-N 3.2Å
371K76.6Confident68.3Low117 Ų117111.4 Ų111.451%0.50954%0.544SS..Hα-helixtrans-64.6-40.8176.7-165.3178.7-176.8-177.20112.3F367 D368 E374 M375F367-K371 HydrophobicContact CE1-CD 4.48Å; F367-K371 WeakPolarHBondContact O-CB 3.22Å; F367-K371 PolarHBondContact O-N 3.4Å; D368-K371 PolarHBondContact O-N 3.06Å; K371-E374 PolarHBondContact O-N 2.81Å; K371-M375 WeakPolarHBondContact O-CB 3.32Å; K371-M375 WeakPolarHBondContact O-CG 3.27Å; K371-M375 PolarHBondContact O-N 3.25Å
372L66.5Low66.3Low98 Ų98113.4 Ų113.451%0.51355%0.553SS.*Hα-helixtrans-67-39.5172.8-76.2168.7000111.4D368 E374 M375 L376D368-L372 WeakPolarHBondContact O-CB 3.34Å; D368-L372 VanDerWaalsContact O-CG 3.31Å; D368-L372 WeakPolarHBondContact O-CG 3.29Å; D368-L372 PolarHBondContact O-N 3.48Å; L372-E374 VanDerWaalsContact C-N 3.35Å; L372-M375 PolarHBondContact O-N 2.96Å; L372-L376 VanDerWaalsContact O-CB 3.31Å; L372-L376 WeakPolarHBondContact O-CB 3.25Å; L372-L376 PolarHBondContact O-N 2.86Å
373K70Confident64.3Low146 Ų146112.6 Ų112.664%0.63556%0.555SS**Hα-helixtrans-66.8-33.5171.5-82.7-179176.9179.60112.5N369 R370 L376 Q377N369-K373 WeakPolarHBondContact O-CB 3.42Å; N369-K373 VanDerWaalsContact O-CG 3.3Å; N369-K373 WeakPolarHBondContact O-CG 3.35Å; N369-K373 PolarHBondContact O-N 3.39Å; R370-K373 CarbonylContact O-C 3.57Å; R370-K373 PolarHBondContact O-N 2.85Å; K373-L376 CarbonylContact O-C 3.59Å; K373-L376 PolarHBondContact O-N 2.84Å; K373-Q377 WeakPolarHBondContact O-CA 3.1Å; K373-Q377 WeakPolarHBondContact O-CB 3.45Å; K373-Q377 PolarHBondContact O-N 3.49Å
374E70Confident62.1Low115 Ų115116.4 Ų116.454%0.53757%0.57SS.*Hα-helixtrans-75.3-36177.8-154.8170.3-148.800110.1R370 K371 L372 Q377 N378R370-E374 WeakPolarHBondContact O-CB 3.31Å; R370-E374 PolarHBondContact O-N 3.2Å; K371-E374 PolarHBondContact O-N 2.81Å; L372-E374 VanDerWaalsContact C-N 3.35Å; E374-Q377 PolarHBondContact O-N 2.83Å; E374-N378 WeakPolarHBondContact O-CB 3.28Å; E374-N378 PolarHBondContact O-N 2.91Å; E374-N378 PolarHBondContact O-ND2 3.41Å
375M64.7Low60Low114 Ų114113.6 Ų113.656%0.56258%0.577SS**Hα-helixtrans-64.4-43.7166.1-75.7174.858.800111.5K371 L372 N378 C379K371-M375 WeakPolarHBondContact O-CB 3.32Å; K371-M375 WeakPolarHBondContact O-CG 3.27Å; K371-M375 PolarHBondContact O-N 3.25Å; L372-M375 PolarHBondContact O-N 2.96Å; M375-N378 PolarHBondContact O-N 2.99Å; M375-C379 WeakPolarHBondContact O-CB 3.39Å; M375-C379 PolarHBondContact O-N 3.46Å; M375-C379 PolarHBondContact O-SG 3.15Å; M375-C379 VanDerWaalsContact O-SG 3.32Å
376L58.5Low57.7Low116 Ų116115.6 Ų115.661%0.60759%0.589SS**Hα-helixtrans-67.6-35.7175.9-110.9149.9000112L372 K373 C379 S380L372-L376 VanDerWaalsContact O-CB 3.31Å; L372-L376 WeakPolarHBondContact O-CB 3.25Å; L372-L376 PolarHBondContact O-N 2.86Å; K373-L376 CarbonylContact O-C 3.59Å; K373-L376 PolarHBondContact O-N 2.84Å; L376-C379 CarbonylContact O-C 3.58Å; L376-C379 PolarHBondContact O-N 3.41Å; L376-S380 VanDerWaalsContact O-CB 3.27Å; L376-S380 WeakPolarHBondContact O-CB 3.38Å; L376-S380 PolarHBondContact O-N 3.19Å
377Q61.8Low55.6Low128 Ų128115.4 Ų115.460%0.59860%0.603SS**Hα-helixtrans-75.4-34.9177.7-166.6172.613.200110.5K373 E374 C379 S380 I381K373-Q377 WeakPolarHBondContact O-CA 3.1Å; K373-Q377 WeakPolarHBondContact O-CB 3.45Å; K373-Q377 PolarHBondContact O-N 3.49Å; E374-Q377 PolarHBondContact O-N 2.83Å; Q377-C379 VanDerWaalsContact C-N 3.27Å; Q377-C379 PolarHBondContact O-N 3.32Å; Q377-S380 CarbonylContact O-C 3.6Å; Q377-S380 PolarHBondContact O-N 2.94Å; Q377-S380 VanDerWaalsContact O-N 3.13Å; Q377-I381 VanDerWaalsContact O-CG1 3.31Å; Q377-I381 WeakPolarHBondContact O-CG1 3.47Å; Q377-I381 PolarHBondContact O-N 2.98Å
378N53.1Low53.4Low107 Ų107119.5 Ų119.557%0.57262%0.62SS**Hα-helixtrans-67.4-29.4167.9-73.9-10.3000111.9E374 M375E374-N378 WeakPolarHBondContact O-CB 3.28Å; E374-N378 PolarHBondContact O-N 2.91Å; E374-N378 PolarHBondContact O-ND2 3.41Å; M375-N378 PolarHBondContact O-N 2.99Å
379C47.7Very low50.8Low91 Ų91123.1 Ų123.162%0.61564%0.639SS**Hα-helixtrans-78.7-25.7168-69.80000113.2M375 L376 Q377 F382M375-C379 WeakPolarHBondContact O-CB 3.39Å; M375-C379 PolarHBondContact O-N 3.46Å; M375-C379 PolarHBondContact O-SG 3.15Å; M375-C379 VanDerWaalsContact O-SG 3.32Å; L376-C379 CarbonylContact O-C 3.58Å; L376-C379 PolarHBondContact O-N 3.41Å; Q377-C379 VanDerWaalsContact C-N 3.27Å; Q377-C379 PolarHBondContact O-N 3.32Å; C379-F382 PolarHBondContact O-N 3.46Å
380S43.3Very low48.5Very low69 Ų69129.5 Ų129.548%0.48366%0.658SS.*Hα-helixtrans-90.9-6.6179.6-102.60000114.4L376 Q377 F382 S383L376-S380 VanDerWaalsContact O-CB 3.27Å; L376-S380 WeakPolarHBondContact O-CB 3.38Å; L376-S380 PolarHBondContact O-N 3.19Å; Q377-S380 CarbonylContact O-C 3.6Å; Q377-S380 PolarHBondContact O-N 2.94Å; Q377-S380 VanDerWaalsContact O-N 3.13Å; S380-F382 PolarHBondContact O-N 3.34Å; S380-S383 PolarHBondContact O-N 2.96Å
381I39.7Very low46.1Very low127 Ų127128.7 Ų128.765%0.65166%0.663SS**THydrogen-bonded Turntrans-72.5-8.2161.7-65.7162000110.5Q377Q377-I381 VanDerWaalsContact O-CG1 3.31Å; Q377-I381 WeakPolarHBondContact O-CG1 3.47Å; Q377-I381 PolarHBondContact O-N 2.98Å
382F37.2Very low43.9Very low184 Ų184131.7 Ų131.781%0.80768%0.683SS**SBendtrans-103.462.3162.2-78.1-86.3000111C379 S380C379-F382 PolarHBondContact O-N 3.46Å; S380-F382 PolarHBondContact O-N 3.34Å
383S36.5Very low42.1Very low78 Ų78132.2 Ų132.255%0.54569%0.687SS.*SBendtrans-145.9116162.6-67.10000109.6S380S380-S383 PolarHBondContact O-N 2.96Å
384E33.4Very low40.3Very low188 Ų188131 Ų13188%0.87969%0.691SS**SBendtrans73.375160.1-62.7-178.5146.500118.5
385S34.3Very low38.5Very low118 Ų118131.1 Ų131.183%0.82571%0.705SS**  trans-156.766.4146.2-73.80000110.7
386D28.3Very low36.9Very low149 Ų149131 Ų13180%0.79772%0.715SS**  trans-153.663.8151.6-96.5-24.3000108.9
387A31.3Very low35.5Very low90 Ų90130.7 Ų130.774%0.74472%0.72SS**SBendtrans-106103.7154.100000106.6
388K30Very low33.8Very low193 Ų193130.7 Ų130.784%0.83973%0.729SS**  trans98.183.2175.7-56.1158.7-179174.50115.6
389L26.4Very low32.6Very low143 Ų143130.6 Ų130.675%0.74974%0.737SS**  trans-125.272.9144.6-127.1164.4000108.9D391L389-D391 VanDerWaalsContact C-N 3.31Å; L389-D391 HydrophobicContact CD2-CB 3.87Å; L389-D391 PolarHBondContact O-N 3.22Å
390Y31.1Very low31.8Very low227 Ų227135.4 Ų135.489%0.8975%0.75SS**  trans-67.894.1144.5-89.6-96.2000106.3
391D27.9Very low31.4Very low105 Ų105136.9 Ų136.956%0.56176%0.758SS**  trans-170.781.8153.5-123.2-18.6000111.6L389 N393L389-D391 VanDerWaalsContact C-N 3.31Å; L389-D391 HydrophobicContact CD2-CB 3.87Å; L389-D391 PolarHBondContact O-N 3.22Å; D391-N393 VanDerWaalsContact OD1-CB 3.26Å; D391-N393 WeakPolarHBondContact OD1-CB 3.32Å; D391-N393 PolarHBondContact OD1-ND2 2.82Å
392L29.7Very low31Very low179 Ų179140 Ų14094%0.93777%0.767SS**  trans-159.874.1157.3-103.4156.9000102.8
393N30.4Very low30.8Very low110 Ų110136.5 Ų136.559%0.58877%0.765SS**  cis56.286.639.1-139.56.8000113.3D391D391-N393 VanDerWaalsContact OD1-CB 3.26Å; D391-N393 WeakPolarHBondContact OD1-CB 3.32Å; D391-N393 PolarHBondContact OD1-ND2 2.82Å
394V30.9Very low30.6Very low121 Ų121140.1 Ų140.173%0.73378%0.778SS**  trans71.6102.8144178.10000116.7
395S33.2Very low30.5Very low117 Ų117137.4 Ų137.482%0.81877%0.769SS**  168.486.3117.2-71.80000111.5
396S31.1Very low30.9Very low110 Ų110139.3 Ų139.377%0.76977%0.77SS**  trans-137.3144.213373.30000108.3
397P29.1Very low31.4Very low110 Ų110139.6 Ų139.671%0.71477%0.766SS**  trans-76147.6173.634.9-33.6000109.8
398T25.2Very low31.7Very low129 Ų129142.4 Ų142.479%0.79177%0.768SS**  trans76.3132145.6-41.10000119.1
399S28.2Very low32.5Very low105 Ų105142.3 Ų142.373%0.73477%0.768SS**  trans68.276.5160.566.60000118.8
400Q30Very low33.2Very low191 Ų191142.8 Ų142.889%0.89377%0.771SS**  -57.5146.2120.6-71.5-178.9-20.100108.2
401P36.5Very low33.7Very low101 Ų101134.6 Ų134.666%0.65676%0.756SS**  -155.7167.784.342.8-23.2000117.2
402F31.1Very low34.6Very low193 Ų193138.5 Ų138.585%0.84677%0.768SS**  trans78.178.3161.3-68.2-72.4000117.7L404F402-L404 PolarHBondContact O-N 3.47Å
403S32Very low35.6Very low109 Ų109138.5 Ų138.576%0.76276%0.763SS**  -48.1121.2128.4-48.70000109.5
404L32.2Very low36.5Very low155 Ų155137.3 Ų137.381%0.81276%0.762SS**  172.4110.1122.2-90168.6000109.9F402F402-L404 PolarHBondContact O-N 3.47Å
405L30.7Very low37.4Very low130 Ų130136.6 Ų136.668%0.68175%0.754SS**  66.377.7124.3-158.772.8000117
406N43.7Very low38.6Very low159 Ų159134.6 Ų134.685%0.8574%0.737SS**  trans-161.170.3136.8-99.5-3.2000106.1
407E38.6Very low40.2Very low154 Ų154132.1 Ų132.172%0.7272%0.723SS**  24109.596.1-83.9-169-170.900115.2
408L38.3Very low41.8Very low150 Ų150129.5 Ų129.579%0.78571%0.707SS**  trans81.596.4159.2-74.589.2000118.8
409K45Very low44Very low191 Ų191126.7 Ų126.783%0.8369%0.688SS**  trans152.6130130.6-86.5172.9178-175.30108
410D43.2Very low46.2Very low153 Ų153130 Ų13082%0.81868%0.684SS**SBendcis-160.8142.92-82-44.9000105.4
411G40.5Very low48.4Very low55 Ų55125.9 Ų125.957%0.56767%0.668SS**  trans158.617.9174.500000118.7E413 C414G411-E413 PolarHBondContact O-N 3.33Å; G411-C414 PolarHBondContact O-N 2.88Å
412K47.8Very low50.3Low187 Ų187128.5 Ų128.581%0.81366%0.664SS**THydrogen-bonded Turntrans-64.116.8176.4-73-171.1174.8-177.70115.4
413E49.4Very low52.5Low178 Ų178124.1 Ų124.183%0.83265%0.647SS**THydrogen-bonded Turntrans-99.6-17.7171.6-67.7-172.8166.400113G411G411-E413 PolarHBondContact O-N 3.33Å
414C48.8Very low54.6Low85 Ų85124.4 Ų124.457%0.57464%0.637SS**Hα-helixtrans-84.7-31.3178-156.70000113.1G411 A417 S418G411-C414 PolarHBondContact O-N 2.88Å; C414-A417 PolarHBondContact O-N 2.71Å; C414-S418 PolarHBondContact O-N 2.95Å; C414-S418 PolarHBondContact O-OG 3.39Å; C414-S418 VanDerWaalsContact O-OG 3.06Å
415D50.4Low57Low106 Ų106122.9 Ų122.957%0.56762%0.624SS**Hα-helixtrans-68.9-36177.4-70.2-31.3000111.8A417 S418 D419D415-A417 VanDerWaalsContact C-N 3.3Å; D415-A417 PolarHBondContact O-N 2.67Å; D415-S418 PolarHBondContact O-N 3.24Å; D415-D419 VanDerWaalsContact O-CB 3.28Å; D415-D419 WeakPolarHBondContact O-CB 3.34Å; D415-D419 VanDerWaalsContact O-CG 3.27Å; D415-D419 PolarHBondContact O-N 3Å
416V59.1Low59.5Low76 Ų76122.2 Ų122.246%0.46162%0.617SS.*Hα-helixtrans-67.5-33.7175.1-175.40000111.2R420V416-R420 VanDerWaalsContact O-CB 3.26Å; V416-R420 WeakPolarHBondContact O-CB 3.36Å; V416-R420 VanDerWaalsContact O-CG 3.25Å; V416-R420 WeakPolarHBondContact O-CG 3.44Å; V416-R420 PolarHBondContact O-N 2.78Å
417A63.4Low61.3Low58 Ų58121.4 Ų121.448%0.47960%0.602SS.*Hα-helixtrans-70.4-40.4174.800000111.8C414 D415 L421C414-A417 PolarHBondContact O-N 2.71Å; D415-A417 VanDerWaalsContact C-N 3.3Å; D415-A417 PolarHBondContact O-N 2.67Å; A417-L421 WeakPolarHBondContact O-CB 3.39Å; A417-L421 PolarHBondContact O-N 3.49Å
418S63.8Low63.6Low54 Ų54119.3 Ų119.338%0.37859%0.593SS.*Hα-helixtrans-72.1-38.1178.7-61.10000112.7C414 D415 L421 R422C414-S418 PolarHBondContact O-N 2.95Å; C414-S418 PolarHBondContact O-OG 3.39Å; C414-S418 VanDerWaalsContact O-OG 3.06Å; D415-S418 PolarHBondContact O-N 3.24Å; S418-L421 PolarHBondContact O-N 3.02Å; S418-R422 PolarHBondContact O-N 2.88Å
419D71.3Confident65.6Low71 Ų71116.1 Ų116.138%0.3858%0.582SS.*Hα-helixtrans-69.2-40.6174.4-72.9-22000111.1D415 L421 R422 E423D415-D419 VanDerWaalsContact O-CB 3.28Å; D415-D419 WeakPolarHBondContact O-CB 3.34Å; D415-D419 VanDerWaalsContact O-CG 3.27Å; D415-D419 PolarHBondContact O-N 3Å; D419-L421 VanDerWaalsContact C-N 3.28Å; D419-L421 PolarHBondContact O-N 3.38Å; D419-R422 PolarHBondContact O-N 2.89Å; D419-R422 VanDerWaalsContact O-N 3.14Å; D419-R422 IonicContact OD1-CZ 2.77Å; D419-R422 IonicContact OD1-NH1 3.78Å; D419-R422 PolarHBondContact OD1-NH1 3.49Å; D419-R422 IonicContact OD1-NH2 2.86Å; D419-E423 WeakPolarHBondContact O-CG 3.43Å; D419-E423 PolarHBondContact O-N 3.16Å
420R74.1Confident67.5Low173 Ų173112.4 Ų112.465%0.65357%0.568SS**Hα-helixtrans-60.4-37.5170.7-82.2177.8173.3176.8-0.3112.3V416 M424V416-R420 VanDerWaalsContact O-CB 3.26Å; V416-R420 WeakPolarHBondContact O-CB 3.36Å; V416-R420 VanDerWaalsContact O-CG 3.25Å; V416-R420 WeakPolarHBondContact O-CG 3.44Å; V416-R420 PolarHBondContact O-N 2.78Å; R420-M424 WeakPolarHBondContact O-CB 3.35Å; R420-M424 WeakPolarHBondContact O-CG 3.4Å; R420-M424 PolarHBondContact O-N 3.24Å
421L75.5Confident69.4Low106 Ų106110.9 Ų110.956%0.55556%0.559SS**Hα-helixtrans-68.5-37.7175.1-172.664.3000111.6A417 S418 D419 M424 K425A417-L421 WeakPolarHBondContact O-CB 3.39Å; A417-L421 PolarHBondContact O-N 3.49Å; S418-L421 PolarHBondContact O-N 3.02Å; D419-L421 VanDerWaalsContact C-N 3.28Å; D419-L421 PolarHBondContact O-N 3.38Å; L421-M424 PolarHBondContact O-N 2.83Å; L421-K425 WeakPolarHBondContact O-CB 3.48Å; L421-K425 VanDerWaalsContact O-CG 3.27Å; L421-K425 WeakPolarHBondContact O-CG 3.28Å; L421-K425 PolarHBondContact O-N 3.41Å
422R76.9Confident71.6Confident155 Ų155111.2 Ų111.259%0.58556%0.556SS**Hα-helixtrans-67.7-43.3176.4-159-176.9-63.8121.53.2111.5S418 D419 M424 K425 Q426S418-R422 PolarHBondContact O-N 2.88Å; D419-R422 PolarHBondContact O-N 2.89Å; D419-R422 VanDerWaalsContact O-N 3.14Å; D419-R422 IonicContact OD1-CZ 2.77Å; D419-R422 IonicContact OD1-NH1 3.78Å; D419-R422 PolarHBondContact OD1-NH1 3.49Å; D419-R422 IonicContact OD1-NH2 2.86Å; R422-M424 VanDerWaalsContact C-N 3.34Å; R422-K425 PolarHBondContact O-N 2.89Å; R422-Q426 VanDerWaalsContact O-CB 3.3Å; R422-Q426 WeakPolarHBondContact O-CB 3.31Å; R422-Q426 PolarHBondContact O-N 3.37Å
423E77.5Confident73.4Confident102 Ų102109.2 Ų109.248%0.47755%0.55SS..Hα-helixtrans-63.4-38.8173.1-75.3-173.7-168.500112.4D419 Q426 R427D419-E423 WeakPolarHBondContact O-CG 3.43Å; D419-E423 PolarHBondContact O-N 3.16Å; E423-Q426 PolarHBondContact O-N 2.92Å; E423-R427 WeakPolarHBondContact O-CB 3.43Å; E423-R427 WeakPolarHBondContact O-CG 3.35Å; E423-R427 PolarHBondContact O-N 3.2Å; E423-R427 IonicContact OE2-NH1 3.88Å; E423-R427 PolarHBondContact OE2-NH1 2.89Å
424M76.3Confident75.3Confident115 Ų115104.4 Ų104.457%0.56754%0.536SS*.Hα-helixtrans-63.1-47.1173.8-91.5-97.6-69.800111.6R420 L421 R422 Q426 R427 E428R420-M424 WeakPolarHBondContact O-CB 3.35Å; R420-M424 WeakPolarHBondContact O-CG 3.4Å; R420-M424 PolarHBondContact O-N 3.24Å; L421-M424 PolarHBondContact O-N 2.83Å; R422-M424 VanDerWaalsContact C-N 3.34Å; M424-Q426 VanDerWaalsContact C-N 3.3Å; M424-Q426 PolarHBondContact O-N 3.4Å; M424-R427 PolarHBondContact O-N 3.11Å; M424-E428 PolarHBondContact O-N 3.46Å
425K82.9Confident77.1Confident122 Ų122105.3 Ų105.353%0.5353%0.534SS..Hα-helixtrans-61.2-39.1175.5-74.9-84-177.9-179.50112.1L421 R422 E428 C429L421-K425 WeakPolarHBondContact O-CB 3.48Å; L421-K425 VanDerWaalsContact O-CG 3.27Å; L421-K425 WeakPolarHBondContact O-CG 3.28Å; L421-K425 PolarHBondContact O-N 3.41Å; R422-K425 PolarHBondContact O-N 2.89Å; K425-E428 PolarHBondContact O-N 3.35Å; K425-C429 PolarHBondContact O-N 3.38Å; K425-C429 PolarHBondContact O-SG 2.85Å
426Q83Confident78.9Confident117 Ų117102.9 Ų102.955%0.54753%0.529SS..Hα-helixtrans-67.9-43.3177.7-159.6168.88.100111R422 E423 M424 E428 C429 E430R422-Q426 VanDerWaalsContact O-CB 3.3Å; R422-Q426 WeakPolarHBondContact O-CB 3.31Å; R422-Q426 PolarHBondContact O-N 3.37Å; E423-Q426 PolarHBondContact O-N 2.92Å; M424-Q426 VanDerWaalsContact C-N 3.3Å; M424-Q426 PolarHBondContact O-N 3.4Å; Q426-E428 VanDerWaalsContact C-N 3.34Å; Q426-E428 PolarHBondContact O-N 2.88Å; Q426-C429 PolarHBondContact O-N 2.92Å; Q426-E430 WeakPolarHBondContact O-CG 3.22Å; Q426-E430 PolarHBondContact O-N 3.28Å
427R82.4Confident80.2Confident141 Ų141102.6 Ų102.653%0.53253%0.525SS..Hα-helixtrans-61.7-38.3171-81.9174.8166.1107.5-2.8112.6E423 M424 E430 L431E423-R427 WeakPolarHBondContact O-CB 3.43Å; E423-R427 WeakPolarHBondContact O-CG 3.35Å; E423-R427 PolarHBondContact O-N 3.2Å; E423-R427 IonicContact OE2-NH1 3.88Å; E423-R427 PolarHBondContact OE2-NH1 2.89Å; M424-R427 PolarHBondContact O-N 3.11Å; R427-E430 PolarHBondContact O-N 3.48Å; R427-L431 VanDerWaalsContact O-CB 3.31Å; R427-L431 WeakPolarHBondContact O-CB 3.34Å; R427-L431 WeakPolarHBondContact O-CD1 3.47Å; R427-L431 PolarHBondContact O-N 2.77Å
428E85.4Confident81.1Confident110 Ų110102.2 Ų102.251%0.51452%0.522SS..Hα-helixtrans-62.5-43.3173.7-81.6-175.715500111.8M424 K425 Q426 L431 A432M424-E428 PolarHBondContact O-N 3.46Å; K425-E428 PolarHBondContact O-N 3.35Å; Q426-E428 VanDerWaalsContact C-N 3.34Å; Q426-E428 PolarHBondContact O-N 2.88Å; E428-L431 PolarHBondContact O-N 3.43Å; E428-A432 VanDerWaalsContact O-CB 3.29Å; E428-A432 WeakPolarHBondContact O-CB 3.33Å; E428-A432 PolarHBondContact O-N 3.38Å
429C81.4Confident82.2Confident83 Ų83103.8 Ų103.856%0.56152%0.524SS*.Hα-helixtrans-63.7-43.7174.8-71.90000112.2K425 Q426 A432 E433K425-C429 PolarHBondContact O-N 3.38Å; K425-C429 PolarHBondContact O-SG 2.85Å; Q426-C429 PolarHBondContact O-N 2.92Å; C429-A432 PolarHBondContact O-N 3.26Å; C429-E433 PolarHBondContact O-N 3.03Å
430E84.3Confident82.9Confident114 Ų114106.1 Ų106.153%0.53353%0.534SS..Hα-helixtrans-63.5-41176.8-72170.7-173.500112Q426 R427 S434Q426-E430 WeakPolarHBondContact O-CG 3.22Å; Q426-E430 PolarHBondContact O-N 3.28Å; R427-E430 PolarHBondContact O-N 3.48Å; E430-S434 VanDerWaalsContact O-CB 3.3Å; E430-S434 WeakPolarHBondContact O-CB 3.27Å; E430-S434 PolarHBondContact O-N 3.42Å
431L83.7Confident83.5Confident120 Ų120104.8 Ų104.863%0.62853%0.528SS*.Hα-helixtrans-65.9-40.9174.3-94.9144000111.7R427 E428 S434 L435R427-L431 VanDerWaalsContact O-CB 3.31Å; R427-L431 WeakPolarHBondContact O-CB 3.34Å; R427-L431 WeakPolarHBondContact O-CD1 3.47Å; R427-L431 PolarHBondContact O-N 2.77Å; E428-L431 PolarHBondContact O-N 3.43Å; L431-S434 PolarHBondContact O-N 2.9Å; L431-L435 VanDerWaalsContact O-CB 3.27Å; L431-L435 WeakPolarHBondContact O-CB 3.42Å; L431-L435 PolarHBondContact O-N 3.21Å
432A86.9Confident84Confident62 Ų62104.7 Ų104.751%0.51253%0.529SS..Hα-helixtrans-66.1-42177.400000112.1E428 C429 L435 A436E428-A432 VanDerWaalsContact O-CB 3.29Å; E428-A432 WeakPolarHBondContact O-CB 3.33Å; E428-A432 PolarHBondContact O-N 3.38Å; C429-A432 PolarHBondContact O-N 3.26Å; A432-L435 PolarHBondContact O-N 2.87Å; A432-A436 WeakPolarHBondContact O-CB 3.37Å; A432-A436 PolarHBondContact O-N 2.87Å
433E85.9Confident84.5Confident145 Ų145104.6 Ų104.668%0.67853%0.528SS*.Hα-helixtrans-61.8-49.6173.1-80-174.416600110.9C429 L435 A436 D437C429-E433 PolarHBondContact O-N 3.03Å; E433-L435 VanDerWaalsContact C-N 3.27Å; E433-L435 PolarHBondContact O-N 3.4Å; E433-A436 PolarHBondContact O-N 3.31Å; E433-D437 VanDerWaalsContact O-CB 3.31Å; E433-D437 WeakPolarHBondContact O-CB 3.44Å; E433-D437 PolarHBondContact O-N 3.44Å
434S88.4Confident84.9Confident78 Ų78101.6 Ų101.655%0.54552%0.519SS..Hα-helixtrans-58.4-38.2178.1-175.70000112.7E430 L431 D437 A438E430-S434 VanDerWaalsContact O-CB 3.3Å; E430-S434 WeakPolarHBondContact O-CB 3.27Å; E430-S434 PolarHBondContact O-N 3.42Å; L431-S434 PolarHBondContact O-N 2.9Å; S434-D437 WeakPolarHBondContact O-CB 3.45Å; S434-D437 PolarHBondContact O-N 2.9Å; S434-A438 WeakPolarHBondContact O-CB 3.28Å; S434-A438 PolarHBondContact O-N 3.43Å
435L87.5Confident85.3Confident103 Ų103100.7 Ų100.754%0.53952%0.516SS..Hα-helixtrans-71.5-41177.8-158.4139.3000111.7L431 A432 E433 D437 A438 E439L431-L435 VanDerWaalsContact O-CB 3.27Å; L431-L435 WeakPolarHBondContact O-CB 3.42Å; L431-L435 PolarHBondContact O-N 3.21Å; A432-L435 PolarHBondContact O-N 2.87Å; E433-L435 VanDerWaalsContact C-N 3.27Å; E433-L435 PolarHBondContact O-N 3.4Å; L435-D437 VanDerWaalsContact C-N 3.3Å; L435-D437 PolarHBondContact O-N 3.34Å; L435-A438 PolarHBondContact O-N 2.88Å; L435-E439 HydrophobicContact CD2-CG 4.47Å; L435-E439 WeakPolarHBondContact O-CG 3.33Å; L435-E439 PolarHBondContact O-N 3.12Å
436A86.6Confident85.4Confident56 Ų5698.2 Ų98.246%0.46351%0.513SS..Hα-helixtrans-62.1-39172.200000112A432 E433 E439 M440A432-A436 WeakPolarHBondContact O-CB 3.37Å; A432-A436 PolarHBondContact O-N 2.87Å; E433-A436 PolarHBondContact O-N 3.31Å; A436-E439 PolarHBondContact O-N 3.34Å; A436-M440 WeakPolarHBondContact O-CB 3.44Å; A436-M440 PolarHBondContact O-N 3.32Å
437D86.6Confident85.6Confident69 Ų6999.3 Ų99.337%0.36951%0.513SS..Hα-helixtrans-65.4-43.2175.7-122.830.7000111.9E433 S434 L435 M440 R441E433-D437 VanDerWaalsContact O-CB 3.31Å; E433-D437 WeakPolarHBondContact O-CB 3.44Å; E433-D437 PolarHBondContact O-N 3.44Å; S434-D437 WeakPolarHBondContact O-CB 3.45Å; S434-D437 PolarHBondContact O-N 2.9Å; L435-D437 VanDerWaalsContact C-N 3.3Å; L435-D437 PolarHBondContact O-N 3.34Å; D437-M440 PolarHBondContact O-N 2.87Å; D437-R441 VanDerWaalsContact CB-NH1 3.34Å; D437-R441 WeakPolarHBondContact O-CG 3.26Å; D437-R441 PolarHBondContact O-N 3.47Å; D437-R441 PolarHBondContact O-NH1 2.95Å; D437-R441 IonicContact OD2-CZ 2.7Å; D437-R441 IonicContact OD2-NH1 3.89Å; D437-R441 PolarHBondContact OD2-NH1 3.5Å; D437-R441 VanDerWaalsContact OD2-NH1 3.12Å; D437-R441 IonicContact OD2-NH2 3.59Å; D437-R441 PolarHBondContact OD2-NH2 3.45Å
438A83.6Confident85.8Confident51 Ų5198.3 Ų98.342%0.42151%0.512SS..Hα-helixtrans-63.9-43.217400000111.3S434 L435 R441 N442S434-A438 WeakPolarHBondContact O-CB 3.28Å; S434-A438 PolarHBondContact O-N 3.43Å; L435-A438 PolarHBondContact O-N 2.88Å; A438-R441 PolarHBondContact O-N 2.79Å; A438-N442 WeakPolarHBondContact O-CB 3.47Å; A438-N442 PolarHBondContact O-N 2.8Å
439E85.6Confident85.7Confident87 Ų8797.9 Ų97.941%0.40751%0.513SS..Hα-helixtrans-62.2-41.2173.6-76.8-171.5-169.700112.4L435 A436 N442 R443L435-E439 HydrophobicContact CD2-CG 4.47Å; L435-E439 WeakPolarHBondContact O-CG 3.33Å; L435-E439 PolarHBondContact O-N 3.12Å; A436-E439 PolarHBondContact O-N 3.34Å; E439-N442 PolarHBondContact O-N 3.48Å; E439-R443 VanDerWaalsContact O-CG 3.32Å; E439-R443 WeakPolarHBondContact O-CG 3.44Å; E439-R443 PolarHBondContact O-N 3.33Å; E439-R443 IonicContact OE2-CZ 3.05Å; E439-R443 IonicContact OE2-NH2 3.36Å; E439-R443 PolarHBondContact OE2-NH2 3.02Å
440M86.7Confident85.8Confident120 Ų12096 Ų9659%0.59150%0.504SS*.Hα-helixtrans-64.5-41.8177.1-131.3-137-63.200111.3A436 D437 N442 R443 S444A436-M440 WeakPolarHBondContact O-CB 3.44Å; A436-M440 PolarHBondContact O-N 3.32Å; D437-M440 PolarHBondContact O-N 2.87Å; M440-N442 VanDerWaalsContact C-N 3.34Å; M440-R443 PolarHBondContact O-N 3.41Å; M440-S444 WeakPolarHBondContact O-CB 3.45Å; M440-S444 PolarHBondContact O-N 3.42Å
441R87.4Confident85.8Confident144 Ų14495.9 Ų95.954%0.54350%0.503SS..Hα-helixtrans-61.8-42171.8-72-179.8-167.693.78.1111.1D437 A438 S444 L445D437-R441 VanDerWaalsContact CB-NH1 3.34Å; D437-R441 WeakPolarHBondContact O-CG 3.26Å; D437-R441 PolarHBondContact O-N 3.47Å; D437-R441 PolarHBondContact O-NH1 2.95Å; D437-R441 IonicContact OD2-CZ 2.7Å; D437-R441 IonicContact OD2-NH1 3.89Å; D437-R441 PolarHBondContact OD2-NH1 3.5Å; D437-R441 VanDerWaalsContact OD2-NH1 3.12Å; D437-R441 IonicContact OD2-NH2 3.59Å; D437-R441 PolarHBondContact OD2-NH2 3.45Å; A438-R441 PolarHBondContact O-N 2.79Å; R441-S444 WeakPolarHBondContact O-CB 3.47Å; R441-S444 PolarHBondContact O-N 3.27Å; R441-L445 WeakPolarHBondContact O-CB 3.27Å; R441-L445 VanDerWaalsContact O-CG 3.3Å; R441-L445 WeakPolarHBondContact O-CG 3.43Å; R441-L445 PolarHBondContact O-N 3.28Å
442N85.1Confident85.7Confident105 Ų10593.3 Ų93.356%0.56149%0.492SS*.Hα-helixtrans-66.6-41.1179.5-127.6-7.8000112.4A438 E439 M440 S444 L445 S446A438-N442 WeakPolarHBondContact O-CB 3.47Å; A438-N442 PolarHBondContact O-N 2.8Å; E439-N442 PolarHBondContact O-N 3.48Å; M440-N442 VanDerWaalsContact C-N 3.34Å; N442-S444 VanDerWaalsContact C-N 3.33Å; N442-S444 PolarHBondContact O-N 3Å; N442-L445 PolarHBondContact O-N 2.88Å; N442-S446 WeakPolarHBondContact O-CB 3.36Å; N442-S446 PolarHBondContact O-N 2.95Å; N442-S446 PolarHBondContact O-OG 3.41Å
443R86.9Confident85.7Confident153 Ų15395.7 Ų95.758%0.57749%0.493SS*.Hα-helixtrans-65.2-36.4173.5-68.2176.2-155.7168.58.2111.8E439 M440 R447E439-R443 VanDerWaalsContact O-CG 3.32Å; E439-R443 WeakPolarHBondContact O-CG 3.44Å; E439-R443 PolarHBondContact O-N 3.33Å; E439-R443 IonicContact OE2-CZ 3.05Å; E439-R443 IonicContact OE2-NH2 3.36Å; E439-R443 PolarHBondContact OE2-NH2 3.02Å; M440-R443 PolarHBondContact O-N 3.41Å; R443-R447 PolarHBondContact O-N 3.15Å
444S86.9Confident85.4Confident39 Ų3993.7 Ų93.727%0.27349%0.487SS..Hα-helixtrans-68.8-43.6175.1-1670000111.8M440 R441 N442 R447 K448M440-S444 WeakPolarHBondContact O-CB 3.45Å; M440-S444 PolarHBondContact O-N 3.42Å; R441-S444 WeakPolarHBondContact O-CB 3.47Å; R441-S444 PolarHBondContact O-N 3.27Å; N442-S444 VanDerWaalsContact C-N 3.33Å; N442-S444 PolarHBondContact O-N 3Å; S444-R447 PolarHBondContact O-N 2.69Å; S444-K448 WeakPolarHBondContact O-CG 3.3Å; S444-K448 PolarHBondContact O-N 3.13Å
445L85.2Confident85.2Confident96 Ų9695.8 Ų95.850%0.50349%0.488SS..Hα-helixtrans-66-39.3175.3-72.1173.7000112R441 N442 K448 L449R441-L445 WeakPolarHBondContact O-CB 3.27Å; R441-L445 VanDerWaalsContact O-CG 3.3Å; R441-L445 WeakPolarHBondContact O-CG 3.43Å; R441-L445 PolarHBondContact O-N 3.28Å; N442-L445 PolarHBondContact O-N 2.88Å; L445-K448 PolarHBondContact O-N 3.5Å; L445-L449 WeakPolarHBondContact O-CB 3.31Å; L445-L449 PolarHBondContact O-N 3.41Å
446S84.5Confident84.6Confident69 Ų6993.7 Ų93.748%0.48348%0.481SS..Hα-helixtrans-65.3-38.3175.5-57.90000111.9N442 L449 A450N442-S446 WeakPolarHBondContact O-CB 3.36Å; N442-S446 PolarHBondContact O-N 2.95Å; N442-S446 PolarHBondContact O-OG 3.41Å; S446-L449 PolarHBondContact O-N 3.38Å; S446-A450 WeakPolarHBondContact O-CB 3.32Å; S446-A450 PolarHBondContact O-N 2.79Å
447R86.1Confident84.3Confident141 Ų14195.8 Ų95.853%0.53248%0.482SS..Hα-helixtrans-64.6-44.6171.3-90.1-176.2-77.4114.3-4.3112.3R443 S444 L449 A450 E451R443-R447 PolarHBondContact O-N 3.15Å; S444-R447 PolarHBondContact O-N 2.69Å; R447-L449 VanDerWaalsContact C-N 3.33Å; R447-L449 PolarHBondContact O-N 2.92Å; R447-A450 PolarHBondContact O-N 3.34Å; R447-E451 WeakPolarHBondContact O-CB 3.28Å; R447-E451 VanDerWaalsContact O-CG 3.32Å; R447-E451 WeakPolarHBondContact O-CG 3.36Å; R447-E451 PolarHBondContact O-N 2.81Å
448K86.7Confident84Confident119 Ų11999 Ų9952%0.51749%0.492SS..Hα-helixtrans-62.7-39.9175.4-73178.4-179.9-174.50112S444 L445 E451 T452S444-K448 WeakPolarHBondContact O-CG 3.3Å; S444-K448 PolarHBondContact O-N 3.13Å; L445-K448 PolarHBondContact O-N 3.5Å; K448-E451 PolarHBondContact O-N 2.98Å; K448-T452 WeakPolarHBondContact O-CB 3.26Å; K448-T452 VanDerWaalsContact O-CG2 3.26Å; K448-T452 WeakPolarHBondContact O-CG2 3.44Å; K448-T452 PolarHBondContact O-N 2.83Å; K448-T452 PolarHBondContact O-OG1 3.47Å; K448-T452 VanDerWaalsContact O-OG1 3.11Å
449L83.5Confident83.7Confident101 Ų101101 Ų10153%0.52950%0.495SS..Hα-helixtrans-60.4-50173.9-95.5158.7000110.7L445 S446 R447 E451 T452 E453L445-L449 WeakPolarHBondContact O-CB 3.31Å; L445-L449 PolarHBondContact O-N 3.41Å; S446-L449 PolarHBondContact O-N 3.38Å; R447-L449 VanDerWaalsContact C-N 3.33Å; R447-L449 PolarHBondContact O-N 2.92Å; L449-E451 PolarHBondContact O-N 3.34Å; L449-T452 WeakPolarHBondContact CA-OG1 3.46Å; L449-T452 PolarHBondContact O-N 3.29Å; L449-T452 PolarHBondContact O-OG1 3.09Å; L449-E453 WeakPolarHBondContact O-CB 3.36Å; L449-E453 VanDerWaalsContact O-CG 3.3Å; L449-E453 WeakPolarHBondContact O-CG 3.42Å; L449-E453 PolarHBondContact O-N 2.83Å
450A83.5Confident83.3Confident45 Ų45104.9 Ų104.937%0.37251%0.506SS..Hα-helixtrans-60.4-42.7176.300000112.7S446 R447 E453 D454S446-A450 WeakPolarHBondContact O-CB 3.32Å; S446-A450 PolarHBondContact O-N 2.79Å; R447-A450 PolarHBondContact O-N 3.34Å; A450-E453 PolarHBondContact O-N 3.45Å; A450-D454 WeakPolarHBondContact O-CB 3.37Å; A450-D454 PolarHBondContact O-N 3.43Å
451E85.1Confident82.8Confident110 Ų110105.1 Ų105.151%0.51451%0.505SS..Hα-helixtrans-61.1-44.8174.5-75.3166.9-171.500111.4R447 K448 L449 E453 D454 E455R447-E451 WeakPolarHBondContact O-CB 3.28Å; R447-E451 VanDerWaalsContact O-CG 3.32Å; R447-E451 WeakPolarHBondContact O-CG 3.36Å; R447-E451 PolarHBondContact O-N 2.81Å; K448-E451 PolarHBondContact O-N 2.98Å; L449-E451 PolarHBondContact O-N 3.34Å; E451-E453 VanDerWaalsContact C-N 3.32Å; E451-E453 PolarHBondContact O-N 2.94Å; E451-D454 PolarHBondContact O-N 3.19Å; E451-E455 WeakPolarHBondContact O-CB 3.38Å; E451-E455 VanDerWaalsContact O-CG 3.27Å; E451-E455 WeakPolarHBondContact O-CG 3.28Å; E451-E455 PolarHBondContact O-N 3.44Å
452T82Confident82.1Confident67 Ų67103.4 Ų103.441%0.41150%0.504SS..Hα-helixtrans-68.7-31176.258.60000112.7K448 L449 C456K448-T452 WeakPolarHBondContact O-CB 3.26Å; K448-T452 VanDerWaalsContact O-CG2 3.26Å; K448-T452 WeakPolarHBondContact O-CG2 3.44Å; K448-T452 PolarHBondContact O-N 2.83Å; K448-T452 PolarHBondContact O-OG1 3.47Å; K448-T452 VanDerWaalsContact O-OG1 3.11Å; L449-T452 WeakPolarHBondContact CA-OG1 3.46Å; L449-T452 PolarHBondContact O-N 3.29Å; L449-T452 PolarHBondContact O-OG1 3.09Å; T452-C456 VanDerWaalsContact O-CB 3.22Å; T452-C456 WeakPolarHBondContact O-CB 3.4Å; T452-C456 PolarHBondContact O-N 3.44Å; T452-C456 PolarHBondContact O-SG 3.44Å
453E85.6Confident81.3Confident111 Ų111102.8 Ų102.852%0.51950%0.5SS..Hα-helixtrans-70.6-42175.1-77.6176.8174.900111.2L449 A450 E451 C456 Q457L449-E453 WeakPolarHBondContact O-CB 3.36Å; L449-E453 VanDerWaalsContact O-CG 3.3Å; L449-E453 WeakPolarHBondContact O-CG 3.42Å; L449-E453 PolarHBondContact O-N 2.83Å; A450-E453 PolarHBondContact O-N 3.45Å; E451-E453 VanDerWaalsContact C-N 3.32Å; E451-E453 PolarHBondContact O-N 2.94Å; E453-C456 CarbonylContact O-C 3.59Å; E453-C456 WeakPolarHBondContact O-CB 3.4Å; E453-C456 PolarHBondContact O-N 2.94Å; E453-Q457 WeakPolarHBondContact O-CB 3.36Å; E453-Q457 WeakPolarHBondContact O-CG 3.43Å; E453-Q457 PolarHBondContact O-N 2.95Å
454D81.1Confident80.5Confident104 Ų104102.1 Ų102.156%0.55650%0.503SS*.Hα-helixtrans-65.9-42173.2-81.6-9.6000111.4A450 E451 C456 Q457 K458A450-D454 WeakPolarHBondContact O-CB 3.37Å; A450-D454 PolarHBondContact O-N 3.43Å; E451-D454 PolarHBondContact O-N 3.19Å; D454-C456 VanDerWaalsContact C-N 3.34Å; D454-Q457 PolarHBondContact O-N 3.19Å; D454-K458 VanDerWaalsContact O-CB 3.27Å; D454-K458 WeakPolarHBondContact O-CB 3.28Å; D454-K458 PolarHBondContact O-N 2.92Å
455E83.6Confident79.6Confident121 Ų121103.5 Ų103.557%0.56551%0.513SS*.Hα-helixtrans-61.7-42.5171.8-75.6177176.800111.1E451 K458 I459E451-E455 WeakPolarHBondContact O-CB 3.38Å; E451-E455 VanDerWaalsContact O-CG 3.27Å; E451-E455 WeakPolarHBondContact O-CG 3.28Å; E451-E455 PolarHBondContact O-N 3.44Å; E455-K458 PolarHBondContact O-N 3.3Å; E455-I459 WeakPolarHBondContact O-CB 3.39Å; E455-I459 WeakPolarHBondContact O-CG1 3.31Å; E455-I459 PolarHBondContact O-N 3.45Å
456C74.9Confident78.2Confident59 Ų59104.9 Ų104.940%0.39952%0.518SS..Hα-helixtrans-64-39.5174.7-77.40000112.2T452 E453 D454 R460T452-C456 VanDerWaalsContact O-CB 3.22Å; T452-C456 WeakPolarHBondContact O-CB 3.4Å; T452-C456 PolarHBondContact O-N 3.44Å; T452-C456 PolarHBondContact O-SG 3.44Å; E453-C456 CarbonylContact O-C 3.59Å; E453-C456 WeakPolarHBondContact O-CB 3.4Å; E453-C456 PolarHBondContact O-N 2.94Å; D454-C456 VanDerWaalsContact C-N 3.34Å; C456-R460 WeakPolarHBondContact O-CB 3.29Å; C456-R460 WeakPolarHBondContact O-CG 3.36Å; C456-R460 PolarHBondContact O-N 2.87Å
457Q79.2Confident77.1Confident101 Ų101108 Ų10847%0.47253%0.525SS..Hα-helixtrans-67.1-43.9175.4-75.8177.725.200111.1E453 D454 I459 R460 E461E453-Q457 WeakPolarHBondContact O-CB 3.36Å; E453-Q457 WeakPolarHBondContact O-CG 3.43Å; E453-Q457 PolarHBondContact O-N 2.95Å; D454-Q457 PolarHBondContact O-N 3.19Å; Q457-I459 PolarHBondContact O-N 3.45Å; Q457-R460 CarbonylContact O-C 3.56Å; Q457-R460 WeakPolarHBondContact O-CB 3.37Å; Q457-R460 PolarHBondContact O-N 3.43Å; Q457-R460 VanDerWaalsContact O-N 3.12Å; Q457-E461 WeakPolarHBondContact O-CG 2.85Å; Q457-E461 PolarHBondContact O-N 3.43Å
458K81Confident75.8Confident137 Ų137106 Ų10660%0.59653%0.533SS*.Hα-helixtrans-63.4-40.6176.3-164.5176.2-170.7176.10112.1D454 E455 E461 Q462D454-K458 VanDerWaalsContact O-CB 3.27Å; D454-K458 WeakPolarHBondContact O-CB 3.28Å; D454-K458 PolarHBondContact O-N 2.92Å; E455-K458 PolarHBondContact O-N 3.3Å; K458-E461 PolarHBondContact O-N 3.25Å; K458-Q462 WeakPolarHBondContact O-CB 3.47Å; K458-Q462 VanDerWaalsContact O-CG 3.27Å; K458-Q462 WeakPolarHBondContact O-CG 3.44Å; K458-Q462 PolarHBondContact O-N 2.87Å
459I77.5Confident74.1Confident92 Ų92103.9 Ų103.947%0.47254%0.538SS..Hα-helixtrans-64.5-42.7172.5-70.2165.7000109.8E455 Q457 Q462 L463E455-I459 WeakPolarHBondContact O-CB 3.39Å; E455-I459 WeakPolarHBondContact O-CG1 3.31Å; E455-I459 PolarHBondContact O-N 3.45Å; Q457-I459 PolarHBondContact O-N 3.45Å; I459-Q462 CarbonylContact O-C 3.56Å; I459-Q462 PolarHBondContact O-N 2.95Å; I459-L463 HydrophobicContact CG2-CD1 4.4Å; I459-L463 VanDerWaalsContact O-CB 3.31Å; I459-L463 WeakPolarHBondContact O-CB 3.37Å; I459-L463 PolarHBondContact O-N 2.96Å
460R77.1Confident72.3Confident168 Ų168102 Ų10263%0.63454%0.537SS*.Hα-helixtrans-62.4-42175.7-76.3170.8-166.41555.6112.1C456 Q457 L463 Q464C456-R460 WeakPolarHBondContact O-CB 3.29Å; C456-R460 WeakPolarHBondContact O-CG 3.36Å; C456-R460 PolarHBondContact O-N 2.87Å; Q457-R460 CarbonylContact O-C 3.56Å; Q457-R460 WeakPolarHBondContact O-CB 3.37Å; Q457-R460 PolarHBondContact O-N 3.43Å; Q457-R460 VanDerWaalsContact O-N 3.12Å; R460-L463 CarbonylContact O-C 3.59Å; R460-L463 PolarHBondContact O-N 2.94Å; R460-Q464 VanDerWaalsContact O-CB 3.32Å; R460-Q464 WeakPolarHBondContact O-CB 3.35Å; R460-Q464 PolarHBondContact O-N 3.35Å
461E75.5Confident70.3Confident125 Ų125104.6 Ų104.658%0.58456%0.558SS**Hα-helixtrans-64.6-42.3174.7-73.9179.5172.600111.6Q457 K458 Q464 S465Q457-E461 WeakPolarHBondContact O-CG 2.85Å; Q457-E461 PolarHBondContact O-N 3.43Å; K458-E461 PolarHBondContact O-N 3.25Å; E461-Q464 PolarHBondContact O-N 3.18Å; E461-S465 WeakPolarHBondContact O-CB 3.48Å; E461-S465 PolarHBondContact O-N 3.04Å
462Q73.1Confident68.2Low109 Ų109102.8 Ų102.851%0.50956%0.562SS.*Hα-helixtrans-61.8-43.6172.3-76.2178.3-13.800111.3K458 I459 Q464 S465 M466K458-Q462 WeakPolarHBondContact O-CB 3.47Å; K458-Q462 VanDerWaalsContact O-CG 3.27Å; K458-Q462 WeakPolarHBondContact O-CG 3.44Å; K458-Q462 PolarHBondContact O-N 2.87Å; I459-Q462 CarbonylContact O-C 3.56Å; I459-Q462 PolarHBondContact O-N 2.95Å; Q462-Q464 VanDerWaalsContact C-N 3.35Å; Q462-Q464 PolarHBondContact O-N 3.46Å; Q462-S465 PolarHBondContact O-N 3.33Å; Q462-S465 PolarHBondContact O-OG 2.86Å; Q462-M466 WeakPolarHBondContact O-CB 3.37Å; Q462-M466 WeakPolarHBondContact O-CG 3.31Å; Q462-M466 PolarHBondContact O-N 2.84Å
463L67.8Low66.3Low92 Ų92107.6 Ų107.648%0.48258%0.579SS.*Hα-helixtrans-65-38.2176.6-121.7155.8000111.4I459 R460 M466 Q467I459-L463 HydrophobicContact CG2-CD1 4.4Å; I459-L463 VanDerWaalsContact O-CB 3.31Å; I459-L463 WeakPolarHBondContact O-CB 3.37Å; I459-L463 PolarHBondContact O-N 2.96Å; R460-L463 CarbonylContact O-C 3.59Å; R460-L463 PolarHBondContact O-N 2.94Å; L463-M466 PolarHBondContact O-N 2.89Å; L463-Q467 HydrophobicContact CD2-CG 4.16Å; L463-Q467 VanDerWaalsContact O-CB 3.25Å; L463-Q467 WeakPolarHBondContact O-CB 3.31Å; L463-Q467 VanDerWaalsContact O-CG 3.27Å; L463-Q467 WeakPolarHBondContact O-CG 3.43Å; L463-Q467 PolarHBondContact O-N 3.44Å
464Q70.8Confident64.2Low139 Ų139107.6 Ų107.665%0.6559%0.589SS**Hα-helixtrans-69.4-38.2176.3-154.1173.215.600110.9R460 E461 Q462 S468R460-Q464 VanDerWaalsContact O-CB 3.32Å; R460-Q464 WeakPolarHBondContact O-CB 3.35Å; R460-Q464 PolarHBondContact O-N 3.35Å; E461-Q464 PolarHBondContact O-N 3.18Å; Q462-Q464 VanDerWaalsContact C-N 3.35Å; Q462-Q464 PolarHBondContact O-N 3.46Å; Q464-S468 PolarHBondContact O-N 2.89Å; Q464-S468 VanDerWaalsContact O-N 3.13Å
465S69Low62.7Low67 Ų67106.8 Ų106.847%0.46959%0.588SS.*Hα-helixtrans-64.4-42.1171.684.20000111.7E461 Q462 S468 A469E461-S465 WeakPolarHBondContact O-CB 3.48Å; E461-S465 PolarHBondContact O-N 3.04Å; Q462-S465 PolarHBondContact O-N 3.33Å; Q462-S465 PolarHBondContact O-OG 2.86Å; S465-S468 PolarHBondContact O-N 2.9Å; S465-S468 PolarHBondContact O-OG 2.98Å; S465-A469 PolarHBondContact O-N 3.48Å
466M55.6Low61.3Low125 Ų125104.5 Ų104.562%0.61659%0.59SS**Hα-helixtrans-71.7-37.2178-76.9-141.465.300112.1Q462 L463 S468 A469 A470Q462-M466 WeakPolarHBondContact O-CB 3.37Å; Q462-M466 WeakPolarHBondContact O-CG 3.31Å; Q462-M466 PolarHBondContact O-N 2.84Å; L463-M466 PolarHBondContact O-N 2.89Å; M466-S468 VanDerWaalsContact C-N 3.26Å; M466-S468 PolarHBondContact O-N 2.85Å; M466-A469 CarbonylContact O-C 3.58Å; M466-A469 PolarHBondContact O-N 3.1Å; M466-A469 VanDerWaalsContact O-N 3.07Å; M466-A470 WeakPolarHBondContact O-CB 3.48Å; M466-A470 PolarHBondContact O-N 3.32Å
467Q60.3Low60.4Low135 Ų135105.4 Ų105.463%0.63160%0.602SS**Hα-helixtrans-63.2-34.3174-82.8177.7-15.500111.4L463 A469L463-Q467 HydrophobicContact CD2-CG 4.16Å; L463-Q467 VanDerWaalsContact O-CB 3.25Å; L463-Q467 WeakPolarHBondContact O-CB 3.31Å; L463-Q467 VanDerWaalsContact O-CG 3.27Å; L463-Q467 WeakPolarHBondContact O-CG 3.43Å; L463-Q467 PolarHBondContact O-N 3.44Å; Q467-A469 VanDerWaalsContact C-N 3.33Å
468S58.7Low59.4Low99 Ų99107 Ų10769%0.69261%0.609SS**Hα-helixtrans-70.2-28.2172.778.80000113.3Q464 S465 M466Q464-S468 PolarHBondContact O-N 2.89Å; Q464-S468 VanDerWaalsContact O-N 3.13Å; S465-S468 PolarHBondContact O-N 2.9Å; S465-S468 PolarHBondContact O-OG 2.98Å; M466-S468 VanDerWaalsContact C-N 3.26Å; M466-S468 PolarHBondContact O-N 2.85Å
469A51.3Low58.6Low75 Ų75106 Ų10662%0.6261%0.609SS**Hα-helixtrans-91.2-23178.300000114.1S465 M466 Q467S465-A469 PolarHBondContact O-N 3.48Å; M466-A469 CarbonylContact O-C 3.58Å; M466-A469 PolarHBondContact O-N 3.1Å; M466-A469 VanDerWaalsContact O-N 3.07Å; Q467-A469 VanDerWaalsContact C-N 3.33Å
470A45.6Very low58.3Low62 Ų62106.6 Ų106.651%0.51261%0.614SS.*  trans-87.3-1-172.800000114.3M466 A472M466-A470 WeakPolarHBondContact O-CB 3.48Å; M466-A470 PolarHBondContact O-N 3.32Å; A470-A472 PolarHBondContact O-N 2.89Å
471A42.6Very low58.1Low99 Ų99105.7 Ų105.782%0.81861%0.614SS**THydrogen-bonded Turntrans-64.47.917200000114.1
472A41Very low58.1Low71 Ų71104.3 Ų104.359%0.58761%0.61SS**THydrogen-bonded Turntrans-142.144.5-176.900000114.5A470A470-A472 PolarHBondContact O-N 2.89Å
473Q41.6Very low58.5Low168 Ų168101.4 Ų101.479%0.78560%0.6SS**  trans-158.4143.2153.3-82.7-47.6-60.600112.1
474P41.8Very low59Low112 Ų112101 Ų10173%0.72760%0.599SS**  trans-99.4105.6-174.135.7-26.4000112.5
475T48.8Very low59.4Low87 Ų87100.4 Ų100.453%0.53460%0.596SS.*  trans-126.958.9162.451.90000110A477 E478 L479T475-A477 PolarHBondContact O-N 3.36Å; T475-E478 PolarHBondContact O-N 3.39Å; T475-L479 PolarHBondContact O-N 2.89Å
476A53.7Low60Low73 Ų73102.5 Ų102.560%0.60360%0.601SS**Hα-helixtrans-60.1-26.1-177.900000114D480A476-D480 PolarHBondContact O-N 3.45Å; A476-D480 VanDerWaalsContact O-N 3.08Å
477A56.7Low61.3Low78 Ų78104 Ų10465%0.64560%0.6SS**Hα-helixtrans-80.4-29.3-177.500000114.2T475T475-A477 PolarHBondContact O-N 3.36Å
478E57.9Low62.4Low135 Ų135101.2 Ų101.263%0.63159%0.592SS**Hα-helixtrans-77.1-34.3172-69.7178.1167.700110.4T475 K481 L482T475-E478 PolarHBondContact O-N 3.39Å; E478-K481 PolarHBondContact O-N 3.13Å; E478-L482 PolarHBondContact O-N 3Å; E478-L482 VanDerWaalsContact O-N 3.1Å
479L63.7Low63.6Low114 Ų11499 Ų9960%0.59758%0.579SS**Hα-helixtrans-64.7-42.8175.8-149.379000112T475 K481 L482 V483T475-L479 PolarHBondContact O-N 2.89Å; L479-K481 PolarHBondContact O-N 2.89Å; L479-L482 PolarHBondContact O-N 2.91Å; L479-V483 WeakPolarHBondContact O-CB 3.34Å; L479-V483 WeakPolarHBondContact O-CG2 3.24Å; L479-V483 PolarHBondContact O-N 3.44Å
480D71.1Confident65.2Low105 Ų105100.6 Ų100.656%0.56158%0.578SS**Hα-helixtrans-63.9-39.2178.3-98.9-8.8000112.6A476 V483 D484A476-D480 PolarHBondContact O-N 3.45Å; A476-D480 VanDerWaalsContact O-N 3.08Å; D480-V483 PolarHBondContact O-N 2.83Å; D480-D484 PolarHBondContact O-N 3.32Å
481K73.2Confident67.2Low149 Ų149103.7 Ų103.765%0.64859%0.585SS**Hα-helixtrans-64.7-44.2174.1-78.3-174.7177.8-178.90112.3E478 L479 V483 D484 E485E478-K481 PolarHBondContact O-N 3.13Å; L479-K481 PolarHBondContact O-N 2.89Å; K481-V483 VanDerWaalsContact C-N 3.28Å; K481-V483 PolarHBondContact O-N 2.82Å; K481-D484 PolarHBondContact O-N 3.38Å; K481-E485 WeakPolarHBondContact O-CB 3.47Å; K481-E485 WeakPolarHBondContact O-CG 3.45Å; K481-E485 PolarHBondContact O-N 3.39Å
482L77.1Confident69.2Low96 Ų96103.9 Ų103.950%0.50357%0.569SS.*Hα-helixtrans-62.5-36.9175.4-106.6151.6000111.9E478 L479 L486E478-L482 PolarHBondContact O-N 3Å; E478-L482 VanDerWaalsContact O-N 3.1Å; L479-L482 PolarHBondContact O-N 2.91Å; L482-L486 VanDerWaalsContact O-CB 3.27Å; L482-L486 WeakPolarHBondContact O-CB 3.46Å; L482-L486 VanDerWaalsContact O-CG 3.29Å; L482-L486 WeakPolarHBondContact O-CG 3.39Å; L482-L486 PolarHBondContact O-N 3.25Å
483V79.9Confident71.3Confident49 Ų49102.4 Ų102.430%0.29756%0.557SS.*Hα-helixtrans-66.8-41.8175167.20000111L479 D480 K481 L486 R487L479-V483 WeakPolarHBondContact O-CB 3.34Å; L479-V483 WeakPolarHBondContact O-CG2 3.24Å; L479-V483 PolarHBondContact O-N 3.44Å; D480-V483 PolarHBondContact O-N 2.83Å; K481-V483 VanDerWaalsContact C-N 3.28Å; K481-V483 PolarHBondContact O-N 2.82Å; V483-L486 PolarHBondContact O-N 3.34Å; V483-R487 WeakPolarHBondContact O-CB 3.21Å; V483-R487 WeakPolarHBondContact O-CG 3.45Å; V483-R487 PolarHBondContact O-N 2.82Å
484D78.9Confident73.2Confident84 Ų8498.1 Ų98.145%0.44954%0.544SS..Hα-helixtrans-70.5-39.3177.1-76-18.9000112.3D480 K481 L486 R487 T488D480-D484 PolarHBondContact O-N 3.32Å; K481-D484 PolarHBondContact O-N 3.38Å; D484-L486 VanDerWaalsContact C-N 3.35Å; D484-R487 WeakPolarHBondContact O-CB 3.33Å; D484-R487 PolarHBondContact O-N 2.88Å; D484-R487 IonicContact OD1-CZ 3.18Å; D484-R487 IonicContact OD1-NH1 3.59Å; D484-R487 PolarHBondContact OD1-NH1 3.41Å; D484-T488 WeakPolarHBondContact O-CG2 3.25Å; D484-T488 PolarHBondContact O-N 2.97Å; D484-T488 PolarHBondContact O-OG1 3.49Å
485E79.1Confident75.4Confident125 Ų12595.9 Ų95.958%0.58453%0.532SS*.Hα-helixtrans-62.8-39.1171.2-75.7176-172.800112.1K481 T488 A489K481-E485 WeakPolarHBondContact O-CB 3.47Å; K481-E485 WeakPolarHBondContact O-CG 3.45Å; K481-E485 PolarHBondContact O-N 3.39Å; E485-T488 WeakPolarHBondContact CA-OG1 3.49Å; E485-T488 PolarHBondContact O-OG1 2.91Å; E485-A489 WeakPolarHBondContact O-CB 3.3Å; E485-A489 PolarHBondContact O-N 3.44Å
486L81.4Confident77.3Confident112 Ų11299.4 Ų99.459%0.58654%0.535SS*.Hα-helixtrans-67.5-36.9172.8-82.2166.9000111.9L482 V483 D484 N490L482-L486 VanDerWaalsContact O-CB 3.27Å; L482-L486 WeakPolarHBondContact O-CB 3.46Å; L482-L486 VanDerWaalsContact O-CG 3.29Å; L482-L486 WeakPolarHBondContact O-CG 3.39Å; L482-L486 PolarHBondContact O-N 3.25Å; V483-L486 PolarHBondContact O-N 3.34Å; D484-L486 VanDerWaalsContact C-N 3.35Å; L486-N490 WeakPolarHBondContact O-CB 3.5Å; L486-N490 PolarHBondContact O-N 2.99Å
487R83.7Confident78.9Confident157 Ų157100.4 Ų100.459%0.59253%0.53SS*.Hα-helixtrans-67.1-42.6175.8-77.1167.1176.2166.30.2111.5V483 D484 N490 L491V483-R487 WeakPolarHBondContact O-CB 3.21Å; V483-R487 WeakPolarHBondContact O-CG 3.45Å; V483-R487 PolarHBondContact O-N 2.82Å; D484-R487 WeakPolarHBondContact O-CB 3.33Å; D484-R487 PolarHBondContact O-N 2.88Å; D484-R487 IonicContact OD1-CZ 3.18Å; D484-R487 IonicContact OD1-NH1 3.59Å; D484-R487 PolarHBondContact OD1-NH1 3.41Å; R487-N490 PolarHBondContact O-N 3.3Å; R487-L491 VanDerWaalsContact O-CB 3.31Å; R487-L491 WeakPolarHBondContact O-CB 3.37Å; R487-L491 PolarHBondContact O-N 2.99Å
488T83.3Confident80.5Confident76 Ų7699.3 Ų99.347%0.46652%0.521SS..Hα-helixtrans-66.5-45.4175.554.80000110.7D484 E485 N490 L491 E492D484-T488 WeakPolarHBondContact O-CG2 3.25Å; D484-T488 PolarHBondContact O-N 2.97Å; D484-T488 PolarHBondContact O-OG1 3.49Å; E485-T488 WeakPolarHBondContact CA-OG1 3.49Å; E485-T488 PolarHBondContact O-OG1 2.91Å; T488-N490 VanDerWaalsContact C-N 3.31Å; T488-N490 PolarHBondContact O-N 2.83Å; T488-L491 PolarHBondContact O-N 3.24Å; T488-E492 WeakPolarHBondContact O-CB 3.32Å; T488-E492 WeakPolarHBondContact O-CG 3.3Å; T488-E492 PolarHBondContact O-N 3.3Å
489A82.6Confident82.1Confident51 Ų5196.9 Ų96.942%0.42152%0.516SS..Hα-helixtrans-60.1-39.817500000112.4E485 E492 A493E485-A489 WeakPolarHBondContact O-CB 3.3Å; E485-A489 PolarHBondContact O-N 3.44Å; A489-E492 PolarHBondContact O-N 3.36Å; A489-A493 VanDerWaalsContact O-CB 3.29Å; A489-A493 WeakPolarHBondContact O-CB 3.5Å; A489-A493 PolarHBondContact O-N 3.47Å
490N85.7Confident83.4Confident109 Ų10995.7 Ų95.758%0.58351%0.509SS*.Hα-helixtrans-70.2-37.5176.7-16942.6000112.1L486 R487 T488 A493 C494L486-N490 WeakPolarHBondContact O-CB 3.5Å; L486-N490 PolarHBondContact O-N 2.99Å; R487-N490 PolarHBondContact O-N 3.3Å; T488-N490 VanDerWaalsContact C-N 3.31Å; T488-N490 PolarHBondContact O-N 2.83Å; N490-A493 PolarHBondContact O-N 2.88Å; N490-C494 WeakPolarHBondContact O-CB 3.41Å; N490-C494 PolarHBondContact O-N 3.43Å
491L87.2Confident84.3Confident128 Ų12895.8 Ų95.867%0.6751%0.509SS*.Hα-helixtrans-65.7-42.9173.9-169.971.8000111R487 T488 C494 S495R487-L491 VanDerWaalsContact O-CB 3.31Å; R487-L491 WeakPolarHBondContact O-CB 3.37Å; R487-L491 PolarHBondContact O-N 2.99Å; T488-L491 PolarHBondContact O-N 3.24Å; L491-C494 PolarHBondContact O-N 2.89Å; L491-S495 WeakPolarHBondContact O-CB 3.29Å; L491-S495 PolarHBondContact O-N 2.87Å; L491-S495 PolarHBondContact O-OG 2.87Å
492E85.4Confident85.1Confident103 Ų10394.7 Ų94.748%0.48151%0.506SS..Hα-helixtrans-62-44.4173.9-75.2-178.7-162.300111.4T488 A489 S495 R496T488-E492 WeakPolarHBondContact O-CB 3.32Å; T488-E492 WeakPolarHBondContact O-CG 3.3Å; T488-E492 PolarHBondContact O-N 3.3Å; A489-E492 PolarHBondContact O-N 3.36Å; E492-S495 WeakPolarHBondContact CA-OG 3.49Å; E492-S495 PolarHBondContact O-N 3.33Å; E492-S495 PolarHBondContact O-OG 2.83Å; E492-R496 PolarHBondContact O-N 3.29Å; E492-R496 IonicContact OE2-NH1 2.78Å
493A84.7Confident85.8Confident40 Ų4094.3 Ų94.333%0.33150%0.502SS..Hα-helixtrans-62.8-43175.300000111.8A489 N490 S495 R496 N497A489-A493 VanDerWaalsContact O-CB 3.29Å; A489-A493 WeakPolarHBondContact O-CB 3.5Å; A489-A493 PolarHBondContact O-N 3.47Å; N490-A493 PolarHBondContact O-N 2.88Å; A493-S495 PolarHBondContact O-N 2.64Å; A493-R496 PolarHBondContact O-N 2.88Å; A493-N497 WeakPolarHBondContact O-CB 3.4Å; A493-N497 VanDerWaalsContact O-CG 3.25Å; A493-N497 PolarHBondContact O-N 3.42Å; A493-N497 PolarHBondContact O-ND2 3.3Å
494C82.3Confident86.3Confident77 Ų7796.1 Ų96.152%0.5251%0.509SS..Hα-helixtrans-60.7-43.3173.2-1080000111.9N490 L491 N497 A498N490-C494 WeakPolarHBondContact O-CB 3.41Å; N490-C494 PolarHBondContact O-N 3.43Å; L491-C494 PolarHBondContact O-N 2.89Å; C494-N497 PolarHBondContact O-N 3.28Å; C494-A498 WeakPolarHBondContact O-CB 3.37Å; C494-A498 PolarHBondContact O-N 2.94Å
495S86.4Confident86.9Confident66 Ų6696.8 Ų96.846%0.46251%0.512SS..Hα-helixtrans-66-39.8178.270.80000112.4L491 E492 A493 A498 V499L491-S495 WeakPolarHBondContact O-CB 3.29Å; L491-S495 PolarHBondContact O-N 2.87Å; L491-S495 PolarHBondContact O-OG 2.87Å; E492-S495 WeakPolarHBondContact CA-OG 3.49Å; E492-S495 PolarHBondContact O-N 3.33Å; E492-S495 PolarHBondContact O-OG 2.83Å; A493-S495 PolarHBondContact O-N 2.64Å; S495-A498 PolarHBondContact O-N 2.9Å; S495-V499 WeakPolarHBondContact O-CG2 3.49Å; S495-V499 PolarHBondContact O-N 3.47Å; S495-V499 VanDerWaalsContact O-N 3.07Å
496R88.5Confident87.4Confident161 Ų16196.3 Ų96.361%0.60851%0.51SS*.Hα-helixtrans-63.4-44.7172.4-81.5178.8164.3108.3-4.2111.8E492 A493 A498 V499 L500E492-R496 PolarHBondContact O-N 3.29Å; E492-R496 IonicContact OE2-NH1 2.78Å; A493-R496 PolarHBondContact O-N 2.88Å; R496-A498 VanDerWaalsContact C-N 3.32Å; R496-A498 PolarHBondContact O-N 3.36Å; R496-V499 PolarHBondContact O-N 3.41Å; R496-L500 WeakPolarHBondContact O-CB 3.5Å; R496-L500 WeakPolarHBondContact O-CG 3.49Å; R496-L500 PolarHBondContact O-N 2.97Å
497N87.3Confident87.9Confident94 Ų9497.5 Ų97.550%0.50351%0.511SS..Hα-helixtrans-63-38.5177-73.7-21.5000112A493 C494 L500 L501A493-N497 WeakPolarHBondContact O-CB 3.4Å; A493-N497 VanDerWaalsContact O-CG 3.25Å; A493-N497 PolarHBondContact O-N 3.42Å; A493-N497 PolarHBondContact O-ND2 3.3Å; C494-N497 PolarHBondContact O-N 3.28Å; N497-L500 PolarHBondContact O-N 3.46Å; N497-L501 WeakPolarHBondContact O-CB 3.33Å; N497-L501 VanDerWaalsContact O-CG 3.27Å; N497-L501 WeakPolarHBondContact O-CG 3.26Å; N497-L501 PolarHBondContact O-N 2.9Å
498A90.8Very high88.3Confident55 Ų5594.3 Ų94.346%0.45550%0.503SS..Hα-helixtrans-62.8-45.6175.200000111.8C494 S495 R496 L501 E502C494-A498 WeakPolarHBondContact O-CB 3.37Å; C494-A498 PolarHBondContact O-N 2.94Å; S495-A498 PolarHBondContact O-N 2.9Å; R496-A498 VanDerWaalsContact C-N 3.32Å; R496-A498 PolarHBondContact O-N 3.36Å; A498-L501 PolarHBondContact O-N 2.96Å; A498-E502 PolarHBondContact O-N 2.85Å
499V91.8Very high88.8Confident84 Ų8495.2 Ų95.251%0.50950%0.504SS..Hα-helixtrans-63.2-44.5176.1174.10000111.5S495 R496 L501 E502 E503S495-V499 WeakPolarHBondContact O-CG2 3.49Å; S495-V499 PolarHBondContact O-N 3.47Å; S495-V499 VanDerWaalsContact O-N 3.07Å; R496-V499 PolarHBondContact O-N 3.41Å; V499-L501 VanDerWaalsContact C-N 3.35Å; V499-L501 PolarHBondContact O-N 2.88Å; V499-E502 WeakPolarHBondContact O-CB 3.42Å; V499-E502 PolarHBondContact O-N 3.47Å; V499-E502 VanDerWaalsContact O-N 3.16Å; V499-E503 PolarHBondContact O-N 3.32Å
500L90.9Very high89.2Confident88 Ų8896.6 Ų96.646%0.46151%0.505SS..Hα-helixtrans-63.6-38.4177.8-72.7173.3000112.4R496 N497 E502 E503 I504R496-L500 WeakPolarHBondContact O-CB 3.5Å; R496-L500 WeakPolarHBondContact O-CG 3.49Å; R496-L500 PolarHBondContact O-N 2.97Å; N497-L500 PolarHBondContact O-N 3.46Å; L500-E502 VanDerWaalsContact C-N 3.31Å; L500-E503 PolarHBondContact O-N 3.33Å; L500-I504 WeakPolarHBondContact O-CB 3.36Å; L500-I504 VanDerWaalsContact O-CG1 3.23Å; L500-I504 WeakPolarHBondContact O-CG1 3.36Å; L500-I504 PolarHBondContact O-N 3.22Å
501L90.3Very high89.5Confident107 Ų10797 Ų9756%0.5651%0.506SS*.Hα-helixtrans-64.3-37.6173.9-76.1170.8000111.6N497 A498 V499 I504 N505N497-L501 WeakPolarHBondContact O-CB 3.33Å; N497-L501 VanDerWaalsContact O-CG 3.27Å; N497-L501 WeakPolarHBondContact O-CG 3.26Å; N497-L501 PolarHBondContact O-N 2.9Å; A498-L501 PolarHBondContact O-N 2.96Å; V499-L501 VanDerWaalsContact C-N 3.35Å; V499-L501 PolarHBondContact O-N 2.88Å; L501-I504 PolarHBondContact O-N 3.43Å; L501-N505 WeakPolarHBondContact O-CB 3.44Å; L501-N505 VanDerWaalsContact O-CG 3.27Å; L501-N505 PolarHBondContact O-N 2.89Å; L501-N505 PolarHBondContact O-ND2 3.04Å; L501-N505 VanDerWaalsContact O-ND2 3.13Å
502E89.6Confident89.8Confident127 Ų12797.8 Ų97.859%0.59350%0.504SS*.Hα-helixtrans-68.3-41.3175.8-162.9131.8-159.500111.7A498 V499 L500 N505 Q506A498-E502 PolarHBondContact O-N 2.85Å; V499-E502 WeakPolarHBondContact O-CB 3.42Å; V499-E502 PolarHBondContact O-N 3.47Å; V499-E502 VanDerWaalsContact O-N 3.16Å; L500-E502 VanDerWaalsContact C-N 3.31Å; E502-N505 PolarHBondContact O-N 3.41Å; E502-Q506 WeakPolarHBondContact O-CB 3.26Å; E502-Q506 VanDerWaalsContact O-CG 3.28Å; E502-Q506 WeakPolarHBondContact O-CG 3.28Å; E502-Q506 PolarHBondContact O-N 3.4Å
503E92Very high90.2Very high87 Ų8798 Ų9841%0.40750%0.503SS..Hα-helixtrans-62.8-40.8172.2-73.6-176.6-172.100112.6V499 L500 Q506 K507V499-E503 PolarHBondContact O-N 3.32Å; L500-E503 PolarHBondContact O-N 3.33Å; E503-Q506 PolarHBondContact O-N 3.41Å; E503-K507 WeakPolarHBondContact O-CB 3.27Å; E503-K507 WeakPolarHBondContact O-CG 3.45Å; E503-K507 PolarHBondContact O-N 3.2Å
504I91Very high90.4Very high87 Ų8799.9 Ų99.945%0.44651%0.511SS..Hα-helixtrans-64.1-48175.4-71.8166.2000109.9L500 L501 Q506 K507 E508L500-I504 WeakPolarHBondContact O-CB 3.36Å; L500-I504 VanDerWaalsContact O-CG1 3.23Å; L500-I504 WeakPolarHBondContact O-CG1 3.36Å; L500-I504 PolarHBondContact O-N 3.22Å; L501-I504 PolarHBondContact O-N 3.43Å; I504-Q506 VanDerWaalsContact C-N 3.3Å; I504-Q506 PolarHBondContact O-N 3.39Å; I504-K507 PolarHBondContact O-N 3.23Å; I504-E508 HydrophobicContact CG2-CG 4.34Å; I504-E508 WeakPolarHBondContact O-CB 3.45Å; I504-E508 WeakPolarHBondContact O-CG 3.36Å; I504-E508 PolarHBondContact O-N 2.9Å
505N90.3Very high91Very high98 Ų98102.4 Ų102.452%0.52451%0.513SS..Hα-helixtrans-60.8-39.2177.6-78.4-35.5000112.1L501 E502 L509L501-N505 WeakPolarHBondContact O-CB 3.44Å; L501-N505 VanDerWaalsContact O-CG 3.27Å; L501-N505 PolarHBondContact O-N 2.89Å; L501-N505 PolarHBondContact O-ND2 3.04Å; L501-N505 VanDerWaalsContact O-ND2 3.13Å; E502-N505 PolarHBondContact O-N 3.41Å; N505-L509 VanDerWaalsContact O-CB 3.24Å; N505-L509 WeakPolarHBondContact O-CB 3.45Å; N505-L509 PolarHBondContact O-N 2.87Å
506Q90.3Very high91.3Very high116 Ų116101.8 Ų101.854%0.54251%0.512SS..Hα-helixtrans-64.3-46.1173.9-75.2176.314.100111.5E502 E503 I504 E508 L509 D510E502-Q506 WeakPolarHBondContact O-CB 3.26Å; E502-Q506 VanDerWaalsContact O-CG 3.28Å; E502-Q506 WeakPolarHBondContact O-CG 3.28Å; E502-Q506 PolarHBondContact O-N 3.4Å; E503-Q506 PolarHBondContact O-N 3.41Å; I504-Q506 VanDerWaalsContact C-N 3.3Å; I504-Q506 PolarHBondContact O-N 3.39Å; Q506-E508 PolarHBondContact O-N 2.85Å; Q506-L509 PolarHBondContact O-N 3.23Å; Q506-D510 PolarHBondContact O-N 3.44Å
507K91.8Very high91.6Very high136 Ų136100.4 Ų100.459%0.59151%0.51SS*.Hα-helixtrans-63.5-38.9176.2-75.8174.7-179165.50112.7E503 I504 L509 D510 L511E503-K507 WeakPolarHBondContact O-CB 3.27Å; E503-K507 WeakPolarHBondContact O-CG 3.45Å; E503-K507 PolarHBondContact O-N 3.2Å; I504-K507 PolarHBondContact O-N 3.23Å; K507-L509 VanDerWaalsContact C-N 3.34Å; K507-D510 PolarHBondContact O-N 3.43Å; K507-L511 VanDerWaalsContact O-CB 3.32Å; K507-L511 WeakPolarHBondContact O-CB 3.46Å; K507-L511 WeakPolarHBondContact O-CG 3.01Å; K507-L511 PolarHBondContact O-N 3.47Å
508E92.9Very high91.8Very high91 Ų91100.5 Ų100.543%0.42551%0.51SS..Hα-helixtrans-64.6-39.8173.8-76.7-171.9-177.500111.9I504 Q506 L511 K512I504-E508 HydrophobicContact CG2-CG 4.34Å; I504-E508 WeakPolarHBondContact O-CB 3.45Å; I504-E508 WeakPolarHBondContact O-CG 3.36Å; I504-E508 PolarHBondContact O-N 2.9Å; Q506-E508 PolarHBondContact O-N 2.85Å; E508-L511 PolarHBondContact O-N 3.35Å; E508-K512 WeakPolarHBondContact O-CB 3.41Å; E508-K512 VanDerWaalsContact O-CG 3.26Å; E508-K512 WeakPolarHBondContact O-CG 3.25Å; E508-K512 PolarHBondContact O-N 2.97Å
509L92.6Very high91.9Very high94 Ų94103.1 Ų103.149%0.49251%0.513SS..Hα-helixtrans-67.7-39.4177-175.7135.5000111.1N505 Q506 K507 K512 K513N505-L509 VanDerWaalsContact O-CB 3.24Å; N505-L509 WeakPolarHBondContact O-CB 3.45Å; N505-L509 PolarHBondContact O-N 2.87Å; Q506-L509 PolarHBondContact O-N 3.23Å; K507-L509 VanDerWaalsContact C-N 3.34Å; L509-K512 PolarHBondContact O-N 3.47Å; L509-K513 HydrophobicContact CD2-CD 4.36Å; L509-K513 WeakPolarHBondContact O-CG 3.39Å; L509-K513 PolarHBondContact O-N 3.03Å
510D91.6Very high92Very high81 Ų81104.6 Ų104.643%0.43352%0.515SS..Hα-helixtrans-71-37.6174.6-69.9-23.9000112.6Q506 K507 K512 K513 T514Q506-D510 PolarHBondContact O-N 3.44Å; K507-D510 PolarHBondContact O-N 3.43Å; D510-K512 VanDerWaalsContact C-N 3.34Å; D510-K512 PolarHBondContact O-N 2.87Å; D510-K513 WeakPolarHBondContact O-CB 3.46Å; D510-K513 PolarHBondContact O-N 3.4Å; D510-K513 IonicContact OD1-NZ 3.46Å; D510-K513 PolarHBondContact OD1-NZ 3.35Å; D510-T514 WeakPolarHBondContact O-CG2 3.2Å; D510-T514 PolarHBondContact O-N 2.91Å; D510-T514 PolarHBondContact O-OG1 2.96Å
511L91.1Very high92Very high118 Ų118106.5 Ų106.562%0.61852%0.521SS*.Hα-helixtrans-61.4-40.1170.2-89.1166000112.2K507 E508 K513 T514 K515K507-L511 VanDerWaalsContact O-CB 3.32Å; K507-L511 WeakPolarHBondContact O-CB 3.46Å; K507-L511 WeakPolarHBondContact O-CG 3.01Å; K507-L511 PolarHBondContact O-N 3.47Å; E508-L511 PolarHBondContact O-N 3.35Å; L511-K513 VanDerWaalsContact C-N 3.34Å; L511-T514 WeakPolarHBondContact CA-OG1 3.32Å; L511-T514 PolarHBondContact O-N 2.84Å; L511-T514 PolarHBondContact O-OG1 3.47Å; L511-T514 VanDerWaalsContact O-OG1 3.04Å; L511-K515 VanDerWaalsContact O-CB 3.24Å; L511-K515 WeakPolarHBondContact O-CB 3.4Å; L511-K515 PolarHBondContact O-N 3.3Å
512K94.3Very high92Very high143 Ų143107 Ų10762%0.62252%0.521SS*.Hα-helixtrans-63.8-40.6173.7-76.5166.8-176.91620111.3E508 L509 D510 A516E508-K512 WeakPolarHBondContact O-CB 3.41Å; E508-K512 VanDerWaalsContact O-CG 3.26Å; E508-K512 WeakPolarHBondContact O-CG 3.25Å; E508-K512 PolarHBondContact O-N 2.97Å; L509-K512 PolarHBondContact O-N 3.47Å; D510-K512 VanDerWaalsContact C-N 3.34Å; D510-K512 PolarHBondContact O-N 2.87Å; K512-A516 WeakPolarHBondContact O-CB 3.42Å; K512-A516 PolarHBondContact O-N 2.94Å
513K93.3Very high92.1Very high107 Ų107103.9 Ų103.947%0.46552%0.517SS..Hα-helixtrans-64.5-44175.2-70.9173.3-166.5154.70112.3L509 D510 L511 A516 K517L509-K513 HydrophobicContact CD2-CD 4.36Å; L509-K513 WeakPolarHBondContact O-CG 3.39Å; L509-K513 PolarHBondContact O-N 3.03Å; D510-K513 WeakPolarHBondContact O-CB 3.46Å; D510-K513 PolarHBondContact O-N 3.4Å; D510-K513 IonicContact OD1-NZ 3.46Å; D510-K513 PolarHBondContact OD1-NZ 3.35Å; L511-K513 VanDerWaalsContact C-N 3.34Å; K513-A516 PolarHBondContact O-N 3.43Å; K513-K517 WeakPolarHBondContact O-CG 3.33Å; K513-K517 PolarHBondContact O-N 2.88Å; K513-K517 VanDerWaalsContact O-N 3.08Å
514T90.6Very high92.1Very high81 Ų81105 Ų10550%0.49752%0.522SS..Hα-helixtrans-69.8-37.6179.8560000111.6D510 L511 K517 L518D510-T514 WeakPolarHBondContact O-CG2 3.2Å; D510-T514 PolarHBondContact O-N 2.91Å; D510-T514 PolarHBondContact O-OG1 2.96Å; L511-T514 WeakPolarHBondContact CA-OG1 3.32Å; L511-T514 PolarHBondContact O-N 2.84Å; L511-T514 PolarHBondContact O-OG1 3.47Å; L511-T514 VanDerWaalsContact O-OG1 3.04Å; T514-K517 PolarHBondContact O-N 2.89Å; T514-L518 PolarHBondContact O-N 3.28Å
515K93.8Very high92.1Very high130 Ų130107.1 Ų107.157%0.56553%0.528SS*.Hα-helixtrans-62.3-45.2173.3-172.4177.5177.6-176.20112.1L511 K517 L518 E519L511-K515 VanDerWaalsContact O-CB 3.24Å; L511-K515 WeakPolarHBondContact O-CB 3.4Å; L511-K515 PolarHBondContact O-N 3.3Å; K515-K517 VanDerWaalsContact C-N 3.32Å; K515-K517 PolarHBondContact O-N 3.03Å; K515-L518 WeakPolarHBondContact O-CB 3.34Å; K515-L518 PolarHBondContact O-N 3.31Å; K515-L518 VanDerWaalsContact O-N 3.15Å; K515-E519 WeakPolarHBondContact CE-OE1 3.46Å; K515-E519 WeakPolarHBondContact O-CG 3.35Å; K515-E519 PolarHBondContact O-N 3.06Å
516A93.7Very high92.2Very high53 Ų53109.7 Ų109.744%0.43854%0.535SS..Hα-helixtrans-60.8-40175.700000112.3K512 K513 E519 E520K512-A516 WeakPolarHBondContact O-CB 3.42Å; K512-A516 PolarHBondContact O-N 2.94Å; K513-A516 PolarHBondContact O-N 3.43Å; A516-E519 PolarHBondContact O-N 3.3Å; A516-E520 WeakPolarHBondContact O-CB 3.37Å; A516-E520 PolarHBondContact O-N 2.94Å
517K94.2Very high92.3Very high132 Ų132106.8 Ų106.857%0.57453%0.527SS*.Hα-helixtrans-65.2-36.6174.1-72.3175.4180-174.60112.8K513 T514 K515 E520 Q521K513-K517 WeakPolarHBondContact O-CG 3.33Å; K513-K517 PolarHBondContact O-N 2.88Å; K513-K517 VanDerWaalsContact O-N 3.08Å; T514-K517 PolarHBondContact O-N 2.89Å; K515-K517 VanDerWaalsContact C-N 3.32Å; K515-K517 PolarHBondContact O-N 3.03Å; K517-E520 PolarHBondContact O-N 3.25Å; K517-Q521 WeakPolarHBondContact O-CG 3.37Å; K517-Q521 PolarHBondContact O-N 2.96Å
518L92Very high92.1Very high96 Ų96104.5 Ų104.550%0.50352%0.524SS..Hα-helixtrans-67-45176.9-172.770000110.9T514 K515 E520 Q521 E522T514-L518 PolarHBondContact O-N 3.28Å; K515-L518 WeakPolarHBondContact O-CB 3.34Å; K515-L518 PolarHBondContact O-N 3.31Å; K515-L518 VanDerWaalsContact O-N 3.15Å; L518-E520 VanDerWaalsContact C-N 3.29Å; L518-E520 PolarHBondContact O-N 2.88Å; L518-Q521 PolarHBondContact O-N 2.92Å; L518-E522 WeakPolarHBondContact O-CG 3.39Å; L518-E522 PolarHBondContact O-N 3.26Å
519E92.6Very high92.1Very high109 Ų109105 Ų10551%0.50953%0.527SS..Hα-helixtrans-61.5-36.9175.3-70.7173-174.100111.8K515 A516 A523K515-E519 WeakPolarHBondContact CE-OE1 3.46Å; K515-E519 WeakPolarHBondContact O-CG 3.35Å; K515-E519 PolarHBondContact O-N 3.06Å; A516-E519 PolarHBondContact O-N 3.3Å; E519-A523 WeakPolarHBondContact O-CB 3.34Å; E519-A523 PolarHBondContact O-N 3.5Å
520E93.3Very high91.9Very high116 Ų116103 Ų10354%0.54252%0.524SS..Hα-helixtrans-62.9-48.3172.2-175.2175.5-160.100111.7A516 K517 L518 E522 A523 E524A516-E520 WeakPolarHBondContact O-CB 3.37Å; A516-E520 PolarHBondContact O-N 2.94Å; K517-E520 PolarHBondContact O-N 3.25Å; L518-E520 VanDerWaalsContact C-N 3.29Å; L518-E520 PolarHBondContact O-N 2.88Å; E520-E522 VanDerWaalsContact C-N 3.34Å; E520-E522 PolarHBondContact O-N 2.8Å; E520-A523 PolarHBondContact O-N 2.9Å; E520-E524 WeakPolarHBondContact O-CG 3.41Å; E520-E524 PolarHBondContact O-N 3.37Å
521Q90Very high92Very high127 Ų127105.1 Ų105.159%0.59353%0.532SS*.Hα-helixtrans-64.8-34.3177.3-72.8-162.7-38.300113.3K517 L518 K525K517-Q521 WeakPolarHBondContact O-CG 3.37Å; K517-Q521 PolarHBondContact O-N 2.96Å; L518-Q521 PolarHBondContact O-N 2.92Å; Q521-K525 VanDerWaalsContact O-CB 3.28Å; Q521-K525 WeakPolarHBondContact O-CB 3.42Å; Q521-K525 PolarHBondContact O-N 2.91Å
522E92Very high91.8Very high118 Ų118104.9 Ų104.955%0.55153%0.53SS*.Hα-helixtrans-68.5-40.2174.5-74.4179.6174.600111.9L518 E520 K525 F526L518-E522 WeakPolarHBondContact O-CG 3.39Å; L518-E522 PolarHBondContact O-N 3.26Å; E520-E522 VanDerWaalsContact C-N 3.34Å; E520-E522 PolarHBondContact O-N 2.8Å; E522-K525 PolarHBondContact O-N 3.43Å; E522-F526 WeakPolarHBondContact O-CB 3.42Å; E522-F526 PolarHBondContact O-N 3.24Å
523A90.8Very high91.7Very high62 Ų62102 Ų10251%0.51253%0.528SS..Hα-helixtrans-66.5-40.1174.500000112.1E519 E520 F526 S527E519-A523 WeakPolarHBondContact O-CB 3.34Å; E519-A523 PolarHBondContact O-N 3.5Å; E520-A523 PolarHBondContact O-N 2.9Å; A523-F526 PolarHBondContact O-N 2.99Å; A523-S527 WeakPolarHBondContact O-CB 3.22Å; A523-S527 PolarHBondContact O-N 3.42Å
524E92.5Very high91.7Very high111 Ų11199.2 Ų99.252%0.51952%0.521SS..Hα-helixtrans-62.9-46.4173.2-75-178.4169.800111.5E520 F526 S527 V528E520-E524 WeakPolarHBondContact O-CG 3.41Å; E520-E524 PolarHBondContact O-N 3.37Å; E524-F526 VanDerWaalsContact C-N 3.35Å; E524-F526 PolarHBondContact O-N 3.48Å; E524-S527 WeakPolarHBondContact O-CB 3.35Å; E524-S527 PolarHBondContact O-N 3.38Å; E524-V528 WeakPolarHBondContact O-CG2 3.46Å; E524-V528 PolarHBondContact O-N 3.31Å
525K90.5Very high91.6Very high130 Ų13097.8 Ų97.857%0.56552%0.518SS*.Hα-helixtrans-57.2-47.7175.1179.6-176.1167.2-174.10111.2Q521 E522 S527 V528 E529Q521-K525 VanDerWaalsContact O-CB 3.28Å; Q521-K525 WeakPolarHBondContact O-CB 3.42Å; Q521-K525 PolarHBondContact O-N 2.91Å; E522-K525 PolarHBondContact O-N 3.43Å; K525-S527 VanDerWaalsContact C-N 3.32Å; K525-S527 PolarHBondContact O-N 3.35Å; K525-V528 PolarHBondContact O-N 2.91Å; K525-E529 WeakPolarHBondContact CE-OE1 3.28Å; K525-E529 HydrophobicContact CG-CG 4.45Å; K525-E529 IonicContact NZ-OE1 3.7Å; K525-E529 WeakPolarHBondContact O-CB 3.48Å; K525-E529 WeakPolarHBondContact O-CG 3.17Å; K525-E529 PolarHBondContact O-N 2.87Å
526F91.7Very high91.5Very high152 Ų15295 Ų9567%0.66751%0.511SS*.Hα-helixtrans-61.9-40.1177.8-172.7-95.3000112.1E522 A523 E524 A530E522-F526 WeakPolarHBondContact O-CB 3.42Å; E522-F526 PolarHBondContact O-N 3.24Å; A523-F526 PolarHBondContact O-N 2.99Å; E524-F526 VanDerWaalsContact C-N 3.35Å; E524-F526 PolarHBondContact O-N 3.48Å; F526-A530 WeakPolarHBondContact O-CB 3.48Å; F526-A530 PolarHBondContact O-N 2.89Å
527S92.7Very high91.4Very high56 Ų5698.3 Ų98.339%0.39251%0.513SS..Hα-helixtrans-63.1-44.9174.6179.10000112A523 E524 K525 A530 Q531A523-S527 WeakPolarHBondContact O-CB 3.22Å; A523-S527 PolarHBondContact O-N 3.42Å; E524-S527 WeakPolarHBondContact O-CB 3.35Å; E524-S527 PolarHBondContact O-N 3.38Å; K525-S527 VanDerWaalsContact C-N 3.32Å; K525-S527 PolarHBondContact O-N 3.35Å; S527-A530 PolarHBondContact O-N 3.46Å; S527-Q531 VanDerWaalsContact O-CG 3.28Å; S527-Q531 WeakPolarHBondContact O-CG 3.4Å; S527-Q531 PolarHBondContact O-N 2.97Å; S527-Q531 PolarHBondContact OG-NE2 3.26Å
528V88.5Confident91.2Very high87 Ų8797.2 Ų97.253%0.52751%0.51SS..Hα-helixtrans-67.2-40.2178.6172.70000111.3E524 K525 A530 Q531 L532E524-V528 WeakPolarHBondContact O-CG2 3.46Å; E524-V528 PolarHBondContact O-N 3.31Å; K525-V528 PolarHBondContact O-N 2.91Å; V528-A530 PolarHBondContact O-N 3.14Å; V528-Q531 PolarHBondContact O-N 3.38Å; V528-L532 WeakPolarHBondContact O-CB 3.49Å; V528-L532 PolarHBondContact O-N 3.42Å
529E92.4Very high91.2Very high101 Ų10198 Ų9847%0.47251%0.511SS..Hα-helixtrans-62.9-40.4174.7-75.7175.9173.400111.9K525 L532 S533K525-E529 WeakPolarHBondContact CE-OE1 3.28Å; K525-E529 HydrophobicContact CG-CG 4.45Å; K525-E529 IonicContact NZ-OE1 3.7Å; K525-E529 WeakPolarHBondContact O-CB 3.48Å; K525-E529 WeakPolarHBondContact O-CG 3.17Å; K525-E529 PolarHBondContact O-N 2.87Å; E529-L532 PolarHBondContact O-N 3.02Å; E529-S533 WeakPolarHBondContact O-CB 3.33Å; E529-S533 PolarHBondContact O-N 3.43Å
530A89.5Confident91.2Very high54 Ų5496.7 Ų96.745%0.44651%0.507SS..Hα-helixtrans-65.8-41.5174.500000112.2F526 S527 V528 S533 C534F526-A530 WeakPolarHBondContact O-CB 3.48Å; F526-A530 PolarHBondContact O-N 2.89Å; S527-A530 PolarHBondContact O-N 3.46Å; V528-A530 PolarHBondContact O-N 3.14Å; A530-S533 PolarHBondContact O-N 2.9Å; A530-C534 PolarHBondContact O-N 2.98Å
531Q91.8Very high91.1Very high125 Ų12595.5 Ų95.558%0.58450%0.502SS*.Hα-helixtrans-63.3-42.7174.3-72.5172.415.900111.5S527 V528 C534 A535S527-Q531 VanDerWaalsContact O-CG 3.28Å; S527-Q531 WeakPolarHBondContact O-CG 3.4Å; S527-Q531 PolarHBondContact O-N 2.97Å; S527-Q531 PolarHBondContact OG-NE2 3.26Å; V528-Q531 PolarHBondContact O-N 3.38Å; Q531-C534 PolarHBondContact O-N 3.3Å; Q531-A535 WeakPolarHBondContact O-CB 3.31Å; Q531-A535 PolarHBondContact O-N 2.8Å
532L88.5Confident91.1Very high113 Ų11392 Ų9259%0.59250%0.495SS*.Hα-helixtrans-61.9-44.2175.5-174.669.7000111.1V528 E529 C534 A535 V536V528-L532 WeakPolarHBondContact O-CB 3.49Å; V528-L532 PolarHBondContact O-N 3.42Å; E529-L532 PolarHBondContact O-N 3.02Å; L532-C534 VanDerWaalsContact C-N 3.35Å; L532-C534 PolarHBondContact O-N 2.8Å; L532-A535 PolarHBondContact O-N 3.28Å; L532-V536 HydrophobicContact CG-CG2 4.47Å; L532-V536 WeakPolarHBondContact O-CB 3.37Å; L532-V536 WeakPolarHBondContact O-CG2 3.42Å; L532-V536 PolarHBondContact O-N 3.41Å
533S91.4Very high91.1Very high81 Ų8190.1 Ų90.157%0.56649%0.489SS*.Hα-helixtrans-61.8-41.6176.1-173.40000112.3E529 A530 R537E529-S533 WeakPolarHBondContact O-CB 3.33Å; E529-S533 PolarHBondContact O-N 3.43Å; A530-S533 PolarHBondContact O-N 2.9Å; S533-R537 PolarHBondContact O-N 2.71Å
534C93Very high91.2Very high49 Ų4992.4 Ų92.433%0.33149%0.489SS..Hα-helixtrans-64.6-46.5175.7-162.90000111.8A530 Q531 L532 V536 R537 E538A530-C534 PolarHBondContact O-N 2.98Å; Q531-C534 PolarHBondContact O-N 3.3Å; L532-C534 VanDerWaalsContact C-N 3.35Å; L532-C534 PolarHBondContact O-N 2.8Å; C534-V536 PolarHBondContact O-N 2.92Å; C534-R537 WeakPolarHBondContact O-CB 3.13Å; C534-R537 PolarHBondContact O-N 3.29Å; C534-R537 PolarHBondContact SG-NH2 2.98Å; C534-R537 VanDerWaalsContact SG-NH2 3.4Å; C534-E538 WeakPolarHBondContact O-CG 3.4Å; C534-E538 PolarHBondContact O-N 2.99Å; C534-E538 PolarHBondContact SG-OE1 3.1Å; C534-E538 VanDerWaalsContact SG-OE1 3.41Å
535A88Confident91.1Very high51 Ų5192.8 Ų92.842%0.42149%0.49SS..Hα-helixtrans-62.9-39.6177.900000112.3Q531 L532 E538 H539Q531-A535 WeakPolarHBondContact O-CB 3.31Å; Q531-A535 PolarHBondContact O-N 2.8Å; L532-A535 PolarHBondContact O-N 3.28Å; A535-E538 PolarHBondContact O-N 3.47Å; A535-H539 WeakPolarHBondContact O-CB 3.34Å; A535-H539 PolarHBondContact O-N 3.02Å
536V93.1Very high91Very high71 Ų7190 Ų9043%0.4349%0.487SS..Hα-helixtrans-63.7-42.6174.7167.80000111L532 C534 H539 N540L532-V536 HydrophobicContact CG-CG2 4.47Å; L532-V536 WeakPolarHBondContact O-CB 3.37Å; L532-V536 WeakPolarHBondContact O-CG2 3.42Å; L532-V536 PolarHBondContact O-N 3.41Å; C534-V536 PolarHBondContact O-N 2.92Å; V536-H539 PolarHBondContact O-N 3.47Å; V536-N540 WeakPolarHBondContact O-CB 3.26Å; V536-N540 PolarHBondContact O-N 2.92Å; V536-N540 PolarHBondContact O-ND2 3.4Å
537R91.1Very high91Very high124 Ų12488.3 Ų88.347%0.46848%0.482SS..Hα-helixtrans-62-44.7176.1-176.5-176.458.671.18.4111.4S533 C534 N540 M541S533-R537 PolarHBondContact O-N 2.71Å; C534-R537 WeakPolarHBondContact O-CB 3.13Å; C534-R537 PolarHBondContact O-N 3.29Å; C534-R537 PolarHBondContact SG-NH2 2.98Å; C534-R537 VanDerWaalsContact SG-NH2 3.4Å; R537-N540 PolarHBondContact O-N 3.37Å; R537-M541 HydrophobicContact CG-SD 4.45Å; R537-M541 PolarHBondContact NH1-SD 3.18Å; R537-M541 VanDerWaalsContact NH1-SD 3.42Å; R537-M541 WeakPolarHBondContact O-CG 3.47Å; R537-M541 PolarHBondContact O-N 2.9Å
538E90.2Very high91.1Very high109 Ų10992.1 Ų92.151%0.50949%0.491SS..Hα-helixtrans-64.5-43.1177.5-73.8169.8-16700112C534 A535 N540 M541 A542C534-E538 WeakPolarHBondContact O-CG 3.4Å; C534-E538 PolarHBondContact O-N 2.99Å; C534-E538 PolarHBondContact SG-OE1 3.1Å; C534-E538 VanDerWaalsContact SG-OE1 3.41Å; A535-E538 PolarHBondContact O-N 3.47Å; E538-N540 VanDerWaalsContact C-N 3.35Å; E538-N540 PolarHBondContact O-N 3.34Å; E538-M541 PolarHBondContact O-N 3.43Å; E538-A542 WeakPolarHBondContact O-CB 3.35Å; E538-A542 PolarHBondContact O-N 3.49Å
539H91.2Very high91.1Very high113 Ų11393.5 Ų93.552%0.52350%0.495SS..Hα-helixtrans-59.6-44173.5178.8-92.3000111.9A535 V536 M541 A542 L543A535-H539 WeakPolarHBondContact O-CB 3.34Å; A535-H539 PolarHBondContact O-N 3.02Å; V536-H539 PolarHBondContact O-N 3.47Å; H539-M541 PolarHBondContact O-N 3.31Å; H539-A542 PolarHBondContact O-N 2.8Å; H539-L543 WeakPolarHBondContact CE1-CD1 3.42Å; H539-L543 WeakPolarHBondContact O-CG 3.36Å; H539-L543 PolarHBondContact O-N 3.44Å
540N93.2Very high91.2Very high80 Ų8097.5 Ų97.543%0.42851%0.506SS..Hα-helixtrans-65.3-37.8177.2-70.7-19.4000112.3V536 R537 E538 L543 Q544V536-N540 WeakPolarHBondContact O-CB 3.26Å; V536-N540 PolarHBondContact O-N 2.92Å; V536-N540 PolarHBondContact O-ND2 3.4Å; R537-N540 PolarHBondContact O-N 3.37Å; E538-N540 VanDerWaalsContact C-N 3.35Å; E538-N540 PolarHBondContact O-N 3.34Å; N540-L543 PolarHBondContact O-N 2.9Å; N540-Q544 WeakPolarHBondContact O-CG 3.46Å; N540-Q544 PolarHBondContact O-N 3.31Å
541M91.6Very high91.3Very high92 Ų9299.3 Ų99.345%0.45351%0.508SS..Hα-helixtrans-64.8-44.2173.4-71.5178.865.300111.5R537 E538 H539 L543 Q544 E545R537-M541 HydrophobicContact CG-SD 4.45Å; R537-M541 PolarHBondContact NH1-SD 3.18Å; R537-M541 VanDerWaalsContact NH1-SD 3.42Å; R537-M541 WeakPolarHBondContact O-CG 3.47Å; R537-M541 PolarHBondContact O-N 2.9Å; E538-M541 PolarHBondContact O-N 3.43Å; H539-M541 PolarHBondContact O-N 3.31Å; M541-L543 VanDerWaalsContact C-N 3.34Å; M541-L543 PolarHBondContact O-N 3.11Å; M541-Q544 PolarHBondContact O-N 3.46Å; M541-E545 PolarHBondContact O-N 2.95Å
542A89.8Confident91.4Very high54 Ų5495.8 Ų95.845%0.44650%0.5SS..Hα-helixtrans-64-37.4176.700000112.3E538 H539 E545 S546E538-A542 WeakPolarHBondContact O-CB 3.35Å; E538-A542 PolarHBondContact O-N 3.49Å; H539-A542 PolarHBondContact O-N 2.8Å; A542-E545 PolarHBondContact O-N 2.97Å; A542-S546 VanDerWaalsContact O-CB 3.32Å; A542-S546 WeakPolarHBondContact O-CB 3.5Å; A542-S546 PolarHBondContact O-N 3.26Å
543L91.5Very high91.5Very high78 Ų7895.6 Ų95.641%0.40850%0.499SS..Hα-helixtrans-63.2-44.9172.7-77.7-179.3000111.8H539 N540 M541 E545 S546 E547H539-L543 WeakPolarHBondContact CE1-CD1 3.42Å; H539-L543 WeakPolarHBondContact O-CG 3.36Å; H539-L543 PolarHBondContact O-N 3.44Å; N540-L543 PolarHBondContact O-N 2.9Å; M541-L543 VanDerWaalsContact C-N 3.34Å; M541-L543 PolarHBondContact O-N 3.11Å; L543-E545 VanDerWaalsContact C-N 3.32Å; L543-E545 PolarHBondContact O-N 3.25Å; L543-S546 WeakPolarHBondContact O-CB 3.22Å; L543-S546 PolarHBondContact O-N 3.48Å; L543-E547 WeakPolarHBondContact O-CB 3.4Å; L543-E547 WeakPolarHBondContact O-CG 3.34Å; L543-E547 PolarHBondContact O-N 3.05Å
544Q92.8Very high91.6Very high110 Ų11097.1 Ų97.151%0.51450%0.497SS..Hα-helixtrans-63.2-37.5176.4-73.4179.5-0.700112.4N540 M541 K548N540-Q544 WeakPolarHBondContact O-CG 3.46Å; N540-Q544 PolarHBondContact O-N 3.31Å; M541-Q544 PolarHBondContact O-N 3.46Å; Q544-K548 WeakPolarHBondContact O-CG 3.45Å; Q544-K548 PolarHBondContact O-N 3.41Å
545E91.4Very high91.6Very high118 Ų11899.2 Ų99.255%0.55151%0.509SS*.Hα-helixtrans-67.2-42.7173.4-75.2-178.8176.200111.9M541 A542 L543 E547 K548 L549M541-E545 PolarHBondContact O-N 2.95Å; A542-E545 PolarHBondContact O-N 2.97Å; L543-E545 VanDerWaalsContact C-N 3.32Å; L543-E545 PolarHBondContact O-N 3.25Å; E545-E547 VanDerWaalsContact C-N 3.34Å; E545-E547 PolarHBondContact O-N 3.47Å; E545-K548 PolarHBondContact O-N 3.43Å; E545-L549 WeakPolarHBondContact O-CG 3.22Å; E545-L549 PolarHBondContact O-N 3.06Å
546S87.2Confident91.7Very high72 Ų7298.9 Ų98.950%0.50351%0.506SS..Hα-helixtrans-60.1-42.3174.1-173.30000111.9A542 L543 L549 R550A542-S546 VanDerWaalsContact O-CB 3.32Å; A542-S546 WeakPolarHBondContact O-CB 3.5Å; A542-S546 PolarHBondContact O-N 3.26Å; L543-S546 WeakPolarHBondContact O-CB 3.22Å; L543-S546 PolarHBondContact O-N 3.48Å; S546-L549 PolarHBondContact O-N 2.95Å; S546-R550 WeakPolarHBondContact O-CB 3.49Å; S546-R550 PolarHBondContact O-N 3.28Å
547E92.2Very high91.6Very high117 Ų11799.6 Ų99.655%0.54751%0.507SS..Hα-helixtrans-63.9-42.6174.2-76.4178.217500112.2L543 E545 R550 N551L543-E547 WeakPolarHBondContact O-CB 3.4Å; L543-E547 WeakPolarHBondContact O-CG 3.34Å; L543-E547 PolarHBondContact O-N 3.05Å; E545-E547 VanDerWaalsContact C-N 3.34Å; E545-E547 PolarHBondContact O-N 3.47Å; E547-R550 PolarHBondContact O-N 3.47Å; E547-N551 WeakPolarHBondContact O-CB 3.28Å; E547-N551 PolarHBondContact O-N 3.23Å; E547-N551 PolarHBondContact O-ND2 2.86Å
548K94.2Very high91.8Very high136 Ų13697.7 Ų97.759%0.59151%0.507SS*.Hα-helixtrans-61.5-44.1174.7-73.5167.5-172.4172.40111.7Q544 E545 N551 A552Q544-K548 WeakPolarHBondContact O-CG 3.45Å; Q544-K548 PolarHBondContact O-N 3.41Å; E545-K548 PolarHBondContact O-N 3.43Å; K548-N551 PolarHBondContact O-N 2.85Å; K548-A552 WeakPolarHBondContact O-CB 3.38Å; K548-A552 PolarHBondContact O-N 3.29Å
549L90.2Very high91.9Very high116 Ų11696.9 Ų96.961%0.60750%0.503SS*.Hα-helixtrans-65.3-39.5176.5-71.1174.5000111.6E545 S546 A552 L553E545-L549 WeakPolarHBondContact O-CG 3.22Å; E545-L549 PolarHBondContact O-N 3.06Å; S546-L549 PolarHBondContact O-N 2.95Å; L549-A552 PolarHBondContact O-N 3.24Å; L549-L553 WeakPolarHBondContact O-CB 3.48Å; L549-L553 WeakPolarHBondContact O-CG 3.32Å; L549-L553 PolarHBondContact O-N 3.3Å
550R92.7Very high92Very high184 Ų18496.4 Ų96.469%0.69450%0.503SS*.Hα-helixtrans-62.5-43.2175-173-178.317788.93.3111.8S546 E547 L553 Q554S546-R550 WeakPolarHBondContact O-CB 3.49Å; S546-R550 PolarHBondContact O-N 3.28Å; E547-R550 PolarHBondContact O-N 3.47Å; R550-L553 PolarHBondContact O-N 3.5Å; R550-Q554 WeakPolarHBondContact O-CB 3.45Å; R550-Q554 PolarHBondContact O-N 3.36Å
551N92.4Very high91.9Very high92 Ų9298.5 Ų98.549%0.49251%0.511SS..Hα-helixtrans-66.4-41176.3-67.9-21000111.4E547 K548 Q554 T555E547-N551 WeakPolarHBondContact O-CB 3.28Å; E547-N551 PolarHBondContact O-N 3.23Å; E547-N551 PolarHBondContact O-ND2 2.86Å; K548-N551 PolarHBondContact O-N 2.85Å; N551-Q554 PolarHBondContact O-N 3.36Å; N551-T555 WeakPolarHBondContact O-CG2 3.49Å; N551-T555 PolarHBondContact O-N 2.94Å; N551-T555 PolarHBondContact O-OG1 3.46Å
552A93.7Very high92.1Very high52 Ų5299 Ų9943%0.4351%0.507SS..Hα-helixtrans-63.5-43175.700000112K548 L549 T555 A556K548-A552 WeakPolarHBondContact O-CB 3.38Å; K548-A552 PolarHBondContact O-N 3.29Å; L549-A552 PolarHBondContact O-N 3.24Å; A552-T555 WeakPolarHBondContact CA-OG1 3.48Å; A552-T555 PolarHBondContact O-N 2.98Å; A552-T555 PolarHBondContact O-OG1 3.27Å; A552-A556 PolarHBondContact O-N 3.45Å
553L89.9Confident92.2Very high109 Ų10999.1 Ų99.157%0.57150%0.502SS*.Hα-helixtrans-59.9-46.4173.3-78.5168.8000111.2L549 R550 T555 A556 D557L549-L553 WeakPolarHBondContact O-CB 3.48Å; L549-L553 WeakPolarHBondContact O-CG 3.32Å; L549-L553 PolarHBondContact O-N 3.3Å; R550-L553 PolarHBondContact O-N 3.5Å; L553-T555 VanDerWaalsContact C-N 3.31Å; L553-T555 PolarHBondContact O-N 2.82Å; L553-A556 PolarHBondContact O-N 3.2Å; L553-A556 VanDerWaalsContact O-N 3.09Å; L553-D557 PolarHBondContact O-N 2.95Å
554Q94.8Very high92.3Very high112 Ų11298.4 Ų98.452%0.52350%0.501SS..Hα-helixtrans-59.8-40.4176.7-172.917716.100112.4R550 N551 D557 N558R550-Q554 WeakPolarHBondContact O-CB 3.45Å; R550-Q554 PolarHBondContact O-N 3.36Å; N551-Q554 PolarHBondContact O-N 3.36Å; Q554-D557 PolarHBondContact O-N 3.1Å; Q554-N558 WeakPolarHBondContact O-CB 3.33Å; Q554-N558 PolarHBondContact O-N 2.87Å; Q554-N558 PolarHBondContact O-ND2 2.83Å
555T92.7Very high92.4Very high93 Ų9396.7 Ų96.757%0.57150%0.5SS*.Hα-helixtrans-67.1-35.9175.2560000112.8N551 A552 L553 E559N551-T555 WeakPolarHBondContact O-CG2 3.49Å; N551-T555 PolarHBondContact O-N 2.94Å; N551-T555 PolarHBondContact O-OG1 3.46Å; A552-T555 WeakPolarHBondContact CA-OG1 3.48Å; A552-T555 PolarHBondContact O-N 2.98Å; A552-T555 PolarHBondContact O-OG1 3.27Å; L553-T555 VanDerWaalsContact C-N 3.31Å; L553-T555 PolarHBondContact O-N 2.82Å; T555-E559 WeakPolarHBondContact O-CB 3.42Å; T555-E559 PolarHBondContact O-N 3.43Å; T555-E559 VanDerWaalsContact O-N 3.11Å
556A89.1Confident92.5Very high45 Ų4594.6 Ų94.637%0.37249%0.491SS..Hα-helixtrans-69.3-41.5176.300000111.4A552 L553 E559 I560A552-A556 PolarHBondContact O-N 3.45Å; L553-A556 PolarHBondContact O-N 3.2Å; L553-A556 VanDerWaalsContact O-N 3.09Å; A556-E559 PolarHBondContact O-N 3.2Å; A556-I560 VanDerWaalsContact O-CG1 3.28Å; A556-I560 WeakPolarHBondContact O-CG1 3.04Å; A556-I560 PolarHBondContact O-N 3.01Å
557D92.7Very high92.6Very high85 Ų8597.3 Ų97.346%0.45550%0.497SS..Hα-helixtrans-61.9-44.8175.7-70.4-28.8000111.1L553 Q554 E559 I560 E561L553-D557 PolarHBondContact O-N 2.95Å; Q554-D557 PolarHBondContact O-N 3.1Å; D557-E559 VanDerWaalsContact C-N 3.29Å; D557-E559 PolarHBondContact O-N 2.83Å; D557-I560 PolarHBondContact O-N 2.9Å; D557-E561 WeakPolarHBondContact O-CG 3.19Å; D557-E561 PolarHBondContact O-N 2.97Å
558N93.5Very high92.6Very high85 Ų8596.2 Ų96.246%0.45549%0.492SS..Hα-helixtrans-60.1-38.5174.9-68.4-23.5000112.4Q554 E561 R562Q554-N558 WeakPolarHBondContact O-CB 3.33Å; Q554-N558 PolarHBondContact O-N 2.87Å; Q554-N558 PolarHBondContact O-ND2 2.83Å; N558-E561 PolarHBondContact O-N 2.92Å; N558-R562 WeakPolarHBondContact O-CB 3.49Å; N558-R562 PolarHBondContact O-N 2.99Å
559E93.1Very high92.6Very high92 Ų9298.3 Ų98.343%0.4350%0.496SS..Hα-helixtrans-71-38177.9-178.163.3-17500111.8T555 A556 D557 R562 V563T555-E559 WeakPolarHBondContact O-CB 3.42Å; T555-E559 PolarHBondContact O-N 3.43Å; T555-E559 VanDerWaalsContact O-N 3.11Å; A556-E559 PolarHBondContact O-N 3.2Å; D557-E559 VanDerWaalsContact C-N 3.29Å; D557-E559 PolarHBondContact O-N 2.83Å; E559-R562 PolarHBondContact O-N 3.46Å; E559-R562 IonicContact OE1-CZ 2.82Å; E559-R562 IonicContact OE1-NE 3.08Å; E559-R562 PolarHBondContact OE1-NE 2.63Å; E559-R562 IonicContact OE1-NH2 2.89Å; E559-R562 PolarHBondContact OE1-NH2 2.93Å; E559-R562 IonicContact OE2-CZ 2.74Å; E559-R562 IonicContact OE2-NE 3.4Å; E559-R562 PolarHBondContact OE2-NE 3.27Å; E559-R562 IonicContact OE2-NH2 3.75Å; E559-V563 WeakPolarHBondContact O-CG2 3.48Å; E559-V563 PolarHBondContact O-N 3.42Å
560I92.3Very high92.6Very high102 Ų10299.9 Ų99.952%0.52350%0.495SS..Hα-helixtrans-62.3-45.2172.4-70.1165.9000110.2A556 D557 R562 V563 T564A556-I560 VanDerWaalsContact O-CG1 3.28Å; A556-I560 WeakPolarHBondContact O-CG1 3.04Å; A556-I560 PolarHBondContact O-N 3.01Å; D557-I560 PolarHBondContact O-N 2.9Å; I560-R562 VanDerWaalsContact C-N 3.35Å; I560-R562 PolarHBondContact O-N 2.83Å; I560-V563 PolarHBondContact O-N 2.94Å; I560-T564 VanDerWaalsContact O-CB 3.3Å; I560-T564 WeakPolarHBondContact O-CB 3.44Å; I560-T564 PolarHBondContact O-N 2.83Å; I560-T564 PolarHBondContact O-OG1 3.47Å
561E92.9Very high92.5Very high125 Ų12597.5 Ų97.558%0.58449%0.492SS*.Hα-helixtrans-61.3-41.9175.9-73.8-179.5-177.700111.9D557 N558 T564 C565D557-E561 WeakPolarHBondContact O-CG 3.19Å; D557-E561 PolarHBondContact O-N 2.97Å; N558-E561 PolarHBondContact O-N 2.92Å; E561-T564 PolarHBondContact O-N 2.89Å; E561-C565 WeakPolarHBondContact O-CB 3.44Å; E561-C565 PolarHBondContact O-N 3.37Å; E561-C565 PolarHBondContact O-SG 3.24Å; E561-C565 VanDerWaalsContact O-SG 3.33Å
562R95Very high92.5Very high102 Ų10299 Ų9939%0.38549%0.494SS..Hα-helixtrans-60.5-50.7175.8-171.4-167.668696.7111.8N558 E559 I560 T564 C565 E566N558-R562 WeakPolarHBondContact O-CB 3.49Å; N558-R562 PolarHBondContact O-N 2.99Å; E559-R562 PolarHBondContact O-N 3.46Å; E559-R562 IonicContact OE1-CZ 2.82Å; E559-R562 IonicContact OE1-NE 3.08Å; E559-R562 PolarHBondContact OE1-NE 2.63Å; E559-R562 IonicContact OE1-NH2 2.89Å; E559-R562 PolarHBondContact OE1-NH2 2.93Å; E559-R562 IonicContact OE2-CZ 2.74Å; E559-R562 IonicContact OE2-NE 3.4Å; E559-R562 PolarHBondContact OE2-NE 3.27Å; E559-R562 IonicContact OE2-NH2 3.75Å; I560-R562 VanDerWaalsContact C-N 3.35Å; I560-R562 PolarHBondContact O-N 2.83Å; R562-T564 VanDerWaalsContact C-N 3.32Å; R562-T564 PolarHBondContact O-N 2.77Å; R562-C565 WeakPolarHBondContact O-CB 3.3Å; R562-C565 PolarHBondContact O-N 2.98Å; R562-E566 IonicContact CZ-OE1 3.91Å; R562-E566 IonicContact CZ-OE2 3.7Å; R562-E566 IonicContact NH1-OE1 3.77Å; R562-E566 PolarHBondContact NH1-OE1 3.26Å; R562-E566 IonicContact NH1-OE2 3.1Å; R562-E566 PolarHBondContact NH1-OE2 3.18Å; R562-E566 WeakPolarHBondContact O-CG 3.44Å; R562-E566 PolarHBondContact O-N 2.84Å
563V92.6Very high92.4Very high56 Ų56101.1 Ų101.134%0.33950%0.495SS..Hα-helixtrans-64.3-38.5178.7172.60000111.1E559 I560 E566 M567E559-V563 WeakPolarHBondContact O-CG2 3.48Å; E559-V563 PolarHBondContact O-N 3.42Å; I560-V563 PolarHBondContact O-N 2.94Å; V563-E566 PolarHBondContact O-N 3.35Å; V563-M567 HydrophobicContact CG1-CG 4.43Å; V563-M567 HydrophobicContact CG1-SD 4.4Å; V563-M567 WeakPolarHBondContact O-CG 3.43Å; V563-M567 PolarHBondContact O-N 2.86Å
564T93.9Very high92.3Very high63 Ų6399.9 Ų99.939%0.38749%0.494SS..Hα-helixtrans-62.4-45.4176-55.90000110.9I560 E561 R562 E566 M567 E568I560-T564 VanDerWaalsContact O-CB 3.3Å; I560-T564 WeakPolarHBondContact O-CB 3.44Å; I560-T564 PolarHBondContact O-N 2.83Å; I560-T564 PolarHBondContact O-OG1 3.47Å; E561-T564 PolarHBondContact O-N 2.89Å; R562-T564 VanDerWaalsContact C-N 3.32Å; R562-T564 PolarHBondContact O-N 2.77Å; T564-E566 VanDerWaalsContact C-N 3.33Å; T564-E566 PolarHBondContact O-N 3.03Å; T564-M567 PolarHBondContact O-N 2.91Å; T564-E568 WeakPolarHBondContact O-CG 3.49Å; T564-E568 PolarHBondContact O-N 2.86Å
565C93.4Very high92.1Very high74 Ų7498.7 Ų98.750%0.550%0.495SS..Hα-helixtrans-61.3-38.2174.9-77.10000112.7E561 R562 R569E561-C565 WeakPolarHBondContact O-CB 3.44Å; E561-C565 PolarHBondContact O-N 3.37Å; E561-C565 PolarHBondContact O-SG 3.24Å; E561-C565 VanDerWaalsContact O-SG 3.33Å; R562-C565 WeakPolarHBondContact O-CB 3.3Å; R562-C565 PolarHBondContact O-N 2.98Å; C565-R569 PolarHBondContact O-N 3.34Å
566E94.1Very high92Very high75 Ų75100 Ų10035%0.3550%0.495SS..Hα-helixtrans-68.1-44.1175.3-75.5176.8176.400112.1R562 V563 T564 E568 R569 Y570R562-E566 IonicContact CZ-OE1 3.91Å; R562-E566 IonicContact CZ-OE2 3.7Å; R562-E566 IonicContact NH1-OE1 3.77Å; R562-E566 PolarHBondContact NH1-OE1 3.26Å; R562-E566 IonicContact NH1-OE2 3.1Å; R562-E566 PolarHBondContact NH1-OE2 3.18Å; R562-E566 WeakPolarHBondContact O-CG 3.44Å; R562-E566 PolarHBondContact O-N 2.84Å; V563-E566 PolarHBondContact O-N 3.35Å; T564-E566 VanDerWaalsContact C-N 3.33Å; T564-E566 PolarHBondContact O-N 3.03Å; E566-E568 VanDerWaalsContact C-N 3.32Å; E566-E568 PolarHBondContact O-N 2.67Å; E566-R569 WeakPolarHBondContact O-CB 3.28Å; E566-R569 PolarHBondContact O-N 2.84Å; E566-R569 VanDerWaalsContact O-N 3.16Å; E566-Y570 HydrophobicContact CB-CE2 4.37Å; E566-Y570 WeakPolarHBondContact O-CD2 3.34Å; E566-Y570 PolarHBondContact O-N 2.89Å
567M88.7Confident91.9Very high129 Ų129102.7 Ų102.764%0.63550%0.502SS*.Hα-helixtrans-58.5-43.6174-76.3-173.560.300111.7V563 T564 R569 Y570 Q571V563-M567 HydrophobicContact CG1-CG 4.43Å; V563-M567 HydrophobicContact CG1-SD 4.4Å; V563-M567 WeakPolarHBondContact O-CG 3.43Å; V563-M567 PolarHBondContact O-N 2.86Å; T564-M567 PolarHBondContact O-N 2.91Å; M567-R569 PolarHBondContact O-N 3.39Å; M567-Y570 PolarHBondContact O-N 2.84Å; M567-Q571 VanDerWaalsContact O-CB 3.32Å; M567-Q571 WeakPolarHBondContact O-CB 3.47Å; M567-Q571 PolarHBondContact O-N 3.32Å
568E93.7Very high91.8Very high94 Ų94101 Ų10144%0.43950%0.5SS..Hα-helixtrans-63.3-38.8175-74.3-176.4-172.400112.7T564 E566 Q571 K572T564-E568 WeakPolarHBondContact O-CG 3.49Å; T564-E568 PolarHBondContact O-N 2.86Å; E566-E568 VanDerWaalsContact C-N 3.32Å; E566-E568 PolarHBondContact O-N 2.67Å; E568-Q571 PolarHBondContact O-N 2.82Å; E568-K572 WeakPolarHBondContact O-CB 3.38Å; E568-K572 WeakPolarHBondContact O-CG 3.42Å; E568-K572 PolarHBondContact O-N 2.92Å
569R92.5Very high91.7Very high180 Ų18099.7 Ų99.768%0.67950%0.497SS*.Hα-helixtrans-63.7-47.9173.9-84.6-177176.1166.70.5111.6C565 E566 M567 Q571 K572 Q573C565-R569 PolarHBondContact O-N 3.34Å; E566-R569 WeakPolarHBondContact O-CB 3.28Å; E566-R569 PolarHBondContact O-N 2.84Å; E566-R569 VanDerWaalsContact O-N 3.16Å; M567-R569 PolarHBondContact O-N 3.39Å; R569-Q571 VanDerWaalsContact C-N 3.28Å; R569-Q571 PolarHBondContact O-N 3.43Å; R569-K572 PolarHBondContact O-N 3.05Å; R569-Q573 WeakPolarHBondContact O-CG 3.39Å; R569-Q573 PolarHBondContact O-N 2.87Å
570Y90.7Very high91.6Very high149 Ų14998.7 Ų98.758%0.58450%0.497SS*.Hα-helixtrans-63.1-36.6176.9-72.8-56.4000111.8E566 M567 Q573 C574E566-Y570 HydrophobicContact CB-CE2 4.37Å; E566-Y570 WeakPolarHBondContact O-CD2 3.34Å; E566-Y570 PolarHBondContact O-N 2.89Å; M567-Y570 PolarHBondContact O-N 2.84Å; Y570-Q573 PolarHBondContact O-N 3.35Å; Y570-C574 WeakPolarHBondContact O-CB 3.33Å; Y570-C574 PolarHBondContact O-N 2.86Å; Y570-C574 PolarHBondContact O-SG 3.3Å
571Q91.4Very high91.4Very high134 Ų134102.4 Ų102.463%0.62651%0.505SS*.Hα-helixtrans-64.2-44.7174.2-173.1174.2-0.800111.7M567 E568 R569 C574 T575M567-Q571 VanDerWaalsContact O-CB 3.32Å; M567-Q571 WeakPolarHBondContact O-CB 3.47Å; M567-Q571 PolarHBondContact O-N 3.32Å; E568-Q571 PolarHBondContact O-N 2.82Å; R569-Q571 VanDerWaalsContact C-N 3.28Å; R569-Q571 PolarHBondContact O-N 3.43Å; Q571-C574 PolarHBondContact O-N 3.39Å; Q571-T575 WeakPolarHBondContact O-CG2 3.27Å; Q571-T575 PolarHBondContact O-N 3.33Å; Q571-T575 PolarHBondContact O-OG1 3.42Å
572K92.1Very high91.4Very high123 Ų123103.8 Ų103.854%0.53551%0.509SS..Hα-helixtrans-63-39.9174.1-73.3170.5-176.7167.10112.3E568 R569 T575 Q576E568-K572 WeakPolarHBondContact O-CB 3.38Å; E568-K572 WeakPolarHBondContact O-CG 3.42Å; E568-K572 PolarHBondContact O-N 2.92Å; R569-K572 PolarHBondContact O-N 3.05Å; K572-T575 PolarHBondContact O-N 2.88Å; K572-T575 PolarHBondContact O-OG1 3.44Å; K572-Q576 WeakPolarHBondContact O-CB 3.41Å; K572-Q576 VanDerWaalsContact O-CG 3.29Å; K572-Q576 WeakPolarHBondContact O-CG 3.45Å; K572-Q576 PolarHBondContact O-N 3.18Å
573Q91.9Very high91.3Very high97 Ų97104.9 Ų104.945%0.45352%0.518SS..Hα-helixtrans-65.2-40.4174.2-73.6177.1-13.800111.5R569 Y570 T575 Q576 L577R569-Q573 WeakPolarHBondContact O-CG 3.39Å; R569-Q573 PolarHBondContact O-N 2.87Å; Y570-Q573 PolarHBondContact O-N 3.35Å; Q573-T575 VanDerWaalsContact C-N 3.35Å; Q573-T575 PolarHBondContact O-N 3.29Å; Q573-Q576 PolarHBondContact O-N 2.96Å; Q573-L577 WeakPolarHBondContact O-CB 3.5Å; Q573-L577 VanDerWaalsContact O-CG 3.3Å; Q573-L577 WeakPolarHBondContact O-CG 3.1Å; Q573-L577 PolarHBondContact O-N 3.27Å
574C87.4Confident91.1Very high82 Ų82106.4 Ų106.455%0.55453%0.525SS*.Hα-helixtrans-63.4-38.9176.1-71.70000112.2Y570 Q571 A578Y570-C574 WeakPolarHBondContact O-CB 3.33Å; Y570-C574 PolarHBondContact O-N 2.86Å; Y570-C574 PolarHBondContact O-SG 3.3Å; Q571-C574 PolarHBondContact O-N 3.39Å; C574-A578 VanDerWaalsContact O-CB 3.31Å; C574-A578 WeakPolarHBondContact O-CB 3.32Å; C574-A578 PolarHBondContact O-N 2.9Å
575T89.9Confident91Very high88 Ų88108.5 Ų108.554%0.5453%0.534SS..Hα-helixtrans-71-37.9176.656.90000112.4Q571 K572 Q573 A578 S579Q571-T575 WeakPolarHBondContact O-CG2 3.27Å; Q571-T575 PolarHBondContact O-N 3.33Å; Q571-T575 PolarHBondContact O-OG1 3.42Å; K572-T575 PolarHBondContact O-N 2.88Å; K572-T575 PolarHBondContact O-OG1 3.44Å; Q573-T575 VanDerWaalsContact C-N 3.35Å; Q573-T575 PolarHBondContact O-N 3.29Å; T575-A578 PolarHBondContact O-N 3.09Å; T575-S579 PolarHBondContact O-N 3.44Å
576Q90.6Very high90.9Very high120 Ų120107.9 Ų107.956%0.56153%0.533SS*.Hα-helixtrans-63.5-45.5172-72.9173.7-0.100111.9K572 Q573 A578 S579 V580K572-Q576 WeakPolarHBondContact O-CB 3.41Å; K572-Q576 VanDerWaalsContact O-CG 3.29Å; K572-Q576 WeakPolarHBondContact O-CG 3.45Å; K572-Q576 PolarHBondContact O-N 3.18Å; Q573-Q576 PolarHBondContact O-N 2.96Å; Q576-A578 VanDerWaalsContact C-N 3.27Å; Q576-A578 PolarHBondContact O-N 3.34Å; Q576-S579 PolarHBondContact O-N 2.9Å; Q576-S579 VanDerWaalsContact O-N 3.15Å; Q576-S579 PolarHBondContact O-OG 3.34Å; Q576-V580 WeakPolarHBondContact O-CG2 3.33Å; Q576-V580 PolarHBondContact O-N 3.44Å
577L88.1Confident90.7Very high102 Ų102109.2 Ų109.253%0.53454%0.543SS..Hα-helixtrans-63.2-36.1175.3-72.1174.9000111.6Q573 V580 R581Q573-L577 WeakPolarHBondContact O-CB 3.5Å; Q573-L577 VanDerWaalsContact O-CG 3.3Å; Q573-L577 WeakPolarHBondContact O-CG 3.1Å; Q573-L577 PolarHBondContact O-N 3.27Å; L577-V580 PolarHBondContact O-N 3.32Å; L577-R581 WeakPolarHBondContact O-CB 3.39Å; L577-R581 WeakPolarHBondContact O-CG 3.44Å; L577-R581 PolarHBondContact O-N 2.94Å
578A90.1Very high90.8Very high48 Ų48108 Ų10840%0.39754%0.539SS..Hα-helixtrans-66-36.417400000112.5C574 T575 Q576 K582C574-A578 VanDerWaalsContact O-CB 3.31Å; C574-A578 WeakPolarHBondContact O-CB 3.32Å; C574-A578 PolarHBondContact O-N 2.9Å; T575-A578 PolarHBondContact O-N 3.09Å; Q576-A578 VanDerWaalsContact C-N 3.27Å; Q576-A578 PolarHBondContact O-N 3.34Å; A578-K582 WeakPolarHBondContact O-CG 3.3Å; A578-K582 PolarHBondContact O-N 2.83Å
579S91.2Very high90.7Very high58 Ų58105.9 Ų105.941%0.40654%0.537SS..Hα-helixtrans-70-41.1174.868.30000112.2T575 Q576 K582 Q583T575-S579 PolarHBondContact O-N 3.44Å; Q576-S579 PolarHBondContact O-N 2.9Å; Q576-S579 VanDerWaalsContact O-N 3.15Å; Q576-S579 PolarHBondContact O-OG 3.34Å; S579-K582 PolarHBondContact O-N 3.28Å; S579-Q583 WeakPolarHBondContact O-CG 3.42Å; S579-Q583 PolarHBondContact O-N 3.34Å
580V90.7Very high90.8Very high71 Ų7199.2 Ų99.243%0.4352%0.52SS..Hα-helixtrans-63.4-41.9176.11730000111Q576 L577 K582 Q583 N584Q576-V580 WeakPolarHBondContact O-CG2 3.33Å; Q576-V580 PolarHBondContact O-N 3.44Å; L577-V580 PolarHBondContact O-N 3.32Å; V580-K582 PolarHBondContact O-N 3.4Å; V580-Q583 WeakPolarHBondContact O-CB 3.38Å; V580-Q583 PolarHBondContact O-N 2.95Å; V580-N584 PolarHBondContact O-N 2.96Å
581R89.4Confident90.6Very high180 Ų18096 Ų9668%0.67951%0.514SS*.Hα-helixtrans-58.6-46.1174.1-77.6177.5-179.1178.41.2112.2L577 Q583 N584 D585L577-R581 WeakPolarHBondContact O-CB 3.39Å; L577-R581 WeakPolarHBondContact O-CG 3.44Å; L577-R581 PolarHBondContact O-N 2.94Å; R581-Q583 VanDerWaalsContact C-N 3.29Å; R581-Q583 PolarHBondContact O-N 2.89Å; R581-N584 PolarHBondContact O-N 2.72Å; R581-N584 VanDerWaalsContact O-N 3.15Å; R581-D585 VanDerWaalsContact O-CG 3.25Å; R581-D585 PolarHBondContact O-N 2.78Å
582K92.8Very high90.6Very high155 Ų15591.9 Ų91.967%0.67450%0.502SS*.Hα-helixtrans-60.7-37.3175.7-73.1179.6179.8-176.30113A578 S579 V580 A586A578-K582 WeakPolarHBondContact O-CG 3.3Å; A578-K582 PolarHBondContact O-N 2.83Å; S579-K582 PolarHBondContact O-N 3.28Å; V580-K582 PolarHBondContact O-N 3.4Å; K582-A586 WeakPolarHBondContact O-CB 3.41Å; K582-A586 PolarHBondContact O-N 2.96Å
583Q92.7Very high90.6Very high124 Ų12491.9 Ų91.958%0.57950%0.504SS*.Hα-helixtrans-66.8-41.5174.9-73.5174.4-32.400111.6S579 V580 R581 A586 L587S579-Q583 WeakPolarHBondContact O-CG 3.42Å; S579-Q583 PolarHBondContact O-N 3.34Å; V580-Q583 WeakPolarHBondContact O-CB 3.38Å; V580-Q583 PolarHBondContact O-N 2.95Å; R581-Q583 VanDerWaalsContact C-N 3.29Å; R581-Q583 PolarHBondContact O-N 2.89Å; Q583-A586 PolarHBondContact O-N 2.85Å; Q583-L587 WeakPolarHBondContact O-CG 3.35Å; Q583-L587 PolarHBondContact O-N 2.88Å
584N87.6Confident90.5Very high89 Ų8992 Ų9248%0.47651%0.507SS..Hα-helixtrans-63.9-45174-90-1.2000112.2V580 R581 A586 L587 D588V580-N584 PolarHBondContact O-N 2.96Å; R581-N584 PolarHBondContact O-N 2.72Å; R581-N584 VanDerWaalsContact O-N 3.15Å; N584-A586 PolarHBondContact O-N 3.36Å; N584-L587 PolarHBondContact O-N 2.98Å; N584-L587 VanDerWaalsContact O-N 3.09Å; N584-D588 PolarHBondContact O-N 2.87Å
585D92.1Very high90.7Very high107 Ų10794.7 Ų94.757%0.57251%0.51SS*.Hα-helixtrans-59.3-37.2176.5-63.8-27.8000111.2R581 A589R581-D585 VanDerWaalsContact O-CG 3.25Å; R581-D585 PolarHBondContact O-N 2.78Å; D585-A589 WeakPolarHBondContact O-CB 3.42Å; D585-A589 PolarHBondContact O-N 3.49Å
586A91.7Very high90.8Very high60 Ų6094.8 Ų94.850%0.49651%0.507SS..Hα-helixtrans-68.7-39.9174.700000112.8K582 Q583 N584 A589 A590K582-A586 WeakPolarHBondContact O-CB 3.41Å; K582-A586 PolarHBondContact O-N 2.96Å; Q583-A586 PolarHBondContact O-N 2.85Å; N584-A586 PolarHBondContact O-N 3.36Å; A586-A589 PolarHBondContact O-N 2.87Å; A586-A590 WeakPolarHBondContact O-CB 3.35Å; A586-A590 PolarHBondContact O-N 3.49Å
587L90.5Very high90.9Very high104 Ų10494.1 Ų94.155%0.54550%0.504SS..Hα-helixtrans-66.9-38.4174.7-73173.8000111.9Q583 N584 A590 N591Q583-L587 WeakPolarHBondContact O-CG 3.35Å; Q583-L587 PolarHBondContact O-N 2.88Å; N584-L587 PolarHBondContact O-N 2.98Å; N584-L587 VanDerWaalsContact O-N 3.09Å; L587-A590 PolarHBondContact O-N 3.44Å; L587-N591 WeakPolarHBondContact O-CB 3.46Å; L587-N591 PolarHBondContact O-N 3.39Å; L587-N591 PolarHBondContact O-ND2 2.86Å
588D90.7Very high91Very high104 Ų10497 Ų9756%0.55651%0.512SS*.Hα-helixtrans-67-39.2175.6-77.8-28.9000111.7N584 N591 A592N584-D588 PolarHBondContact O-N 2.87Å; D588-N591 PolarHBondContact O-N 3.5Å; D588-A592 WeakPolarHBondContact O-CB 3.27Å; D588-A592 PolarHBondContact O-N 2.89Å
589A91.6Very high91.1Very high49 Ų49100.8 Ų100.841%0.40552%0.519SS..Hα-helixtrans-61.8-48.2171.900000111.6D585 A586 N591 A592 E593D585-A589 WeakPolarHBondContact O-CB 3.42Å; D585-A589 PolarHBondContact O-N 3.49Å; A586-A589 PolarHBondContact O-N 2.87Å; A589-N591 VanDerWaalsContact C-N 3.32Å; A589-N591 PolarHBondContact O-N 2.87Å; A589-A592 WeakPolarHBondContact O-CB 3.48Å; A589-A592 PolarHBondContact O-N 3.01Å; A589-A592 VanDerWaalsContact O-N 3.1Å; A589-E593 WeakPolarHBondContact O-CG 3.34Å; A589-E593 PolarHBondContact O-N 3.01Å
590A93Very high91.2Very high39 Ų39102.6 Ų102.632%0.32252%0.524SS..Hα-helixtrans-61.4-38.7176.300000112.3A586 L587 A592 E593 L594A586-A590 WeakPolarHBondContact O-CB 3.35Å; A586-A590 PolarHBondContact O-N 3.49Å; L587-A590 PolarHBondContact O-N 3.44Å; A590-A592 VanDerWaalsContact C-N 3.34Å; A590-A592 PolarHBondContact O-N 2.88Å; A590-E593 PolarHBondContact O-N 3.07Å; A590-L594 WeakPolarHBondContact O-CG 3.44Å; A590-L594 PolarHBondContact O-N 3.37Å
591N87.7Confident91.1Very high83 Ų83104.2 Ų104.244%0.44453%0.53SS..Hα-helixtrans-65.9-35.2174.3-82.8-36.5000112.6L587 D588 A589 K595L587-N591 WeakPolarHBondContact O-CB 3.46Å; L587-N591 PolarHBondContact O-N 3.39Å; L587-N591 PolarHBondContact O-ND2 2.86Å; D588-N591 PolarHBondContact O-N 3.5Å; A589-N591 VanDerWaalsContact C-N 3.32Å; A589-N591 PolarHBondContact O-N 2.87Å; N591-K595 WeakPolarHBondContact O-CB 3.49Å; N591-K595 VanDerWaalsContact O-CG 3.23Å; N591-K595 WeakPolarHBondContact O-CG 3.47Å; N591-K595 PolarHBondContact O-N 3.35Å
592A90.4Very high91.3Very high47 Ų4798.4 Ų98.439%0.38852%0.517SS..Hα-helixtrans-68-40.5173.700000111.4D588 A589 A590 K595 N596D588-A592 WeakPolarHBondContact O-CB 3.27Å; D588-A592 PolarHBondContact O-N 2.89Å; A589-A592 WeakPolarHBondContact O-CB 3.48Å; A589-A592 PolarHBondContact O-N 3.01Å; A589-A592 VanDerWaalsContact O-N 3.1Å; A590-A592 VanDerWaalsContact C-N 3.34Å; A590-A592 PolarHBondContact O-N 2.88Å; A592-K595 PolarHBondContact O-N 3.41Å; A592-N596 PolarHBondContact O-N 3.04Å; A592-N596 PolarHBondContact O-ND2 3.19Å
593E92.4Very high91.1Very high122 Ų12296.7 Ų96.757%0.5751%0.512SS*.Hα-helixtrans-61.1-51.6173.7-71.4173.9-178.600111.4A589 A590 K595 N596 E597A589-E593 WeakPolarHBondContact O-CG 3.34Å; A589-E593 PolarHBondContact O-N 3.01Å; A590-E593 PolarHBondContact O-N 3.07Å; E593-K595 VanDerWaalsContact C-N 3.29Å; E593-K595 PolarHBondContact O-N 3.12Å; E593-N596 CarbonylContact O-C 3.56Å; E593-N596 WeakPolarHBondContact O-CA 3.49Å; E593-N596 WeakPolarHBondContact O-CB 3.32Å; E593-N596 PolarHBondContact O-N 3.5Å; E593-E597 WeakPolarHBondContact O-CG 3.48Å; E593-E597 PolarHBondContact O-N 2.88Å
594L89.7Confident91Very high101 Ų10196.3 Ų96.353%0.52951%0.51SS..Hα-helixtrans-59.9-36.6176.2-75.6171.8000112.8A590 N596 E597 K598A590-L594 WeakPolarHBondContact O-CG 3.44Å; A590-L594 PolarHBondContact O-N 3.37Å; L594-N596 VanDerWaalsContact C-N 3.35Å; L594-E597 PolarHBondContact O-N 3.11Å; L594-K598 VanDerWaalsContact O-CB 3.31Å; L594-K598 WeakPolarHBondContact O-CB 3.11Å; L594-K598 PolarHBondContact O-N 3.22Å
595K92Very high91.1Very high138 Ų13895.9 Ų95.960%0.651%0.51SS*.Hα-helixtrans-65.4-38.7173.3-80.1171.9-176.5171.60111.8N591 A592 E593 K599N591-K595 WeakPolarHBondContact O-CB 3.49Å; N591-K595 VanDerWaalsContact O-CG 3.23Å; N591-K595 WeakPolarHBondContact O-CG 3.47Å; N591-K595 PolarHBondContact O-N 3.35Å; A592-K595 PolarHBondContact O-N 3.41Å; E593-K595 VanDerWaalsContact C-N 3.29Å; E593-K595 PolarHBondContact O-N 3.12Å; K595-K599 WeakPolarHBondContact O-CG 3.24Å; K595-K599 PolarHBondContact O-N 3.18Å
596N91.7Very high91Very high89 Ų8994.8 Ų94.848%0.47650%0.502SS..Hα-helixtrans-69.4-43176.3-69.2-23.4000111A592 E593 L594 K598 K599 N600A592-N596 PolarHBondContact O-N 3.04Å; A592-N596 PolarHBondContact O-ND2 3.19Å; E593-N596 CarbonylContact O-C 3.56Å; E593-N596 WeakPolarHBondContact O-CA 3.49Å; E593-N596 WeakPolarHBondContact O-CB 3.32Å; E593-N596 PolarHBondContact O-N 3.5Å; L594-N596 VanDerWaalsContact C-N 3.35Å; N596-K598 PolarHBondContact O-N 2.89Å; N596-K599 PolarHBondContact O-N 3.46Å; N596-N600 WeakPolarHBondContact O-CB 3.34Å; N596-N600 PolarHBondContact O-N 2.87Å; N596-N600 PolarHBondContact O-ND2 3.34Å; N596-N600 PolarHBondContact O-OD1 3.39Å
597E92.4Very high90.9Very high107 Ų10797.8 Ų97.850%0.550%0.504SS..Hα-helixtrans-59.5-45.6172.8-71.5-179171.300111.7E593 L594 K599 N600 L601E593-E597 WeakPolarHBondContact O-CG 3.48Å; E593-E597 PolarHBondContact O-N 2.88Å; L594-E597 PolarHBondContact O-N 3.11Å; E597-K599 VanDerWaalsContact C-N 3.33Å; E597-K599 PolarHBondContact O-N 3.31Å; E597-N600 PolarHBondContact O-N 3.46Å; E597-N600 VanDerWaalsContact O-N 3.16Å; E597-L601 WeakPolarHBondContact O-CB 3.47Å; E597-L601 WeakPolarHBondContact O-CG 3.44Å; E597-L601 PolarHBondContact O-N 2.9Å
598K91Very high90.8Very high161 Ų16197.8 Ų97.870%0.750%0.501SS*.Hα-helixtrans-59.1-43.3174.8-178.8178.5178177.30111.9L594 N596 S602L594-K598 VanDerWaalsContact O-CB 3.31Å; L594-K598 WeakPolarHBondContact O-CB 3.11Å; L594-K598 PolarHBondContact O-N 3.22Å; N596-K598 PolarHBondContact O-N 2.89Å; K598-S602 VanDerWaalsContact O-CB 3.24Å; K598-S602 WeakPolarHBondContact O-CB 3.23Å; K598-S602 PolarHBondContact O-N 3.38Å
599K92.7Very high90.9Very high128 Ų12898.5 Ų98.556%0.55750%0.501SS*.Hα-helixtrans-63-42.7175.4-76.4175.7-179.9179.90111.4K595 N596 E597 S602 Q603K595-K599 WeakPolarHBondContact O-CG 3.24Å; K595-K599 PolarHBondContact O-N 3.18Å; N596-K599 PolarHBondContact O-N 3.46Å; E597-K599 VanDerWaalsContact C-N 3.33Å; E597-K599 PolarHBondContact O-N 3.31Å; K599-S602 PolarHBondContact O-N 3.24Å; K599-Q603 WeakPolarHBondContact O-CB 3.39Å; K599-Q603 VanDerWaalsContact O-CG 3.25Å; K599-Q603 WeakPolarHBondContact O-CG 3.46Å; K599-Q603 PolarHBondContact O-N 2.89Å
600N91.9Very high90.7Very high96 Ų96103.2 Ų103.251%0.51351%0.508SS..Hα-helixtrans-64.9-44.6178.3-67.1-15.5000111.5N596 E597 Q603 Q604N596-N600 WeakPolarHBondContact O-CB 3.34Å; N596-N600 PolarHBondContact O-N 2.87Å; N596-N600 PolarHBondContact O-ND2 3.34Å; N596-N600 PolarHBondContact O-OD1 3.39Å; E597-N600 PolarHBondContact O-N 3.46Å; E597-N600 VanDerWaalsContact O-N 3.16Å; N600-Q603 PolarHBondContact O-N 3.09Å; N600-Q604 WeakPolarHBondContact O-CB 3.33Å; N600-Q604 PolarHBondContact O-N 2.87Å
601L89.9Confident90.7Very high105 Ų105106.9 Ų106.955%0.5552%0.517SS..Hα-helixtrans-63.8-42.4175.1-70.8173.7000111.3E597 Q604 V605E597-L601 WeakPolarHBondContact O-CB 3.47Å; E597-L601 WeakPolarHBondContact O-CG 3.44Å; E597-L601 PolarHBondContact O-N 2.9Å; L601-Q604 PolarHBondContact O-N 2.79Å; L601-V605 WeakPolarHBondContact O-CG2 3.47Å; L601-V605 PolarHBondContact O-N 2.94Å
602S92.3Very high90.7Very high59 Ų59108 Ų10841%0.41352%0.522SS..Hα-helixtrans-60.1-46.6174.5-166.80000111.3K598 K599 Q604 V605 E606K598-S602 VanDerWaalsContact O-CB 3.24Å; K598-S602 WeakPolarHBondContact O-CB 3.23Å; K598-S602 PolarHBondContact O-N 3.38Å; K599-S602 PolarHBondContact O-N 3.24Å; S602-Q604 VanDerWaalsContact C-N 3.28Å; S602-Q604 PolarHBondContact O-N 3.39Å; S602-V605 PolarHBondContact O-N 2.88Å; S602-E606 WeakPolarHBondContact O-CG 3.4Å; S602-E606 PolarHBondContact O-N 2.91Å
603Q89.6Confident90.5Very high119 Ų119108.2 Ų108.256%0.55652%0.524SS*.Hα-helixtrans-62.5-36.5175.5-73.417311.200112K599 N600 F607K599-Q603 WeakPolarHBondContact O-CB 3.39Å; K599-Q603 VanDerWaalsContact O-CG 3.25Å; K599-Q603 WeakPolarHBondContact O-CG 3.46Å; K599-Q603 PolarHBondContact O-N 2.89Å; N600-Q603 PolarHBondContact O-N 3.09Å; Q603-F607 WeakPolarHBondContact O-CB 3.39Å; Q603-F607 PolarHBondContact O-N 3.46Å
604Q89.3Confident90.3Very high116 Ų116104.6 Ų104.654%0.54251%0.514SS..Hα-helixtrans-69.2-39.5176.5-170.4170.616.400112N600 L601 S602 F607 Q608N600-Q604 WeakPolarHBondContact O-CB 3.33Å; N600-Q604 PolarHBondContact O-N 2.87Å; L601-Q604 PolarHBondContact O-N 2.79Å; S602-Q604 VanDerWaalsContact C-N 3.28Å; S602-Q604 PolarHBondContact O-N 3.39Å; Q604-F607 PolarHBondContact O-N 3.28Å; Q604-Q608 WeakPolarHBondContact O-CG 3.43Å; Q604-Q608 PolarHBondContact O-N 3.22Å
605V89.7Confident90.2Very high80 Ų80104.6 Ų104.649%0.48552%0.515SS..Hα-helixtrans-64.3-49173.5170.50000110.2L601 S602 F607 Q608 E609L601-V605 WeakPolarHBondContact O-CG2 3.47Å; L601-V605 PolarHBondContact O-N 2.94Å; S602-V605 PolarHBondContact O-N 2.88Å; V605-F607 PolarHBondContact O-N 2.99Å; V605-Q608 WeakPolarHBondContact O-CB 3.4Å; V605-Q608 PolarHBondContact O-N 3.05Å; V605-E609 HydrophobicContact CG1-CG 4.39Å; V605-E609 WeakPolarHBondContact O-CG 3.46Å; V605-E609 PolarHBondContact O-N 3.39Å
606E90.4Very high90.1Very high83 Ų83100.7 Ų100.739%0.38850%0.504SS..Hα-helixtrans-58.9-36.4175.7-72.7178.9-161.400112.3S602 R610S602-E606 WeakPolarHBondContact O-CG 3.4Å; S602-E606 PolarHBondContact O-N 2.91Å; E606-R610 WeakPolarHBondContact O-CB 3.47Å; E606-R610 VanDerWaalsContact O-CG 3.3Å; E606-R610 WeakPolarHBondContact O-CG 3.32Å; E606-R610 PolarHBondContact O-N 3.17Å; E606-R610 IonicContact OE2-NH2 2.75Å; E606-R610 PolarHBondContact OE2-NH2 3.47Å
607F90.9Very high89.8Confident123 Ų123102.6 Ų102.654%0.53951%0.51SS..Hα-helixtrans-66.6-42.1174.5177.6-94.7000112Q603 Q604 V605 R610 K611Q603-F607 WeakPolarHBondContact O-CB 3.39Å; Q603-F607 PolarHBondContact O-N 3.46Å; Q604-F607 PolarHBondContact O-N 3.28Å; V605-F607 PolarHBondContact O-N 2.99Å; F607-R610 PolarHBondContact O-N 3.22Å; F607-K611 HydrophobicContact CE1-CD 4.47Å; F607-K611 VanDerWaalsContact O-CB 3.28Å; F607-K611 WeakPolarHBondContact O-CB 3.4Å; F607-K611 PolarHBondContact O-N 2.65Å
608Q88.1Confident89.4Confident104 Ų104102.1 Ų102.149%0.48651%0.511SS..Hα-helixtrans-63.9-43175.4-66.7-109.2-29.100111.1Q604 V605 K611 I612Q604-Q608 WeakPolarHBondContact O-CG 3.43Å; Q604-Q608 PolarHBondContact O-N 3.22Å; V605-Q608 WeakPolarHBondContact O-CB 3.4Å; V605-Q608 PolarHBondContact O-N 3.05Å; Q608-K611 PolarHBondContact O-N 3.35Å; Q608-I612 WeakPolarHBondContact O-CB 3.38Å; Q608-I612 VanDerWaalsContact O-CG1 3.26Å; Q608-I612 WeakPolarHBondContact O-CG1 3.31Å; Q608-I612 PolarHBondContact O-N 2.86Å
609E91.6Very high89.1Confident119 Ų11999.1 Ų99.156%0.55650%0.502SS*.Hα-helixtrans-61.1-47.7175.5-73.2177169.100111.5V605 K611 I612 A613V605-E609 HydrophobicContact CG1-CG 4.39Å; V605-E609 WeakPolarHBondContact O-CG 3.46Å; V605-E609 PolarHBondContact O-N 3.39Å; E609-K611 VanDerWaalsContact C-N 3.31Å; E609-K611 PolarHBondContact O-N 2.8Å; E609-I612 PolarHBondContact O-N 3.4Å; E609-A613 WeakPolarHBondContact O-CB 3.3Å; E609-A613 PolarHBondContact O-N 3.41Å
610R88.5Confident88.9Confident148 Ų14897.4 Ų97.456%0.55850%0.498SS*.Hα-helixtrans-61.4-38.8174.7-74.3-178.2-117.6136.3-4.9112.2E606 F607 A613 A614E606-R610 WeakPolarHBondContact O-CB 3.47Å; E606-R610 VanDerWaalsContact O-CG 3.3Å; E606-R610 WeakPolarHBondContact O-CG 3.32Å; E606-R610 PolarHBondContact O-N 3.17Å; E606-R610 IonicContact OE2-NH2 2.75Å; E606-R610 PolarHBondContact OE2-NH2 3.47Å; F607-R610 PolarHBondContact O-N 3.22Å; R610-A613 PolarHBondContact O-N 2.95Å; R610-A614 WeakPolarHBondContact O-CB 3.48Å; R610-A614 PolarHBondContact O-N 3.47Å
611K91.8Very high88.3Confident116 Ų11696.7 Ų96.750%0.50449%0.494SS..Hα-helixtrans-66-42.8175.9-176.4-178.8177.1-175.50111.7F607 Q608 E609 L615F607-K611 HydrophobicContact CE1-CD 4.47Å; F607-K611 VanDerWaalsContact O-CB 3.28Å; F607-K611 WeakPolarHBondContact O-CB 3.4Å; F607-K611 PolarHBondContact O-N 2.65Å; Q608-K611 PolarHBondContact O-N 3.35Å; E609-K611 VanDerWaalsContact C-N 3.31Å; E609-K611 PolarHBondContact O-N 2.8Å; K611-L615 HydrophobicContact CG-CD1 4.19Å; K611-L615 WeakPolarHBondContact O-CB 3.49Å; K611-L615 VanDerWaalsContact O-CG 3.26Å; K611-L615 WeakPolarHBondContact O-CG 3.26Å; K611-L615 PolarHBondContact O-N 3.26Å
612I87.9Confident87.9Confident108 Ų10897.4 Ų97.455%0.55450%0.495SS*.Hα-helixtrans-66.2-42.8176.5-69.1165000110.1Q608 E609 L615 S616Q608-I612 WeakPolarHBondContact O-CB 3.38Å; Q608-I612 VanDerWaalsContact O-CG1 3.26Å; Q608-I612 WeakPolarHBondContact O-CG1 3.31Å; Q608-I612 PolarHBondContact O-N 2.86Å; E609-I612 PolarHBondContact O-N 3.4Å; I612-L615 PolarHBondContact O-N 3.35Å; I612-S616 VanDerWaalsContact O-CB 3.31Å; I612-S616 WeakPolarHBondContact O-CB 3.28Å; I612-S616 PolarHBondContact O-N 2.91Å; I612-S616 PolarHBondContact O-OG 2.87Å
613A87.5Confident87.4Confident51 Ų51101.1 Ų101.142%0.42150%0.503SS..Hα-helixtrans-59.1-50175.600000111.1E609 R610 L615 S616 E617E609-A613 WeakPolarHBondContact O-CB 3.3Å; E609-A613 PolarHBondContact O-N 3.41Å; R610-A613 PolarHBondContact O-N 2.95Å; A613-L615 PolarHBondContact O-N 2.97Å; A613-S616 WeakPolarHBondContact CA-OG 3.49Å; A613-S616 PolarHBondContact O-N 3.38Å; A613-S616 VanDerWaalsContact O-N 3.13Å; A613-S616 PolarHBondContact O-OG 3.24Å; A613-E617 WeakPolarHBondContact O-CB 3.21Å; A613-E617 PolarHBondContact O-N 3.4Å
614A87.5Confident87Confident45 Ų45100.4 Ų100.437%0.37250%0.5SS..Hα-helixtrans-60.2-44.9176.300000112.3R610 S616 E617 D618R610-A614 WeakPolarHBondContact O-CB 3.48Å; R610-A614 PolarHBondContact O-N 3.47Å; A614-S616 VanDerWaalsContact C-N 3.29Å; A614-S616 PolarHBondContact O-N 3.49Å; A614-E617 PolarHBondContact O-N 3.29Å; A614-D618 WeakPolarHBondContact O-CB 3.45Å; A614-D618 PolarHBondContact O-N 3.4Å
615L87.1Confident86.6Confident102 Ų102102.9 Ų102.953%0.53451%0.505SS..Hα-helixtrans-64.3-33.8175.5-73.1173.2000112.6K611 I612 A613 L619K611-L615 HydrophobicContact CG-CD1 4.19Å; K611-L615 WeakPolarHBondContact O-CB 3.49Å; K611-L615 VanDerWaalsContact O-CG 3.26Å; K611-L615 WeakPolarHBondContact O-CG 3.26Å; K611-L615 PolarHBondContact O-N 3.26Å; I612-L615 PolarHBondContact O-N 3.35Å; A613-L615 PolarHBondContact O-N 2.97Å; L615-L619 WeakPolarHBondContact O-CB 3.27Å; L615-L619 PolarHBondContact O-N 3.33Å
616S90.4Very high86Confident55 Ų55101.9 Ų101.939%0.38550%0.501SS..Hα-helixtrans-69.9-37.8175.775.20000111.4I612 A613 A614 L619 I620I612-S616 VanDerWaalsContact O-CB 3.31Å; I612-S616 WeakPolarHBondContact O-CB 3.28Å; I612-S616 PolarHBondContact O-N 2.91Å; I612-S616 PolarHBondContact O-OG 2.87Å; A613-S616 WeakPolarHBondContact CA-OG 3.49Å; A613-S616 PolarHBondContact O-N 3.38Å; A613-S616 VanDerWaalsContact O-N 3.13Å; A613-S616 PolarHBondContact O-OG 3.24Å; A614-S616 VanDerWaalsContact C-N 3.29Å; A614-S616 PolarHBondContact O-N 3.49Å; S616-L619 PolarHBondContact O-N 2.68Å; S616-I620 WeakPolarHBondContact O-CD1 3.33Å; S616-I620 WeakPolarHBondContact O-CG1 3.3Å; S616-I620 PolarHBondContact O-N 3.26Å
617E85.8Confident85.5Confident129 Ų129100.6 Ų100.660%0.60350%0.501SS*.Hα-helixtrans-69.7-44.8176.7-159.2168.3-155.400110.7A613 A614 L619 I620 L621A613-E617 WeakPolarHBondContact O-CB 3.21Å; A613-E617 PolarHBondContact O-N 3.4Å; A614-E617 PolarHBondContact O-N 3.29Å; E617-L619 VanDerWaalsContact C-N 3.33Å; E617-L619 PolarHBondContact O-N 2.99Å; E617-I620 WeakPolarHBondContact O-CB 3.38Å; E617-I620 PolarHBondContact O-N 3.39Å; E617-I620 VanDerWaalsContact O-N 3.14Å; E617-L621 WeakPolarHBondContact O-CG 3.45Å; E617-L621 PolarHBondContact O-N 3.3Å
618D83.3Confident85Confident98 Ų9899.1 Ų99.152%0.52450%0.498SS..Hα-helixtrans-59.9-41.4171.5-75.2-20.2000111.6A614 I620 L621 E622A614-D618 WeakPolarHBondContact O-CB 3.45Å; A614-D618 PolarHBondContact O-N 3.4Å; D618-I620 VanDerWaalsContact C-N 3.33Å; D618-I620 PolarHBondContact O-N 3.24Å; D618-L621 PolarHBondContact O-N 2.94Å; D618-E622 VanDerWaalsContact O-CB 3.3Å; D618-E622 WeakPolarHBondContact O-CB 3.4Å; D618-E622 PolarHBondContact O-N 3.28Å
619L85.6Confident84.4Confident97 Ų9798.5 Ų98.551%0.50850%0.501SS..Hα-helixtrans-65-36.8175.5-177.666.3000111.7L615 S616 E617 K623L615-L619 WeakPolarHBondContact O-CB 3.27Å; L615-L619 PolarHBondContact O-N 3.33Å; S616-L619 PolarHBondContact O-N 2.68Å; E617-L619 VanDerWaalsContact C-N 3.33Å; E617-L619 PolarHBondContact O-N 2.99Å; L619-K623 HydrophobicContact CG-CD 4.49Å; L619-K623 VanDerWaalsContact O-CB 3.32Å; L619-K623 WeakPolarHBondContact O-CB 3.44Å; L619-K623 VanDerWaalsContact O-CG 3.26Å; L619-K623 WeakPolarHBondContact O-CG 3.49Å; L619-K623 PolarHBondContact O-N 2.81Å
620I86.8Confident83.6Confident92 Ų9297.3 Ų97.347%0.47250%0.498SS..Hα-helixtrans-66.5-47.6174.3-70.8160.8000109.9S616 E617 D618 E622 K623 Q624S616-I620 WeakPolarHBondContact O-CD1 3.33Å; S616-I620 WeakPolarHBondContact O-CG1 3.3Å; S616-I620 PolarHBondContact O-N 3.26Å; E617-I620 WeakPolarHBondContact O-CB 3.38Å; E617-I620 PolarHBondContact O-N 3.39Å; E617-I620 VanDerWaalsContact O-N 3.14Å; D618-I620 VanDerWaalsContact C-N 3.33Å; D618-I620 PolarHBondContact O-N 3.24Å; I620-E622 VanDerWaalsContact C-N 3.33Å; I620-E622 PolarHBondContact O-N 2.81Å; I620-K623 PolarHBondContact O-N 3.45Å; I620-Q624 HydrophobicContact CG2-CG 4.45Å; I620-Q624 WeakPolarHBondContact O-CB 3.46Å; I620-Q624 VanDerWaalsContact O-CG 3.3Å; I620-Q624 WeakPolarHBondContact O-CG 3.44Å; I620-Q624 PolarHBondContact O-N 3.46Å
621L80.9Confident83Confident81 Ų8195.7 Ų95.742%0.42450%0.497SS..Hα-helixtrans-62.4-39.7178-70.5174.8000111.7E617 D618 Q624 R625E617-L621 WeakPolarHBondContact O-CG 3.45Å; E617-L621 PolarHBondContact O-N 3.3Å; D618-L621 PolarHBondContact O-N 2.94Å; L621-Q624 PolarHBondContact O-N 2.82Å; L621-R625 WeakPolarHBondContact O-CB 3.29Å; L621-R625 VanDerWaalsContact O-CG 3.29Å; L621-R625 WeakPolarHBondContact O-CG 3.26Å; L621-R625 PolarHBondContact O-N 2.86Å
622E81.7Confident82.1Confident121 Ų12195.2 Ų95.257%0.56550%0.5SS*.Hα-helixtrans-69.3-40.6176.5-170.361-158.700111.5D618 I620 Q624 R625 S626D618-E622 VanDerWaalsContact O-CB 3.3Å; D618-E622 WeakPolarHBondContact O-CB 3.4Å; D618-E622 PolarHBondContact O-N 3.28Å; I620-E622 VanDerWaalsContact C-N 3.33Å; I620-E622 PolarHBondContact O-N 2.81Å; E622-Q624 VanDerWaalsContact C-N 3.32Å; E622-Q624 PolarHBondContact O-N 3.11Å; E622-R625 PolarHBondContact O-N 2.81Å; E622-S626 WeakPolarHBondContact O-CB 3.48Å; E622-S626 PolarHBondContact O-N 2.95Å
623K81.2Confident81.5Confident136 Ų13693 Ų9359%0.59149%0.494SS*.Hα-helixtrans-62.9-38.8172.1-79.1-178.9176-1730112.1L619 I620 S627L619-K623 HydrophobicContact CG-CD 4.49Å; L619-K623 VanDerWaalsContact O-CB 3.32Å; L619-K623 WeakPolarHBondContact O-CB 3.44Å; L619-K623 VanDerWaalsContact O-CG 3.26Å; L619-K623 WeakPolarHBondContact O-CG 3.49Å; L619-K623 PolarHBondContact O-N 2.81Å; I620-K623 PolarHBondContact O-N 3.45Å; K623-S627 VanDerWaalsContact O-CB 3.28Å; K623-S627 WeakPolarHBondContact O-CB 3.4Å; K623-S627 PolarHBondContact O-N 3.49Å
624Q80.8Confident80.5Confident105 Ų10592.9 Ų92.949%0.49149%0.493SS..Hα-helixtrans-65.4-43.2173.7-75.4176-6.600111.2I620 L621 E622 S627 I628I620-Q624 HydrophobicContact CG2-CG 4.45Å; I620-Q624 WeakPolarHBondContact O-CB 3.46Å; I620-Q624 VanDerWaalsContact O-CG 3.3Å; I620-Q624 WeakPolarHBondContact O-CG 3.44Å; I620-Q624 PolarHBondContact O-N 3.46Å; L621-Q624 PolarHBondContact O-N 2.82Å; E622-Q624 VanDerWaalsContact C-N 3.32Å; E622-Q624 PolarHBondContact O-N 3.11Å; Q624-S627 PolarHBondContact O-N 3.44Å; Q624-I628 WeakPolarHBondContact O-CB 3.49Å; Q624-I628 WeakPolarHBondContact O-CD1 3.38Å; Q624-I628 VanDerWaalsContact O-CG1 3.22Å; Q624-I628 WeakPolarHBondContact O-CG1 3.47Å; Q624-I628 PolarHBondContact O-N 3.44Å
625R80.1Confident79.5Confident168 Ų16895.2 Ų95.263%0.63450%0.499SS*.Hα-helixtrans-62.4-46.9174.8-75.6173.1-177.7-95.60.1111.9L621 E622 S627 I628 V629L621-R625 WeakPolarHBondContact O-CB 3.29Å; L621-R625 VanDerWaalsContact O-CG 3.29Å; L621-R625 WeakPolarHBondContact O-CG 3.26Å; L621-R625 PolarHBondContact O-N 2.86Å; E622-R625 PolarHBondContact O-N 2.81Å; R625-S627 PolarHBondContact O-N 3.25Å; R625-I628 PolarHBondContact O-N 2.81Å; R625-V629 WeakPolarHBondContact O-CB 3.5Å; R625-V629 VanDerWaalsContact O-CG2 3.28Å; R625-V629 WeakPolarHBondContact O-CG2 3.42Å; R625-V629 PolarHBondContact O-N 3.32Å
626S77.6Confident78.4Confident58 Ų5896.8 Ų96.841%0.40651%0.505SS..Hα-helixtrans-56.9-48.6173.5-177.80000110.8E622 I628 V629 D630E622-S626 WeakPolarHBondContact O-CB 3.48Å; E622-S626 PolarHBondContact O-N 2.95Å; S626-I628 VanDerWaalsContact C-N 3.34Å; S626-I628 PolarHBondContact O-N 3.41Å; S626-V629 CarbonylContact O-C 3.56Å; S626-V629 PolarHBondContact O-N 3.3Å; S626-V629 VanDerWaalsContact O-N 3.16Å; S626-D630 WeakPolarHBondContact O-CB 3.49Å; S626-D630 PolarHBondContact O-N 2.88Å; S626-D630 VanDerWaalsContact O-OD2 3.12Å; S626-D630 PolarHBondContact OG-OD2 2.68Å
627S79.9Confident77.2Confident57 Ų5799.8 Ų99.840%0.39952%0.516SS..Hα-helixtrans-59.5-42.7177.8178.20000112.4K623 Q624 R625 D630 Q631K623-S627 VanDerWaalsContact O-CB 3.28Å; K623-S627 WeakPolarHBondContact O-CB 3.4Å; K623-S627 PolarHBondContact O-N 3.49Å; Q624-S627 PolarHBondContact O-N 3.44Å; R625-S627 PolarHBondContact O-N 3.25Å; S627-D630 PolarHBondContact O-N 2.77Å; S627-Q631 VanDerWaalsContact O-CB 3.32Å; S627-Q631 WeakPolarHBondContact O-CB 3.36Å; S627-Q631 WeakPolarHBondContact O-CG 3.32Å; S627-Q631 PolarHBondContact O-N 2.85Å; S627-Q631 PolarHBondContact O-OE1 2.94Å
628I79.8Confident76.1Confident91 Ų9197 Ų9747%0.46751%0.508SS..Hα-helixtrans-66.4-41.2177.1-69.4163.4000110.3Q624 R625 S626 Q631 L632Q624-I628 WeakPolarHBondContact O-CB 3.49Å; Q624-I628 WeakPolarHBondContact O-CD1 3.38Å; Q624-I628 VanDerWaalsContact O-CG1 3.22Å; Q624-I628 WeakPolarHBondContact O-CG1 3.47Å; Q624-I628 PolarHBondContact O-N 3.44Å; R625-I628 PolarHBondContact O-N 2.81Å; S626-I628 VanDerWaalsContact C-N 3.34Å; S626-I628 PolarHBondContact O-N 3.41Å; I628-Q631 PolarHBondContact O-N 2.99Å; I628-L632 HydrophobicContact CG2-CD1 3.88Å; I628-L632 HydrophobicContact CG2-CG 4.33Å; I628-L632 WeakPolarHBondContact O-CB 3.35Å; I628-L632 VanDerWaalsContact O-CG 3.24Å; I628-L632 WeakPolarHBondContact O-CG 3.47Å; I628-L632 PolarHBondContact O-N 3.29Å
629V77Confident74.6Confident92 Ų9295.8 Ų95.856%0.55851%0.507SS*.Hα-helixtrans-64.9-42.9176.1169.90000110.8R625 S626 L632 S633R625-V629 WeakPolarHBondContact O-CB 3.5Å; R625-V629 VanDerWaalsContact O-CG2 3.28Å; R625-V629 WeakPolarHBondContact O-CG2 3.42Å; R625-V629 PolarHBondContact O-N 3.32Å; S626-V629 CarbonylContact O-C 3.56Å; S626-V629 PolarHBondContact O-N 3.3Å; S626-V629 VanDerWaalsContact O-N 3.16Å; V629-L632 PolarHBondContact O-N 3.16Å; V629-S633 VanDerWaalsContact O-CB 3.28Å; V629-S633 WeakPolarHBondContact O-CB 3.07Å; V629-S633 PolarHBondContact O-N 2.87Å; V629-S633 PolarHBondContact O-OG 3.47Å
630D75Confident73.2Confident93 Ų9393.3 Ų93.350%0.49750%0.5SS..Hα-helixtrans-63.9-44.1176.9-68.4-33.2000110.5S626 S627 S633 A634S626-D630 WeakPolarHBondContact O-CB 3.49Å; S626-D630 PolarHBondContact O-N 2.88Å; S626-D630 VanDerWaalsContact O-OD2 3.12Å; S626-D630 PolarHBondContact OG-OD2 2.68Å; S627-D630 PolarHBondContact O-N 2.77Å; D630-S633 PolarHBondContact O-N 3.03Å; D630-S633 PolarHBondContact O-OG 2.8Å; D630-A634 WeakPolarHBondContact O-CB 3.23Å; D630-A634 PolarHBondContact O-N 3.43Å
631Q74.6Confident71.7Confident115 Ų11593.4 Ų93.454%0.53750%0.501SS..Hα-helixtrans-61.1-47.6173.2-84.1169.5-35.200112.1S627 I628 S633 A634 D635S627-Q631 VanDerWaalsContact O-CB 3.32Å; S627-Q631 WeakPolarHBondContact O-CB 3.36Å; S627-Q631 WeakPolarHBondContact O-CG 3.32Å; S627-Q631 PolarHBondContact O-N 2.85Å; S627-Q631 PolarHBondContact O-OE1 2.94Å; I628-Q631 PolarHBondContact O-N 2.99Å; Q631-S633 VanDerWaalsContact C-N 3.29Å; Q631-S633 PolarHBondContact O-N 3.36Å; Q631-A634 PolarHBondContact O-N 3.48Å; Q631-D635 WeakPolarHBondContact O-CB 3.31Å; Q631-D635 VanDerWaalsContact O-CG 3.31Å; Q631-D635 PolarHBondContact O-N 3.43Å
632L73.4Confident70.4Confident105 Ų10594.2 Ų94.255%0.5550%0.503SS..Hα-helixtrans-64-35.4176.7-73.7171.6000112I628 V629 M636I628-L632 HydrophobicContact CG2-CD1 3.88Å; I628-L632 HydrophobicContact CG2-CG 4.33Å; I628-L632 WeakPolarHBondContact O-CB 3.35Å; I628-L632 VanDerWaalsContact O-CG 3.24Å; I628-L632 WeakPolarHBondContact O-CG 3.47Å; I628-L632 PolarHBondContact O-N 3.29Å; V629-L632 PolarHBondContact O-N 3.16Å; L632-M636 VanDerWaalsContact O-CB 3.25Å; L632-M636 WeakPolarHBondContact O-CB 3.14Å; L632-M636 VanDerWaalsContact O-CG 3.3Å; L632-M636 WeakPolarHBondContact O-CG 3.39Å; L632-M636 PolarHBondContact O-N 3.32Å
633S75.4Confident68.8Low62 Ų6295.8 Ų95.843%0.43451%0.509SS..Hα-helixtrans-68.4-38.9175.780.40000111.6V629 D630 Q631 L637V629-S633 VanDerWaalsContact O-CB 3.28Å; V629-S633 WeakPolarHBondContact O-CB 3.07Å; V629-S633 PolarHBondContact O-N 2.87Å; V629-S633 PolarHBondContact O-OG 3.47Å; D630-S633 PolarHBondContact O-N 3.03Å; D630-S633 PolarHBondContact O-OG 2.8Å; Q631-S633 VanDerWaalsContact C-N 3.29Å; Q631-S633 PolarHBondContact O-N 3.36Å; S633-L637 PolarHBondContact O-N 2.85Å
634A67.7Low67.3Low48 Ų4896.2 Ų96.240%0.39751%0.51SS..Hα-helixtrans-67.9-43.7174.300000111.3D630 Q631 M636 L637 T638D630-A634 WeakPolarHBondContact O-CB 3.23Å; D630-A634 PolarHBondContact O-N 3.43Å; Q631-A634 PolarHBondContact O-N 3.48Å; A634-M636 PolarHBondContact O-N 2.96Å; A634-L637 WeakPolarHBondContact O-CB 3.31Å; A634-L637 PolarHBondContact O-N 3.36Å; A634-T638 WeakPolarHBondContact O-CB 3.5Å; A634-T638 PolarHBondContact O-N 2.89Å; A634-T638 PolarHBondContact O-OG1 3.33Å
635D65.8Low65.7Low94 Ų9498 Ų9850%0.50352%0.522SS..Hα-helixtrans-66.1-37.1176.9-74.2-16.5000111.7Q631 T638 C639Q631-D635 WeakPolarHBondContact O-CB 3.31Å; Q631-D635 VanDerWaalsContact O-CG 3.31Å; Q631-D635 PolarHBondContact O-N 3.43Å; D635-T638 PolarHBondContact O-N 3.03Å; D635-C639 VanDerWaalsContact O-CB 3.3Å; D635-C639 WeakPolarHBondContact O-CB 3.42Å; D635-C639 PolarHBondContact O-N 2.95Å; D635-C639 PolarHBondContact O-SG 3.49Å; D635-C639 VanDerWaalsContact O-SG 3.35Å
636M62.8Low64.1Low135 Ų13594.2 Ų94.267%0.66552%0.518SS*.Hα-helixtrans-65.8-39.7171.1-83.5-67.5-63.700111.9L632 A634 T638 A640L632-M636 VanDerWaalsContact O-CB 3.25Å; L632-M636 WeakPolarHBondContact O-CB 3.14Å; L632-M636 VanDerWaalsContact O-CG 3.3Å; L632-M636 WeakPolarHBondContact O-CG 3.39Å; L632-M636 PolarHBondContact O-N 3.32Å; A634-M636 PolarHBondContact O-N 2.96Å; M636-T638 VanDerWaalsContact C-N 3.3Å; M636-A640 WeakPolarHBondContact O-CB 3.38Å; M636-A640 PolarHBondContact O-N 3.26Å
637L65.4Low62.5Low119 Ų11998.5 Ų98.562%0.62353%0.532SS*.Hα-helixtrans-63.6-39.4173.1-122.796.5000111.3S633 A634 N641S633-L637 PolarHBondContact O-N 2.85Å; A634-L637 WeakPolarHBondContact O-CB 3.31Å; A634-L637 PolarHBondContact O-N 3.36Å; L637-N641 WeakPolarHBondContact O-CB 3.42Å; L637-N641 PolarHBondContact O-N 3.46Å
638T62.6Low60.8Low70 Ų7099.2 Ų99.243%0.42955%0.548SS..Hα-helixtrans-71.2-46.4-179.1-460000110.6A634 D635 M636 A640 N641 E642A634-T638 WeakPolarHBondContact O-CB 3.5Å; A634-T638 PolarHBondContact O-N 2.89Å; A634-T638 PolarHBondContact O-OG1 3.33Å; D635-T638 PolarHBondContact O-N 3.03Å; M636-T638 VanDerWaalsContact C-N 3.3Å; T638-A640 PolarHBondContact O-N 2.71Å; T638-N641 PolarHBondContact O-N 2.92Å; T638-E642 PolarHBondContact O-N 3.36Å
639C52.8Low59Low73 Ų73102.3 Ų102.349%0.49356%0.564SS.*Hα-helixtrans-64.2-37.7173.7-73.10000111.9D635 N641 E642 F643D635-C639 VanDerWaalsContact O-CB 3.3Å; D635-C639 WeakPolarHBondContact O-CB 3.42Å; D635-C639 PolarHBondContact O-N 2.95Å; D635-C639 PolarHBondContact O-SG 3.49Å; D635-C639 VanDerWaalsContact O-SG 3.35Å; C639-N641 VanDerWaalsContact C-N 3.34Å; C639-E642 PolarHBondContact O-N 2.96Å; C639-F643 WeakPolarHBondContact O-CB 3.35Å; C639-F643 PolarHBondContact O-N 3.17Å
640A55.4Low57.3Low45 Ų45102.3 Ų102.337%0.37257%0.568SS.*Hα-helixtrans-67.5-34.7174.700000112.2M636 T638 K644M636-A640 WeakPolarHBondContact O-CB 3.38Å; M636-A640 PolarHBondContact O-N 3.26Å; T638-A640 PolarHBondContact O-N 2.71Å; A640-K644 WeakPolarHBondContact O-CG 3.47Å; A640-K644 PolarHBondContact O-N 2.9Å
641N55.1Low55.8Low93 Ų93104.9 Ų104.950%0.49758%0.581SS.*Hα-helixtrans-70.8-37.4172.2-87.1-7.1000112.2L637 T638 C639 K644 L645L637-N641 WeakPolarHBondContact O-CB 3.42Å; L637-N641 PolarHBondContact O-N 3.46Å; T638-N641 PolarHBondContact O-N 2.92Å; C639-N641 VanDerWaalsContact C-N 3.34Å; N641-K644 PolarHBondContact O-N 3.46Å; N641-L645 PolarHBondContact O-N 2.93Å
642E54Low54.1Low98 Ų98106.8 Ų106.846%0.45860%0.596SS.*Hα-helixtrans-70.3-33.6173.4-72-166.6179.700111.8T638 C639 K644 L645 T646T638-E642 PolarHBondContact O-N 3.36Å; C639-E642 PolarHBondContact O-N 2.96Å; E642-K644 PolarHBondContact O-N 3.43Å; E642-L645 PolarHBondContact O-N 3.23Å; E642-L645 VanDerWaalsContact O-N 3.14Å; E642-T646 PolarHBondContact O-N 3.13Å
643F49.2Very low52.7Low155 Ų155106 Ų10668%0.6860%0.604SS**Hα-helixtrans-67.4-35.5173.2-134.5-89.2000112.1C639 L645 T646 E647C639-F643 WeakPolarHBondContact O-CB 3.35Å; C639-F643 PolarHBondContact O-N 3.17Å; F643-L645 VanDerWaalsContact C-N 3.27Å; F643-L645 PolarHBondContact O-N 2.87Å; F643-T646 WeakPolarHBondContact CA-OG1 3.5Å; F643-T646 PolarHBondContact O-N 3.07Å; F643-T646 VanDerWaalsContact O-N 3.11Å; F643-T646 PolarHBondContact O-OG1 3.44Å; F643-E647 PolarHBondContact O-N 3.42Å
644K49.1Very low51.2Low145 Ų145111.3 Ų111.363%0.6362%0.622SS**Hα-helixtrans-67.6-24.1171.6-78.6171.6-179.5172.80113.4A640 N641 E642 T646A640-K644 WeakPolarHBondContact O-CG 3.47Å; A640-K644 PolarHBondContact O-N 2.9Å; N641-K644 PolarHBondContact O-N 3.46Å; E642-K644 PolarHBondContact O-N 3.43Å; K644-T646 VanDerWaalsContact C-N 3.32Å
645L48.2Very low50.2Low142 Ų142118 Ų11874%0.74365%0.645SS**Hα-helixtrans-79.3-15.8171.7-74.1170.4000112.9N641 E642 F643N641-L645 PolarHBondContact O-N 2.93Å; E642-L645 PolarHBondContact O-N 3.23Å; E642-L645 VanDerWaalsContact O-N 3.14Å; F643-L645 VanDerWaalsContact C-N 3.27Å; F643-L645 PolarHBondContact O-N 2.87Å
646T45.6Very low49.2Very low89 Ų89121.8 Ų121.855%0.54666%0.66SS.*Hα-helixtrans-93.8-19.2174.249.20000114.6E642 F643 K644 G648 I649E642-T646 PolarHBondContact O-N 3.13Å; F643-T646 WeakPolarHBondContact CA-OG1 3.5Å; F643-T646 PolarHBondContact O-N 3.07Å; F643-T646 VanDerWaalsContact O-N 3.11Å; F643-T646 PolarHBondContact O-OG1 3.44Å; K644-T646 VanDerWaalsContact C-N 3.32Å; T646-G648 PolarHBondContact O-N 2.95Å; T646-I649 PolarHBondContact O-N 3.14Å
647E44.1Very low48.5Very low148 Ų148119.1 Ų119.169%0.69265%0.648SS**G310 helixtrans-73-10.2177.6-144170.5-165.900113.2F643F643-E647 PolarHBondContact O-N 3.42Å
648G44.8Very low48Very low71 Ų71118.8 Ų118.873%0.73265%0.651SS**G310 helixtrans-81.6-1.7172.700000115.9T646T646-G648 PolarHBondContact O-N 2.95Å
649I41.1Very low47.9Very low157 Ų157124.1 Ų124.181%0.80566%0.663SS**G310 helixtrans-118.848.5169.9-42.4177.5000108.9T646T646-I649 PolarHBondContact O-N 3.14Å
650S40.9Very low48.3Very low92 Ų92124 Ų12464%0.64366%0.66SS**  trans-116.262.5170.2-171.20000109.1
651N44.4Very low48.6Very low146 Ų146125.1 Ų125.178%0.78167%0.665SS**SBendtrans-140.5100.6159-83.2-28.6000107.6
652D39.5Very low49.1Very low156 Ų156126.6 Ų126.683%0.83467%0.667SS**  trans45.690.3134-60.5-21.3000117.9
653A42.6Very low49.7Very low89 Ų89130.6 Ų130.674%0.73668%0.678SS**  -174.5101.9116.900000109.1
654E44.4Very low50.5Low172 Ų172128.2 Ų128.280%0.80467%0.673SS**  trans54.1107.2132.3-58.2-178.9173.800117.8Q656E654-Q656 PolarHBondContact O-N 2.84Å
655Q47.3Very low51.4Low188 Ų188125.7 Ų125.788%0.87967%0.666SS**  trans7619.9143.4-60170.2-1.200118.2D657Q655-D657 VanDerWaalsContact C-N 3.26Å; Q655-D657 PolarHBondContact O-N 3.38Å
656Q43.4Very low52.5Low175 Ų175122.3 Ų122.382%0.81865%0.648SS**SBendtrans-73.489.3155.7-158.31022.700108.4E654 V658E654-Q656 PolarHBondContact O-N 2.84Å; Q656-V658 PolarHBondContact O-N 3.24Å
657D48.3Very low53.7Low79 Ų79119.7 Ų119.742%0.42264%0.638SS.*  trans-21.9109.8-177.3-163.40.1000113.5Q655 R659 V660 S661Q655-D657 VanDerWaalsContact C-N 3.26Å; Q655-D657 PolarHBondContact O-N 3.38Å; D657-R659 PolarHBondContact O-N 3.43Å; D657-R659 WeakPolarHBondContact OD1-CB 3.43Å; D657-R659 WeakPolarHBondContact OD1-CG 3.26Å; D657-R659 PolarHBondContact OD1-N 2.86Å; D657-R659 IonicContact OD1-NE 2.79Å; D657-V660 HydrophobicContact CB-CG2 4.06Å; D657-V660 WeakPolarHBondContact O-CA 3.5Å; D657-V660 WeakPolarHBondContact O-CB 3.19Å; D657-V660 PolarHBondContact O-N 2.89Å; D657-S661 PolarHBondContact O-N 3.46Å
658V56Low54.9Low111 Ų111118.1 Ų118.167%0.67363%0.63SS**Hα-helixtrans-53-23175.3-178.70000110.8Q656 S661 F662Q656-V658 PolarHBondContact O-N 3.24Å; V658-S661 WeakPolarHBondContact CA-OG 3.25Å; V658-S661 PolarHBondContact O-OG 2.92Å; V658-F662 WeakPolarHBondContact O-CB 3.47Å; V658-F662 PolarHBondContact O-N 3.4Å
659R59.8Low56Low182 Ų182120.8 Ų120.869%0.68762%0.622SS**Hα-helixtrans-64.4-37171.1-63.1-177.3-133.2-1340113.1D657 W663D657-R659 PolarHBondContact O-N 3.43Å; D657-R659 WeakPolarHBondContact OD1-CB 3.43Å; D657-R659 WeakPolarHBondContact OD1-CG 3.26Å; D657-R659 PolarHBondContact OD1-N 2.86Å; D657-R659 IonicContact OD1-NE 2.79Å; R659-W663 WeakPolarHBondContact O-CB 3.35Å; R659-W663 VanDerWaalsContact O-CD1 3.3Å; R659-W663 PolarHBondContact O-N 3.26Å
660V62.2Low57.4Low71 Ų71120.4 Ų120.443%0.4362%0.615SS.*Hα-helixtrans-71.5-43.1179.2176.80000110.2D657 W663 N664D657-V660 HydrophobicContact CB-CG2 4.06Å; D657-V660 WeakPolarHBondContact O-CA 3.5Å; D657-V660 WeakPolarHBondContact O-CB 3.19Å; D657-V660 PolarHBondContact O-N 2.89Å; V660-W663 PolarHBondContact O-N 2.93Å; V660-N664 VanDerWaalsContact O-CB 3.23Å; V660-N664 WeakPolarHBondContact O-CB 3.5Å; V660-N664 PolarHBondContact O-N 3.06Å; V660-N664 PolarHBondContact O-ND2 3Å; V660-N664 PolarHBondContact O-OD1 2.77Å
661S61.7Low58.7Low68 Ų68118.6 Ų118.648%0.47660%0.602SS.*Hα-helixtrans-68.4-36.5174.746.30000112.4D657 V658 N664 L665D657-S661 PolarHBondContact O-N 3.46Å; V658-S661 WeakPolarHBondContact CA-OG 3.25Å; V658-S661 PolarHBondContact O-OG 2.92Å; S661-N664 PolarHBondContact O-N 3.03Å; S661-L665 WeakPolarHBondContact O-CB 3.28Å; S661-L665 PolarHBondContact O-N 2.87Å
662F64.3Low59.8Low125 Ų125116.1 Ų116.155%0.54858%0.584SS.*Hα-helixtrans-69.2-39.3172.8-161-100.3000112.3V658 N664 L665 I666V658-F662 WeakPolarHBondContact O-CB 3.47Å; V658-F662 PolarHBondContact O-N 3.4Å; F662-N664 VanDerWaalsContact C-N 3.34Å; F662-L665 PolarHBondContact O-N 3.3Å; F662-I666 HydrophobicContact CD1-CD1 3.56Å; F662-I666 HydrophobicContact CD1-CG1 4.22Å; F662-I666 HydrophobicContact CE1-CD1 3.41Å; F662-I666 VanDerWaalsContact CE1-CD1 3.41Å; F662-I666 HydrophobicContact CE1-CG1 4.17Å; F662-I666 HydrophobicContact CZ-CD1 4.35Å; F662-I666 WeakPolarHBondContact O-CB 3.42Å; F662-I666 WeakPolarHBondContact O-CG1 3.31Å; F662-I666 PolarHBondContact O-N 3.4Å
663W67.3Low60.8Low181 Ų181115 Ų11569%0.68658%0.576SS**Hα-helixtrans-67.9-32.8171.8-97.293.9000112.4R659 V660 G667R659-W663 WeakPolarHBondContact O-CB 3.35Å; R659-W663 VanDerWaalsContact O-CD1 3.3Å; R659-W663 PolarHBondContact O-N 3.26Å; V660-W663 PolarHBondContact O-N 2.93Å; W663-G667 WeakPolarHBondContact O-CA 3.48Å; W663-G667 PolarHBondContact O-N 2.82Å
664N64.7Low61.9Low106 Ų106113.7 Ų113.757%0.56756%0.561SS**Hα-helixtrans-71-38.1173.4-72.3-14.8000110.7V660 S661 F662 G667 H668V660-N664 VanDerWaalsContact O-CB 3.23Å; V660-N664 WeakPolarHBondContact O-CB 3.5Å; V660-N664 PolarHBondContact O-N 3.06Å; V660-N664 PolarHBondContact O-ND2 3Å; V660-N664 PolarHBondContact O-OD1 2.77Å; S661-N664 PolarHBondContact O-N 3.03Å; F662-N664 VanDerWaalsContact C-N 3.34Å; N664-G667 CarbonylContact O-C 3.59Å; N664-G667 PolarHBondContact O-N 3.22Å; N664-H668 VanDerWaalsContact O-CB 3.25Å; N664-H668 WeakPolarHBondContact O-CB 3.15Å; N664-H668 PolarHBondContact O-N 3.42Å
665L68.5Low62.8Low91 Ų91109.9 Ų109.948%0.47655%0.546SS..Hα-helixtrans-70.2-43.3175.2-170.366.2000111.4S661 F662 G667 H668 F669S661-L665 WeakPolarHBondContact O-CB 3.28Å; S661-L665 PolarHBondContact O-N 2.87Å; F662-L665 PolarHBondContact O-N 3.3Å; L665-G667 VanDerWaalsContact C-N 3.29Å; L665-G667 PolarHBondContact O-N 2.94Å; L665-H668 PolarHBondContact O-N 2.85Å; L665-F669 HydrophobicContact CD1-CD2 4.11Å; L665-F669 HydrophobicContact CD1-CE2 3.7Å; L665-F669 HydrophobicContact CD2-CE2 4.08Å; L665-F669 HydrophobicContact CG-CD2 3.81Å; L665-F669 HydrophobicContact CG-CE2 3.62Å; L665-F669 WeakPolarHBondContact O-CB 3.45Å; L665-F669 WeakPolarHBondContact O-CD2 3.47Å; L665-F669 PolarHBondContact O-N 3.44Å
666I71.5Confident63.3Low72 Ų72105.7 Ų105.737%0.36953%0.53SS..Hα-helixtrans-61-41.4169.2-72.5175.1000109.9F662 H668 F669 K670F662-I666 HydrophobicContact CD1-CD1 3.56Å; F662-I666 HydrophobicContact CD1-CG1 4.22Å; F662-I666 HydrophobicContact CE1-CD1 3.41Å; F662-I666 VanDerWaalsContact CE1-CD1 3.41Å; F662-I666 HydrophobicContact CE1-CG1 4.17Å; F662-I666 HydrophobicContact CZ-CD1 4.35Å; F662-I666 WeakPolarHBondContact O-CB 3.42Å; F662-I666 WeakPolarHBondContact O-CG1 3.31Å; F662-I666 PolarHBondContact O-N 3.4Å; I666-H668 VanDerWaalsContact C-N 3.32Å; I666-H668 PolarHBondContact O-N 3.22Å; I666-F669 PolarHBondContact O-N 3.47Å; I666-K670 WeakPolarHBondContact O-CA 3.2Å; I666-K670 WeakPolarHBondContact O-CB 3.33Å; I666-K670 PolarHBondContact O-N 3.04Å
667G70.5Confident64Low33 Ų33100.3 Ų100.334%0.3451%0.508SS..Hα-helixtrans-63.1-38.7176.600000111.9W663 N664 L665 K670 S671W663-G667 WeakPolarHBondContact O-CA 3.48Å; W663-G667 PolarHBondContact O-N 2.82Å; N664-G667 CarbonylContact O-C 3.59Å; N664-G667 PolarHBondContact O-N 3.22Å; L665-G667 VanDerWaalsContact C-N 3.29Å; L665-G667 PolarHBondContact O-N 2.94Å; G667-K670 PolarHBondContact O-N 2.88Å; G667-S671 WeakPolarHBondContact O-CB 3.44Å; G667-S671 PolarHBondContact O-N 3.41Å
668H69.5Low64.3Low115 Ų11599.4 Ų99.453%0.53251%0.512SS..Hα-helixtrans-75.8-37.3177.2-155.5-94.2000111.7N664 L665 I666 K670 K672N664-H668 VanDerWaalsContact O-CB 3.25Å; N664-H668 WeakPolarHBondContact O-CB 3.15Å; N664-H668 PolarHBondContact O-N 3.42Å; L665-H668 PolarHBondContact O-N 2.85Å; I666-H668 VanDerWaalsContact C-N 3.32Å; I666-H668 PolarHBondContact O-N 3.22Å; H668-K670 VanDerWaalsContact C-N 3.34Å; H668-K672 WeakPolarHBondContact O-CA 3.22Å; H668-K672 WeakPolarHBondContact O-CB 3.46Å; H668-K672 PolarHBondContact O-N 3.45Å
669F69Low64.5Low128 Ų12898.5 Ų98.556%0.56151%0.511SS*.Hα-helixtrans-69.7-32.4169.7-81.6-62.6000112L665 I666 M673L665-F669 HydrophobicContact CD1-CD2 4.11Å; L665-F669 HydrophobicContact CD1-CE2 3.7Å; L665-F669 HydrophobicContact CD2-CE2 4.08Å; L665-F669 HydrophobicContact CG-CD2 3.81Å; L665-F669 HydrophobicContact CG-CE2 3.62Å; L665-F669 WeakPolarHBondContact O-CB 3.45Å; L665-F669 WeakPolarHBondContact O-CD2 3.47Å; L665-F669 PolarHBondContact O-N 3.44Å; I666-F669 PolarHBondContact O-N 3.47Å; F669-M673 WeakPolarHBondContact O-CA 3.33Å; F669-M673 WeakPolarHBondContact O-CB 3.48Å; F669-M673 VanDerWaalsContact O-CG 3.25Å; F669-M673 WeakPolarHBondContact O-CG 3.4Å; F669-M673 PolarHBondContact O-N 3.49Å
670K69.5Low64Low149 Ų14994 Ų9465%0.64851%0.506SS*.Hα-helixtrans-76.6-33.9176.4-164.6177.8-172.7-1760111I666 G667 H668 S674I666-K670 WeakPolarHBondContact O-CA 3.2Å; I666-K670 WeakPolarHBondContact O-CB 3.33Å; I666-K670 PolarHBondContact O-N 3.04Å; G667-K670 PolarHBondContact O-N 2.88Å; H668-K670 VanDerWaalsContact C-N 3.34Å; K670-S674 WeakPolarHBondContact O-CA 3.41Å; K670-S674 WeakPolarHBondContact O-CB 3.43Å; K670-S674 PolarHBondContact O-N 2.9Å; K670-S674 PolarHBondContact O-OG 3.48Å
671S68.6Low63.4Low54 Ų5494.8 Ų94.838%0.37851%0.508SS..Hα-helixtrans-69.7-51.1169.3-169.50000110G667 M673 S674 D675G667-S671 WeakPolarHBondContact O-CB 3.44Å; G667-S671 PolarHBondContact O-N 3.41Å; S671-M673 VanDerWaalsContact C-N 3.34Å; S671-M673 PolarHBondContact O-N 3.19Å; S671-S674 WeakPolarHBondContact CA-OG 3.46Å; S671-S674 CarbonylContact O-C 3.55Å; S671-S674 WeakPolarHBondContact O-CA 3.39Å; S671-S674 PolarHBondContact O-N 3.17Å; S671-S674 PolarHBondContact O-OG 2.85Å; S671-D675 VanDerWaalsContact O-CB 3.28Å; S671-D675 WeakPolarHBondContact O-CB 3.29Å; S671-D675 PolarHBondContact O-N 3.46Å; S671-D675 VanDerWaalsContact O-OD2 3.12Å; S671-D675 PolarHBondContact OG-OD2 3.47Å
672K66.7Low62.8Low93 Ų9397.4 Ų97.440%0.40452%0.516SS..Hα-helixtrans-66.9-35.2179.3-160.2162.7-173.3176.80111.5H668 D675 L676H668-K672 WeakPolarHBondContact O-CA 3.22Å; H668-K672 WeakPolarHBondContact O-CB 3.46Å; H668-K672 PolarHBondContact O-N 3.45Å; K672-D675 PolarHBondContact O-N 2.96Å; K672-L676 HydrophobicContact CG-CD1 4.09Å; K672-L676 VanDerWaalsContact O-CB 3.26Å; K672-L676 WeakPolarHBondContact O-CB 3.48Å; K672-L676 WeakPolarHBondContact O-CD1 3.41Å; K672-L676 PolarHBondContact O-N 3.38Å
673M61.9Low62.3Low133 Ų13398.4 Ų98.466%0.65552%0.52SS*.Hα-helixtrans-69.8-35.7166.5-81-122.3-7200111.7F669 S671 D675 T677F669-M673 WeakPolarHBondContact O-CA 3.33Å; F669-M673 WeakPolarHBondContact O-CB 3.48Å; F669-M673 VanDerWaalsContact O-CG 3.25Å; F669-M673 WeakPolarHBondContact O-CG 3.4Å; F669-M673 PolarHBondContact O-N 3.49Å; S671-M673 VanDerWaalsContact C-N 3.34Å; S671-M673 PolarHBondContact O-N 3.19Å; M673-D675 VanDerWaalsContact C-N 3.3Å; M673-T677 WeakPolarHBondContact O-CA 3.26Å; M673-T677 WeakPolarHBondContact O-CB 3.36Å; M673-T677 PolarHBondContact O-N 3.33Å; M673-T677 PolarHBondContact O-OG1 2.93Å
674S64.2Low61.8Low62 Ų6294.9 Ų94.943%0.43451%0.514SS..Hα-helixtrans-71-29.2174.174.30000112.1K670 S671 T677 A678K670-S674 WeakPolarHBondContact O-CA 3.41Å; K670-S674 WeakPolarHBondContact O-CB 3.43Å; K670-S674 PolarHBondContact O-N 2.9Å; K670-S674 PolarHBondContact O-OG 3.48Å; S671-S674 WeakPolarHBondContact CA-OG 3.46Å; S671-S674 CarbonylContact O-C 3.55Å; S671-S674 WeakPolarHBondContact O-CA 3.39Å; S671-S674 PolarHBondContact O-N 3.17Å; S671-S674 PolarHBondContact O-OG 2.85Å; S674-T677 CarbonylContact O-C 3.53Å; S674-A678 WeakPolarHBondContact O-CA 3.5Å; S674-A678 WeakPolarHBondContact O-CB 3.11Å; S674-A678 PolarHBondContact O-N 2.84Å
675D63.4Low61.1Low92 Ų9296.3 Ų96.349%0.49252%0.518SS..Hα-helixtrans-81.3-37.3178.8-63.7-23.2000110S671 K672 M673 A678 S679S671-D675 VanDerWaalsContact O-CB 3.28Å; S671-D675 WeakPolarHBondContact O-CB 3.29Å; S671-D675 PolarHBondContact O-N 3.46Å; S671-D675 VanDerWaalsContact O-OD2 3.12Å; S671-D675 PolarHBondContact OG-OD2 3.47Å; K672-D675 PolarHBondContact O-N 2.96Å; M673-D675 VanDerWaalsContact C-N 3.3Å; D675-A678 CarbonylContact O-C 3.56Å; D675-A678 PolarHBondContact O-N 2.96Å; D675-S679 WeakPolarHBondContact O-CA 3.11Å; D675-S679 WeakPolarHBondContact O-CB 3.46Å; D675-S679 PolarHBondContact O-N 2.83Å
676L57.6Low60.5Low100 Ų10096.5 Ų96.552%0.52452%0.519SS..Hα-helixtrans-74-31.2167.7-95.7129.1000112K672 S679 C680K672-L676 HydrophobicContact CG-CD1 4.09Å; K672-L676 VanDerWaalsContact O-CB 3.26Å; K672-L676 WeakPolarHBondContact O-CB 3.48Å; K672-L676 WeakPolarHBondContact O-CD1 3.41Å; K672-L676 PolarHBondContact O-N 3.38Å; L676-S679 CarbonylContact O-C 3.58Å; L676-S679 PolarHBondContact O-N 3.15Å; L676-C680 VanDerWaalsContact O-CA 3.28Å; L676-C680 WeakPolarHBondContact O-CA 3.19Å; L676-C680 WeakPolarHBondContact O-CB 3.42Å; L676-C680 PolarHBondContact O-N 3.36Å
677T58.7Low59.9Low61 Ų6197.7 Ų97.737%0.37453%0.525SS..Hα-helixtrans-76.8-28.7172.3-60.10000110M673 S674 N681M673-T677 WeakPolarHBondContact O-CA 3.26Å; M673-T677 WeakPolarHBondContact O-CB 3.36Å; M673-T677 PolarHBondContact O-N 3.33Å; M673-T677 PolarHBondContact O-OG1 2.93Å; S674-T677 CarbonylContact O-C 3.53Å; T677-N681 WeakPolarHBondContact CG2-ND2 3.27Å; T677-N681 WeakPolarHBondContact O-CA 3.46Å; T677-N681 WeakPolarHBondContact O-CB 3.33Å; T677-N681 PolarHBondContact O-N 3.47Å; T677-N681 PolarHBondContact O-ND2 3Å
678A55.2Low59.3Low61 Ų61100.3 Ų100.350%0.50453%0.529SS..Hα-helixtrans-75.6-35.2168.600000111.1S674 D675S674-A678 WeakPolarHBondContact O-CA 3.5Å; S674-A678 WeakPolarHBondContact O-CB 3.11Å; S674-A678 PolarHBondContact O-N 2.84Å; D675-A678 CarbonylContact O-C 3.56Å; D675-A678 PolarHBondContact O-N 2.96Å
679S59.2Low58.5Low92 Ų9299.5 Ų99.564%0.64353%0.528SS*.Hα-helixtrans-81.5-24178.2-178.30000113.2D675 L676D675-S679 WeakPolarHBondContact O-CA 3.11Å; D675-S679 WeakPolarHBondContact O-CB 3.46Å; D675-S679 PolarHBondContact O-N 2.83Å; L676-S679 CarbonylContact O-C 3.58Å; L676-S679 PolarHBondContact O-N 3.15Å
680C50.2Low58.1Low86 Ų8695.9 Ų95.958%0.58152%0.518SS*.Hα-helixtrans-125.43.6-176.6-640000113.9L676 L682L676-C680 VanDerWaalsContact O-CA 3.28Å; L676-C680 WeakPolarHBondContact O-CA 3.19Å; L676-C680 WeakPolarHBondContact O-CB 3.42Å; L676-C680 PolarHBondContact O-N 3.36Å; C680-L682 PolarHBondContact O-N 2.97Å
681N48.4Very low57.5Low89 Ų8996.9 Ų96.948%0.47652%0.518SS..  trans-71.197.9154.6-77.3-18.1000106.4T677 K683 D684T677-N681 WeakPolarHBondContact CG2-ND2 3.27Å; T677-N681 WeakPolarHBondContact O-CA 3.46Å; T677-N681 WeakPolarHBondContact O-CB 3.33Å; T677-N681 PolarHBondContact O-N 3.47Å; T677-N681 PolarHBondContact O-ND2 3Å; N681-K683 HydrophobicContact CB-CB 4.24Å; N681-K683 PolarHBondContact O-N 3.23Å; N681-D684 PolarHBondContact O-N 3.39Å
682L50.2Low56.7Low122 Ų12299 Ų9964%0.63952%0.524SS*.THydrogen-bonded Turntrans-18.7-8.2137.4-152.3121.6000116C680 D684 L686C680-L682 PolarHBondContact O-N 2.97Å; L682-D684 VanDerWaalsContact C-N 3.34Å; L682-L686 HydrophobicContact CD2-CB 4.44Å; L682-L686 VanDerWaalsContact O-CA 3.28Å; L682-L686 WeakPolarHBondContact O-CA 3.3Å; L682-L686 WeakPolarHBondContact O-CB 3.29Å; L682-L686 PolarHBondContact O-N 3.18Å
683K53.7Low56.1Low147 Ų14799.8 Ų99.864%0.63953%0.529SS*.Hα-helixtrans-70.4-23.8164.1-156.3157.6-169.71700113.6N681 L686 L687N681-K683 HydrophobicContact CB-CB 4.24Å; N681-K683 PolarHBondContact O-N 3.23Å; K683-L686 CarbonylContact O-C 3.6Å; K683-L687 HydrophobicContact CG-CD1 4.29Å; K683-L687 WeakPolarHBondContact O-CA 3.4Å; K683-L687 WeakPolarHBondContact O-CB 3.47Å; K683-L687 WeakPolarHBondContact O-CD1 3.41Å; K683-L687 VanDerWaalsContact O-CG 3.25Å; K683-L687 WeakPolarHBondContact O-CG 3.48Å; K683-L687 PolarHBondContact O-N 3.27Å
684D56.5Low55.6Low106 Ų10695.4 Ų95.457%0.56751%0.514SS*.Hα-helixtrans-87.1-31.6171.7-80.1-0000112.1N681 L682 L687 E688N681-D684 PolarHBondContact O-N 3.39Å; L682-D684 VanDerWaalsContact C-N 3.34Å; D684-L687 PolarHBondContact O-N 2.94Å; D684-E688 WeakPolarHBondContact O-CB 3.22Å; D684-E688 PolarHBondContact O-N 3.5Å
685H49.7Very low54.8Low137 Ų13795.7 Ų95.763%0.63452%0.516SS*.Hα-helixtrans-77.6-25165.8-71.7-48.7000113.1L689H685-L689 WeakPolarHBondContact O-CA 3.42Å; H685-L689 WeakPolarHBondContact O-CB 3.3Å; H685-L689 WeakPolarHBondContact O-CG 3.26Å; H685-L689 PolarHBondContact O-N 3.37Å
686L55.7Low54Low95 Ų9598.2 Ų98.250%0.49753%0.525SS..Hα-helixtrans-84.8-21.8168.8-164.783.5000110.4L682 K683 S690L682-L686 HydrophobicContact CD2-CB 4.44Å; L682-L686 VanDerWaalsContact O-CA 3.28Å; L682-L686 WeakPolarHBondContact O-CA 3.3Å; L682-L686 WeakPolarHBondContact O-CB 3.29Å; L682-L686 PolarHBondContact O-N 3.18Å; K683-L686 CarbonylContact O-C 3.6Å; L686-S690 VanDerWaalsContact O-CA 3.24Å; L686-S690 WeakPolarHBondContact O-CA 3.28Å; L686-S690 WeakPolarHBondContact O-CB 3.41Å; L686-S690 PolarHBondContact O-N 2.97Å; L686-S690 PolarHBondContact O-OG 3.49Å
687L60.5Low53.3Low96 Ų96100.5 Ų100.550%0.50353%0.531SS..Hα-helixtrans-77.9-31.9165.3-92.6158.3000109.9K683 D684 S690 R691K683-L687 HydrophobicContact CG-CD1 4.29Å; K683-L687 WeakPolarHBondContact O-CA 3.4Å; K683-L687 WeakPolarHBondContact O-CB 3.47Å; K683-L687 WeakPolarHBondContact O-CD1 3.41Å; K683-L687 VanDerWaalsContact O-CG 3.25Å; K683-L687 WeakPolarHBondContact O-CG 3.48Å; K683-L687 PolarHBondContact O-N 3.27Å; D684-L687 PolarHBondContact O-N 2.94Å; L687-S690 CarbonylContact O-C 3.59Å; L687-R691 VanDerWaalsContact O-CA 3.29Å; L687-R691 WeakPolarHBondContact O-CA 3.41Å; L687-R691 WeakPolarHBondContact O-CB 3.36Å; L687-R691 PolarHBondContact O-N 3.04Å
688E56.7Low52.5Low89 Ų89104.7 Ų104.742%0.41654%0.544SS..Hα-helixtrans-80.2-34.7174.4-158.362.6-157.500110.9D684 R691 L692D684-E688 WeakPolarHBondContact O-CB 3.22Å; D684-E688 PolarHBondContact O-N 3.5Å; E688-R691 CarbonylContact O-C 3.59Å; E688-R691 PolarHBondContact O-N 3.1Å; E688-L692 VanDerWaalsContact O-CB 3.27Å; E688-L692 WeakPolarHBondContact O-CB 3.46Å; E688-L692 VanDerWaalsContact O-CG 3.25Å; E688-L692 WeakPolarHBondContact O-CG 3.47Å; E688-L692 PolarHBondContact O-N 3.45Å
689L52.4Low52Low98 Ų98104.9 Ų104.951%0.51355%0.546SS..Hα-helixtrans-74.7-30.6167.5-71.2171000111.7H685 R691 E693H685-L689 WeakPolarHBondContact O-CA 3.42Å; H685-L689 WeakPolarHBondContact O-CB 3.3Å; H685-L689 WeakPolarHBondContact O-CG 3.26Å; H685-L689 PolarHBondContact O-N 3.37Å; L689-R691 VanDerWaalsContact C-N 3.3Å; L689-E693 WeakPolarHBondContact O-CA 3.45Å; L689-E693 WeakPolarHBondContact O-CB 3.43Å; L689-E693 WeakPolarHBondContact O-CG 3.46Å; L689-E693 PolarHBondContact O-N 3.06Å
690S60.9Low51.1Low51 Ų51106.7 Ų106.736%0.35755%0.548SS..Hα-helixtrans-80.5-11.5167.2-59.90000111.6L686 L687 A694L686-S690 VanDerWaalsContact O-CA 3.24Å; L686-S690 WeakPolarHBondContact O-CA 3.28Å; L686-S690 WeakPolarHBondContact O-CB 3.41Å; L686-S690 PolarHBondContact O-N 2.97Å; L686-S690 PolarHBondContact O-OG 3.49Å; L687-S690 CarbonylContact O-C 3.59Å; S690-A694 VanDerWaalsContact O-CA 3.24Å; S690-A694 WeakPolarHBondContact O-CA 3.36Å; S690-A694 WeakPolarHBondContact O-CB 3.23Å; S690-A694 PolarHBondContact O-N 3.19Å
691R56Low50.6Low171 Ų171109.4 Ų109.465%0.64555%0.552SS**Hα-helixtrans-94.3-23.7172.7-176.1-179.8-174173.70.6110.3L687 E688 L689 S695L687-R691 VanDerWaalsContact O-CA 3.29Å; L687-R691 WeakPolarHBondContact O-CA 3.41Å; L687-R691 WeakPolarHBondContact O-CB 3.36Å; L687-R691 PolarHBondContact O-N 3.04Å; E688-R691 CarbonylContact O-C 3.59Å; E688-R691 PolarHBondContact O-N 3.1Å; L689-R691 VanDerWaalsContact C-N 3.3Å; R691-S695 WeakPolarHBondContact O-CA 3.34Å; R691-S695 WeakPolarHBondContact O-CB 3.42Å; R691-S695 PolarHBondContact O-N 2.97Å; R691-S695 PolarHBondContact O-OG 2.97Å
692L53.8Low50.3Low97 Ų97108.4 Ų108.451%0.50855%0.552SS.*Hα-helixtrans-80.3-41.8163.6-70.2172.6000110.4E688 S695 E696E688-L692 VanDerWaalsContact O-CB 3.27Å; E688-L692 WeakPolarHBondContact O-CB 3.46Å; E688-L692 VanDerWaalsContact O-CG 3.25Å; E688-L692 WeakPolarHBondContact O-CG 3.47Å; E688-L692 PolarHBondContact O-N 3.45Å; L692-S695 WeakPolarHBondContact CA-OG 3.46Å; L692-S695 PolarHBondContact O-N 3.36Å; L692-S695 PolarHBondContact O-OG 3.32Å; L692-E696 WeakPolarHBondContact O-CB 3.48Å; L692-E696 PolarHBondContact O-N 3.26Å
693E52.4Low50Low111 Ų111106.9 Ų106.952%0.51955%0.552SS.*Hα-helixtrans-75.6-29173-72.7-177.4175.500112.4L689 K697L689-E693 WeakPolarHBondContact O-CA 3.45Å; L689-E693 WeakPolarHBondContact O-CB 3.43Å; L689-E693 WeakPolarHBondContact O-CG 3.46Å; L689-E693 PolarHBondContact O-N 3.06Å; E693-K697 WeakPolarHBondContact O-CB 3.46Å; E693-K697 VanDerWaalsContact O-CG 3.29Å; E693-K697 WeakPolarHBondContact O-CG 3.43Å; E693-K697 PolarHBondContact O-N 3.03Å
694A51.2Low49.4Very low40 Ų40104.7 Ų104.733%0.33155%0.547SS..Hα-helixtrans-85.2-16.9167.800000112.6S690 F698S690-A694 VanDerWaalsContact O-CA 3.24Å; S690-A694 WeakPolarHBondContact O-CA 3.36Å; S690-A694 WeakPolarHBondContact O-CB 3.23Å; S690-A694 PolarHBondContact O-N 3.19Å; A694-F698 HydrophobicContact CB-CD2 4.26Å; A694-F698 WeakPolarHBondContact O-CB 3.47Å; A694-F698 WeakPolarHBondContact O-CD2 3.2Å; A694-F698 PolarHBondContact O-N 3.49Å
695S48.9Very low48.6Very low69 Ų69110.1 Ų110.148%0.48356%0.56SS.*Hα-helixtrans-80.6-23.8163.972.40000111.8R691 L692 A699R691-S695 WeakPolarHBondContact O-CA 3.34Å; R691-S695 WeakPolarHBondContact O-CB 3.42Å; R691-S695 PolarHBondContact O-N 2.97Å; R691-S695 PolarHBondContact O-OG 2.97Å; L692-S695 WeakPolarHBondContact CA-OG 3.46Å; L692-S695 PolarHBondContact O-N 3.36Å; L692-S695 PolarHBondContact O-OG 3.32Å; S695-A699 PolarHBondContact O-N 2.83Å
696E45.1Very low48.3Very low144 Ų144108.1 Ų108.167%0.67355%0.554SS**Hα-helixtrans-82.4-27171.5-154.7163.8-151.400111.4L692L692-E696 WeakPolarHBondContact O-CB 3.48Å; L692-E696 PolarHBondContact O-N 3.26Å
697K44.7Very low47.8Very low148 Ų148109.3 Ų109.364%0.64356%0.561SS**Hα-helixtrans-94.2-12.6171.3-67.6178.7-178.1171.50115.4E693 A699 D700E693-K697 WeakPolarHBondContact O-CB 3.46Å; E693-K697 VanDerWaalsContact O-CG 3.29Å; E693-K697 WeakPolarHBondContact O-CG 3.43Å; E693-K697 PolarHBondContact O-N 3.03Å; K697-A699 VanDerWaalsContact C-N 3.32Å; K697-D700 PolarHBondContact O-N 3.26Å
698F41.7Very low47.2Very low149 Ų149107 Ų10765%0.65455%0.55SS**Hα-helixtrans-85.5-4.4161.9-87.2-81.2000113.5A694 S702A694-F698 HydrophobicContact CB-CD2 4.26Å; A694-F698 WeakPolarHBondContact O-CB 3.47Å; A694-F698 WeakPolarHBondContact O-CD2 3.2Å; A694-F698 PolarHBondContact O-N 3.49Å; F698-S702 PolarHBondContact O-OG 3.43Å
699A43.1Very low46.9Very low65 Ų65105.2 Ų105.254%0.53755%0.548SS..Hα-helixtrans-78.8-19159.800000112.9S695 K697S695-A699 PolarHBondContact O-N 2.83Å; K697-A699 VanDerWaalsContact C-N 3.32Å
700D40.7Very low46.8Very low131 Ų131106.4 Ų106.470%0.70155%0.552SS**Hα-helixtrans-106.2-4.4-177.4-80.5-11.6000116.5K697K697-D700 PolarHBondContact O-N 3.26Å
701E40.3Very low46.7Very low142 Ų142110.5 Ų110.566%0.66457%0.566SS**Hα-helixtrans-131.43.6169.9-87.7-169.3166.300117.6S703 N704E701-S703 PolarHBondContact O-N 2.65Å; E701-N704 PolarHBondContact O-N 3.02Å
702S42.8Very low46.9Very low68 Ų68107.5 Ų107.548%0.47656%0.559SS.*THydrogen-bonded Turntrans-77.4-2.1156.958.90000113.1F698 N704F698-S702 PolarHBondContact O-OG 3.43Å; S702-N704 VanDerWaalsContact C-N 3.29Å
703S44.1Very low47.2Very low90 Ų90105.1 Ų105.163%0.62955%0.546SS*.THydrogen-bonded Turntrans-75.8-12.1158.2-1490000113.4E701E701-S703 PolarHBondContact O-N 2.65Å
704N41Very low47.9Very low102 Ų102105.5 Ų105.555%0.54555%0.546SS..SBendtrans-110.33.9176.7-151.228000115.5E701 S702 N707E701-N704 PolarHBondContact O-N 3.02Å; S702-N704 VanDerWaalsContact C-N 3.29Å; N704-N707 PolarHBondContact OD1-ND2 3.35Å
705R39.1Very low48.9Very low220 Ų220106.2 Ų106.283%0.8355%0.552SS**SBendtrans-96.61.9153.7-91.8-173.1174-179.1-0.5114.1V708R705-V708 WeakPolarHBondContact O-CG2 3.2Å
706N43.9Very low50.2Low94 Ų94108.3 Ų108.350%0.50356%0.555SS.*  trans-106.420.3167.3-74-7.5000113.4L713N706-L713 HydrophobicContact CB-CD1 4.23Å; N706-L713 WeakPolarHBondContact O-CD1 3.26Å
707N43.9Very low51.4Low121 Ų121106.6 Ų106.665%0.64755%0.55SS**  trans-89.631.8145.8-73.8-30.1000110.5N704 S709N704-N707 PolarHBondContact OD1-ND2 3.35Å; N707-S709 PolarHBondContact O-N 2.9Å
708V48.2Very low53Low47 Ų47105.5 Ų105.529%0.28555%0.547SS..SBendtrans-50.1106.3132.81670000103.6R705 E712 L713R705-V708 WeakPolarHBondContact O-CG2 3.2Å; V708-E712 WeakPolarHBondContact CA-OE2 3.38Å; V708-E712 HydrophobicContact CB-CB 4.47Å; V708-E712 HydrophobicContact CG1-CB 3.21Å; V708-E712 HydrophobicContact CG1-CG 4.21Å; V708-E712 WeakPolarHBondContact CG1-OE2 3.47Å; V708-L713 HydrophobicContact CG1-CG 4.26Å
709S49.7Very low54.8Low52 Ų52101.7 Ų101.736%0.36454%0.539SS..  trans-44.8147.1-161.962.80000110.7N707 E711 E712 L713N707-S709 PolarHBondContact O-N 2.9Å; S709-E711 CarbonylContact O-C 3.41Å; S709-E711 PolarHBondContact O-N 3.41Å; S709-E712 PolarHBondContact N-OE2 2.92Å; S709-E712 WeakPolarHBondContact O-CA 3.37Å; S709-E712 PolarHBondContact O-N 3.39Å; S709-E712 PolarHBondContact OG-N 2.99Å; S709-L713 PolarHBondContact O-N 2.89Å
710M50.4Low56.4Low122 Ų122102.7 Ų102.760%0.60154%0.535SS*.Hα-helixtrans-46.8-26.8175.7-173.696-96.700112K714M710-K714 HydrophobicContact CG-CD 4.39Å; M710-K714 WeakPolarHBondContact O-CB 3.41Å; M710-K714 WeakPolarHBondContact O-CG 3.35Å; M710-K714 PolarHBondContact O-N 3.48Å
711E60.3Low58.4Low137 Ų137101.9 Ų101.964%0.6453%0.53SS*.Hα-helixtrans-65.9-46.9167.3-102.573.7-133.600115S709 K714 A715S709-E711 CarbonylContact O-C 3.41Å; S709-E711 PolarHBondContact O-N 3.41Å; E711-K714 PolarHBondContact O-N 2.88Å; E711-A715 WeakPolarHBondContact O-CB 3.06Å; E711-A715 PolarHBondContact O-N 3.43Å
712E59.5Low60.3Low108 Ų108101.1 Ų101.151%0.50553%0.528SS..Hα-helixtrans-70.2-36.4176.4-75.6174.7144.200112.3V708 S709 A715 Q716V708-E712 WeakPolarHBondContact CA-OE2 3.38Å; V708-E712 HydrophobicContact CB-CB 4.47Å; V708-E712 HydrophobicContact CG1-CB 3.21Å; V708-E712 HydrophobicContact CG1-CG 4.21Å; V708-E712 WeakPolarHBondContact CG1-OE2 3.47Å; S709-E712 PolarHBondContact N-OE2 2.92Å; S709-E712 WeakPolarHBondContact O-CA 3.37Å; S709-E712 PolarHBondContact O-N 3.39Å; S709-E712 PolarHBondContact OG-N 2.99Å; E712-A715 CarbonylContact O-C 3.52Å; E712-A715 PolarHBondContact O-N 3.27Å; E712-Q716 VanDerWaalsContact O-CB 3.31Å; E712-Q716 WeakPolarHBondContact O-CB 3.18Å; E712-Q716 PolarHBondContact O-N 3.44Å
713L59.5Low62Low47 Ų47102.6 Ų102.625%0.24653%0.527CS..Hα-helixtrans-69.9-37.4172.7-89.9171.4000111.7N706 V708 S709 N717N706-L713 HydrophobicContact CB-CD1 4.23Å; N706-L713 WeakPolarHBondContact O-CD1 3.26Å; V708-L713 HydrophobicContact CG1-CG 4.26Å; S709-L713 PolarHBondContact O-N 2.89Å; L713-N717 VanDerWaalsContact O-CB 3.3Å; L713-N717 WeakPolarHBondContact O-CB 3.48Å; L713-N717 PolarHBondContact O-N 3.1Å
714K67.9Low63.6Low119 Ų119102.9 Ų102.952%0.51752%0.522SS..Hα-helixtrans-66.2-39.4169.2-81.5174.3-178.4172.80111.2M710 E711 N717 Q718M710-K714 HydrophobicContact CG-CD 4.39Å; M710-K714 WeakPolarHBondContact O-CB 3.41Å; M710-K714 WeakPolarHBondContact O-CG 3.35Å; M710-K714 PolarHBondContact O-N 3.48Å; E711-K714 PolarHBondContact O-N 2.88Å; K714-N717 PolarHBondContact O-N 2.95Å; K714-Q718 WeakPolarHBondContact O-CB 3.36Å; K714-Q718 PolarHBondContact O-N 2.95Å
715A72.8Confident65.6Low55 Ų55104.2 Ų104.246%0.45552%0.523SS..Hα-helixtrans-68.5-38.8177.200000111.7E711 E712 S719E711-A715 WeakPolarHBondContact O-CB 3.06Å; E711-A715 PolarHBondContact O-N 3.43Å; E712-A715 CarbonylContact O-C 3.52Å; E712-A715 PolarHBondContact O-N 3.27Å; A715-S719 WeakPolarHBondContact O-CA 3.31Å; A715-S719 WeakPolarHBondContact O-CB 3.35Å; A715-S719 PolarHBondContact O-N 2.91Å
716Q75.1Confident67.7Low114 Ų114102.5 Ų102.553%0.53352%0.516SS..Hα-helixtrans-67.2-42.7171.6-86.1-174-19.600111.2E712 S719 L720E712-Q716 VanDerWaalsContact O-CB 3.31Å; E712-Q716 WeakPolarHBondContact O-CB 3.18Å; E712-Q716 PolarHBondContact O-N 3.44Å; Q716-S719 PolarHBondContact O-N 3.43Å; Q716-L720 VanDerWaalsContact O-CB 3.23Å; Q716-L720 WeakPolarHBondContact O-CB 3.44Å; Q716-L720 VanDerWaalsContact O-CG 3.22Å; Q716-L720 WeakPolarHBondContact O-CG 3.3Å; Q716-L720 PolarHBondContact O-N 3.19Å
717N70Confident69.5Low108 Ų108101.7 Ų101.758%0.57851%0.511SS*.Hα-helixtrans-66.6-39.3175.3-110.9-47.5000111.9L713 K714 L721L713-N717 VanDerWaalsContact O-CB 3.3Å; L713-N717 WeakPolarHBondContact O-CB 3.48Å; L713-N717 PolarHBondContact O-N 3.1Å; K714-N717 PolarHBondContact O-N 2.95Å; N717-L721 WeakPolarHBondContact O-CB 3.45Å; N717-L721 PolarHBondContact O-N 3.06Å
718Q78Confident71.4Confident125 Ų125101.2 Ų101.258%0.58451%0.508SS*.Hα-helixtrans-72.1-34.6177.9-153.2173.131.800110.7K714 L721 M722K714-Q718 WeakPolarHBondContact O-CB 3.36Å; K714-Q718 PolarHBondContact O-N 2.95Å; Q718-L721 PolarHBondContact O-N 2.92Å; Q718-M722 HydrophobicContact CG-CE 4.24Å; Q718-M722 WeakPolarHBondContact O-CB 3.47Å; Q718-M722 VanDerWaalsContact O-CG 3.24Å; Q718-M722 WeakPolarHBondContact O-CG 3.49Å; Q718-M722 PolarHBondContact O-N 3.21Å
719S80.2Confident72.9Confident69 Ų69104 Ų10448%0.48352%0.518SS..Hα-helixtrans-66.6-47.3171-175.90000111.5A715 Q716 L721 M722 E723A715-S719 WeakPolarHBondContact O-CA 3.31Å; A715-S719 WeakPolarHBondContact O-CB 3.35Å; A715-S719 PolarHBondContact O-N 2.91Å; Q716-S719 PolarHBondContact O-N 3.43Å; S719-L721 VanDerWaalsContact C-N 3.29Å; S719-L721 PolarHBondContact O-N 3.45Å; S719-M722 CarbonylContact O-C 3.6Å; S719-M722 PolarHBondContact O-N 2.86Å; S719-E723 WeakPolarHBondContact O-CB 3.48Å; S719-E723 PolarHBondContact O-N 3.36Å
720L76.4Confident74.5Confident85 Ų85107 Ų10745%0.44553%0.526SS..Hα-helixtrans-65.3-33.1175.4-75172.1000111.2Q716 E723 N724Q716-L720 VanDerWaalsContact O-CB 3.23Å; Q716-L720 WeakPolarHBondContact O-CB 3.44Å; Q716-L720 VanDerWaalsContact O-CG 3.22Å; Q716-L720 WeakPolarHBondContact O-CG 3.3Å; Q716-L720 PolarHBondContact O-N 3.19Å; L720-E723 PolarHBondContact O-N 3.15Å; L720-N724 WeakPolarHBondContact O-CB 3.49Å; L720-N724 PolarHBondContact O-N 2.92Å; L720-N724 PolarHBondContact O-ND2 3.03Å
721L83.4Confident75.9Confident115 Ų115104 Ų10460%0.60252%0.515SS*.Hα-helixtrans-73.7-38175.7-164.9142.3000111.4N717 Q718 S719 K725N717-L721 WeakPolarHBondContact O-CB 3.45Å; N717-L721 PolarHBondContact O-N 3.06Å; Q718-L721 PolarHBondContact O-N 2.92Å; S719-L721 VanDerWaalsContact C-N 3.29Å; S719-L721 PolarHBondContact O-N 3.45Å; L721-K725 VanDerWaalsContact O-CB 3.26Å; L721-K725 WeakPolarHBondContact O-CB 3.26Å; L721-K725 PolarHBondContact O-N 3.03Å
722M79.4Confident77Confident125 Ų125103.1 Ų103.162%0.61651%0.511SS*.Hα-helixtrans-67.4-37.6169.9-73.5-168.2-159.800112Q718 S719 K725 R726Q718-M722 HydrophobicContact CG-CE 4.24Å; Q718-M722 WeakPolarHBondContact O-CB 3.47Å; Q718-M722 VanDerWaalsContact O-CG 3.24Å; Q718-M722 WeakPolarHBondContact O-CG 3.49Å; Q718-M722 PolarHBondContact O-N 3.21Å; S719-M722 CarbonylContact O-C 3.6Å; S719-M722 PolarHBondContact O-N 2.86Å; M722-K725 PolarHBondContact O-N 3.46Å; M722-R726 VanDerWaalsContact O-CB 3.29Å; M722-R726 WeakPolarHBondContact O-CB 3.46Å; M722-R726 PolarHBondContact O-N 3.3Å
723E78.8Confident78.1Confident99 Ų99103.9 Ų103.946%0.46352%0.518SS..Hα-helixtrans-69.3-45.3176.4-176.6170.3-166.300110.9S719 L720 K725 R726 I727S719-E723 WeakPolarHBondContact O-CB 3.48Å; S719-E723 PolarHBondContact O-N 3.36Å; L720-E723 PolarHBondContact O-N 3.15Å; E723-K725 VanDerWaalsContact C-N 3.28Å; E723-K725 PolarHBondContact O-N 3.03Å; E723-R726 CarbonylContact O-C 3.57Å; E723-R726 WeakPolarHBondContact O-CB 3.2Å; E723-R726 PolarHBondContact O-N 2.81Å; E723-R726 VanDerWaalsContact O-N 3.12Å; E723-I727 HydrophobicContact CG-CD1 3.84Å; E723-I727 HydrophobicContact CG-CG1 4.4Å; E723-I727 WeakPolarHBondContact O-CB 3.35Å; E723-I727 VanDerWaalsContact O-CG1 3.23Å; E723-I727 WeakPolarHBondContact O-CG1 3.48Å; E723-I727 PolarHBondContact O-N 3.15Å
724N78.7Confident79Confident97 Ų97106.4 Ų106.452%0.51953%0.531SS..Hα-helixtrans-61-38.8173-77.3-33.8000111.4L720 L728L720-N724 WeakPolarHBondContact O-CB 3.49Å; L720-N724 PolarHBondContact O-N 2.92Å; L720-N724 PolarHBondContact O-ND2 3.03Å; N724-L728 VanDerWaalsContact O-CB 3.32Å; N724-L728 WeakPolarHBondContact O-CB 3.34Å; N724-L728 PolarHBondContact O-N 2.66Å
725K82.3Confident79.6Confident130 Ų130106.1 Ų106.157%0.56553%0.531SS*.Hα-helixtrans-67.2-40.1174-166.9179.3178.5-174.80111.8L721 M722 E723 L728 E729L721-K725 VanDerWaalsContact O-CB 3.26Å; L721-K725 WeakPolarHBondContact O-CB 3.26Å; L721-K725 PolarHBondContact O-N 3.03Å; M722-K725 PolarHBondContact O-N 3.46Å; E723-K725 VanDerWaalsContact C-N 3.28Å; E723-K725 PolarHBondContact O-N 3.03Å; K725-L728 WeakPolarHBondContact O-CB 3.31Å; K725-L728 PolarHBondContact O-N 3.26Å; K725-E729 WeakPolarHBondContact CE-OE1 3.35Å; K725-E729 WeakPolarHBondContact O-CB 3.35Å; K725-E729 WeakPolarHBondContact O-CG 3.48Å; K725-E729 PolarHBondContact O-N 2.87Å
726R83Confident80Confident183 Ų183106.2 Ų106.269%0.69153%0.529SS*.Hα-helixtrans-65.8-42175.6-168.8-176.1-166.4-164.43.2112M722 E723 L728 E729 E730M722-R726 VanDerWaalsContact O-CB 3.29Å; M722-R726 WeakPolarHBondContact O-CB 3.46Å; M722-R726 PolarHBondContact O-N 3.3Å; E723-R726 CarbonylContact O-C 3.57Å; E723-R726 WeakPolarHBondContact O-CB 3.2Å; E723-R726 PolarHBondContact O-N 2.81Å; E723-R726 VanDerWaalsContact O-N 3.12Å; R726-L728 VanDerWaalsContact C-N 3.35Å; R726-E729 PolarHBondContact O-N 3.42Å; R726-E730 VanDerWaalsContact O-CB 3.26Å; R726-E730 WeakPolarHBondContact O-CB 3.46Å; R726-E730 PolarHBondContact O-N 3.01Å
727I82.1Confident80.5Confident78 Ų78109.7 Ų109.740%0.454%0.537SS..Hα-helixtrans-65.4-40.2174.5-67.8167.2000109.5E723 E730 V731E723-I727 HydrophobicContact CG-CD1 3.84Å; E723-I727 HydrophobicContact CG-CG1 4.4Å; E723-I727 WeakPolarHBondContact O-CB 3.35Å; E723-I727 VanDerWaalsContact O-CG1 3.23Å; E723-I727 WeakPolarHBondContact O-CG1 3.48Å; E723-I727 PolarHBondContact O-N 3.15Å; I727-E730 PolarHBondContact O-N 3.33Å; I727-V731 HydrophobicContact CG2-CG2 4.2Å; I727-V731 VanDerWaalsContact O-CB 3.25Å; I727-V731 WeakPolarHBondContact O-CB 3.45Å; I727-V731 WeakPolarHBondContact O-CG2 3.39Å; I727-V731 PolarHBondContact O-N 2.88Å
728L83.8Confident80.9Confident110 Ų110109.5 Ų109.558%0.57654%0.536SS*.Hα-helixtrans-62.4-44.2173.4-104.6151.2000112.5N724 K725 R726 V731 Q732N724-L728 VanDerWaalsContact O-CB 3.32Å; N724-L728 WeakPolarHBondContact O-CB 3.34Å; N724-L728 PolarHBondContact O-N 2.66Å; K725-L728 WeakPolarHBondContact O-CB 3.31Å; K725-L728 PolarHBondContact O-N 3.26Å; R726-L728 VanDerWaalsContact C-N 3.35Å; L728-V731 PolarHBondContact O-N 3.45Å; L728-Q732 WeakPolarHBondContact O-CB 3.42Å; L728-Q732 PolarHBondContact O-N 2.83Å
729E79.9Confident81Confident107 Ų107109.7 Ų109.750%0.554%0.537SS..Hα-helixtrans-66.2-39175.8-73.5172.3-167.900111.6K725 R726 Q732 L733K725-E729 WeakPolarHBondContact CE-OE1 3.35Å; K725-E729 WeakPolarHBondContact O-CB 3.35Å; K725-E729 WeakPolarHBondContact O-CG 3.48Å; K725-E729 PolarHBondContact O-N 2.87Å; R726-E729 PolarHBondContact O-N 3.42Å; E729-Q732 PolarHBondContact O-N 2.9Å; E729-L733 WeakPolarHBondContact O-CB 3.31Å; E729-L733 PolarHBondContact O-N 3.25Å
730E82.1Confident80.9Confident113 Ų113113.8 Ų113.853%0.52855%0.546SS..Hα-helixtrans-68.6-39.9175.1-173.5167.5-167.100111.7R726 I727 L733 L734R726-E730 VanDerWaalsContact O-CB 3.26Å; R726-E730 WeakPolarHBondContact O-CB 3.46Å; R726-E730 PolarHBondContact O-N 3.01Å; I727-E730 PolarHBondContact O-N 3.33Å; E730-L733 PolarHBondContact O-N 3.27Å; E730-L734 HydrophobicContact CG-CD1 4.27Å; E730-L734 VanDerWaalsContact O-CB 3.29Å; E730-L734 WeakPolarHBondContact O-CB 3.42Å; E730-L734 VanDerWaalsContact O-CG 3.26Å; E730-L734 WeakPolarHBondContact O-CG 3.37Å; E730-L734 PolarHBondContact O-N 3.35Å
731V80.9Confident81Confident61 Ų61112.4 Ų112.437%0.3754%0.543SS..Hα-helixtrans-65.8-41.2173.1168.70000110.6I727 L728 L734 Q735I727-V731 HydrophobicContact CG2-CG2 4.2Å; I727-V731 VanDerWaalsContact O-CB 3.25Å; I727-V731 WeakPolarHBondContact O-CB 3.45Å; I727-V731 WeakPolarHBondContact O-CG2 3.39Å; I727-V731 PolarHBondContact O-N 2.88Å; L728-V731 PolarHBondContact O-N 3.45Å; V731-L734 PolarHBondContact O-N 2.95Å; V731-Q735 HydrophobicContact CG1-CG 4.28Å; V731-Q735 VanDerWaalsContact O-CB 3.27Å; V731-Q735 WeakPolarHBondContact O-CB 3.42Å; V731-Q735 VanDerWaalsContact O-CG 3.24Å; V731-Q735 WeakPolarHBondContact O-CG 3.19Å; V731-Q735 PolarHBondContact O-N 3.46Å
732Q82.8Confident80.7Confident118 Ų118112.1 Ų112.155%0.55154%0.539SS*.Hα-helixtrans-65-38.6173.6-86.2-173.2-18.900112.3L728 E729 S736L728-Q732 WeakPolarHBondContact O-CB 3.42Å; L728-Q732 PolarHBondContact O-N 2.83Å; E729-Q732 PolarHBondContact O-N 2.9Å; Q732-S736 VanDerWaalsContact O-CB 3.31Å; Q732-S736 WeakPolarHBondContact O-CB 3.44Å; Q732-S736 PolarHBondContact O-N 2.68Å; Q732-S736 PolarHBondContact O-OG 3.3Å
733L83.9Confident80.7Confident124 Ų124111.2 Ų111.265%0.64954%0.536SS*.Hα-helixtrans-66.9-41.8175.1-163.192000111.1E729 E730 S736 R737E729-L733 WeakPolarHBondContact O-CB 3.31Å; E729-L733 PolarHBondContact O-N 3.25Å; E730-L733 PolarHBondContact O-N 3.27Å; L733-S736 PolarHBondContact O-N 3.29Å; L733-R737 WeakPolarHBondContact O-CB 3.39Å; L733-R737 PolarHBondContact O-N 3.04Å
734L77.1Confident80.7Confident99 Ų99109 Ų10952%0.51854%0.536SS..Hα-helixtrans-67.8-41.2175.6-76.3174.6000111.4E730 V731 R737 N738E730-L734 HydrophobicContact CG-CD1 4.27Å; E730-L734 VanDerWaalsContact O-CB 3.29Å; E730-L734 WeakPolarHBondContact O-CB 3.42Å; E730-L734 VanDerWaalsContact O-CG 3.26Å; E730-L734 WeakPolarHBondContact O-CG 3.37Å; E730-L734 PolarHBondContact O-N 3.35Å; V731-L734 PolarHBondContact O-N 2.95Å; L734-R737 CarbonylContact O-C 3.59Å; L734-R737 PolarHBondContact O-N 2.88Å; L734-N738 VanDerWaalsContact O-CB 3.29Å; L734-N738 WeakPolarHBondContact O-CB 3.03Å; L734-N738 PolarHBondContact O-N 3.46Å
735Q81.7Confident80.6Confident113 Ų113109 Ų10953%0.52854%0.535SS..Hα-helixtrans-61-48.4172.7-78.6174.2-17.200110.5V731 R737 N738 E739V731-Q735 HydrophobicContact CG1-CG 4.28Å; V731-Q735 VanDerWaalsContact O-CB 3.27Å; V731-Q735 WeakPolarHBondContact O-CB 3.42Å; V731-Q735 VanDerWaalsContact O-CG 3.24Å; V731-Q735 WeakPolarHBondContact O-CG 3.19Å; V731-Q735 PolarHBondContact O-N 3.46Å; Q735-R737 VanDerWaalsContact C-N 3.28Å; Q735-R737 PolarHBondContact O-N 2.9Å; Q735-N738 PolarHBondContact O-N 3.4Å; Q735-N738 VanDerWaalsContact O-N 3.17Å; Q735-E739 WeakPolarHBondContact O-CB 3.44Å; Q735-E739 WeakPolarHBondContact O-CG 3.4Å; Q735-E739 PolarHBondContact O-N 3.32Å
736S81.2Confident80.4Confident58 Ų58107.4 Ų107.441%0.40653%0.532SS..Hα-helixtrans-62.4-34.2175.2-63.70000112.7Q732 L733 K740Q732-S736 VanDerWaalsContact O-CB 3.31Å; Q732-S736 WeakPolarHBondContact O-CB 3.44Å; Q732-S736 PolarHBondContact O-N 2.68Å; Q732-S736 PolarHBondContact O-OG 3.3Å; L733-S736 PolarHBondContact O-N 3.29Å; S736-K740 WeakPolarHBondContact O-CB 3.17Å; S736-K740 VanDerWaalsContact O-CG 3.24Å; S736-K740 WeakPolarHBondContact O-CG 3.42Å; S736-K740 PolarHBondContact O-N 3.23Å; S736-K740 VanDerWaalsContact O-N 3.11Å
737R84.7Confident79.9Confident187 Ų187101.9 Ų101.971%0.70653%0.526SS*.Hα-helixtrans-75.4-35.3175.8-172.4165.9-179.298.5-0.1111.7L733 L734 Q735 S741L733-R737 WeakPolarHBondContact O-CB 3.39Å; L733-R737 PolarHBondContact O-N 3.04Å; L734-R737 CarbonylContact O-C 3.59Å; L734-R737 PolarHBondContact O-N 2.88Å; Q735-R737 VanDerWaalsContact C-N 3.28Å; Q735-R737 PolarHBondContact O-N 2.9Å; R737-S741 VanDerWaalsContact O-CB 3.24Å; R737-S741 WeakPolarHBondContact O-CB 3.38Å; R737-S741 PolarHBondContact O-N 3.29Å
738N78.7Confident79.8Confident104 Ų104101.7 Ų101.756%0.55653%0.529SS*.Hα-helixtrans-69.5-43.7174.7-122.42.4000110.3L734 Q735 S741 Q742L734-N738 VanDerWaalsContact O-CB 3.29Å; L734-N738 WeakPolarHBondContact O-CB 3.03Å; L734-N738 PolarHBondContact O-N 3.46Å; Q735-N738 PolarHBondContact O-N 3.4Å; Q735-N738 VanDerWaalsContact O-N 3.17Å; N738-S741 CarbonylContact O-C 3.58Å; N738-S741 WeakPolarHBondContact O-CB 3.4Å; N738-S741 PolarHBondContact O-N 2.84Å; N738-Q742 VanDerWaalsContact O-CB 3.29Å; N738-Q742 WeakPolarHBondContact O-CB 3.29Å; N738-Q742 PolarHBondContact O-N 3.45Å
739E79.1Confident79.4Confident129 Ų129101.1 Ų101.160%0.60352%0.523SS*.Hα-helixtrans-59.5-47.2173.7-77.3178.1167.700111.2Q735 S741 Q742 D743Q735-E739 WeakPolarHBondContact O-CB 3.44Å; Q735-E739 WeakPolarHBondContact O-CG 3.4Å; Q735-E739 PolarHBondContact O-N 3.32Å; E739-S741 VanDerWaalsContact C-N 3.31Å; E739-S741 PolarHBondContact O-N 3.04Å; E739-Q742 CarbonylContact O-C 3.6Å; E739-Q742 WeakPolarHBondContact O-CB 3.42Å; E739-Q742 PolarHBondContact O-N 3.46Å; E739-Q742 VanDerWaalsContact O-N 3.15Å; E739-D743 WeakPolarHBondContact O-CB 3.33Å; E739-D743 PolarHBondContact O-N 3.2Å
740K79.1Confident79.1Confident155 Ų15597.6 Ų97.667%0.67452%0.515SS*.Hα-helixtrans-61.3-37.5174.1-74.1172.9-175.8176.70113.2S736 A744S736-K740 WeakPolarHBondContact O-CB 3.17Å; S736-K740 VanDerWaalsContact O-CG 3.24Å; S736-K740 WeakPolarHBondContact O-CG 3.42Å; S736-K740 PolarHBondContact O-N 3.23Å; S736-K740 VanDerWaalsContact O-N 3.11Å; K740-A744 WeakPolarHBondContact O-CB 3.47Å; K740-A744 PolarHBondContact O-N 2.82Å
741S78.8Confident78.8Confident56 Ų5695 Ų9539%0.39251%0.51SS..Hα-helixtrans-66.7-43.1173.9173.10000111.1R737 N738 E739 A744 L745R737-S741 VanDerWaalsContact O-CB 3.24Å; R737-S741 WeakPolarHBondContact O-CB 3.38Å; R737-S741 PolarHBondContact O-N 3.29Å; N738-S741 CarbonylContact O-C 3.58Å; N738-S741 WeakPolarHBondContact O-CB 3.4Å; N738-S741 PolarHBondContact O-N 2.84Å; E739-S741 VanDerWaalsContact C-N 3.31Å; E739-S741 PolarHBondContact O-N 3.04Å; S741-A744 PolarHBondContact O-N 2.91Å; S741-L745 WeakPolarHBondContact O-CB 3.46Å; S741-L745 PolarHBondContact O-N 3.42Å
742Q77.4Confident78.6Confident109 Ų10996 Ų9651%0.50951%0.512SS..Hα-helixtrans-64.1-42.4177.8-151.791.56.200110.3N738 E739 L745 N746N738-Q742 VanDerWaalsContact O-CB 3.29Å; N738-Q742 WeakPolarHBondContact O-CB 3.29Å; N738-Q742 PolarHBondContact O-N 3.45Å; E739-Q742 CarbonylContact O-C 3.6Å; E739-Q742 WeakPolarHBondContact O-CB 3.42Å; E739-Q742 PolarHBondContact O-N 3.46Å; E739-Q742 VanDerWaalsContact O-N 3.15Å; Q742-L745 CarbonylContact O-C 3.57Å; Q742-L745 WeakPolarHBondContact O-CB 3.17Å; Q742-L745 PolarHBondContact O-N 3.4Å; Q742-N746 VanDerWaalsContact O-CB 3.28Å; Q742-N746 WeakPolarHBondContact O-CB 3.44Å; Q742-N746 PolarHBondContact O-N 3.45Å; Q742-N746 PolarHBondContact O-ND2 3.4Å; Q742-N746 VanDerWaalsContact O-ND2 3.16Å
743D78.6Confident78.2Confident105 Ų10593.2 Ų93.256%0.56150%0.501SS*.Hα-helixtrans-67.5-39.4176.1-72.4-20.8000111.9E739 N746 A747E739-D743 WeakPolarHBondContact O-CB 3.33Å; E739-D743 PolarHBondContact O-N 3.2Å; D743-N746 PolarHBondContact O-N 2.96Å; D743-A747 VanDerWaalsContact O-CB 3.24Å; D743-A747 WeakPolarHBondContact O-CB 3.17Å; D743-A747 PolarHBondContact O-N 2.97Å
744A78.2Confident77.7Confident54 Ų5490.8 Ų90.845%0.44649%0.486SS..Hα-helixtrans-65.9-39.7172.400000111.8K740 S741 T748K740-A744 WeakPolarHBondContact O-CB 3.47Å; K740-A744 PolarHBondContact O-N 2.82Å; S741-A744 PolarHBondContact O-N 2.91Å; A744-T748 WeakPolarHBondContact O-CB 3.27Å; A744-T748 VanDerWaalsContact O-CG2 3.27Å; A744-T748 WeakPolarHBondContact O-CG2 3.43Å; A744-T748 PolarHBondContact O-N 2.88Å; A744-T748 PolarHBondContact O-OG1 2.87Å
745L77.2Confident77.8Confident96 Ų9692.1 Ų92.150%0.50349%0.488SS..Hα-helixtrans-63.8-45172.5-112.5149.2000110.8S741 Q742 A747 T748 Q749S741-L745 WeakPolarHBondContact O-CB 3.46Å; S741-L745 PolarHBondContact O-N 3.42Å; Q742-L745 CarbonylContact O-C 3.57Å; Q742-L745 WeakPolarHBondContact O-CB 3.17Å; Q742-L745 PolarHBondContact O-N 3.4Å; L745-A747 PolarHBondContact O-N 2.81Å; L745-T748 WeakPolarHBondContact CA-OG1 3.4Å; L745-T748 PolarHBondContact O-N 2.91Å; L745-T748 PolarHBondContact O-OG1 2.81Å; L745-Q749 WeakPolarHBondContact O-CA 3.23Å; L745-Q749 WeakPolarHBondContact O-CB 3.45Å; L745-Q749 PolarHBondContact O-N 3.13Å
746N78.1Confident77.3Confident96 Ų9690.3 Ų90.351%0.51348%0.481SS..Hα-helixtrans-66.7-37.1178.3-69.6-24.1000111.9Q742 D743 G750Q742-N746 VanDerWaalsContact O-CB 3.28Å; Q742-N746 WeakPolarHBondContact O-CB 3.44Å; Q742-N746 PolarHBondContact O-N 3.45Å; Q742-N746 PolarHBondContact O-ND2 3.4Å; Q742-N746 VanDerWaalsContact O-ND2 3.16Å; D743-N746 PolarHBondContact O-N 2.96Å; N746-G750 PolarHBondContact O-N 3.45Å
747A73.5Confident77Confident67 Ų6793.2 Ų93.255%0.55448%0.483SS*.Hα-helixtrans-70.2-41175.600000112.3D743 L745 G750 S751D743-A747 VanDerWaalsContact O-CB 3.24Å; D743-A747 WeakPolarHBondContact O-CB 3.17Å; D743-A747 PolarHBondContact O-N 2.97Å; L745-A747 PolarHBondContact O-N 2.81Å; A747-G750 PolarHBondContact O-N 3.43Å; A747-S751 WeakPolarHBondContact O-CB 3.24Å; A747-S751 PolarHBondContact O-N 2.86Å
748T79.8Confident76.3Confident75 Ų7588.8 Ų88.846%0.4647%0.471SS..Hα-helixtrans-69.8-41.6174.653.20000111.2A744 L745 G750 S751 I752A744-T748 WeakPolarHBondContact O-CB 3.27Å; A744-T748 VanDerWaalsContact O-CG2 3.27Å; A744-T748 WeakPolarHBondContact O-CG2 3.43Å; A744-T748 PolarHBondContact O-N 2.88Å; A744-T748 PolarHBondContact O-OG1 2.87Å; L745-T748 WeakPolarHBondContact CA-OG1 3.4Å; L745-T748 PolarHBondContact O-N 2.91Å; L745-T748 PolarHBondContact O-OG1 2.81Å; T748-G750 VanDerWaalsContact C-N 3.34Å; T748-G750 PolarHBondContact O-N 3.35Å; T748-S751 PolarHBondContact O-N 3.18Å; T748-I752 WeakPolarHBondContact O-CB 3.26Å; T748-I752 WeakPolarHBondContact O-CD1 3.05Å; T748-I752 WeakPolarHBondContact O-CG1 3.49Å; T748-I752 PolarHBondContact O-N 3.4Å
749Q73.8Confident76.1Confident97 Ų9789.3 Ų89.345%0.45347%0.47SS..Hα-helixtrans-59.2-44.5171.9-166.579.92.500110.6L745 S751 I752 D753L745-Q749 WeakPolarHBondContact O-CA 3.23Å; L745-Q749 WeakPolarHBondContact O-CB 3.45Å; L745-Q749 PolarHBondContact O-N 3.13Å; Q749-S751 PolarHBondContact O-N 3.43Å; Q749-I752 PolarHBondContact O-N 2.82Å; Q749-D753 WeakPolarHBondContact O-CB 3.46Å; Q749-D753 PolarHBondContact O-N 3.28Å
750G74.8Confident75.8Confident33 Ų3387 Ų8734%0.3446%0.461SS..Hα-helixtrans-63.3-38.4175.300000113.4N746 A747 T748 E754N746-G750 PolarHBondContact O-N 3.45Å; A747-G750 PolarHBondContact O-N 3.43Å; T748-G750 VanDerWaalsContact C-N 3.34Å; T748-G750 PolarHBondContact O-N 3.35Å; G750-E754 VanDerWaalsContact O-CB 3.32Å; G750-E754 WeakPolarHBondContact O-CB 3.38Å; G750-E754 PolarHBondContact O-N 2.99Å
751S76.3Confident75.5Confident59 Ų5986.5 Ų86.541%0.41345%0.454SS..Hα-helixtrans-70.9-39.8175.1-172.80000112.5A747 T748 Q749 E754 K755A747-S751 WeakPolarHBondContact O-CB 3.24Å; A747-S751 PolarHBondContact O-N 2.86Å; T748-S751 PolarHBondContact O-N 3.18Å; Q749-S751 PolarHBondContact O-N 3.43Å; S751-E754 PolarHBondContact O-N 2.93Å; S751-K755 WeakPolarHBondContact O-CB 3.42Å; S751-K755 WeakPolarHBondContact O-CG 3.36Å; S751-K755 PolarHBondContact O-N 3.39Å
752I75.8Confident74.8Confident83 Ų8389.9 Ų89.943%0.42646%0.464SS..Hα-helixtrans-66.1-46.3175-69.7163.8000109.4T748 Q749 E754 K755 I756T748-I752 WeakPolarHBondContact O-CB 3.26Å; T748-I752 WeakPolarHBondContact O-CD1 3.05Å; T748-I752 WeakPolarHBondContact O-CG1 3.49Å; T748-I752 PolarHBondContact O-N 3.4Å; Q749-I752 PolarHBondContact O-N 2.82Å; I752-E754 VanDerWaalsContact C-N 3.32Å; I752-E754 PolarHBondContact O-N 3.32Å; I752-K755 CarbonylContact O-C 3.59Å; I752-K755 WeakPolarHBondContact O-CB 3.37Å; I752-K755 PolarHBondContact O-N 2.97Å; I752-I756 HydrophobicContact CG2-CD1 3.65Å; I752-I756 HydrophobicContact CG2-CG1 4.31Å; I752-I756 WeakPolarHBondContact O-CB 3.32Å; I752-I756 VanDerWaalsContact O-CG1 3.23Å; I752-I756 WeakPolarHBondContact O-CG1 3.43Å; I752-I756 PolarHBondContact O-N 3.1Å
753D75Confident74Confident59 Ų5990 Ų9032%0.31647%0.468SS..Hα-helixtrans-63.1-37.2176.5-76.8-14.8000111.6Q749 I756 R757Q749-D753 WeakPolarHBondContact O-CB 3.46Å; Q749-D753 PolarHBondContact O-N 3.28Å; D753-I756 PolarHBondContact O-N 2.93Å; D753-R757 VanDerWaalsContact O-CB 3.29Å; D753-R757 WeakPolarHBondContact O-CB 3.34Å; D753-R757 VanDerWaalsContact O-CG 3.23Å; D753-R757 WeakPolarHBondContact O-CG 3.34Å; D753-R757 PolarHBondContact O-N 3.3Å
754E73.3Confident73Confident72 Ų7291.9 Ų91.934%0.33647%0.471SS..Hα-helixtrans-71.1-38174.8-165.656.2-146.900112.1G750 S751 I752 R757 Q758 R761G750-E754 VanDerWaalsContact O-CB 3.32Å; G750-E754 WeakPolarHBondContact O-CB 3.38Å; G750-E754 PolarHBondContact O-N 2.99Å; S751-E754 PolarHBondContact O-N 2.93Å; I752-E754 VanDerWaalsContact C-N 3.32Å; I752-E754 PolarHBondContact O-N 3.32Å; E754-R757 PolarHBondContact O-N 3Å; E754-R757 IonicContact OE2-CZ 3.37Å; E754-R757 IonicContact OE2-NE 2.9Å; E754-R757 PolarHBondContact OE2-NE 2.94Å; E754-R757 IonicContact OE2-NH2 2.92Å; E754-R757 PolarHBondContact OE2-NH2 3.1Å; E754-Q758 WeakPolarHBondContact O-CB 3.24Å; E754-Q758 WeakPolarHBondContact O-CG 3.25Å; E754-Q758 PolarHBondContact O-N 3.09Å; E754-R761 IonicContact OE1-NH2 2.94Å; E754-R761 PolarHBondContact OE1-NH2 2.93Å
755K78.3Confident71.8Confident128 Ų12895.1 Ų95.156%0.55748%0.48SS*.Hα-helixtrans-63.2-42.2171-80.2177179.1178.20111.7S751 I752 Q758 Q759S751-K755 WeakPolarHBondContact O-CB 3.42Å; S751-K755 WeakPolarHBondContact O-CG 3.36Å; S751-K755 PolarHBondContact O-N 3.39Å; I752-K755 CarbonylContact O-C 3.59Å; I752-K755 WeakPolarHBondContact O-CB 3.37Å; I752-K755 PolarHBondContact O-N 2.97Å; K755-Q758 PolarHBondContact O-N 3.45Å; K755-Q759 WeakPolarHBondContact O-CB 3.29Å; K755-Q759 WeakPolarHBondContact O-CG 3.1Å; K755-Q759 PolarHBondContact O-N 2.77Å
756I72.7Confident70.6Confident74 Ų7493.6 Ų93.638%0.37948%0.475SS..Hα-helixtrans-65-43.7175.1-70.2169000109.5I752 D753 Q758 Q759 I760I752-I756 HydrophobicContact CG2-CD1 3.65Å; I752-I756 HydrophobicContact CG2-CG1 4.31Å; I752-I756 WeakPolarHBondContact O-CB 3.32Å; I752-I756 VanDerWaalsContact O-CG1 3.23Å; I752-I756 WeakPolarHBondContact O-CG1 3.43Å; I752-I756 PolarHBondContact O-N 3.1Å; D753-I756 PolarHBondContact O-N 2.93Å; I756-Q758 VanDerWaalsContact C-N 3.33Å; I756-Q758 PolarHBondContact O-N 3.24Å; I756-Q759 PolarHBondContact O-N 3.5Å; I756-I760 HydrophobicContact CG2-CD1 3.65Å; I756-I760 HydrophobicContact CG2-CG1 4.31Å; I756-I760 VanDerWaalsContact O-CB 3.32Å; I756-I760 WeakPolarHBondContact O-CB 3.33Å; I756-I760 WeakPolarHBondContact O-CG1 2.96Å; I756-I760 PolarHBondContact O-N 3.45Å
757R73.2Confident69Low120 Ų12095.4 Ų95.445%0.45348%0.481SS..Hα-helixtrans-63.6-34.8174.5-77.4-173.4-68.8-95.5-0.6112.7D753 E754 R761D753-R757 VanDerWaalsContact O-CB 3.29Å; D753-R757 WeakPolarHBondContact O-CB 3.34Å; D753-R757 VanDerWaalsContact O-CG 3.23Å; D753-R757 WeakPolarHBondContact O-CG 3.34Å; D753-R757 PolarHBondContact O-N 3.3Å; E754-R757 PolarHBondContact O-N 3Å; E754-R757 IonicContact OE2-CZ 3.37Å; E754-R757 IonicContact OE2-NE 2.9Å; E754-R757 PolarHBondContact OE2-NE 2.94Å; E754-R757 IonicContact OE2-NH2 2.92Å; E754-R757 PolarHBondContact OE2-NH2 3.1Å; R757-R761 WeakPolarHBondContact O-CG 3.4Å; R757-R761 PolarHBondContact O-N 2.83Å; R757-R761 PolarHBondContact O-NE 3.48Å
758Q71.8Confident67.9Low94 Ų9496.8 Ų96.844%0.43949%0.487SS..Hα-helixtrans-69-49.2172.8-80.5-179.5-8.500111.5E754 K755 I756 I760 R761 E762E754-Q758 WeakPolarHBondContact O-CB 3.24Å; E754-Q758 WeakPolarHBondContact O-CG 3.25Å; E754-Q758 PolarHBondContact O-N 3.09Å; K755-Q758 PolarHBondContact O-N 3.45Å; I756-Q758 VanDerWaalsContact C-N 3.33Å; I756-Q758 PolarHBondContact O-N 3.24Å; Q758-I760 VanDerWaalsContact C-N 3.27Å; Q758-I760 PolarHBondContact O-N 2.74Å; Q758-R761 CarbonylContact O-C 3.57Å; Q758-R761 WeakPolarHBondContact O-CA 3.37Å; Q758-R761 WeakPolarHBondContact O-CB 3.43Å; Q758-R761 PolarHBondContact O-N 2.88Å; Q758-E762 WeakPolarHBondContact O-CG 3.36Å; Q758-E762 PolarHBondContact O-N 3.02Å
759Q74.6Confident66.2Low115 Ų115100.1 Ų100.154%0.53749%0.493SS..Hα-helixtrans-60.7-36.3175.4-77.7177-2400111.9K755 I756 E762 L763K755-Q759 WeakPolarHBondContact O-CB 3.29Å; K755-Q759 WeakPolarHBondContact O-CG 3.1Å; K755-Q759 PolarHBondContact O-N 2.77Å; I756-Q759 PolarHBondContact O-N 3.5Å; Q759-E762 PolarHBondContact O-N 3.42Å; Q759-L763 WeakPolarHBondContact O-CB 3.25Å; Q759-L763 WeakPolarHBondContact O-CG 3.36Å; Q759-L763 PolarHBondContact O-N 3.22Å
760I72.5Confident64.8Low81 Ų81100.2 Ų100.242%0.41550%0.5SS..Hα-helixtrans-67.6-37.9173.2-71.5168000111I756 Q758 K764I756-I760 HydrophobicContact CG2-CD1 3.65Å; I756-I760 HydrophobicContact CG2-CG1 4.31Å; I756-I760 VanDerWaalsContact O-CB 3.32Å; I756-I760 WeakPolarHBondContact O-CB 3.33Å; I756-I760 WeakPolarHBondContact O-CG1 2.96Å; I756-I760 PolarHBondContact O-N 3.45Å; Q758-I760 VanDerWaalsContact C-N 3.27Å; Q758-I760 PolarHBondContact O-N 2.74Å; I760-K764 HydrophobicContact CG2-CD 4.25Å; I760-K764 HydrophobicContact CG2-CG 4.48Å; I760-K764 WeakPolarHBondContact O-CB 3.47Å; I760-K764 VanDerWaalsContact O-CG 3.31Å; I760-K764 WeakPolarHBondContact O-CG 3.34Å; I760-K764 PolarHBondContact O-N 2.81Å
761R72.6Confident63.4Low143 Ų143101.3 Ų101.354%0.5451%0.511SS..Hα-helixtrans-65.5-43.2173.4-81.9-178.5-78.1155-13.7111.7E754 R757 Q758 K764 L765E754-R761 IonicContact OE1-NH2 2.94Å; E754-R761 PolarHBondContact OE1-NH2 2.93Å; R757-R761 WeakPolarHBondContact O-CG 3.4Å; R757-R761 PolarHBondContact O-N 2.83Å; R757-R761 PolarHBondContact O-NE 3.48Å; Q758-R761 CarbonylContact O-C 3.57Å; Q758-R761 WeakPolarHBondContact O-CA 3.37Å; Q758-R761 WeakPolarHBondContact O-CB 3.43Å; Q758-R761 PolarHBondContact O-N 2.88Å; R761-K764 PolarHBondContact O-N 3.39Å; R761-L765 PolarHBondContact O-N 2.79Å
762E64.4Low62.1Low128 Ų128106 Ų10660%0.59853%0.531SS*.Hα-helixtrans-66.2-44.2176-71.7-179.5174.500111.8Q758 Q759 L765 V766Q758-E762 WeakPolarHBondContact O-CG 3.36Å; Q758-E762 PolarHBondContact O-N 3.02Å; Q759-E762 PolarHBondContact O-N 3.42Å; E762-L765 CarbonylContact O-C 3.53Å; E762-L765 WeakPolarHBondContact O-CA 3.31Å; E762-L765 VanDerWaalsContact O-CB 3.26Å; E762-L765 WeakPolarHBondContact O-CB 3.16Å; E762-L765 PolarHBondContact O-N 2.85Å; E762-L765 VanDerWaalsContact O-N 3.13Å; E762-V766 VanDerWaalsContact O-CG2 3.28Å; E762-V766 WeakPolarHBondContact O-CG2 3.49Å; E762-V766 PolarHBondContact O-N 2.67Å
763L59.8Low60.5Low112 Ų112108 Ų10859%0.58655%0.549SS*.Hα-helixtrans-67.7-36.9176.1-74.4170.2000112Q759 L765 V766 M767Q759-L763 WeakPolarHBondContact O-CB 3.25Å; Q759-L763 WeakPolarHBondContact O-CG 3.36Å; Q759-L763 PolarHBondContact O-N 3.22Å; L763-L765 PolarHBondContact O-N 3.39Å; L763-V766 PolarHBondContact O-N 2.78Å; L763-M767 VanDerWaalsContact O-CB 3.24Å; L763-M767 WeakPolarHBondContact O-CB 3.4Å; L763-M767 PolarHBondContact O-N 3.4Å
764K56.4Low59.2Low144 Ų144110 Ų11063%0.62656%0.555SS**Hα-helixtrans-61.1-35.3170.6-86.1179.2176178.30111.6I760 R761I760-K764 HydrophobicContact CG2-CD 4.25Å; I760-K764 HydrophobicContact CG2-CG 4.48Å; I760-K764 WeakPolarHBondContact O-CB 3.47Å; I760-K764 VanDerWaalsContact O-CG 3.31Å; I760-K764 WeakPolarHBondContact O-CG 3.34Å; I760-K764 PolarHBondContact O-N 2.81Å; R761-K764 PolarHBondContact O-N 3.39Å
765L54.7Low58Low121 Ų121113.8 Ų113.863%0.63458%0.577SS**Hα-helixtrans-67.5-46.9172.4-157.776.1000110.7R761 E762 L763 M767 S768 Y769R761-L765 PolarHBondContact O-N 2.79Å; E762-L765 CarbonylContact O-C 3.53Å; E762-L765 WeakPolarHBondContact O-CA 3.31Å; E762-L765 VanDerWaalsContact O-CB 3.26Å; E762-L765 WeakPolarHBondContact O-CB 3.16Å; E762-L765 PolarHBondContact O-N 2.85Å; E762-L765 VanDerWaalsContact O-N 3.13Å; L763-L765 PolarHBondContact O-N 3.39Å; L765-M767 VanDerWaalsContact C-N 3.26Å; L765-M767 PolarHBondContact O-N 3.31Å; L765-S768 PolarHBondContact O-N 3.28Å; L765-S768 PolarHBondContact O-OG 2.93Å; L765-Y769 WeakPolarHBondContact O-CD1 3.22Å; L765-Y769 WeakPolarHBondContact O-CE1 3.48Å
766V50.3Low56.8Low65 Ų65115.7 Ų115.739%0.39459%0.586SS.*Hα-helixtrans-61.7-34.1178.5176.30000112.6E762 L763 S768 Y769E762-V766 VanDerWaalsContact O-CG2 3.28Å; E762-V766 WeakPolarHBondContact O-CG2 3.49Å; E762-V766 PolarHBondContact O-N 2.67Å; L763-V766 PolarHBondContact O-N 2.78Å; V766-S768 PolarHBondContact O-N 3.42Å; V766-Y769 VanDerWaalsContact CA-CZ 3.45Å; V766-Y769 WeakPolarHBondContact CA-OH 3.3Å; V766-Y769 HydrophobicContact CG1-CE2 4.37Å; V766-Y769 VanDerWaalsContact CG2-OH 3.31Å; V766-Y769 WeakPolarHBondContact CG2-OH 3.4Å
767M45.2Very low55.9Low133 Ų133116.9 Ų116.966%0.65560%0.596SS**THydrogen-bonded Turntrans-73.9-11.6-176.9-153.3161.561.200113.2L763 L765L763-M767 VanDerWaalsContact O-CB 3.24Å; L763-M767 WeakPolarHBondContact O-CB 3.4Å; L763-M767 PolarHBondContact O-N 3.4Å; L765-M767 VanDerWaalsContact C-N 3.26Å; L765-M767 PolarHBondContact O-N 3.31Å
768S50.3Low55Low97 Ų97117.9 Ų117.968%0.67860%0.604SS**THydrogen-bonded Turntrans-82.2-10.8179.6100.30000114.8L765 V766L765-S768 PolarHBondContact O-N 3.28Å; L765-S768 PolarHBondContact O-OG 2.93Å; V766-S768 PolarHBondContact O-N 3.42Å
769Y43.9Very low54.2Low145 Ų145121.1 Ų121.157%0.56962%0.617SS**SBendtrans-125.74.5-169.147.9-101.5000118.8L765 V766L765-Y769 WeakPolarHBondContact O-CD1 3.22Å; L765-Y769 WeakPolarHBondContact O-CE1 3.48Å; V766-Y769 VanDerWaalsContact CA-CZ 3.45Å; V766-Y769 WeakPolarHBondContact CA-OH 3.3Å; V766-Y769 HydrophobicContact CG1-CE2 4.37Å; V766-Y769 VanDerWaalsContact CG2-OH 3.31Å; V766-Y769 WeakPolarHBondContact CG2-OH 3.4Å
770T45.7Very low53.8Low98 Ų98120.2 Ų120.260%0.60162%0.615SS**  trans-138.5110.1172.151.70000113K774T770-K774 WeakPolarHBondContact O-CE 3.43Å; T770-K774 PolarHBondContact O-NZ 3.46Å
771G45.5Very low53.5Low57 Ų57119.6 Ų119.659%0.58862%0.618SS**  trans-102.1138170.500000110.5
772L47.3Very low53.3Low157 Ų157115.7 Ų115.782%0.82261%0.61SS**SBendtrans76.295.2174.1-55168.1000114
773P43.8Very low53.5Low125 Ų125118 Ų11881%0.81261%0.614SS**SBend-118.970.158.217.63.6000113.3L775P773-L775 PolarHBondContact O-N 3.2Å
774K47.8Very low54.2Low102 Ų102118.7 Ų118.744%0.44361%0.613SS.*Hα-helixtrans-81.9-1.4-173.2-82.8179.9172.1166.70116.3T770 F778T770-K774 WeakPolarHBondContact O-CE 3.43Å; T770-K774 PolarHBondContact O-NZ 3.46Å; K774-F778 WeakPolarHBondContact O-CB 3.4Å; K774-F778 PolarHBondContact O-N 3.3Å
775L47.1Very low54.8Low151 Ų151114.5 Ų114.579%0.79161%0.606SS**Hα-helixtrans-82.7-29.1-174.4-162.764.3000114.2P773P773-L775 PolarHBondContact O-N 3.2Å
776F52.6Low55.8Low168 Ų168113.4 Ų113.474%0.73760%0.6SS**Hα-helixtrans-80.6-36175.9-171.2-104.8000112.3
777V55Low57.2Low99 Ų99114.7 Ų114.760%0.661%0.605SS**Hα-helixtrans-72.9-33.7177.4-179.10000111.8K779 N780 S781V777-K779 PolarHBondContact O-N 2.95Å; V777-N780 PolarHBondContact O-N 3.35Å; V777-S781 VanDerWaalsContact O-CB 3.31Å; V777-S781 WeakPolarHBondContact O-CB 3.46Å; V777-S781 PolarHBondContact O-N 2.9Å
778F53.5Low58.9Low140 Ų140110.9 Ų110.961%0.61459%0.589SS**Hα-helixtrans-63.2-40.1178.8-174-103.3000113K774 S781 V782K774-F778 WeakPolarHBondContact O-CB 3.4Å; K774-F778 PolarHBondContact O-N 3.3Å; F778-S781 WeakPolarHBondContact O-CB 3.17Å; F778-S781 PolarHBondContact O-N 2.86Å; F778-V782 HydrophobicContact CD1-CG2 4.26Å; F778-V782 HydrophobicContact CE1-CG2 3.88Å; F778-V782 HydrophobicContact CE2-CG2 4.41Å; F778-V782 HydrophobicContact CZ-CG2 3.96Å; F778-V782 WeakPolarHBondContact O-CG2 3.16Å; F778-V782 PolarHBondContact O-N 2.84Å
779K55.5Low60.3Low163 Ų163110.6 Ų110.671%0.70958%0.58SS**Hα-helixtrans-69.2-36.2-178.6-158.6172.5-175.2176.90112.9V777 R783V777-K779 PolarHBondContact O-N 2.95Å; K779-R783 PolarHBondContact O-N 3.25Å
780N64.8Low62Low96 Ų96106 Ų10651%0.51357%0.572SS.*Hα-helixtrans-72.5-33.6170.8-74.6-12000111.7V777 R783 H784V777-N780 PolarHBondContact O-N 3.35Å; N780-R783 PolarHBondContact O-N 3.49Å; N780-H784 VanDerWaalsContact O-CB 3.27Å; N780-H784 WeakPolarHBondContact O-CB 3.26Å; N780-H784 PolarHBondContact O-N 3.22Å
781S66.7Low63.9Low68 Ų68107 Ų10748%0.47657%0.57SS.*Hα-helixtrans-66.6-34.9175.9-167.60000113V777 F778 H784 A785V777-S781 VanDerWaalsContact O-CB 3.31Å; V777-S781 WeakPolarHBondContact O-CB 3.46Å; V777-S781 PolarHBondContact O-N 2.9Å; F778-S781 WeakPolarHBondContact O-CB 3.17Å; F778-S781 PolarHBondContact O-N 2.86Å; S781-H784 PolarHBondContact O-N 3.49Å; S781-A785 VanDerWaalsContact O-CB 3.27Å; S781-A785 WeakPolarHBondContact O-CB 3.28Å; S781-A785 PolarHBondContact O-N 3.38Å
782V68.1Low65.6Low61 Ų61109.1 Ų109.137%0.3757%0.567SS.*Hα-helixtrans-69.7-47175173.80000110.9F778 H784 A785 D786F778-V782 HydrophobicContact CD1-CG2 4.26Å; F778-V782 HydrophobicContact CE1-CG2 3.88Å; F778-V782 HydrophobicContact CE2-CG2 4.41Å; F778-V782 HydrophobicContact CZ-CG2 3.96Å; F778-V782 WeakPolarHBondContact O-CG2 3.16Å; F778-V782 PolarHBondContact O-N 2.84Å; V782-H784 VanDerWaalsContact C-N 3.25Å; V782-H784 PolarHBondContact O-N 2.81Å; V782-A785 PolarHBondContact O-N 2.8Å; V782-A785 VanDerWaalsContact O-N 3.13Å; V782-D786 PolarHBondContact O-N 2.95Å
783R68.9Low67.6Low177 Ų177106.5 Ų106.567%0.66855%0.551SS**Hα-helixtrans-60-37.1173.1-85.3-177.181.4169.55.3112.2K779 N780 N787K779-R783 PolarHBondContact O-N 3.25Å; N780-R783 PolarHBondContact O-N 3.49Å; R783-N787 VanDerWaalsContact O-CB 3.31Å; R783-N787 WeakPolarHBondContact O-CB 3.41Å; R783-N787 PolarHBondContact O-N 3.49Å; R783-N787 PolarHBondContact O-OD1 3.3Å
784H74.5Confident69.6Low126 Ų126104.7 Ų104.758%0.58354%0.537SS*.Hα-helixtrans-69.1-40.2176-164.246.9000111.4N780 S781 V782 N787 V788N780-H784 VanDerWaalsContact O-CB 3.27Å; N780-H784 WeakPolarHBondContact O-CB 3.26Å; N780-H784 PolarHBondContact O-N 3.22Å; S781-H784 PolarHBondContact O-N 3.49Å; V782-H784 VanDerWaalsContact C-N 3.25Å; V782-H784 PolarHBondContact O-N 2.81Å; H784-N787 PolarHBondContact O-N 3.39Å; H784-V788 WeakPolarHBondContact O-CB 3.41Å; H784-V788 WeakPolarHBondContact O-CG2 3.43Å; H784-V788 PolarHBondContact O-N 3.17Å
785A69.4Low71.5Confident56 Ų56103.9 Ų103.946%0.46354%0.538SS..Hα-helixtrans-64.6-41.1174.800000112.5S781 V782 V788 N789S781-A785 VanDerWaalsContact O-CB 3.27Å; S781-A785 WeakPolarHBondContact O-CB 3.28Å; S781-A785 PolarHBondContact O-N 3.38Å; V782-A785 PolarHBondContact O-N 2.8Å; V782-A785 VanDerWaalsContact O-N 3.13Å; A785-V788 PolarHBondContact O-N 2.86Å; A785-N789 VanDerWaalsContact O-CB 3.25Å; A785-N789 WeakPolarHBondContact O-CB 3.44Å; A785-N789 PolarHBondContact O-N 3.35Å
786D75.3Confident73.4Confident98 Ų98103 Ų10352%0.52453%0.531SS..Hα-helixtrans-66.3-41.2174.6-71.4-29.7000111.4V782 N789 A790V782-D786 PolarHBondContact O-N 2.95Å; D786-N789 PolarHBondContact O-N 3.43Å; D786-A790 VanDerWaalsContact O-CB 3.29Å; D786-A790 WeakPolarHBondContact O-CB 3.3Å; D786-A790 PolarHBondContact O-N 3.22Å
787N79.5Confident75.1Confident91 Ų91102.8 Ų102.849%0.48753%0.526SS..Hα-helixtrans-62-44.8173.6-76.9-1.6000111.3R783 H784 A790 E791R783-N787 VanDerWaalsContact O-CB 3.31Å; R783-N787 WeakPolarHBondContact O-CB 3.41Å; R783-N787 PolarHBondContact O-N 3.49Å; R783-N787 PolarHBondContact O-OD1 3.3Å; H784-N787 PolarHBondContact O-N 3.39Å; N787-A790 PolarHBondContact O-N 3.49Å; N787-E791 WeakPolarHBondContact O-CB 3.28Å; N787-E791 VanDerWaalsContact O-CG 3.31Å; N787-E791 WeakPolarHBondContact O-CG 3.46Å; N787-E791 PolarHBondContact O-N 2.86Å
788V81.8Confident76.7Confident53 Ų53100.3 Ų100.332%0.32151%0.512SS..Hα-helixtrans-66.7-37177.2170.80000111.3H784 A785 E791 L792H784-V788 WeakPolarHBondContact O-CB 3.41Å; H784-V788 WeakPolarHBondContact O-CG2 3.43Å; H784-V788 PolarHBondContact O-N 3.17Å; A785-V788 PolarHBondContact O-N 2.86Å; V788-E791 PolarHBondContact O-N 3.43Å; V788-L792 HydrophobicContact CG1-CD1 4.06Å; V788-L792 HydrophobicContact CG1-CG 4.44Å; V788-L792 WeakPolarHBondContact O-CB 3.31Å; V788-L792 VanDerWaalsContact O-CG 3.29Å; V788-L792 WeakPolarHBondContact O-CG 3.42Å; V788-L792 PolarHBondContact O-N 2.9Å
789N79.1Confident78.4Confident92 Ų9299.1 Ų99.149%0.49251%0.512SS..Hα-helixtrans-70.4-36.9176.6-167.334.4000111.7A785 D786 L792 Q793A785-N789 VanDerWaalsContact O-CB 3.25Å; A785-N789 WeakPolarHBondContact O-CB 3.44Å; A785-N789 PolarHBondContact O-N 3.35Å; D786-N789 PolarHBondContact O-N 3.43Å; N789-L792 PolarHBondContact O-N 2.85Å; N789-Q793 WeakPolarHBondContact O-CB 3.46Å; N789-Q793 PolarHBondContact O-N 3Å
790A80.1Confident80.2Confident49 Ų4997 Ų9741%0.40550%0.504SS..Hα-helixtrans-65.7-44170.700000111.1D786 N787 L792 Q793 V794D786-A790 VanDerWaalsContact O-CB 3.29Å; D786-A790 WeakPolarHBondContact O-CB 3.3Å; D786-A790 PolarHBondContact O-N 3.22Å; N787-A790 PolarHBondContact O-N 3.49Å; A790-L792 PolarHBondContact O-N 2.64Å; A790-Q793 PolarHBondContact O-N 3.41Å; A790-V794 WeakPolarHBondContact O-CB 3.36Å; A790-V794 WeakPolarHBondContact O-CG2 3.41Å; A790-V794 PolarHBondContact O-N 3.23Å
791E84.7Confident81.4Confident117 Ų11797.8 Ų97.855%0.54751%0.508SS..Hα-helixtrans-60.3-42.7173.2-78.3173.2-169.200111.7N787 V788 V794 N795N787-E791 WeakPolarHBondContact O-CB 3.28Å; N787-E791 VanDerWaalsContact O-CG 3.31Å; N787-E791 WeakPolarHBondContact O-CG 3.46Å; N787-E791 PolarHBondContact O-N 2.86Å; V788-E791 PolarHBondContact O-N 3.43Å; E791-V794 PolarHBondContact O-N 3.24Å; E791-N795 VanDerWaalsContact O-CB 3.24Å; E791-N795 WeakPolarHBondContact O-CB 3.5Å; E791-N795 PolarHBondContact O-N 2.86Å; E791-N795 PolarHBondContact O-ND2 3Å
792L82.1Confident82.7Confident103 Ų103100.5 Ų100.554%0.53951%0.511SS..Hα-helixtrans-66.4-41.6176-77.7170.2000112.1V788 N789 A790 V794 N795 M796V788-L792 HydrophobicContact CG1-CD1 4.06Å; V788-L792 HydrophobicContact CG1-CG 4.44Å; V788-L792 WeakPolarHBondContact O-CB 3.31Å; V788-L792 VanDerWaalsContact O-CG 3.29Å; V788-L792 WeakPolarHBondContact O-CG 3.42Å; V788-L792 PolarHBondContact O-N 2.9Å; N789-L792 PolarHBondContact O-N 2.85Å; A790-L792 PolarHBondContact O-N 2.64Å; L792-V794 VanDerWaalsContact C-N 3.35Å; L792-N795 PolarHBondContact O-N 3.41Å; L792-M796 VanDerWaalsContact O-CB 3.27Å; L792-M796 WeakPolarHBondContact O-CB 3.48Å; L792-M796 PolarHBondContact O-N 2.97Å
793Q88.5Confident83.8Confident101 Ų101104.4 Ų104.447%0.47252%0.521SS..Hα-helixtrans-63.2-41.4172.6-94-172.90.900112.1N789 A790 M796 R797N789-Q793 WeakPolarHBondContact O-CB 3.46Å; N789-Q793 PolarHBondContact O-N 3Å; A790-Q793 PolarHBondContact O-N 3.41Å; Q793-M796 PolarHBondContact O-N 2.89Å; Q793-R797 WeakPolarHBondContact O-CB 3.37Å; Q793-R797 VanDerWaalsContact O-CG 3.32Å; Q793-R797 WeakPolarHBondContact O-CG 3.26Å; Q793-R797 PolarHBondContact O-N 3.3Å
794V86.4Confident84.9Confident87 Ų8799.6 Ų99.653%0.52751%0.508SS..Hα-helixtrans-65-42.7175.7168.80000110.3A790 E791 L792 R797 S798A790-V794 WeakPolarHBondContact O-CB 3.36Å; A790-V794 WeakPolarHBondContact O-CG2 3.41Å; A790-V794 PolarHBondContact O-N 3.23Å; E791-V794 PolarHBondContact O-N 3.24Å; L792-V794 VanDerWaalsContact C-N 3.35Å; V794-R797 PolarHBondContact O-N 2.82Å; V794-S798 WeakPolarHBondContact O-CB 3.39Å; V794-S798 PolarHBondContact O-N 3.38Å
795N87.9Confident85.8Confident86 Ų8697.4 Ų97.446%0.4650%0.503SS..Hα-helixtrans-66.3-38.5176.4-74.3-23.5000112E791 L792 S798 L799E791-N795 VanDerWaalsContact O-CB 3.24Å; E791-N795 WeakPolarHBondContact O-CB 3.5Å; E791-N795 PolarHBondContact O-N 2.86Å; E791-N795 PolarHBondContact O-ND2 3Å; L792-N795 PolarHBondContact O-N 3.41Å; N795-S798 PolarHBondContact O-N 3.29Å; N795-L799 WeakPolarHBondContact O-CB 3.26Å; N795-L799 WeakPolarHBondContact O-CG 3.49Å; N795-L799 PolarHBondContact O-N 3.49Å
796M86.9Confident86.9Confident133 Ų13399.8 Ų99.866%0.65551%0.507SS*.Hα-helixtrans-68.8-42.6176.6-165154.1100.100111.1L792 Q793 S798 L799 Q800L792-M796 VanDerWaalsContact O-CB 3.27Å; L792-M796 WeakPolarHBondContact O-CB 3.48Å; L792-M796 PolarHBondContact O-N 2.97Å; Q793-M796 PolarHBondContact O-N 2.89Å; M796-S798 VanDerWaalsContact C-N 3.34Å; M796-L799 PolarHBondContact O-N 2.81Å; M796-Q800 VanDerWaalsContact O-CB 3.23Å; M796-Q800 WeakPolarHBondContact O-CB 3.34Å; M796-Q800 PolarHBondContact O-N 3.29Å
797R88.3Confident87.8Confident163 Ų163101 Ų10162%0.61551%0.508SS*.Hα-helixtrans-62.9-39.6170.4-73.8179.1-178.7151.63.1111.9Q793 V794 Q800 L801Q793-R797 WeakPolarHBondContact O-CB 3.37Å; Q793-R797 VanDerWaalsContact O-CG 3.32Å; Q793-R797 WeakPolarHBondContact O-CG 3.26Å; Q793-R797 PolarHBondContact O-N 3.3Å; V794-R797 PolarHBondContact O-N 2.82Å; R797-Q800 PolarHBondContact O-N 2.91Å; R797-L801 VanDerWaalsContact O-CB 3.31Å; R797-L801 WeakPolarHBondContact O-CB 3.33Å; R797-L801 WeakPolarHBondContact O-CG 3.5Å; R797-L801 PolarHBondContact O-N 3.31Å
798S88.9Confident88.4Confident46 Ų4699.3 Ų99.332%0.32251%0.507SS..Hα-helixtrans-66.1-43.6177.5-177.50000111.7V794 N795 M796 K802V794-S798 WeakPolarHBondContact O-CB 3.39Å; V794-S798 PolarHBondContact O-N 3.38Å; N795-S798 PolarHBondContact O-N 3.29Å; M796-S798 VanDerWaalsContact C-N 3.34Å; S798-K802 WeakPolarHBondContact O-CB 3.37Å; S798-K802 VanDerWaalsContact O-CG 3.23Å; S798-K802 WeakPolarHBondContact O-CG 3.18Å; S798-K802 PolarHBondContact O-N 2.96Å
799L89.9Confident88.9Confident115 Ų115101.3 Ų101.360%0.60252%0.516SS*.Hα-helixtrans-66.5-39.6174.3-79.1168.4000111.9N795 M796 K802 Y803N795-L799 WeakPolarHBondContact O-CB 3.26Å; N795-L799 WeakPolarHBondContact O-CG 3.49Å; N795-L799 PolarHBondContact O-N 3.49Å; M796-L799 PolarHBondContact O-N 2.81Å; L799-K802 PolarHBondContact O-N 3.46Å; L799-Y803 WeakPolarHBondContact O-CB 3.23Å; L799-Y803 PolarHBondContact O-N 3.27Å
800Q92.1Very high89.4Confident118 Ų118101.7 Ų101.755%0.55152%0.518SS*.Hα-helixtrans-66.8-43.4176.4-170140.9-1.500111.6M796 R797 K802 Y803 D804M796-Q800 VanDerWaalsContact O-CB 3.23Å; M796-Q800 WeakPolarHBondContact O-CB 3.34Å; M796-Q800 PolarHBondContact O-N 3.29Å; R797-Q800 PolarHBondContact O-N 2.91Å; Q800-K802 VanDerWaalsContact C-N 3.34Å; Q800-K802 PolarHBondContact O-N 2.99Å; Q800-Y803 WeakPolarHBondContact O-CB 3.45Å; Q800-Y803 PolarHBondContact O-N 2.83Å; Q800-D804 WeakPolarHBondContact O-CB 3.35Å; Q800-D804 VanDerWaalsContact O-CG 3.26Å; Q800-D804 PolarHBondContact O-N 3.27Å
801L90.7Very high90Very high114 Ų114101.8 Ų101.860%0.59752%0.518SS*.Hα-helixtrans-59.6-42.6171.1-75.3172000111.7R797 D804 V805R797-L801 VanDerWaalsContact O-CB 3.31Å; R797-L801 WeakPolarHBondContact O-CB 3.33Å; R797-L801 WeakPolarHBondContact O-CG 3.5Å; R797-L801 PolarHBondContact O-N 3.31Å; L801-D804 PolarHBondContact O-N 2.85Å; L801-V805 WeakPolarHBondContact O-CB 3.31Å; L801-V805 WeakPolarHBondContact O-CG2 3.4Å; L801-V805 PolarHBondContact O-N 2.66Å
802K93Very high90.5Very high124 Ų124100.7 Ų100.754%0.53951%0.513SS..Hα-helixtrans-62.7-41.1174.5-74.7172-175.9-176.20112.2S798 L799 Q800 V805 I806S798-K802 WeakPolarHBondContact O-CB 3.37Å; S798-K802 VanDerWaalsContact O-CG 3.23Å; S798-K802 WeakPolarHBondContact O-CG 3.18Å; S798-K802 PolarHBondContact O-N 2.96Å; L799-K802 PolarHBondContact O-N 3.46Å; Q800-K802 VanDerWaalsContact C-N 3.34Å; Q800-K802 PolarHBondContact O-N 2.99Å; K802-V805 PolarHBondContact O-N 3.43Å; K802-I806 WeakPolarHBondContact O-CB 3.26Å; K802-I806 VanDerWaalsContact O-CG1 3.26Å; K802-I806 WeakPolarHBondContact O-CG1 3.45Å; K802-I806 PolarHBondContact O-N 2.92Å
803Y92.2Very high91Very high144 Ų144100.7 Ų100.757%0.56551%0.512SS*.Hα-helixtrans-63.6-45.3175.7174.7-94.7000111.3L799 Q800 I806 K807L799-Y803 WeakPolarHBondContact O-CB 3.23Å; L799-Y803 PolarHBondContact O-N 3.27Å; Q800-Y803 WeakPolarHBondContact O-CB 3.45Å; Q800-Y803 PolarHBondContact O-N 2.83Å; Y803-I806 PolarHBondContact O-N 3.39Å; Y803-K807 HydrophobicContact CE1-CD 4.09Å; Y803-K807 WeakPolarHBondContact O-CB 3.41Å; Y803-K807 PolarHBondContact O-N 2.9Å
804D92.2Very high91.3Very high76 Ų76102 Ų10241%0.40652%0.518SS..Hα-helixtrans-65.7-38.5178.3-67.5-28.7000111.5Q800 L801 K807 A808Q800-D804 WeakPolarHBondContact O-CB 3.35Å; Q800-D804 VanDerWaalsContact O-CG 3.26Å; Q800-D804 PolarHBondContact O-N 3.27Å; L801-D804 PolarHBondContact O-N 2.85Å; D804-K807 PolarHBondContact O-N 3.42Å; D804-A808 VanDerWaalsContact O-CB 3.31Å; D804-A808 WeakPolarHBondContact O-CB 3.36Å; D804-A808 PolarHBondContact O-N 2.82Å
805V92.8Very high91.6Very high79 Ų79105.6 Ų105.648%0.47952%0.522SS..Hα-helixtrans-63.6-51.5173.1169.30000110.9L801 K802 K807 A808 D809L801-V805 WeakPolarHBondContact O-CB 3.31Å; L801-V805 WeakPolarHBondContact O-CG2 3.4Å; L801-V805 PolarHBondContact O-N 2.66Å; K802-V805 PolarHBondContact O-N 3.43Å; V805-K807 PolarHBondContact O-N 3.31Å; V805-A808 PolarHBondContact O-N 3.26Å; V805-A808 VanDerWaalsContact O-N 3.14Å; V805-D809 WeakPolarHBondContact O-CB 3.46Å; V805-D809 PolarHBondContact O-N 2.93Å
806I93.1Very high92Very high106 Ų106105 Ų10554%0.54452%0.516SS..Hα-helixtrans-61.1-36.7177.9-69.3166.7000111.2K802 Y803 N810K802-I806 WeakPolarHBondContact O-CB 3.26Å; K802-I806 VanDerWaalsContact O-CG1 3.26Å; K802-I806 WeakPolarHBondContact O-CG1 3.45Å; K802-I806 PolarHBondContact O-N 2.92Å; Y803-I806 PolarHBondContact O-N 3.39Å; I806-N810 WeakPolarHBondContact O-CB 3.44Å; I806-N810 PolarHBondContact O-N 2.96Å
807K93.1Very high92.2Very high123 Ų123101.8 Ų101.854%0.53551%0.506SS..Hα-helixtrans-68.6-40.4176.7-173.7179.1178.6-176.90111.7Y803 D804 V805 N810 A811Y803-K807 HydrophobicContact CE1-CD 4.09Å; Y803-K807 WeakPolarHBondContact O-CB 3.41Å; Y803-K807 PolarHBondContact O-N 2.9Å; D804-K807 PolarHBondContact O-N 3.42Å; V805-K807 PolarHBondContact O-N 3.31Å; K807-N810 PolarHBondContact O-N 3.28Å; K807-A811 WeakPolarHBondContact O-CB 3.44Å; K807-A811 PolarHBondContact O-N 3.41Å
808A92.7Very high92.5Very high57 Ų5798.6 Ų98.647%0.47150%0.498SS..Hα-helixtrans-64.1-45.1173.300000111.1D804 V805 N810 A811 E812D804-A808 VanDerWaalsContact O-CB 3.31Å; D804-A808 WeakPolarHBondContact O-CB 3.36Å; D804-A808 PolarHBondContact O-N 2.82Å; V805-A808 PolarHBondContact O-N 3.26Å; V805-A808 VanDerWaalsContact O-N 3.14Å; A808-N810 VanDerWaalsContact C-N 3.35Å; A808-N810 PolarHBondContact O-N 2.91Å; A808-A811 PolarHBondContact O-N 3.16Å; A808-E812 WeakPolarHBondContact O-CB 3.2Å; A808-E812 PolarHBondContact O-N 2.88Å
809D92.1Very high92.8Very high95 Ų9599.2 Ų99.251%0.50850%0.5SS..Hα-helixtrans-61.3-41.7175.3-71.3-8.9000111.3V805 A811 E812 M813V805-D809 WeakPolarHBondContact O-CB 3.46Å; V805-D809 PolarHBondContact O-N 2.93Å; D809-A811 PolarHBondContact O-N 3.41Å; D809-E812 PolarHBondContact O-N 3.25Å; D809-M813 WeakPolarHBondContact O-CB 3.44Å; D809-M813 VanDerWaalsContact O-CG 3.31Å; D809-M813 WeakPolarHBondContact O-CG 3.47Å; D809-M813 PolarHBondContact O-N 3.3Å
810N89.4Confident92.9Very high100 Ų100102.1 Ų102.154%0.53550%0.503SS..Hα-helixtrans-63.3-40.1174.3-99.3-23.5000112.6I806 K807 A808 E812 M813 Q814I806-N810 WeakPolarHBondContact O-CB 3.44Å; I806-N810 PolarHBondContact O-N 2.96Å; K807-N810 PolarHBondContact O-N 3.28Å; A808-N810 VanDerWaalsContact C-N 3.35Å; A808-N810 PolarHBondContact O-N 2.91Å; N810-E812 VanDerWaalsContact C-N 3.33Å; N810-M813 PolarHBondContact O-N 2.82Å; N810-Q814 WeakPolarHBondContact O-CB 3.43Å; N810-Q814 WeakPolarHBondContact O-CG 3.46Å; N810-Q814 PolarHBondContact O-N 3.37Å
811A93.7Very high93Very high50 Ų50102.5 Ų102.541%0.41351%0.505SS..Hα-helixtrans-67.4-36.3176.100000111.6K807 A808 D809 Q814 R815K807-A811 WeakPolarHBondContact O-CB 3.44Å; K807-A811 PolarHBondContact O-N 3.41Å; A808-A811 PolarHBondContact O-N 3.16Å; D809-A811 PolarHBondContact O-N 3.41Å; A811-Q814 PolarHBondContact O-N 2.94Å; A811-R815 WeakPolarHBondContact O-CG 3.31Å; A811-R815 PolarHBondContact O-N 2.84Å
812E94Very high93.2Very high95 Ų95102.6 Ų102.644%0.44450%0.497SS..Hα-helixtrans-68.4-44.6174.6-177.756.5-154.800111.3A808 D809 N810 Q814 R815 Q816A808-E812 WeakPolarHBondContact O-CB 3.2Å; A808-E812 PolarHBondContact O-N 2.88Å; D809-E812 PolarHBondContact O-N 3.25Å; N810-E812 VanDerWaalsContact C-N 3.33Å; E812-Q814 VanDerWaalsContact C-N 3.31Å; E812-Q814 PolarHBondContact O-N 3.23Å; E812-R815 WeakPolarHBondContact O-CB 3.38Å; E812-R815 PolarHBondContact O-N 3.3Å; E812-Q816 WeakPolarHBondContact O-CB 3.44Å; E812-Q816 WeakPolarHBondContact O-CG 3.39Å; E812-Q816 PolarHBondContact O-N 2.86Å; E812-Q816 PolarHBondContact OE1-NE2 3.1Å
813M92.4Very high93.2Very high102 Ų10298.7 Ų98.750%0.50249%0.488SS..Hα-helixtrans-60.5-39.4173.5-72.1-57.1-56.300111.9D809 N810 Q816 C817D809-M813 WeakPolarHBondContact O-CB 3.44Å; D809-M813 VanDerWaalsContact O-CG 3.31Å; D809-M813 WeakPolarHBondContact O-CG 3.47Å; D809-M813 PolarHBondContact O-N 3.3Å; N810-M813 PolarHBondContact O-N 2.82Å; M813-Q816 PolarHBondContact O-N 3.23Å; M813-C817 PolarHBondContact O-N 3.46Å; M813-C817 PolarHBondContact O-SG 3.04Å
814Q95.1Very high93.3Very high129 Ų12995.8 Ų95.860%0.60349%0.485SS*.Hα-helixtrans-64.9-44.6172.8-81.4173.2-30.100112.2N810 A811 E812 Q816 C817 E818N810-Q814 WeakPolarHBondContact O-CB 3.43Å; N810-Q814 WeakPolarHBondContact O-CG 3.46Å; N810-Q814 PolarHBondContact O-N 3.37Å; A811-Q814 PolarHBondContact O-N 2.94Å; E812-Q814 VanDerWaalsContact C-N 3.31Å; E812-Q814 PolarHBondContact O-N 3.23Å; Q814-Q816 VanDerWaalsContact C-N 3.27Å; Q814-Q816 PolarHBondContact O-N 2.75Å; Q814-C817 PolarHBondContact O-N 2.79Å; Q814-E818 WeakPolarHBondContact O-CG 3.17Å; Q814-E818 PolarHBondContact O-N 3.47Å
815R93.8Very high93.4Very high162 Ų16295.6 Ų95.661%0.61149%0.487SS*.Hα-helixtrans-58.7-41.2173-80.5-172.2110.876.60.1111.6A811 E812 E818 T819A811-R815 WeakPolarHBondContact O-CG 3.31Å; A811-R815 PolarHBondContact O-N 2.84Å; E812-R815 WeakPolarHBondContact O-CB 3.38Å; E812-R815 PolarHBondContact O-N 3.3Å; R815-E818 PolarHBondContact O-N 3.11Å; R815-T819 VanDerWaalsContact O-CG2 3.29Å; R815-T819 WeakPolarHBondContact O-CG2 3.3Å; R815-T819 PolarHBondContact O-N 3.37Å; R815-T819 PolarHBondContact O-OG1 3.41Å
816Q94.9Very high93.4Very high74 Ų7497.6 Ų97.635%0.34649%0.491SS..Hα-helixtrans-64.5-46.7177.4-73.8179.313.300111.1E812 M813 Q814 E818 T819 W820E812-Q816 WeakPolarHBondContact O-CB 3.44Å; E812-Q816 WeakPolarHBondContact O-CG 3.39Å; E812-Q816 PolarHBondContact O-N 2.86Å; E812-Q816 PolarHBondContact OE1-NE2 3.1Å; M813-Q816 PolarHBondContact O-N 3.23Å; Q814-Q816 VanDerWaalsContact C-N 3.27Å; Q814-Q816 PolarHBondContact O-N 2.75Å; Q816-E818 VanDerWaalsContact C-N 3.35Å; Q816-E818 PolarHBondContact O-N 3.46Å; Q816-T819 VanDerWaalsContact CA-OG1 3.26Å; Q816-T819 WeakPolarHBondContact CA-OG1 3.42Å; Q816-T819 PolarHBondContact O-N 2.9Å; Q816-T819 VanDerWaalsContact O-N 3.11Å; Q816-T819 PolarHBondContact O-OG1 3.3Å; Q816-W820 PolarHBondContact O-N 3.38Å
817C92.3Very high93.4Very high65 Ų6594.6 Ų94.644%0.43948%0.482SS..Hα-helixtrans-56-47.7172.1-70.40000111.6M813 Q814 T819 W820 E821M813-C817 PolarHBondContact O-N 3.46Å; M813-C817 PolarHBondContact O-SG 3.04Å; Q814-C817 PolarHBondContact O-N 2.79Å; C817-T819 VanDerWaalsContact C-N 3.3Å; C817-T819 PolarHBondContact O-N 3.29Å; C817-W820 PolarHBondContact O-N 2.81Å; C817-E821 WeakPolarHBondContact O-CB 3.46Å; C817-E821 VanDerWaalsContact O-CG 3.31Å; C817-E821 WeakPolarHBondContact O-CG 3.36Å; C817-E821 PolarHBondContact O-N 2.89Å
818E94.6Very high93.4Very high96 Ų9693 Ų9345%0.44948%0.48SS..Hα-helixtrans-61.9-34.8176-71171.8-171.300112.5Q814 R815 Q816 R822Q814-E818 WeakPolarHBondContact O-CG 3.17Å; Q814-E818 PolarHBondContact O-N 3.47Å; R815-E818 PolarHBondContact O-N 3.11Å; Q816-E818 VanDerWaalsContact C-N 3.35Å; Q816-E818 PolarHBondContact O-N 3.46Å; E818-R822 WeakPolarHBondContact O-CB 3.29Å; E818-R822 WeakPolarHBondContact O-CG 3.46Å; E818-R822 VanDerWaalsContact O-CZ 3.3Å; E818-R822 PolarHBondContact O-N 3.44Å; E818-R822 PolarHBondContact O-NE 3.5Å; E818-R822 PolarHBondContact O-NH2 3.29Å
819T94.7Very high93.5Very high59 Ų5996.4 Ų96.436%0.36249%0.486SS..Hα-helixtrans-70.7-41.1175.254.60000112.4R815 Q816 C817 R822 A823R815-T819 VanDerWaalsContact O-CG2 3.29Å; R815-T819 WeakPolarHBondContact O-CG2 3.3Å; R815-T819 PolarHBondContact O-N 3.37Å; R815-T819 PolarHBondContact O-OG1 3.41Å; Q816-T819 VanDerWaalsContact CA-OG1 3.26Å; Q816-T819 WeakPolarHBondContact CA-OG1 3.42Å; Q816-T819 PolarHBondContact O-N 2.9Å; Q816-T819 VanDerWaalsContact O-N 3.11Å; Q816-T819 PolarHBondContact O-OG1 3.3Å; C817-T819 VanDerWaalsContact C-N 3.3Å; C817-T819 PolarHBondContact O-N 3.29Å; T819-R822 PolarHBondContact O-N 2.97Å; T819-A823 VanDerWaalsContact O-CB 3.31Å; T819-A823 WeakPolarHBondContact O-CB 3.3Å; T819-A823 PolarHBondContact O-N 2.83Å
820W92.4Very high93.7Very high176 Ų17695.9 Ų95.967%0.66749%0.489SS*.Hα-helixtrans-67.2-39.8175.2-69.8119.7000111.1Q816 C817 A823 V824Q816-W820 PolarHBondContact O-N 3.38Å; C817-W820 PolarHBondContact O-N 2.81Å; W820-A823 PolarHBondContact O-N 3.24Å; W820-V824 WeakPolarHBondContact O-CB 3.32Å; W820-V824 WeakPolarHBondContact O-CG2 3.26Å; W820-V824 PolarHBondContact O-N 2.89Å
821E94.6Very high93.9Very high127 Ų12797.1 Ų97.159%0.59349%0.489SS*.Hα-helixtrans-60.8-46.9173.4-75.5175.4178.700111.5C817 V824 T825C817-E821 WeakPolarHBondContact O-CB 3.46Å; C817-E821 VanDerWaalsContact O-CG 3.31Å; C817-E821 WeakPolarHBondContact O-CG 3.36Å; C817-E821 PolarHBondContact O-N 2.89Å; E821-V824 PolarHBondContact O-N 2.86Å; E821-T825 WeakPolarHBondContact O-CG2 3.41Å; E821-T825 PolarHBondContact O-N 3.23Å; E821-T825 PolarHBondContact O-OG1 3.23Å
822R93.6Very high93.9Very high115 Ų11598.8 Ų98.843%0.43449%0.488SS..Hα-helixtrans-61.9-44.8174.7-82.6-178.9-86.696.21.7112.7E818 T819 V824 T825 E826E818-R822 WeakPolarHBondContact O-CB 3.29Å; E818-R822 WeakPolarHBondContact O-CG 3.46Å; E818-R822 VanDerWaalsContact O-CZ 3.3Å; E818-R822 PolarHBondContact O-N 3.44Å; E818-R822 PolarHBondContact O-NE 3.5Å; E818-R822 PolarHBondContact O-NH2 3.29Å; T819-R822 PolarHBondContact O-N 2.97Å; R822-V824 VanDerWaalsContact C-N 3.29Å; R822-V824 PolarHBondContact O-N 3.27Å; R822-T825 WeakPolarHBondContact CA-OG1 3.33Å; R822-T825 PolarHBondContact O-N 3.37Å; R822-T825 PolarHBondContact O-OG1 3.01Å; R822-E826 WeakPolarHBondContact O-CB 3.39Å; R822-E826 VanDerWaalsContact O-CG 3.31Å; R822-E826 WeakPolarHBondContact O-CG 3.29Å; R822-E826 PolarHBondContact O-N 3.41Å
823A94.2Very high93.9Very high42 Ų4298.2 Ų98.235%0.34749%0.488SS..Hα-helixtrans-62.3-37.9176.600000111.7T819 W820 A827T819-A823 VanDerWaalsContact O-CB 3.31Å; T819-A823 WeakPolarHBondContact O-CB 3.3Å; T819-A823 PolarHBondContact O-N 2.83Å; W820-A823 PolarHBondContact O-N 3.24Å; A823-A827 VanDerWaalsContact O-CB 3.23Å; A823-A827 WeakPolarHBondContact O-CB 3.21Å; A823-A827 PolarHBondContact O-N 3.23Å
824V94.4Very high93.9Very high83 Ų8398.2 Ų98.250%0.50349%0.49SS..Hα-helixtrans-67.4-40.9174.4168.30000111.3W820 E821 R822 N828W820-V824 WeakPolarHBondContact O-CB 3.32Å; W820-V824 WeakPolarHBondContact O-CG2 3.26Å; W820-V824 PolarHBondContact O-N 2.89Å; E821-V824 PolarHBondContact O-N 2.86Å; R822-V824 VanDerWaalsContact C-N 3.29Å; R822-V824 PolarHBondContact O-N 3.27Å; V824-N828 WeakPolarHBondContact O-CB 3.47Å; V824-N828 VanDerWaalsContact O-CG 3.25Å; V824-N828 PolarHBondContact O-N 2.85Å; V824-N828 PolarHBondContact O-ND2 3.41Å; V824-N828 VanDerWaalsContact O-ND2 3.11Å
825T93.4Very high93.9Very high72 Ų7299.1 Ų99.144%0.44249%0.488SS..Hα-helixtrans-66.3-44.1175.652.40000112.1E821 R822 A827 N828 E829E821-T825 WeakPolarHBondContact O-CG2 3.41Å; E821-T825 PolarHBondContact O-N 3.23Å; E821-T825 PolarHBondContact O-OG1 3.23Å; R822-T825 WeakPolarHBondContact CA-OG1 3.33Å; R822-T825 PolarHBondContact O-N 3.37Å; R822-T825 PolarHBondContact O-OG1 3.01Å; T825-A827 PolarHBondContact O-N 3.49Å; T825-N828 PolarHBondContact O-N 3.49Å; T825-E829 WeakPolarHBondContact O-CG 3.22Å; T825-E829 PolarHBondContact O-N 3.39Å
826E93.7Very high94Very high122 Ų12297.1 Ų97.157%0.5748%0.484SS*.Hα-helixtrans-63.5-41.3177.3-72.8169.3-167.100111.3R822 E829 C830R822-E826 WeakPolarHBondContact O-CB 3.39Å; R822-E826 VanDerWaalsContact O-CG 3.31Å; R822-E826 WeakPolarHBondContact O-CG 3.29Å; R822-E826 PolarHBondContact O-N 3.41Å; E826-E829 PolarHBondContact O-N 3.16Å; E826-C830 VanDerWaalsContact O-CB 3.32Å; E826-C830 WeakPolarHBondContact O-CB 3.47Å; E826-C830 PolarHBondContact O-N 2.87Å
827A92.8Very high93.9Very high42 Ų4299.7 Ų99.735%0.34750%0.496SS..Hα-helixtrans-63.1-42.6173.700000111.7A823 T825 C830 F831A823-A827 VanDerWaalsContact O-CB 3.23Å; A823-A827 WeakPolarHBondContact O-CB 3.21Å; A823-A827 PolarHBondContact O-N 3.23Å; T825-A827 PolarHBondContact O-N 3.49Å; A827-C830 WeakPolarHBondContact O-CB 3.2Å; A827-C830 PolarHBondContact O-N 2.81Å; A827-F831 HydrophobicContact CB-CE2 4.45Å; A827-F831 WeakPolarHBondContact O-CD2 3.47Å; A827-F831 WeakPolarHBondContact O-CG 3.28Å; A827-F831 PolarHBondContact O-N 3.12Å
828N93.7Very high94Very high91 Ų91101.9 Ų101.949%0.48750%0.499SS..Hα-helixtrans-64.5-41.4176.2-77.1-34.2000112.5V824 T825 C830 F831 E832V824-N828 WeakPolarHBondContact O-CB 3.47Å; V824-N828 VanDerWaalsContact O-CG 3.25Å; V824-N828 PolarHBondContact O-N 2.85Å; V824-N828 PolarHBondContact O-ND2 3.41Å; V824-N828 VanDerWaalsContact O-ND2 3.11Å; T825-N828 PolarHBondContact O-N 3.49Å; N828-C830 VanDerWaalsContact C-N 3.35Å; N828-F831 PolarHBondContact O-N 3.46Å; N828-E832 WeakPolarHBondContact O-CG 3.43Å; N828-E832 PolarHBondContact O-N 3.47Å
829E94.8Very high94Very high128 Ų128102.9 Ų102.960%0.59850%0.504SS*.Hα-helixtrans-61.6-44.3173.3-73.7179.7171.600111.1T825 E826 F831 E832 D833T825-E829 WeakPolarHBondContact O-CG 3.22Å; T825-E829 PolarHBondContact O-N 3.39Å; E826-E829 PolarHBondContact O-N 3.16Å; E829-F831 VanDerWaalsContact C-N 3.34Å; E829-F831 PolarHBondContact O-N 3.23Å; E829-E832 PolarHBondContact O-N 2.92Å; E829-D833 PolarHBondContact O-N 3.47Å
830C94.4Very high94Very high84 Ų84105 Ų10557%0.56851%0.512SS*.Hα-helixtrans-59.8-42.1174.5-173.10000112E826 A827 N828 D833 L834E826-C830 VanDerWaalsContact O-CB 3.32Å; E826-C830 WeakPolarHBondContact O-CB 3.47Å; E826-C830 PolarHBondContact O-N 2.87Å; A827-C830 WeakPolarHBondContact O-CB 3.2Å; A827-C830 PolarHBondContact O-N 2.81Å; N828-C830 VanDerWaalsContact C-N 3.35Å; C830-D833 PolarHBondContact O-N 2.84Å; C830-L834 WeakPolarHBondContact O-CB 3.29Å; C830-L834 PolarHBondContact O-N 2.94Å
831F93.8Very high94.2Very high125 Ų125102.1 Ų102.155%0.54851%0.509SS..Hα-helixtrans-64.7-40.1174.2-77.1-59.3000112.8A827 N828 E829 L834 R835A827-F831 HydrophobicContact CB-CE2 4.45Å; A827-F831 WeakPolarHBondContact O-CD2 3.47Å; A827-F831 WeakPolarHBondContact O-CG 3.28Å; A827-F831 PolarHBondContact O-N 3.12Å; N828-F831 PolarHBondContact O-N 3.46Å; E829-F831 VanDerWaalsContact C-N 3.34Å; E829-F831 PolarHBondContact O-N 3.23Å; F831-L834 PolarHBondContact O-N 3.24Å; F831-R835 WeakPolarHBondContact O-CB 3.49Å; F831-R835 VanDerWaalsContact O-CG 3.29Å; F831-R835 WeakPolarHBondContact O-CG 3.36Å; F831-R835 PolarHBondContact O-N 2.94Å
832E93.7Very high94.2Very high85 Ų8599.7 Ų99.740%0.39750%0.5SS..Hα-helixtrans-67.1-39.2176.6-77-59.3132.500111.9N828 E829 R835 K836N828-E832 WeakPolarHBondContact O-CG 3.43Å; N828-E832 PolarHBondContact O-N 3.47Å; E829-E832 PolarHBondContact O-N 2.92Å; E832-R835 WeakPolarHBondContact O-CB 3.41Å; E832-R835 PolarHBondContact O-N 3.39Å; E832-R835 IonicContact OE1-CZ 3.33Å; E832-R835 IonicContact OE1-NH1 3.34Å; E832-R835 PolarHBondContact OE1-NH1 2.92Å; E832-K836 VanDerWaalsContact O-CG 3.26Å; E832-K836 WeakPolarHBondContact O-CG 3.36Å; E832-K836 PolarHBondContact O-N 3.44Å
833D94Very high94.3Very high83 Ų83100.1 Ų100.144%0.44451%0.505SS..Hα-helixtrans-68-40.5174.9-72.8-16.8000111.9E829 C830 R835 K836 Q837E829-D833 PolarHBondContact O-N 3.47Å; C830-D833 PolarHBondContact O-N 2.84Å; D833-R835 VanDerWaalsContact C-N 3.32Å; D833-R835 PolarHBondContact O-N 2.75Å; D833-K836 PolarHBondContact O-N 3.45Å; D833-K836 IonicContact OD1-NZ 3.86Å; D833-K836 PolarHBondContact OD1-NZ 3.34Å; D833-Q837 WeakPolarHBondContact O-CB 3.28Å; D833-Q837 WeakPolarHBondContact O-CG 3.43Å; D833-Q837 PolarHBondContact O-N 2.92Å
834L94.1Very high94.3Very high103 Ų103101.7 Ų101.754%0.53951%0.507SS..Hα-helixtrans-64.3-36.8173.5-169.563.8000111.8C830 F831 Q837 H838C830-L834 WeakPolarHBondContact O-CB 3.29Å; C830-L834 PolarHBondContact O-N 2.94Å; F831-L834 PolarHBondContact O-N 3.24Å; L834-Q837 PolarHBondContact O-N 2.87Å; L834-H838 WeakPolarHBondContact O-CB 3.5Å; L834-H838 PolarHBondContact O-N 3.39Å
835R95.1Very high94.3Very high147 Ų147102.7 Ų102.756%0.55551%0.507SS*.Hα-helixtrans-64.1-43.8172-79.9174.3177.3171.5-0.4112.1F831 E832 D833 Q837 H838 H839F831-R835 WeakPolarHBondContact O-CB 3.49Å; F831-R835 VanDerWaalsContact O-CG 3.29Å; F831-R835 WeakPolarHBondContact O-CG 3.36Å; F831-R835 PolarHBondContact O-N 2.94Å; E832-R835 WeakPolarHBondContact O-CB 3.41Å; E832-R835 PolarHBondContact O-N 3.39Å; E832-R835 IonicContact OE1-CZ 3.33Å; E832-R835 IonicContact OE1-NH1 3.34Å; E832-R835 PolarHBondContact OE1-NH1 2.92Å; D833-R835 VanDerWaalsContact C-N 3.32Å; D833-R835 PolarHBondContact O-N 2.75Å; R835-Q837 VanDerWaalsContact C-N 3.34Å; R835-H838 PolarHBondContact O-N 2.89Å; R835-H839 WeakPolarHBondContact O-CB 3.26Å; R835-H839 PolarHBondContact O-CD2 3.29Å; R835-H839 PolarHBondContact O-N 3.3Å
836K94.9Very high94.4Very high121 Ų121104.5 Ų104.553%0.52651%0.51SS..Hα-helixtrans-61.6-43.5175.1-69.3167.4-155.1156.60111E832 D833 H839 L840E832-K836 VanDerWaalsContact O-CG 3.26Å; E832-K836 WeakPolarHBondContact O-CG 3.36Å; E832-K836 PolarHBondContact O-N 3.44Å; D833-K836 PolarHBondContact O-N 3.45Å; D833-K836 IonicContact OD1-NZ 3.86Å; D833-K836 PolarHBondContact OD1-NZ 3.34Å; K836-H839 PolarHBondContact O-N 2.9Å; K836-L840 WeakPolarHBondContact O-CB 3.22Å; K836-L840 PolarHBondContact O-N 2.86Å
837Q93.7Very high94.5Very high128 Ų128104.5 Ų104.560%0.59851%0.51SS*.Hα-helixtrans-62.6-43.7175.1-74.4-179.7-20.800111.7D833 L834 R835 L840 L841D833-Q837 WeakPolarHBondContact O-CB 3.28Å; D833-Q837 WeakPolarHBondContact O-CG 3.43Å; D833-Q837 PolarHBondContact O-N 2.92Å; L834-Q837 PolarHBondContact O-N 2.87Å; R835-Q837 VanDerWaalsContact C-N 3.34Å; Q837-L840 PolarHBondContact O-N 3.21Å; Q837-L841 WeakPolarHBondContact O-CB 3.24Å; Q837-L841 PolarHBondContact O-N 2.71Å
838H94.2Very high94.6Very high111 Ų111106.8 Ų106.851%0.51452%0.516SS..Hα-helixtrans-63-42.7175.7-175.860.9000111.9L834 R835 L841 L842L834-H838 WeakPolarHBondContact O-CB 3.5Å; L834-H838 PolarHBondContact O-N 3.39Å; R835-H838 PolarHBondContact O-N 2.89Å; H838-L841 PolarHBondContact O-N 3.35Å; H838-L842 WeakPolarHBondContact O-CB 3.17Å; H838-L842 PolarHBondContact O-N 2.77Å
839H94.5Very high94.6Very high116 Ų116107.3 Ų107.354%0.53752%0.515SS..Hα-helixtrans-65.2-37174.5-76.7-37.7000113R835 K836 L842 K843R835-H839 WeakPolarHBondContact O-CB 3.26Å; R835-H839 PolarHBondContact O-CD2 3.29Å; R835-H839 PolarHBondContact O-N 3.3Å; K836-H839 PolarHBondContact O-N 2.9Å; H839-L842 PolarHBondContact O-N 2.89Å; H839-K843 WeakPolarHBondContact O-CG 2.86Å; H839-K843 PolarHBondContact O-N 3.31Å
840L94.8Very high94.7Very high103 Ų103104 Ų10454%0.53951%0.51SS..Hα-helixtrans-65.8-46.2174.1-175.762.8000110.6K836 Q837 L842 K843 D844K836-L840 WeakPolarHBondContact O-CB 3.22Å; K836-L840 PolarHBondContact O-N 2.86Å; Q837-L840 PolarHBondContact O-N 3.21Å; L840-L842 VanDerWaalsContact C-N 3.26Å; L840-L842 PolarHBondContact O-N 2.84Å; L840-K843 WeakPolarHBondContact O-CB 2.77Å; L840-K843 PolarHBondContact O-N 2.79Å; L840-K843 VanDerWaalsContact O-N 3.09Å; L840-D844 PolarHBondContact O-N 3.29Å
841L95.5Very high94.7Very high116 Ų116105 Ų10561%0.60751%0.509SS*.Hα-helixtrans-61.3-36.1176.1-171.667.4000112Q837 H838 D844 H845Q837-L841 WeakPolarHBondContact O-CB 3.24Å; Q837-L841 PolarHBondContact O-N 2.71Å; H838-L841 PolarHBondContact O-N 3.35Å; L841-D844 PolarHBondContact O-N 3.11Å; L841-H845 WeakPolarHBondContact O-CB 3.07Å; L841-H845 PolarHBondContact O-N 3.4Å
842L95.8Very high94.8Very high76 Ų76104.1 Ų104.140%0.39851%0.507SS..Hα-helixtrans-63-45.8173.4-128.481.9000111.3H838 H839 L840 D844 H845 E846H838-L842 WeakPolarHBondContact O-CB 3.17Å; H838-L842 PolarHBondContact O-N 2.77Å; H839-L842 PolarHBondContact O-N 2.89Å; L840-L842 VanDerWaalsContact C-N 3.26Å; L840-L842 PolarHBondContact O-N 2.84Å; L842-D844 VanDerWaalsContact C-N 3.35Å; L842-D844 PolarHBondContact O-N 3.29Å; L842-H845 WeakPolarHBondContact O-CB 3.39Å; L842-H845 PolarHBondContact O-N 3.39Å; L842-E846 VanDerWaalsContact O-CG 3.31Å; L842-E846 WeakPolarHBondContact O-CG 3.24Å; L842-E846 PolarHBondContact O-N 2.85Å
843K95.5Very high94.9Very high124 Ų124107.2 Ų107.254%0.53952%0.521SS..Hα-helixtrans-62.8-41.4176.2-73.5178.1179.2-178.30112H839 L840 H845 E846 Q847H839-K843 WeakPolarHBondContact O-CG 2.86Å; H839-K843 PolarHBondContact O-N 3.31Å; L840-K843 WeakPolarHBondContact O-CB 2.77Å; L840-K843 PolarHBondContact O-N 2.79Å; L840-K843 VanDerWaalsContact O-N 3.09Å; K843-H845 VanDerWaalsContact C-N 3.29Å; K843-H845 PolarHBondContact O-N 2.74Å; K843-E846 PolarHBondContact O-N 2.94Å; K843-Q847 WeakPolarHBondContact O-CB 3.27Å; K843-Q847 VanDerWaalsContact O-CG 3.26Å; K843-Q847 WeakPolarHBondContact O-CG 2.83Å; K843-Q847 PolarHBondContact O-N 2.69Å
844D94.5Very high94.9Very high75 Ų75108.7 Ų108.740%0.40153%0.525SS..Hα-helixtrans-64.7-37.9176.5-67-11000110.6L840 L841 L842 Q847 L848L840-D844 PolarHBondContact O-N 3.29Å; L841-D844 PolarHBondContact O-N 3.11Å; L842-D844 VanDerWaalsContact C-N 3.35Å; L842-D844 PolarHBondContact O-N 3.29Å; D844-Q847 PolarHBondContact O-N 3.47Å; D844-L848 WeakPolarHBondContact O-CB 3.06Å; D844-L848 PolarHBondContact O-N 2.88Å
845H94.5Very high94.9Very high105 Ų105107.6 Ų107.649%0.48652%0.52SS..Hα-helixtrans-65.9-43.4173.7-169.370.9000112.4L841 L842 K843 Q847 L848 Q849L841-H845 WeakPolarHBondContact O-CB 3.07Å; L841-H845 PolarHBondContact O-N 3.4Å; L842-H845 WeakPolarHBondContact O-CB 3.39Å; L842-H845 PolarHBondContact O-N 3.39Å; K843-H845 VanDerWaalsContact C-N 3.29Å; K843-H845 PolarHBondContact O-N 2.74Å; H845-Q847 VanDerWaalsContact C-N 3.34Å; H845-L848 PolarHBondContact O-N 3.42Å; H845-Q849 PolarHBondContact CD2-NE2 3.39Å; H845-Q849 VanDerWaalsContact CD2-NE2 3.29Å; H845-Q849 PolarHBondContact NE2-NE2 3.08Å; H845-Q849 WeakPolarHBondContact O-CB 3.41Å; H845-Q849 VanDerWaalsContact O-CG 3.31Å; H845-Q849 WeakPolarHBondContact O-CG 3.28Å; H845-Q849 PolarHBondContact O-N 2.87Å
846E94.4Very high95Very high109 Ų109103.7 Ų103.751%0.50952%0.515SS..Hα-helixtrans-61.1-42174.1-72.9168.3-178.100111.5L842 K843 Q849 A850L842-E846 VanDerWaalsContact O-CG 3.31Å; L842-E846 WeakPolarHBondContact O-CG 3.24Å; L842-E846 PolarHBondContact O-N 2.85Å; K843-E846 PolarHBondContact O-N 2.94Å; E846-Q849 PolarHBondContact O-N 3.26Å; E846-A850 WeakPolarHBondContact O-CB 3.11Å; E846-A850 PolarHBondContact O-N 3.35Å
847Q95.5Very high95Very high123 Ų123100.1 Ų100.158%0.57551%0.505SS*.Hα-helixtrans-64.2-44175.2-73.917517.900111.7K843 D844 H845 Q849 A850 L851K843-Q847 WeakPolarHBondContact O-CB 3.27Å; K843-Q847 VanDerWaalsContact O-CG 3.26Å; K843-Q847 WeakPolarHBondContact O-CG 2.83Å; K843-Q847 PolarHBondContact O-N 2.69Å; D844-Q847 PolarHBondContact O-N 3.47Å; H845-Q847 VanDerWaalsContact C-N 3.34Å; Q847-Q849 VanDerWaalsContact C-N 3.35Å; Q847-A850 PolarHBondContact O-N 2.84Å; Q847-L851 WeakPolarHBondContact O-CG 3.07Å; Q847-L851 PolarHBondContact O-N 2.88Å
848L95.6Very high95Very high89 Ų8998 Ų9847%0.46650%0.498SS..Hα-helixtrans-65.1-39.7177.1-176.262.7000111.7D844 H845 L851 H852D844-L848 WeakPolarHBondContact O-CB 3.06Å; D844-L848 PolarHBondContact O-N 2.88Å; H845-L848 PolarHBondContact O-N 3.42Å; L848-L851 PolarHBondContact O-N 3.48Å; L848-H852 PolarHBondContact O-CD2 3.31Å; L848-H852 PolarHBondContact O-N 3.4Å
849Q94.3Very high95.1Very high102 Ų10299.8 Ų99.848%0.47750%0.501SS..Hα-helixtrans-60.4-45.6172-77.4179.4-12.200111.2H845 E846 Q847 L851 H852 E853H845-Q849 PolarHBondContact CD2-NE2 3.39Å; H845-Q849 VanDerWaalsContact CD2-NE2 3.29Å; H845-Q849 PolarHBondContact NE2-NE2 3.08Å; H845-Q849 WeakPolarHBondContact O-CB 3.41Å; H845-Q849 VanDerWaalsContact O-CG 3.31Å; H845-Q849 WeakPolarHBondContact O-CG 3.28Å; H845-Q849 PolarHBondContact O-N 2.87Å; E846-Q849 PolarHBondContact O-N 3.26Å; Q847-Q849 VanDerWaalsContact C-N 3.35Å; Q849-L851 VanDerWaalsContact C-N 3.32Å; Q849-L851 PolarHBondContact O-N 3.47Å; Q849-H852 PolarHBondContact O-N 2.87Å; Q849-H852 VanDerWaalsContact O-N 3.13Å; Q849-E853 WeakPolarHBondContact O-CB 2.94Å; Q849-E853 PolarHBondContact O-N 3.08Å
850A95.4Very high95.1Very high59 Ų5998.7 Ų98.749%0.48850%0.499SS..Hα-helixtrans-61.3-39.5176.400000112.4E846 Q847 E853 Q854E846-A850 WeakPolarHBondContact O-CB 3.11Å; E846-A850 PolarHBondContact O-N 3.35Å; Q847-A850 PolarHBondContact O-N 2.84Å; A850-E853 PolarHBondContact O-N 3.35Å; A850-Q854 WeakPolarHBondContact O-CB 3.38Å; A850-Q854 PolarHBondContact O-N 3.02Å
851L95.9Very high95.1Very high104 Ų10499.5 Ų99.555%0.54550%0.5SS..Hα-helixtrans-65.8-38173.7-71.2175000112.2Q847 L848 Q849 L855Q847-L851 WeakPolarHBondContact O-CG 3.07Å; Q847-L851 PolarHBondContact O-N 2.88Å; L848-L851 PolarHBondContact O-N 3.48Å; Q849-L851 VanDerWaalsContact C-N 3.32Å; Q849-L851 PolarHBondContact O-N 3.47Å; L851-L855 WeakPolarHBondContact O-CB 3.24Å; L851-L855 PolarHBondContact O-N 3.17Å
852H95.9Very high95Very high108 Ų10898.9 Ų98.950%0.550%0.497SS..Hα-helixtrans-67.9-39.5174.2-81.4-57.6000112.6L848 Q849 L855 S856L848-H852 PolarHBondContact O-CD2 3.31Å; L848-H852 PolarHBondContact O-N 3.4Å; Q849-H852 PolarHBondContact O-N 2.87Å; Q849-H852 VanDerWaalsContact O-N 3.13Å; H852-L855 PolarHBondContact O-N 3.42Å; H852-S856 VanDerWaalsContact O-CB 3.26Å; H852-S856 WeakPolarHBondContact O-CB 3.41Å; H852-S856 PolarHBondContact O-N 3.42Å; H852-S856 PolarHBondContact O-OG 3.37Å
853E94.2Very high95Very high149 Ų149103 Ų10370%0.69651%0.507SS*.Hα-helixtrans-62.9-44.9174.3-16392.9-151.700110.4Q849 A850 S856 S857Q849-E853 WeakPolarHBondContact O-CB 2.94Å; Q849-E853 PolarHBondContact O-N 3.08Å; A850-E853 PolarHBondContact O-N 3.35Å; E853-S856 PolarHBondContact O-N 2.86Å; E853-S857 WeakPolarHBondContact O-CB 3.38Å; E853-S857 PolarHBondContact O-N 2.84Å; E853-S857 PolarHBondContact O-OG 2.86Å
854Q95.6Very high95Very high114 Ų11499.5 Ų99.553%0.53350%0.501SS..Hα-helixtrans-64.4-45.8175.8-175.4178.9-18.800111.6A850 S856 S857 D858A850-Q854 WeakPolarHBondContact O-CB 3.38Å; A850-Q854 PolarHBondContact O-N 3.02Å; Q854-S856 VanDerWaalsContact C-N 3.28Å; Q854-S856 PolarHBondContact O-N 2.86Å; Q854-S857 PolarHBondContact O-N 3.4Å; Q854-S857 PolarHBondContact O-OG 3.19Å; Q854-D858 WeakPolarHBondContact O-CB 3.32Å; Q854-D858 VanDerWaalsContact O-CG 3.3Å; Q854-D858 PolarHBondContact O-N 3.19Å
855L94Very high95Very high81 Ų81100.6 Ų100.642%0.42451%0.507SS..Hα-helixtrans-63.4-38.1177.2-177.463.2000111.2L851 H852 D858 Y859L851-L855 WeakPolarHBondContact O-CB 3.24Å; L851-L855 PolarHBondContact O-N 3.17Å; H852-L855 PolarHBondContact O-N 3.42Å; L855-D858 PolarHBondContact O-N 2.95Å; L855-Y859 HydrophobicContact CD1-CD2 4.02Å; L855-Y859 HydrophobicContact CD1-CE2 3.57Å; L855-Y859 HydrophobicContact CD2-CE2 3.9Å; L855-Y859 HydrophobicContact CG-CD2 3.77Å; L855-Y859 HydrophobicContact CG-CE2 3.47Å; L855-Y859 VanDerWaalsContact CG-CE2 3.47Å; L855-Y859 WeakPolarHBondContact O-CB 3.44Å; L855-Y859 WeakPolarHBondContact O-CD2 3.34Å; L855-Y859 PolarHBondContact O-N 2.88Å
856S95.7Very high95Very high64 Ų6498.5 Ų98.545%0.44850%0.501SS..Hα-helixtrans-65.8-42.6175.9-59.40000111.4H852 E853 Q854 Y859 D860H852-S856 VanDerWaalsContact O-CB 3.26Å; H852-S856 WeakPolarHBondContact O-CB 3.41Å; H852-S856 PolarHBondContact O-N 3.42Å; H852-S856 PolarHBondContact O-OG 3.37Å; E853-S856 PolarHBondContact O-N 2.86Å; Q854-S856 VanDerWaalsContact C-N 3.28Å; Q854-S856 PolarHBondContact O-N 2.86Å; S856-Y859 PolarHBondContact O-N 3.27Å; S856-D860 PolarHBondContact O-N 3.4Å
857S95.3Very high95Very high46 Ų4698.9 Ų98.932%0.32250%0.503SS..Hα-helixtrans-66.1-40.4176.473.70000111.8E853 Q854 Y859 D860 H861E853-S857 WeakPolarHBondContact O-CB 3.38Å; E853-S857 PolarHBondContact O-N 2.84Å; E853-S857 PolarHBondContact O-OG 2.86Å; Q854-S857 PolarHBondContact O-N 3.4Å; Q854-S857 PolarHBondContact O-OG 3.19Å; S857-Y859 PolarHBondContact O-N 2.83Å; S857-D860 PolarHBondContact O-N 2.79Å; S857-H861 WeakPolarHBondContact O-CB 3.17Å; S857-H861 VanDerWaalsContact O-CG 3.24Å; S857-H861 PolarHBondContact O-N 3.46Å; S857-H861 PolarHBondContact O-ND1 3.31Å
858D94.7Very high94.9Very high85 Ų8595.3 Ų95.346%0.45549%0.492SS..Hα-helixtrans-61.4-42.6172.9-73.4-21.1000111.5Q854 L855 H861 L862Q854-D858 WeakPolarHBondContact O-CB 3.32Å; Q854-D858 VanDerWaalsContact O-CG 3.3Å; Q854-D858 PolarHBondContact O-N 3.19Å; L855-D858 PolarHBondContact O-N 2.95Å; D858-H861 PolarHBondContact O-N 3.46Å; D858-L862 WeakPolarHBondContact O-CB 3.28Å; D858-L862 PolarHBondContact O-N 3.34Å
859Y95.6Very high94.9Very high147 Ų14796.1 Ų96.158%0.57650%0.496SS*.Hα-helixtrans-62.7-42.3173.9-84.9-59.2000112.2L855 S856 S857 L862 R863L855-Y859 HydrophobicContact CD1-CD2 4.02Å; L855-Y859 HydrophobicContact CD1-CE2 3.57Å; L855-Y859 HydrophobicContact CD2-CE2 3.9Å; L855-Y859 HydrophobicContact CG-CD2 3.77Å; L855-Y859 HydrophobicContact CG-CE2 3.47Å; L855-Y859 VanDerWaalsContact CG-CE2 3.47Å; L855-Y859 WeakPolarHBondContact O-CB 3.44Å; L855-Y859 WeakPolarHBondContact O-CD2 3.34Å; L855-Y859 PolarHBondContact O-N 2.88Å; S856-Y859 PolarHBondContact O-N 3.27Å; S857-Y859 PolarHBondContact O-N 2.83Å; Y859-L862 PolarHBondContact O-N 2.77Å; Y859-R863 VanDerWaalsContact O-CB 3.26Å; Y859-R863 WeakPolarHBondContact O-CB 3.33Å; Y859-R863 PolarHBondContact O-N 3.29Å
860D94.5Very high94.9Very high94 Ų9497.1 Ų97.150%0.50350%0.499SS..Hα-helixtrans-67.5-38.3176.9-77.5-28.5000111.9S856 S857 R863 A864S856-D860 PolarHBondContact O-N 3.4Å; S857-D860 PolarHBondContact O-N 2.79Å; D860-R863 WeakPolarHBondContact O-CB 3.17Å; D860-R863 PolarHBondContact O-N 3.46Å; D860-A864 WeakPolarHBondContact O-CB 3.45Å; D860-A864 PolarHBondContact O-N 2.79Å
861H94.9Very high94.8Very high120 Ų12097.2 Ų97.256%0.55650%0.496SS*.Hα-helixtrans-64-45.9174.4-75.233.3000110.8S857 D858 R863 A864 N865S857-H861 WeakPolarHBondContact O-CB 3.17Å; S857-H861 VanDerWaalsContact O-CG 3.24Å; S857-H861 PolarHBondContact O-N 3.46Å; S857-H861 PolarHBondContact O-ND1 3.31Å; D858-H861 PolarHBondContact O-N 3.46Å; H861-R863 VanDerWaalsContact C-N 3.3Å; H861-R863 PolarHBondContact O-N 2.92Å; H861-A864 PolarHBondContact O-N 3.39Å; H861-N865 WeakPolarHBondContact O-CB 3.48Å; H861-N865 VanDerWaalsContact O-CG 3.27Å; H861-N865 PolarHBondContact O-N 2.88Å; H861-N865 PolarHBondContact O-ND2 2.94Å
862L94.2Very high94.7Very high102 Ų10297.5 Ų97.553%0.53449%0.494SS..Hα-helixtrans-62.3-40.2175.2-174.462.3000111.2D858 Y859 N865 V866D858-L862 WeakPolarHBondContact O-CB 3.28Å; D858-L862 PolarHBondContact O-N 3.34Å; Y859-L862 PolarHBondContact O-N 2.77Å; L862-N865 PolarHBondContact O-N 2.84Å; L862-V866 WeakPolarHBondContact O-CB 3.46Å; L862-V866 VanDerWaalsContact O-CG2 3.28Å; L862-V866 WeakPolarHBondContact O-CG2 3.16Å; L862-V866 PolarHBondContact O-N 3.36Å
863R95.2Very high94.5Very high163 Ų16397 Ų9762%0.61550%0.495SS*.Hα-helixtrans-63.7-43.4176.5-165.8179-171.3-175.41.9111.6Y859 D860 H861 V866 Q867Y859-R863 VanDerWaalsContact O-CB 3.26Å; Y859-R863 WeakPolarHBondContact O-CB 3.33Å; Y859-R863 PolarHBondContact O-N 3.29Å; D860-R863 WeakPolarHBondContact O-CB 3.17Å; D860-R863 PolarHBondContact O-N 3.46Å; H861-R863 VanDerWaalsContact C-N 3.3Å; H861-R863 PolarHBondContact O-N 2.92Å; R863-V866 PolarHBondContact O-N 3.4Å; R863-Q867 VanDerWaalsContact O-CG 3.28Å; R863-Q867 WeakPolarHBondContact O-CG 3.49Å; R863-Q867 PolarHBondContact O-N 2.82Å
864A94.8Very high94.6Very high51 Ų5198.9 Ų98.942%0.42150%0.496SS..Hα-helixtrans-63.6-43.6174.800000111.6D860 H861 V866 Q867 S868D860-A864 WeakPolarHBondContact O-CB 3.45Å; D860-A864 PolarHBondContact O-N 2.79Å; H861-A864 PolarHBondContact O-N 3.39Å; A864-V866 PolarHBondContact O-N 3.47Å; A864-Q867 PolarHBondContact O-N 3.13Å; A864-S868 WeakPolarHBondContact O-CB 3.16Å; A864-S868 PolarHBondContact O-N 3.36Å
865N94.2Very high94.4Very high98 Ų9898.5 Ų98.552%0.52449%0.494SS..Hα-helixtrans-62.1-43.6175.6-74-20.9000111.9H861 L862 Q867 S868 L869H861-N865 WeakPolarHBondContact O-CB 3.48Å; H861-N865 VanDerWaalsContact O-CG 3.27Å; H861-N865 PolarHBondContact O-N 2.88Å; H861-N865 PolarHBondContact O-ND2 2.94Å; L862-N865 PolarHBondContact O-N 2.84Å; N865-Q867 VanDerWaalsContact C-N 3.33Å; N865-Q867 PolarHBondContact O-N 3.36Å; N865-S868 PolarHBondContact O-N 2.93Å; N865-L869 WeakPolarHBondContact O-CB 3.48Å; N865-L869 WeakPolarHBondContact O-CG 2.99Å; N865-L869 PolarHBondContact O-N 3.31Å
866V94.4Very high94.2Very high60 Ų6096.9 Ų96.936%0.36449%0.493SS..Hα-helixtrans-63.8-38.3175.3168.90000111.3L862 R863 A864 K870L862-V866 WeakPolarHBondContact O-CB 3.46Å; L862-V866 VanDerWaalsContact O-CG2 3.28Å; L862-V866 WeakPolarHBondContact O-CG2 3.16Å; L862-V866 PolarHBondContact O-N 3.36Å; R863-V866 PolarHBondContact O-N 3.4Å; A864-V866 PolarHBondContact O-N 3.47Å; V866-K870 HydrophobicContact CG1-CD 4.13Å; V866-K870 VanDerWaalsContact O-CB 3.31Å; V866-K870 WeakPolarHBondContact O-CB 2.84Å; V866-K870 VanDerWaalsContact O-CG 3.23Å; V866-K870 WeakPolarHBondContact O-CG 3.29Å; V866-K870 PolarHBondContact O-N 3.38Å
867Q94.8Very high94.2Very high118 Ų118100.3 Ų100.355%0.55150%0.499SS*.Hα-helixtrans-66.4-43.5174.4-73.1175.110.600111.8R863 A864 N865 K870 S871R863-Q867 VanDerWaalsContact O-CG 3.28Å; R863-Q867 WeakPolarHBondContact O-CG 3.49Å; R863-Q867 PolarHBondContact O-N 2.82Å; A864-Q867 PolarHBondContact O-N 3.13Å; N865-Q867 VanDerWaalsContact C-N 3.33Å; N865-Q867 PolarHBondContact O-N 3.36Å; Q867-K870 PolarHBondContact O-N 2.82Å; Q867-S871 PolarHBondContact O-N 3.21Å
868S94.7Very high94Very high47 Ų47102.9 Ų102.933%0.32951%0.506SS..Hα-helixtrans-59.7-51.5174.7179.30000111.1A864 N865 K870 S871 Q872A864-S868 WeakPolarHBondContact O-CB 3.16Å; A864-S868 PolarHBondContact O-N 3.36Å; N865-S868 PolarHBondContact O-N 2.93Å; S868-K870 VanDerWaalsContact C-N 3.32Å; S868-K870 PolarHBondContact O-N 3.35Å; S868-S871 CarbonylContact O-C 3.59Å; S868-S871 WeakPolarHBondContact O-CA 3.25Å; S868-S871 WeakPolarHBondContact O-CB 3.44Å; S868-S871 PolarHBondContact O-N 2.88Å; S868-S871 PolarHBondContact O-OG 3.36Å; S868-Q872 WeakPolarHBondContact O-CG 3.45Å; S868-Q872 PolarHBondContact O-N 3.25Å; S868-Q872 PolarHBondContact OG-NE2 3.33Å
869L93.8Very high93.9Very high107 Ų107102.2 Ų102.256%0.5650%0.502SS*.Hα-helixtrans-61.2-38.3176.6-71.7172.5000112.4N865 S871 Q872 L873N865-L869 WeakPolarHBondContact O-CB 3.48Å; N865-L869 WeakPolarHBondContact O-CG 2.99Å; N865-L869 PolarHBondContact O-N 3.31Å; L869-S871 VanDerWaalsContact C-N 3.34Å; L869-Q872 PolarHBondContact O-N 2.9Å; L869-L873 VanDerWaalsContact O-CB 3.27Å; L869-L873 WeakPolarHBondContact O-CB 3Å; L869-L873 PolarHBondContact O-N 3.46Å
870K95.2Very high93.6Very high122 Ų12299.3 Ų99.353%0.5350%0.503SS..Hα-helixtrans-63.1-39.8172.4-79.8174.4-179.4176.60111.9V866 Q867 S868 R874V866-K870 HydrophobicContact CG1-CD 4.13Å; V866-K870 VanDerWaalsContact O-CB 3.31Å; V866-K870 WeakPolarHBondContact O-CB 2.84Å; V866-K870 VanDerWaalsContact O-CG 3.23Å; V866-K870 WeakPolarHBondContact O-CG 3.29Å; V866-K870 PolarHBondContact O-N 3.38Å; Q867-K870 PolarHBondContact O-N 2.82Å; S868-K870 VanDerWaalsContact C-N 3.32Å; S868-K870 PolarHBondContact O-N 3.35Å; K870-R874 VanDerWaalsContact O-CG 3.3Å; K870-R874 WeakPolarHBondContact O-CG 3.2Å; K870-R874 PolarHBondContact O-N 2.83Å
871S93Very high93.6Very high62 Ų6297.5 Ų97.543%0.43450%0.498SS..Hα-helixtrans-67.5-43.6176.276.60000111.8Q867 S868 L869 L873 R874 Q875Q867-S871 PolarHBondContact O-N 3.21Å; S868-S871 CarbonylContact O-C 3.59Å; S868-S871 WeakPolarHBondContact O-CA 3.25Å; S868-S871 WeakPolarHBondContact O-CB 3.44Å; S868-S871 PolarHBondContact O-N 2.88Å; S868-S871 PolarHBondContact O-OG 3.36Å; L869-S871 VanDerWaalsContact C-N 3.34Å; S871-L873 PolarHBondContact O-N 3.14Å; S871-R874 WeakPolarHBondContact O-CB 3.32Å; S871-R874 PolarHBondContact O-N 2.81Å; S871-Q875 WeakPolarHBondContact O-CB 3.41Å; S871-Q875 PolarHBondContact O-N 3.41Å
872Q93.7Very high93.6Very high109 Ų10995.4 Ų95.451%0.50949%0.491SS..Hα-helixtrans-63.7-39.5175.2-68.9175.821.400111.6S868 L869 Q875 A876S868-Q872 WeakPolarHBondContact O-CG 3.45Å; S868-Q872 PolarHBondContact O-N 3.25Å; S868-Q872 PolarHBondContact OG-NE2 3.33Å; L869-Q872 PolarHBondContact O-N 2.9Å; Q872-Q875 PolarHBondContact O-N 2.84Å; Q872-A876 VanDerWaalsContact O-CB 3.28Å; Q872-A876 WeakPolarHBondContact O-CB 3.25Å; Q872-A876 PolarHBondContact O-N 3.45Å
873L93Very high93.4Very high99 Ų9994.8 Ų94.852%0.51849%0.494SS..Hα-helixtrans-65.6-39.2175.1-17964.9000111.8L869 S871 K877L869-L873 VanDerWaalsContact O-CB 3.27Å; L869-L873 WeakPolarHBondContact O-CB 3Å; L869-L873 PolarHBondContact O-N 3.46Å; S871-L873 PolarHBondContact O-N 3.14Å; L873-K877 HydrophobicContact CG-CD 4.43Å; L873-K877 WeakPolarHBondContact O-CB 3.28Å; L873-K877 VanDerWaalsContact O-CG 3.24Å; L873-K877 WeakPolarHBondContact O-CG 3.4Å; L873-K877 PolarHBondContact O-N 2.97Å
874R94.4Very high93.3Very high187 Ų18789.7 Ų89.771%0.70649%0.486SS*.Hα-helixtrans-64-44173.3-73.4171.8-174.8165.70.5110.9K870 S871 K877 Q878K870-R874 VanDerWaalsContact O-CG 3.3Å; K870-R874 WeakPolarHBondContact O-CG 3.2Å; K870-R874 PolarHBondContact O-N 2.83Å; S871-R874 WeakPolarHBondContact O-CB 3.32Å; S871-R874 PolarHBondContact O-N 2.81Å; R874-K877 PolarHBondContact O-N 2.89Å; R874-Q878 PolarHBondContact O-N 3.44Å
875Q92.7Very high93.1Very high107 Ų10791.5 Ų91.550%0.549%0.489SS..Hα-helixtrans-61.8-51.2176.6-176.158.835.900111.3S871 Q872 K877 Q878 D879S871-Q875 WeakPolarHBondContact O-CB 3.41Å; S871-Q875 PolarHBondContact O-N 3.41Å; Q872-Q875 PolarHBondContact O-N 2.84Å; Q875-K877 VanDerWaalsContact C-N 3.3Å; Q875-K877 PolarHBondContact O-N 2.91Å; Q875-Q878 CarbonylContact O-C 3.52Å; Q875-Q878 WeakPolarHBondContact O-CA 3.16Å; Q875-Q878 WeakPolarHBondContact O-CB 3.46Å; Q875-Q878 PolarHBondContact O-N 2.98Å; Q875-D879 PolarHBondContact NE2-OD1 2.97Å; Q875-D879 PolarHBondContact NE2-OD2 3.42Å; Q875-D879 VanDerWaalsContact O-CG 3.31Å; Q875-D879 PolarHBondContact O-N 3.13Å
876A90.2Very high93.2Very high47 Ų4795.2 Ų95.239%0.38850%0.496SS..Hα-helixtrans-60.4-37.8177.700000112.4Q872 D879 C880Q872-A876 VanDerWaalsContact O-CB 3.28Å; Q872-A876 WeakPolarHBondContact O-CB 3.25Å; Q872-A876 PolarHBondContact O-N 3.45Å; A876-D879 PolarHBondContact O-N 2.93Å; A876-C880 WeakPolarHBondContact O-CB 3.36Å; A876-C880 PolarHBondContact O-N 2.93Å; A876-C880 PolarHBondContact O-SG 2.84Å
877K94.2Very high92.9Very high136 Ų13698.1 Ų98.159%0.59151%0.508SS*.Hα-helixtrans-64.6-41.4172.6-78.2178.5178.7-172.30112.1L873 R874 Q875 S881L873-K877 HydrophobicContact CG-CD 4.43Å; L873-K877 WeakPolarHBondContact O-CB 3.28Å; L873-K877 VanDerWaalsContact O-CG 3.24Å; L873-K877 WeakPolarHBondContact O-CG 3.4Å; L873-K877 PolarHBondContact O-N 2.97Å; R874-K877 PolarHBondContact O-N 2.89Å; Q875-K877 VanDerWaalsContact C-N 3.3Å; Q875-K877 PolarHBondContact O-N 2.91Å; K877-S881 WeakPolarHBondContact O-CB 3.06Å; K877-S881 PolarHBondContact O-N 3.04Å
878Q92.3Very high92.8Very high100 Ų10098.5 Ų98.547%0.46751%0.51SS..Hα-helixtrans-64.6-43.6175.4-173.260.641.200111.1R874 Q875 S881 N882R874-Q878 PolarHBondContact O-N 3.44Å; Q875-Q878 CarbonylContact O-C 3.52Å; Q875-Q878 WeakPolarHBondContact O-CA 3.16Å; Q875-Q878 WeakPolarHBondContact O-CB 3.46Å; Q875-Q878 PolarHBondContact O-N 2.98Å; Q878-S881 PolarHBondContact O-N 3.35Å; Q878-N882 PolarHBondContact NE2-OD1 3.44Å; Q878-N882 WeakPolarHBondContact O-CB 3.43Å; Q878-N882 PolarHBondContact O-N 2.88Å; Q878-N882 PolarHBondContact O-ND2 2.84Å; Q878-N882 PolarHBondContact O-OD1 2.84Å
879D91.6Very high92.7Very high70 Ų70101 Ų10137%0.37452%0.517SS..Hα-helixtrans-65.5-42.6178.2-66.5-28.9000111.5Q875 A876 S881 N882 C883Q875-D879 PolarHBondContact NE2-OD1 2.97Å; Q875-D879 PolarHBondContact NE2-OD2 3.42Å; Q875-D879 VanDerWaalsContact O-CG 3.31Å; Q875-D879 PolarHBondContact O-N 3.13Å; A876-D879 PolarHBondContact O-N 2.93Å; D879-S881 VanDerWaalsContact C-N 3.34Å; D879-S881 PolarHBondContact O-N 3.26Å; D879-N882 PolarHBondContact O-N 2.91Å; D879-C883 WeakPolarHBondContact O-CB 2.93Å; D879-C883 PolarHBondContact O-N 2.83Å; D879-C883 PolarHBondContact O-SG 3.39Å
880C90.8Very high92.6Very high87 Ų8799.4 Ų99.459%0.58851%0.511SS*.Hα-helixtrans-60.6-42.1171.9-74.90000112.1A876 C883 A884A876-C880 WeakPolarHBondContact O-CB 3.36Å; A876-C880 PolarHBondContact O-N 2.93Å; A876-C880 PolarHBondContact O-SG 2.84Å; C880-C883 PolarHBondContact O-N 3.14Å; C880-A884 WeakPolarHBondContact O-CB 3.02Å; C880-A884 PolarHBondContact O-N 3.18Å
881S94.4Very high92.5Very high56 Ų5695.8 Ų95.839%0.39250%0.499SS..Hα-helixtrans-64.5-41.8175.2-177.60000111.7K877 Q878 D879 A884 N885K877-S881 WeakPolarHBondContact O-CB 3.06Å; K877-S881 PolarHBondContact O-N 3.04Å; Q878-S881 PolarHBondContact O-N 3.35Å; D879-S881 VanDerWaalsContact C-N 3.34Å; D879-S881 PolarHBondContact O-N 3.26Å; S881-A884 PolarHBondContact O-N 2.96Å; S881-N885 WeakPolarHBondContact O-CB 3.44Å; S881-N885 PolarHBondContact O-N 2.82Å; S881-N885 PolarHBondContact O-ND2 3.19Å; S881-N885 PolarHBondContact O-OD1 2.87Å
882N93.8Very high92.4Very high76 Ų7695.3 Ų95.341%0.40650%0.496SS..Hα-helixtrans-63.7-44.1176.1-67.3-20.6000111.5Q878 D879 N885 R886Q878-N882 PolarHBondContact NE2-OD1 3.44Å; Q878-N882 WeakPolarHBondContact O-CB 3.43Å; Q878-N882 PolarHBondContact O-N 2.88Å; Q878-N882 PolarHBondContact O-ND2 2.84Å; Q878-N882 PolarHBondContact O-OD1 2.84Å; D879-N882 PolarHBondContact O-N 2.91Å; N882-N885 PolarHBondContact O-N 2.63Å; N882-R886 WeakPolarHBondContact O-CB 3.03Å; N882-R886 PolarHBondContact O-N 2.87Å
883C91Very high92.3Very high88 Ų8894.4 Ų94.460%0.59549%0.492SS*.Hα-helixtrans-63.3-42.4175.7-74.40000111.7D879 C880 R886 L887D879-C883 WeakPolarHBondContact O-CB 2.93Å; D879-C883 PolarHBondContact O-N 2.83Å; D879-C883 PolarHBondContact O-SG 3.39Å; C880-C883 PolarHBondContact O-N 3.14Å; C883-R886 PolarHBondContact O-N 3.48Å; C883-L887 WeakPolarHBondContact O-CB 3.26Å; C883-L887 PolarHBondContact O-N 2.82Å
884A91.3Very high92.2Very high56 Ų5694.3 Ų94.346%0.46349%0.492SS..Hα-helixtrans-61.1-46.6175.200000111.3C880 S881 R886 L887 E888C880-A884 WeakPolarHBondContact O-CB 3.02Å; C880-A884 PolarHBondContact O-N 3.18Å; S881-A884 PolarHBondContact O-N 2.96Å; A884-R886 PolarHBondContact O-N 3.21Å; A884-L887 PolarHBondContact O-N 2.84Å; A884-E888 WeakPolarHBondContact O-CB 3.38Å; A884-E888 PolarHBondContact O-N 3.41Å
885N92.6Very high92.1Very high90 Ų9092.5 Ų92.548%0.48149%0.485SS..Hα-helixtrans-62.6-41.3176.5-66.7-16.6000111.9S881 N882 L887 E888 Q889S881-N885 WeakPolarHBondContact O-CB 3.44Å; S881-N885 PolarHBondContact O-N 2.82Å; S881-N885 PolarHBondContact O-ND2 3.19Å; S881-N885 PolarHBondContact O-OD1 2.87Å; N882-N885 PolarHBondContact O-N 2.63Å; N885-L887 VanDerWaalsContact C-N 3.35Å; N885-E888 PolarHBondContact O-N 3.37Å; N885-Q889 WeakPolarHBondContact O-CB 3.47Å; N885-Q889 PolarHBondContact O-N 2.91Å
886R94.4Very high92.1Very high176 Ų17689.5 Ų89.566%0.66448%0.476SS*.Hα-helixtrans-62.8-42.2175.7-173.879.296.4112.87.2111.3N882 C883 A884 Q889 V890N882-R886 WeakPolarHBondContact O-CB 3.03Å; N882-R886 PolarHBondContact O-N 2.87Å; C883-R886 PolarHBondContact O-N 3.48Å; A884-R886 PolarHBondContact O-N 3.21Å; R886-Q889 PolarHBondContact O-N 3.27Å; R886-V890 WeakPolarHBondContact O-CG2 3.41Å; R886-V890 PolarHBondContact O-N 3.17Å
887L89.4Confident92.1Very high120 Ų12092.6 Ų92.663%0.62849%0.485SS*.Hα-helixtrans-68.9-39179-165137.9000111C883 A884 N885 V890 T891C883-L887 WeakPolarHBondContact O-CB 3.26Å; C883-L887 PolarHBondContact O-N 2.82Å; A884-L887 PolarHBondContact O-N 2.84Å; N885-L887 VanDerWaalsContact C-N 3.35Å; L887-V890 PolarHBondContact O-N 2.97Å; L887-T891 HydrophobicContact CD2-CG2 4.2Å; L887-T891 WeakPolarHBondContact O-CB 3.19Å; L887-T891 WeakPolarHBondContact O-CG2 3.25Å; L887-T891 PolarHBondContact O-N 3.42Å; L887-T891 PolarHBondContact O-OG1 3.28Å
888E92.8Very high91.8Very high127 Ų12790.3 Ų90.359%0.59348%0.483SS*.Hα-helixtrans-63.1-42.1171.6-172.2166.3-159.700111.9A884 N885 T891 S892A884-E888 WeakPolarHBondContact O-CB 3.38Å; A884-E888 PolarHBondContact O-N 3.41Å; N885-E888 PolarHBondContact O-N 3.37Å; E888-T891 WeakPolarHBondContact CA-OG1 3.45Å; E888-T891 PolarHBondContact O-N 2.94Å; E888-T891 PolarHBondContact O-OG1 3.33Å; E888-S892 WeakPolarHBondContact O-CB 3.3Å; E888-S892 PolarHBondContact O-N 3.33Å
889Q92.8Very high91.8Very high99 Ų9992.6 Ų92.646%0.46349%0.487SS..Hα-helixtrans-61-53.5174.4-176.5-176.3-5.800111.4N885 R886 T891 S892 E893N885-Q889 WeakPolarHBondContact O-CB 3.47Å; N885-Q889 PolarHBondContact O-N 2.91Å; R886-Q889 PolarHBondContact O-N 3.27Å; Q889-T891 VanDerWaalsContact C-N 3.29Å; Q889-T891 PolarHBondContact O-N 3.13Å; Q889-S892 WeakPolarHBondContact O-CA 3.37Å; Q889-S892 WeakPolarHBondContact O-CB 3.3Å; Q889-S892 PolarHBondContact O-N 3.12Å; Q889-S892 PolarHBondContact O-OG 3.09Å; Q889-E893 WeakPolarHBondContact CG-OE1 3.1Å; Q889-E893 PolarHBondContact NE2-OE1 2.82Å; Q889-E893 WeakPolarHBondContact O-CG 3.25Å; Q889-E893 PolarHBondContact O-N 3.22Å
890V91.8Very high91.7Very high73 Ų7393.4 Ų93.444%0.44249%0.49SS..Hα-helixtrans-61.1-39.4179.7171.20000111R886 L887 S892 E893 N894R886-V890 WeakPolarHBondContact O-CG2 3.41Å; R886-V890 PolarHBondContact O-N 3.17Å; L887-V890 PolarHBondContact O-N 2.97Å; V890-S892 VanDerWaalsContact C-N 3.35Å; V890-E893 PolarHBondContact O-N 3.05Å; V890-N894 VanDerWaalsContact O-CB 3.22Å; V890-N894 WeakPolarHBondContact O-CB 3.36Å; V890-N894 PolarHBondContact O-N 3.49Å
891T91.4Very high91.6Very high46 Ų4692.8 Ų92.828%0.28249%0.487SS..Hα-helixtrans-67.1-35.5175.155.60000112.1L887 E888 Q889 R895L887-T891 HydrophobicContact CD2-CG2 4.2Å; L887-T891 WeakPolarHBondContact O-CB 3.19Å; L887-T891 WeakPolarHBondContact O-CG2 3.25Å; L887-T891 PolarHBondContact O-N 3.42Å; L887-T891 PolarHBondContact O-OG1 3.28Å; E888-T891 WeakPolarHBondContact CA-OG1 3.45Å; E888-T891 PolarHBondContact O-N 2.94Å; E888-T891 PolarHBondContact O-OG1 3.33Å; Q889-T891 VanDerWaalsContact C-N 3.29Å; Q889-T891 PolarHBondContact O-N 3.13Å; T891-R895 WeakPolarHBondContact O-CB 3.12Å; T891-R895 WeakPolarHBondContact O-CG 3.46Å; T891-R895 PolarHBondContact O-N 3.41Å
892S91.6Very high91.4Very high53 Ų5392.7 Ų92.737%0.37149%0.489SS..Hα-helixtrans-67.2-42.4174.479.80000112.5E888 Q889 V890 R895 S896E888-S892 WeakPolarHBondContact O-CB 3.3Å; E888-S892 PolarHBondContact O-N 3.33Å; Q889-S892 WeakPolarHBondContact O-CA 3.37Å; Q889-S892 WeakPolarHBondContact O-CB 3.3Å; Q889-S892 PolarHBondContact O-N 3.12Å; Q889-S892 PolarHBondContact O-OG 3.09Å; V890-S892 VanDerWaalsContact C-N 3.35Å; S892-R895 PolarHBondContact O-N 2.97Å; S892-S896 PolarHBondContact O-N 3.06Å
893E91.8Very high91.2Very high90 Ų9094 Ų9442%0.42149%0.492SS..Hα-helixtrans-64-45.4174.9-73.2172.6-17200110.2Q889 V890 R895 S896 L897Q889-E893 WeakPolarHBondContact CG-OE1 3.1Å; Q889-E893 PolarHBondContact NE2-OE1 2.82Å; Q889-E893 WeakPolarHBondContact O-CG 3.25Å; Q889-E893 PolarHBondContact O-N 3.22Å; V890-E893 PolarHBondContact O-N 3.05Å; E893-R895 PolarHBondContact O-N 3.18Å; E893-S896 CarbonylContact O-C 3.49Å; E893-S896 WeakPolarHBondContact O-CA 3.3Å; E893-S896 WeakPolarHBondContact O-CB 3.31Å; E893-S896 PolarHBondContact O-N 2.91Å; E893-S896 PolarHBondContact O-OG 2.93Å; E893-L897 WeakPolarHBondContact O-CG 3.4Å; E893-L897 PolarHBondContact O-N 3.25Å
894N90.5Very high90.6Very high97 Ų9797 Ų9752%0.51949%0.492SS..Hα-helixtrans-63.6-43.5177.9-15313.1000111.1V890 S896 L897 T898V890-N894 VanDerWaalsContact O-CB 3.22Å; V890-N894 WeakPolarHBondContact O-CB 3.36Å; V890-N894 PolarHBondContact O-N 3.49Å; N894-S896 PolarHBondContact O-N 2.82Å; N894-L897 PolarHBondContact O-N 3.26Å; N894-T898 PolarHBondContact O-N 3.48Å; N894-T898 PolarHBondContact O-OG1 3.26Å
895R93.3Very high90.5Very high149 Ų149100.2 Ų100.256%0.56250%0.497SS*.Hα-helixtrans-58-36.1171.2-72169.9-161.5152.46.7112T891 S892 E893 R899T891-R895 WeakPolarHBondContact O-CB 3.12Å; T891-R895 WeakPolarHBondContact O-CG 3.46Å; T891-R895 PolarHBondContact O-N 3.41Å; S892-R895 PolarHBondContact O-N 2.97Å; E893-R895 PolarHBondContact O-N 3.18Å; R895-R899 WeakPolarHBondContact O-CB 3.23Å; R895-R899 WeakPolarHBondContact O-CG 3.05Å; R895-R899 PolarHBondContact O-N 3.31Å; R895-R899 VanDerWaalsContact O-N 3.11Å; R895-R899 PolarHBondContact O-NE 3.03Å; R895-R899 VanDerWaalsContact O-NE 3.1Å
896S92.6Very high90.2Very high43 Ų43101.3 Ų101.330%0.30150%0.499SS..Hα-helixtrans-71.4-41.2177.379.80000112.4S892 E893 N894 R899 M900S892-S896 PolarHBondContact O-N 3.06Å; E893-S896 CarbonylContact O-C 3.49Å; E893-S896 WeakPolarHBondContact O-CA 3.3Å; E893-S896 WeakPolarHBondContact O-CB 3.31Å; E893-S896 PolarHBondContact O-N 2.91Å; E893-S896 PolarHBondContact O-OG 2.93Å; N894-S896 PolarHBondContact O-N 2.82Å; S896-R899 PolarHBondContact O-N 2.88Å; S896-M900 WeakPolarHBondContact O-CG 2.99Å; S896-M900 PolarHBondContact O-N 3.01Å
897L89.5Confident89.7Confident113 Ų11396.9 Ų96.959%0.59249%0.486SS*.Hα-helixtrans-66.2-41.7175.3-71.3174.3000111.4E893 N894 R899 M900 S901E893-L897 WeakPolarHBondContact O-CG 3.4Å; E893-L897 PolarHBondContact O-N 3.25Å; N894-L897 PolarHBondContact O-N 3.26Å; L897-R899 VanDerWaalsContact C-N 3.33Å; L897-R899 PolarHBondContact O-N 3.31Å; L897-M900 PolarHBondContact O-N 3.32Å; L897-S901 WeakPolarHBondContact O-CB 3.39Å; L897-S901 PolarHBondContact O-N 3.37Å
898T88.8Confident89.6Confident88 Ų8896.6 Ų96.654%0.5449%0.485SS..Hα-helixtrans-61.4-42.4173.9-49.70000111.2N894 S901 A902N894-T898 PolarHBondContact O-N 3.48Å; N894-T898 PolarHBondContact O-OG1 3.26Å; T898-S901 PolarHBondContact O-N 2.88Å; T898-A902 WeakPolarHBondContact O-CB 3.42Å; T898-A902 PolarHBondContact O-N 3.39Å
899R92.4Very high89.3Confident147 Ų14794.3 Ų94.356%0.55548%0.477SS*.Hα-helixtrans-61.9-46.5174.9-80.9179.6-87.5117.6-7112R895 S896 L897 A902 Q903R895-R899 WeakPolarHBondContact O-CB 3.23Å; R895-R899 WeakPolarHBondContact O-CG 3.05Å; R895-R899 PolarHBondContact O-N 3.31Å; R895-R899 VanDerWaalsContact O-N 3.11Å; R895-R899 PolarHBondContact O-NE 3.03Å; R895-R899 VanDerWaalsContact O-NE 3.1Å; S896-R899 PolarHBondContact O-N 2.88Å; L897-R899 VanDerWaalsContact C-N 3.33Å; L897-R899 PolarHBondContact O-N 3.31Å; R899-A902 PolarHBondContact O-N 3.49Å; R899-Q903 WeakPolarHBondContact O-CG 3Å; R899-Q903 PolarHBondContact O-N 3.36Å
900M89.3Confident89.2Confident88 Ų8893.5 Ų93.543%0.43347%0.473SS..Hα-helixtrans-63.7-43176.7-73.2-60.2-57.100111.9S896 L897 A902 Q903 W904S896-M900 WeakPolarHBondContact O-CG 2.99Å; S896-M900 PolarHBondContact O-N 3.01Å; L897-M900 PolarHBondContact O-N 3.32Å; M900-A902 PolarHBondContact O-N 2.76Å; M900-Q903 WeakPolarHBondContact O-CB 3.32Å; M900-Q903 PolarHBondContact O-N 2.66Å; M900-Q903 PolarHBondContact SD-OE1 2.77Å; M900-W904 PolarHBondContact O-N 2.76Å
901S89.2Confident88.9Confident74 Ų7495.4 Ų95.452%0.51748%0.476SS..Hα-helixtrans-62-42.9177.5-169.20000111.6L897 T898 Q903 W904 E905L897-S901 WeakPolarHBondContact O-CB 3.39Å; L897-S901 PolarHBondContact O-N 3.37Å; T898-S901 PolarHBondContact O-N 2.88Å; S901-Q903 VanDerWaalsContact C-N 3.34Å; S901-W904 PolarHBondContact O-N 3.19Å; S901-E905 WeakPolarHBondContact O-CB 3.46Å; S901-E905 PolarHBondContact O-N 3.35Å
902A88.5Confident88.8Confident53 Ų5394.6 Ų94.644%0.43848%0.476SS..Hα-helixtrans-64.8-37.8175.800000112.1T898 R899 M900 E905 Q906T898-A902 WeakPolarHBondContact O-CB 3.42Å; T898-A902 PolarHBondContact O-N 3.39Å; R899-A902 PolarHBondContact O-N 3.49Å; M900-A902 PolarHBondContact O-N 2.76Å; A902-E905 PolarHBondContact O-N 3.1Å; A902-Q906 WeakPolarHBondContact O-CB 3.28Å; A902-Q906 PolarHBondContact O-N 3.29Å
903Q90.8Very high88.6Confident103 Ų10399.2 Ų99.248%0.48149%0.486SS..Hα-helixtrans-64.6-46.7173.2-76177.5-19.300111.9R899 M900 S901 E905 Q906 E907R899-Q903 WeakPolarHBondContact O-CG 3Å; R899-Q903 PolarHBondContact O-N 3.36Å; M900-Q903 WeakPolarHBondContact O-CB 3.32Å; M900-Q903 PolarHBondContact O-N 2.66Å; M900-Q903 PolarHBondContact SD-OE1 2.77Å; S901-Q903 VanDerWaalsContact C-N 3.34Å; Q903-E905 VanDerWaalsContact C-N 3.32Å; Q903-E905 PolarHBondContact O-N 3.3Å; Q903-Q906 PolarHBondContact O-N 2.85Å; Q903-E907 WeakPolarHBondContact O-CG 3.35Å; Q903-E907 PolarHBondContact O-N 2.87Å
904W78.9Confident88.5Confident152 Ų15299.8 Ų99.858%0.57649%0.491SS*.Hα-helixtrans-60.8-41.2175.9-79.1116.4000112.2M900 S901 E907 N908M900-W904 PolarHBondContact O-N 2.76Å; S901-W904 PolarHBondContact O-N 3.19Å; W904-E907 PolarHBondContact O-N 3.44Å; W904-N908 VanDerWaalsContact O-CB 3.24Å; W904-N908 WeakPolarHBondContact O-CB 3.21Å; W904-N908 PolarHBondContact O-N 2.9Å
905E87.3Confident88.4Confident124 Ų124102.8 Ų102.858%0.57950%0.497SS*.Hα-helixtrans-66.3-40.3176.1-171.8172.9-16900111.7S901 A902 Q903 N908 N909S901-E905 WeakPolarHBondContact O-CB 3.46Å; S901-E905 PolarHBondContact O-N 3.35Å; A902-E905 PolarHBondContact O-N 3.1Å; Q903-E905 VanDerWaalsContact C-N 3.32Å; Q903-E905 PolarHBondContact O-N 3.3Å; E905-N908 PolarHBondContact O-N 3.48Å; E905-N909 VanDerWaalsContact O-CB 3.3Å; E905-N909 WeakPolarHBondContact O-CB 3.43Å; E905-N909 PolarHBondContact O-N 2.9Å; E905-N909 PolarHBondContact O-ND2 2.89Å
906Q86.3Confident88.4Confident113 Ų113103.2 Ų103.253%0.52850%0.503SS..Hα-helixtrans-61.3-50.4173-177.8-178.9-13.800111.5A902 Q903 N908 N909 E910A902-Q906 WeakPolarHBondContact O-CB 3.28Å; A902-Q906 PolarHBondContact O-N 3.29Å; Q903-Q906 PolarHBondContact O-N 2.85Å; Q906-N908 VanDerWaalsContact C-N 3.3Å; Q906-N908 PolarHBondContact O-N 3.33Å; Q906-N909 CarbonylContact O-C 3.58Å; Q906-N909 WeakPolarHBondContact O-CB 2.98Å; Q906-N909 PolarHBondContact O-N 3.31Å; Q906-E910 WeakPolarHBondContact CG-OE1 3.37Å; Q906-E910 PolarHBondContact NE2-OE1 2.82Å; Q906-E910 WeakPolarHBondContact O-CG 3.17Å; Q906-E910 PolarHBondContact O-N 3.08Å
907E85.5Confident88.4Confident82 Ų82105.9 Ų105.938%0.38351%0.513SS..Hα-helixtrans-60.9-38.5177.1-75.4-172.8-171.300112.1Q903 W904 N909 E910 K911Q903-E907 WeakPolarHBondContact O-CG 3.35Å; Q903-E907 PolarHBondContact O-N 2.87Å; W904-E907 PolarHBondContact O-N 3.44Å; E907-N909 VanDerWaalsContact C-N 3.35Å; E907-E910 PolarHBondContact O-N 3.4Å; E907-K911 WeakPolarHBondContact O-CB 3.25Å; E907-K911 VanDerWaalsContact O-CG 3.28Å; E907-K911 WeakPolarHBondContact O-CG 3.34Å; E907-K911 PolarHBondContact O-N 2.98Å; E907-K911 IonicContact OE2-NZ 3.56Å
908N87.1Confident88.5Confident114 Ų114106.7 Ų106.761%0.6151%0.512SS*.Hα-helixtrans-70.2-36178.6-151.840.7000111.1W904 E905 Q906 G912W904-N908 VanDerWaalsContact O-CB 3.24Å; W904-N908 WeakPolarHBondContact O-CB 3.21Å; W904-N908 PolarHBondContact O-N 2.9Å; E905-N908 PolarHBondContact O-N 3.48Å; Q906-N908 VanDerWaalsContact C-N 3.3Å; Q906-N908 PolarHBondContact O-N 3.33Å; N908-G912 PolarHBondContact O-N 3.05Å
909N86.8Confident88.6Confident79 Ų79104.7 Ų104.742%0.42250%0.5SS..Hα-helixtrans-67.4-38171.4-74-35000111.9E905 Q906 E907 G912 R913E905-N909 VanDerWaalsContact O-CB 3.3Å; E905-N909 WeakPolarHBondContact O-CB 3.43Å; E905-N909 PolarHBondContact O-N 2.9Å; E905-N909 PolarHBondContact O-ND2 2.89Å; Q906-N909 CarbonylContact O-C 3.58Å; Q906-N909 WeakPolarHBondContact O-CB 2.98Å; Q906-N909 PolarHBondContact O-N 3.31Å; E907-N909 VanDerWaalsContact C-N 3.35Å; N909-G912 PolarHBondContact O-N 2.89Å; N909-R913 VanDerWaalsContact C-NH1 3.31Å; N909-R913 VanDerWaalsContact O-CG 3.28Å; N909-R913 WeakPolarHBondContact O-CG 3.09Å; N909-R913 PolarHBondContact O-N 3.12Å; N909-R913 PolarHBondContact O-NH1 2.74Å
910E89Confident88.6Confident82 Ų8299.7 Ų99.738%0.38349%0.49SS..Hα-helixtrans-64.4-51.5173.2-74.4170.5-171.100111Q906 E907 G912 R913 D914Q906-E910 WeakPolarHBondContact CG-OE1 3.37Å; Q906-E910 PolarHBondContact NE2-OE1 2.82Å; Q906-E910 WeakPolarHBondContact O-CG 3.17Å; Q906-E910 PolarHBondContact O-N 3.08Å; E907-E910 PolarHBondContact O-N 3.4Å; E910-G912 PolarHBondContact O-N 3.4Å; E910-R913 CarbonylContact O-C 3.55Å; E910-R913 WeakPolarHBondContact O-CA 3.36Å; E910-R913 WeakPolarHBondContact O-CB 3.48Å; E910-R913 PolarHBondContact O-N 3.26Å; E910-D914 PolarHBondContact O-N 2.65Å
911K86.4Confident88.7Confident114 Ų114100.3 Ų100.350%0.49649%0.494SS..Hα-helixtrans-56.7-38.2172.9-72168.3-174.9159.20112.1E907 D914 Y915E907-K911 WeakPolarHBondContact O-CB 3.25Å; E907-K911 VanDerWaalsContact O-CG 3.28Å; E907-K911 WeakPolarHBondContact O-CG 3.34Å; E907-K911 PolarHBondContact O-N 2.98Å; E907-K911 IonicContact OE2-NZ 3.56Å; K911-D914 PolarHBondContact O-N 3.4Å; K911-Y915 VanDerWaalsContact O-CB 3.28Å; K911-Y915 WeakPolarHBondContact O-CB 3.14Å; K911-Y915 PolarHBondContact O-N 3.23Å
912G88.8Confident88.9Confident29 Ų29102.3 Ų102.330%0.29950%0.495SS..Hα-helixtrans-65.8-38.5174.500000113.2N908 N909 E910 K916N908-G912 PolarHBondContact O-N 3.05Å; N909-G912 PolarHBondContact O-N 2.89Å; E910-G912 PolarHBondContact O-N 3.4Å; G912-K916 VanDerWaalsContact O-CG 3.26Å; G912-K916 WeakPolarHBondContact O-CG 3.45Å; G912-K916 PolarHBondContact O-N 2.87Å; G912-K916 VanDerWaalsContact O-N 3.09Å
913R87.7Confident89Confident150 Ų150104.5 Ų104.557%0.56650%0.5SS*.Hα-helixtrans-68.3-43.5172.8-72.1175.8-163.2102.5-1.7111.2N909 E910 K916 L917N909-R913 VanDerWaalsContact C-NH1 3.31Å; N909-R913 VanDerWaalsContact O-CG 3.28Å; N909-R913 WeakPolarHBondContact O-CG 3.09Å; N909-R913 PolarHBondContact O-N 3.12Å; N909-R913 PolarHBondContact O-NH1 2.74Å; E910-R913 CarbonylContact O-C 3.55Å; E910-R913 WeakPolarHBondContact O-CA 3.36Å; E910-R913 WeakPolarHBondContact O-CB 3.48Å; E910-R913 PolarHBondContact O-N 3.26Å; R913-K916 PolarHBondContact O-N 3.4Å; R913-L917 WeakPolarHBondContact O-CB 3.46Å; R913-L917 PolarHBondContact O-N 3.46Å
914D89.5Confident89.1Confident101 Ų101104.6 Ų104.654%0.5450%0.504SS..Hα-helixtrans-63.9-41.1177.7-69.7-14.2000111.6E910 K911 L917 F918E910-D914 PolarHBondContact O-N 2.65Å; K911-D914 PolarHBondContact O-N 3.4Å; D914-L917 PolarHBondContact O-N 2.83Å; D914-F918 VanDerWaalsContact O-CB 3.28Å; D914-F918 WeakPolarHBondContact O-CB 3.43Å; D914-F918 PolarHBondContact O-N 3.13Å
915Y88.7Confident89.6Confident161 Ų161103.3 Ų103.363%0.63150%0.504SS*.Hα-helixtrans-63.8-44.6174.5-177.9-100.3000111.7K911 L917 F918 V919K911-Y915 VanDerWaalsContact O-CB 3.28Å; K911-Y915 WeakPolarHBondContact O-CB 3.14Å; K911-Y915 PolarHBondContact O-N 3.23Å; Y915-L917 VanDerWaalsContact C-N 3.33Å; Y915-L917 PolarHBondContact O-N 3.4Å; Y915-F918 PolarHBondContact O-N 2.79Å; Y915-V919 HydrophobicContact CD1-CG2 4.25Å; Y915-V919 HydrophobicContact CE1-CG2 3.85Å; Y915-V919 HydrophobicContact CE2-CG2 4.28Å; Y915-V919 WeakPolarHBondContact O-CG2 3.37Å; Y915-V919 PolarHBondContact O-N 3.45Å
916K93Very high89.8Confident157 Ų15798.7 Ų98.768%0.68349%0.49SS*.Hα-helixtrans-61.7-42174.7-73.9172.5-176.9-179.90111.6G912 R913 V919 A920G912-K916 VanDerWaalsContact O-CG 3.26Å; G912-K916 WeakPolarHBondContact O-CG 3.45Å; G912-K916 PolarHBondContact O-N 2.87Å; G912-K916 VanDerWaalsContact O-N 3.09Å; R913-K916 PolarHBondContact O-N 3.4Å; K916-V919 PolarHBondContact O-N 3.35Å; K916-A920 WeakPolarHBondContact O-CB 3.44Å; K916-A920 PolarHBondContact O-N 3.26Å
917L92.6Very high90.1Very high100 Ų10094.9 Ų94.952%0.52448%0.477SS..Hα-helixtrans-64.1-42.2175.7179.160.6000111.4R913 D914 Y915 A920 L921R913-L917 WeakPolarHBondContact O-CB 3.46Å; R913-L917 PolarHBondContact O-N 3.46Å; D914-L917 PolarHBondContact O-N 2.83Å; Y915-L917 VanDerWaalsContact C-N 3.33Å; Y915-L917 PolarHBondContact O-N 3.4Å; L917-A920 PolarHBondContact O-N 3.06Å; L917-L921 HydrophobicContact CD1-CD1 4.24Å; L917-L921 HydrophobicContact CD1-CG 4.34Å; L917-L921 HydrophobicContact CG-CD1 4.09Å; L917-L921 WeakPolarHBondContact O-CB 3.41Å; L917-L921 WeakPolarHBondContact O-CG 3.38Å; L917-L921 PolarHBondContact O-N 3.49Å
918F91.9Very high90.5Very high129 Ų12996.6 Ų96.657%0.56649%0.488SS*.Hα-helixtrans-62.9-45.7176.3179.2-95.8000111.8D914 Y915 L921 Q922D914-F918 VanDerWaalsContact O-CB 3.28Å; D914-F918 WeakPolarHBondContact O-CB 3.43Å; D914-F918 PolarHBondContact O-N 3.13Å; Y915-F918 PolarHBondContact O-N 2.79Å; F918-L921 PolarHBondContact O-N 2.89Å; F918-Q922 WeakPolarHBondContact O-CB 3.24Å; F918-Q922 PolarHBondContact O-N 3.41Å
919V91.8Very high90.9Very high47 Ų4797.7 Ų97.729%0.28549%0.488SS..Hα-helixtrans-63.5-42.1175.9172.10000111.1Y915 K916 Q922 N923Y915-V919 HydrophobicContact CD1-CG2 4.25Å; Y915-V919 HydrophobicContact CE1-CG2 3.85Å; Y915-V919 HydrophobicContact CE2-CG2 4.28Å; Y915-V919 WeakPolarHBondContact O-CG2 3.37Å; Y915-V919 PolarHBondContact O-N 3.45Å; K916-V919 PolarHBondContact O-N 3.35Å; V919-Q922 PolarHBondContact O-N 3.34Å; V919-N923 WeakPolarHBondContact O-CB 3.38Å; V919-N923 VanDerWaalsContact O-CG 3.24Å; V919-N923 PolarHBondContact O-N 3.45Å; V919-N923 PolarHBondContact O-ND2 2.88Å
920A92Very high91.3Very high42 Ų42102.4 Ų102.435%0.34750%0.5SS..Hα-helixtrans-60.8-48174.800000111.5K916 L917 Q922 N923 D924K916-A920 WeakPolarHBondContact O-CB 3.44Å; K916-A920 PolarHBondContact O-N 3.26Å; L917-A920 PolarHBondContact O-N 3.06Å; A920-Q922 VanDerWaalsContact C-N 3.32Å; A920-Q922 PolarHBondContact O-N 2.87Å; A920-N923 PolarHBondContact O-N 3.09Å; A920-D924 WeakPolarHBondContact O-CB 3.18Å; A920-D924 VanDerWaalsContact O-CG 3.31Å; A920-D924 PolarHBondContact O-N 3.21Å
921L91.2Very high91.4Very high101 Ų101104.5 Ų104.553%0.52951%0.511SS..Hα-helixtrans-62.1-36.9175.9-76.4169.5000112.6L917 F918 H925L917-L921 HydrophobicContact CD1-CD1 4.24Å; L917-L921 HydrophobicContact CD1-CG 4.34Å; L917-L921 HydrophobicContact CG-CD1 4.09Å; L917-L921 WeakPolarHBondContact O-CB 3.41Å; L917-L921 WeakPolarHBondContact O-CG 3.38Å; L917-L921 PolarHBondContact O-N 3.49Å; F918-L921 PolarHBondContact O-N 2.89Å; L921-H925 VanDerWaalsContact O-CB 3.22Å; L921-H925 WeakPolarHBondContact O-CB 3.22Å; L921-H925 PolarHBondContact O-N 3.38Å
922Q92.4Very high91.7Very high115 Ų115105 Ų10554%0.53752%0.515SS..Hα-helixtrans-67.3-40.1175.6-173.3176.7-3.800111.5F918 V919 A920 H925 G926F918-Q922 WeakPolarHBondContact O-CB 3.24Å; F918-Q922 PolarHBondContact O-N 3.41Å; V919-Q922 PolarHBondContact O-N 3.34Å; A920-Q922 VanDerWaalsContact C-N 3.32Å; A920-Q922 PolarHBondContact O-N 2.87Å; Q922-H925 PolarHBondContact O-N 3.37Å; Q922-G926 PolarHBondContact O-N 2.83Å
923N90.9Very high92Very high100 Ų100107.2 Ų107.254%0.53552%0.523SS..Hα-helixtrans-66.1-43.1174.8-72.4-18.3000111.6V919 A920 G926 A927V919-N923 WeakPolarHBondContact O-CB 3.38Å; V919-N923 VanDerWaalsContact O-CG 3.24Å; V919-N923 PolarHBondContact O-N 3.45Å; V919-N923 PolarHBondContact O-ND2 2.88Å; A920-N923 PolarHBondContact O-N 3.09Å; N923-G926 CarbonylContact O-C 3.59Å; N923-G926 PolarHBondContact O-N 3.34Å; N923-A927 WeakPolarHBondContact O-CB 3.09Å; N923-A927 PolarHBondContact O-N 3.29Å
924D92.5Very high92.4Very high104 Ų104103.5 Ų103.556%0.55652%0.52SS*.Hα-helixtrans-64.7-42.8175.9-72.4-13.6000111.3A920 G926 A927 L928A920-D924 WeakPolarHBondContact O-CB 3.18Å; A920-D924 VanDerWaalsContact O-CG 3.31Å; A920-D924 PolarHBondContact O-N 3.21Å; D924-G926 VanDerWaalsContact C-N 3.32Å; D924-G926 PolarHBondContact O-N 2.83Å; D924-A927 PolarHBondContact O-N 3.45Å; D924-L928 VanDerWaalsContact O-CB 3.25Å; D924-L928 WeakPolarHBondContact O-CB 3.19Å; D924-L928 PolarHBondContact O-N 3.48Å
925H89.7Confident92.6Very high126 Ų126104.3 Ų104.358%0.58352%0.523SS*.Hα-helixtrans-61.1-42.5173.1-176.175.5000111.3L921 Q922 L928 K929L921-H925 VanDerWaalsContact O-CB 3.22Å; L921-H925 WeakPolarHBondContact O-CB 3.22Å; L921-H925 PolarHBondContact O-N 3.38Å; Q922-H925 PolarHBondContact O-N 3.37Å; H925-L928 PolarHBondContact O-N 3.48Å; H925-K929 VanDerWaalsContact O-CB 3.31Å; H925-K929 WeakPolarHBondContact O-CB 3.32Å; H925-K929 PolarHBondContact O-N 3.43Å
926G92Very high92.9Very high27 Ų27100.6 Ų100.628%0.27851%0.512SS..Hα-helixtrans-63.9-41.4174.500000113.1Q922 N923 D924 R930Q922-G926 PolarHBondContact O-N 2.83Å; N923-G926 CarbonylContact O-C 3.59Å; N923-G926 PolarHBondContact O-N 3.34Å; D924-G926 VanDerWaalsContact C-N 3.32Å; D924-G926 PolarHBondContact O-N 2.83Å; G926-R930 WeakPolarHBondContact O-CG 3.23Å; G926-R930 PolarHBondContact O-N 3.38Å
927A92.7Very high92.9Very high33 Ų3396.2 Ų96.227%0.27350%0.498SS..Hα-helixtrans-65.3-45.8175.100000111.5N923 D924 K929 R930 M931N923-A927 WeakPolarHBondContact O-CB 3.09Å; N923-A927 PolarHBondContact O-N 3.29Å; D924-A927 PolarHBondContact O-N 3.45Å; A927-K929 VanDerWaalsContact C-N 3.33Å; A927-K929 PolarHBondContact O-N 3.41Å; A927-R930 PolarHBondContact O-N 2.8Å; A927-M931 WeakPolarHBondContact O-CG 3.45Å; A927-M931 PolarHBondContact O-N 3.14Å
928L94.4Very high93.1Very high117 Ų11799.1 Ų99.161%0.61350%0.502SS*.Hα-helixtrans-63.1-40.1177.6-173.362.3000111.5D924 H925 M931 H932D924-L928 VanDerWaalsContact O-CB 3.25Å; D924-L928 WeakPolarHBondContact O-CB 3.19Å; D924-L928 PolarHBondContact O-N 3.48Å; H925-L928 PolarHBondContact O-N 3.48Å; L928-M931 PolarHBondContact O-N 2.91Å; L928-H932 WeakPolarHBondContact O-CB 3.31Å; L928-H932 PolarHBondContact O-N 3.19Å
929K95.7Very high93.2Very high138 Ų138100 Ų10060%0.650%0.503SS*.Hα-helixtrans-63.2-44.3174.2-170.2174.6-177.6178.10111.7H925 A927 H932 T933H925-K929 VanDerWaalsContact O-CB 3.31Å; H925-K929 WeakPolarHBondContact O-CB 3.32Å; H925-K929 PolarHBondContact O-N 3.43Å; A927-K929 VanDerWaalsContact C-N 3.33Å; A927-K929 PolarHBondContact O-N 3.41Å; K929-H932 PolarHBondContact O-N 3.45Å; K929-T933 WeakPolarHBondContact O-CG2 3.43Å; K929-T933 PolarHBondContact O-N 3.37Å; K929-T933 PolarHBondContact O-OG1 2.84Å
930R93.3Very high93.3Very high178 Ų178101.3 Ų101.367%0.67251%0.506SS*.Hα-helixtrans-62.2-43.9175.1-75.8-175.5-68.1-175.80.3112.1G926 A927 T933 S934G926-R930 WeakPolarHBondContact O-CG 3.23Å; G926-R930 PolarHBondContact O-N 3.38Å; A927-R930 PolarHBondContact O-N 2.8Å; R930-T933 WeakPolarHBondContact CA-OG1 3.23Å; R930-T933 PolarHBondContact O-N 2.85Å; R930-T933 PolarHBondContact O-OG1 3.29Å; R930-S934 WeakPolarHBondContact O-CB 3.35Å; R930-S934 PolarHBondContact O-N 2.85Å
931M92.9Very high93.5Very high126 Ų126103.9 Ų103.962%0.62151%0.511SS*.Hα-helixtrans-63.4-42.5175.3-73.6-164.2-177.700111.6A927 L928 S934 L935A927-M931 WeakPolarHBondContact O-CG 3.45Å; A927-M931 PolarHBondContact O-N 3.14Å; L928-M931 PolarHBondContact O-N 2.91Å; M931-S934 PolarHBondContact O-N 3.31Å; M931-L935 WeakPolarHBondContact O-CB 3.45Å; M931-L935 WeakPolarHBondContact O-CG 3.5Å; M931-L935 PolarHBondContact O-N 2.93Å
932H92.9Very high93.6Very high125 Ų125103.5 Ų103.558%0.57951%0.508SS*.Hα-helixtrans-61.9-45.2175.8-175.965.6000111.4L928 K929 S934 L935 Q936L928-H932 WeakPolarHBondContact O-CB 3.31Å; L928-H932 PolarHBondContact O-N 3.19Å; K929-H932 PolarHBondContact O-N 3.45Å; H932-S934 VanDerWaalsContact C-N 3.35Å; H932-S934 PolarHBondContact O-N 3.37Å; H932-L935 PolarHBondContact O-N 2.83Å; H932-Q936 VanDerWaalsContact O-CB 3.26Å; H932-Q936 WeakPolarHBondContact O-CB 3.29Å; H932-Q936 PolarHBondContact O-N 2.82Å
933T93.9Very high93.7Very high75 Ų75100.8 Ų100.846%0.4650%0.501SS..Hα-helixtrans-62.6-40.6175.150.80000112.2K929 R930 Q936 T937K929-T933 WeakPolarHBondContact O-CG2 3.43Å; K929-T933 PolarHBondContact O-N 3.37Å; K929-T933 PolarHBondContact O-OG1 2.84Å; R930-T933 WeakPolarHBondContact CA-OG1 3.23Å; R930-T933 PolarHBondContact O-N 2.85Å; R930-T933 PolarHBondContact O-OG1 3.29Å; T933-Q936 PolarHBondContact O-N 3.26Å; T933-T937 WeakPolarHBondContact O-CG2 3.31Å; T933-T937 PolarHBondContact O-N 2.86Å; T933-T937 PolarHBondContact O-OG1 3.28Å
934S95.4Very high93.8Very high72 Ų72102.8 Ų102.850%0.50350%0.501SS..Hα-helixtrans-68.6-38.2178.1177.30000112.6R930 M931 H932 T937 R938R930-S934 WeakPolarHBondContact O-CB 3.35Å; R930-S934 PolarHBondContact O-N 2.85Å; M931-S934 PolarHBondContact O-N 3.31Å; H932-S934 VanDerWaalsContact C-N 3.35Å; H932-S934 PolarHBondContact O-N 3.37Å; S934-T937 WeakPolarHBondContact CA-OG1 3.26Å; S934-T937 PolarHBondContact O-OG1 3.5Å; S934-R938 WeakPolarHBondContact O-CB 3.15Å; S934-R938 PolarHBondContact O-N 3.26Å
935L94.8Very high93.9Very high118 Ų118103.1 Ų103.162%0.61850%0.5SS*.Hα-helixtrans-67.5-38.6173.1-77.9171.5000111.3M931 H932 R938 Y939M931-L935 WeakPolarHBondContact O-CB 3.45Å; M931-L935 WeakPolarHBondContact O-CG 3.5Å; M931-L935 PolarHBondContact O-N 2.93Å; H932-L935 PolarHBondContact O-N 2.83Å; L935-R938 PolarHBondContact O-N 2.88Å; L935-Y939 VanDerWaalsContact O-CB 3.29Å; L935-Y939 WeakPolarHBondContact O-CB 3.4Å; L935-Y939 PolarHBondContact O-N 3.47Å
936Q95.2Very high94Very high82 Ų82103.2 Ų103.238%0.38350%0.498SS..Hα-helixtrans-64.9-45.4176.3-176.662.422.300111.5H932 T933 R938 Y939 E940H932-Q936 VanDerWaalsContact O-CB 3.26Å; H932-Q936 WeakPolarHBondContact O-CB 3.29Å; H932-Q936 PolarHBondContact O-N 2.82Å; T933-Q936 PolarHBondContact O-N 3.26Å; Q936-R938 VanDerWaalsContact C-N 3.33Å; Q936-R938 PolarHBondContact O-N 3.35Å; Q936-Y939 WeakPolarHBondContact O-CB 3.45Å; Q936-Y939 PolarHBondContact O-N 2.88Å; Q936-E940 PolarHBondContact NE2-OE1 2.8Å; Q936-E940 WeakPolarHBondContact O-CG 3.45Å; Q936-E940 PolarHBondContact O-N 3.31Å
937T93.2Very high94.1Very high65 Ų65103.5 Ų103.540%0.39950%0.502SS..Hα-helixtrans-62-42.7175.855.50000111.3T933 S934 Y939 E940 E941T933-T937 WeakPolarHBondContact O-CG2 3.31Å; T933-T937 PolarHBondContact O-N 2.86Å; T933-T937 PolarHBondContact O-OG1 3.28Å; S934-T937 WeakPolarHBondContact CA-OG1 3.26Å; S934-T937 PolarHBondContact O-OG1 3.5Å; T937-Y939 VanDerWaalsContact C-N 3.35Å; T937-Y939 PolarHBondContact O-N 3.32Å; T937-E940 WeakPolarHBondContact O-CB 3.39Å; T937-E940 PolarHBondContact O-N 3.04Å; T937-E941 VanDerWaalsContact O-CG 3.32Å; T937-E941 WeakPolarHBondContact O-CG 3.34Å; T937-E941 PolarHBondContact O-N 3.32Å
938R95.9Very high94.1Very high162 Ų162108 Ų10861%0.61152%0.519SS*.Hα-helixtrans-66.2-36.9177.1-167.2164.9-176.3-164.70.2112.5S934 L935 Q936 E940 E941 I942S934-R938 WeakPolarHBondContact O-CB 3.15Å; S934-R938 PolarHBondContact O-N 3.26Å; L935-R938 PolarHBondContact O-N 2.88Å; Q936-R938 VanDerWaalsContact C-N 3.33Å; Q936-R938 PolarHBondContact O-N 3.35Å; R938-E940 VanDerWaalsContact C-N 3.35Å; R938-E941 PolarHBondContact O-N 3.34Å; R938-I942 HydrophobicContact CG-CD1 4.17Å; R938-I942 WeakPolarHBondContact O-CB 3.49Å; R938-I942 WeakPolarHBondContact O-CD1 3.23Å; R938-I942 WeakPolarHBondContact O-CG1 3.48Å; R938-I942 PolarHBondContact O-N 3.05Å
939Y94.4Very high94Very high147 Ų147107.9 Ų107.958%0.57652%0.518SS*.Hα-helixtrans-62-43.5172.4177.5-95.3000111.3L935 Q936 T937 I942 C943L935-Y939 VanDerWaalsContact O-CB 3.29Å; L935-Y939 WeakPolarHBondContact O-CB 3.4Å; L935-Y939 PolarHBondContact O-N 3.47Å; Q936-Y939 WeakPolarHBondContact O-CB 3.45Å; Q936-Y939 PolarHBondContact O-N 2.88Å; T937-Y939 VanDerWaalsContact C-N 3.35Å; T937-Y939 PolarHBondContact O-N 3.32Å; Y939-I942 PolarHBondContact O-N 3.43Å; Y939-C943 WeakPolarHBondContact O-CB 3.41Å; Y939-C943 PolarHBondContact O-N 3.47Å; Y939-C943 PolarHBondContact O-SG 3.24Å
940E94.5Very high93.9Very high74 Ų74105.9 Ų105.935%0.34651%0.511SS..Hα-helixtrans-65.9-40175.8-70.3174.7-161.800112.8Q936 T937 R938 C943 R944Q936-E940 PolarHBondContact NE2-OE1 2.8Å; Q936-E940 WeakPolarHBondContact O-CG 3.45Å; Q936-E940 PolarHBondContact O-N 3.31Å; T937-E940 WeakPolarHBondContact O-CB 3.39Å; T937-E940 PolarHBondContact O-N 3.04Å; R938-E940 VanDerWaalsContact C-N 3.35Å; E940-C943 WeakPolarHBondContact O-CB 3.26Å; E940-C943 PolarHBondContact O-N 2.92Å; E940-R944 WeakPolarHBondContact O-CG 3.31Å; E940-R944 PolarHBondContact O-N 2.9Å; E940-R944 PolarHBondContact O-NH1 3.34Å; E940-R944 IonicContact OE2-NH2 2.59Å; E940-R944 PolarHBondContact OE2-NH2 2.88Å
941E95.2Very high93.8Very high96 Ų96104 Ų10445%0.44951%0.51SS..Hα-helixtrans-59.4-50.2173-74.1162-169.800111.2T937 R938 C943 R944 E945T937-E941 VanDerWaalsContact O-CG 3.32Å; T937-E941 WeakPolarHBondContact O-CG 3.34Å; T937-E941 PolarHBondContact O-N 3.32Å; R938-E941 PolarHBondContact O-N 3.34Å; E941-C943 PolarHBondContact O-N 2.86Å; E941-R944 CarbonylContact O-C 3.52Å; E941-R944 WeakPolarHBondContact O-CB 3.32Å; E941-R944 PolarHBondContact O-N 3.45Å; E941-E945 WeakPolarHBondContact O-CG 3.48Å; E941-E945 PolarHBondContact O-N 3.41Å
942I93.4Very high93.8Very high93 Ų93102.4 Ų102.448%0.47750%0.5SS..Hα-helixtrans-58.8-38.8175.6-69.3165.9000110.8R938 Y939 K946R938-I942 HydrophobicContact CG-CD1 4.17Å; R938-I942 WeakPolarHBondContact O-CB 3.49Å; R938-I942 WeakPolarHBondContact O-CD1 3.23Å; R938-I942 WeakPolarHBondContact O-CG1 3.48Å; R938-I942 PolarHBondContact O-N 3.05Å; Y939-I942 PolarHBondContact O-N 3.43Å; I942-K946 VanDerWaalsContact O-CB 3.23Å; I942-K946 WeakPolarHBondContact O-CB 3.26Å; I942-K946 PolarHBondContact O-N 3.42Å
943C93.9Very high93.7Very high58 Ų58100.4 Ų100.439%0.39249%0.494SS..Hα-helixtrans-65.3-41.7175-70.90000112.3Y939 E940 E941 G947Y939-C943 WeakPolarHBondContact O-CB 3.41Å; Y939-C943 PolarHBondContact O-N 3.47Å; Y939-C943 PolarHBondContact O-SG 3.24Å; E940-C943 WeakPolarHBondContact O-CB 3.26Å; E940-C943 PolarHBondContact O-N 2.92Å; E941-C943 PolarHBondContact O-N 2.86Å; C943-G947 PolarHBondContact O-N 2.82Å
944R93.7Very high93.7Very high143 Ų143105 Ų10554%0.5450%0.503SS..Hα-helixtrans-64.4-47.9175-73.2-176.3-158.688.35.3111.3E940 E941 K946 G947 M948E940-R944 WeakPolarHBondContact O-CG 3.31Å; E940-R944 PolarHBondContact O-N 2.9Å; E940-R944 PolarHBondContact O-NH1 3.34Å; E940-R944 IonicContact OE2-NH2 2.59Å; E940-R944 PolarHBondContact OE2-NH2 2.88Å; E941-R944 CarbonylContact O-C 3.52Å; E941-R944 WeakPolarHBondContact O-CB 3.32Å; E941-R944 PolarHBondContact O-N 3.45Å; R944-K946 PolarHBondContact O-N 3.35Å; R944-G947 CarbonylContact O-C 3.39Å; R944-G947 WeakPolarHBondContact O-CA 3.29Å; R944-G947 PolarHBondContact O-N 2.82Å; R944-G947 VanDerWaalsContact O-N 3.07Å; R944-M948 WeakPolarHBondContact O-CG 3.33Å; R944-M948 PolarHBondContact O-N 3.35Å
945E95.1Very high93.6Very high111 Ų111107.4 Ų107.452%0.51950%0.501SS..Hα-helixtrans-58.7-46.5177.1-73.8177.9179.100111.5E941 G947 M948 L949E941-E945 WeakPolarHBondContact O-CG 3.48Å; E941-E945 PolarHBondContact O-N 3.41Å; E945-G947 VanDerWaalsContact C-N 3.28Å; E945-G947 PolarHBondContact O-N 2.84Å; E945-M948 PolarHBondContact O-N 2.78Å; E945-L949 WeakPolarHBondContact O-CB 3.34Å; E945-L949 VanDerWaalsContact O-CG 3.31Å; E945-L949 WeakPolarHBondContact O-CG 3.47Å; E945-L949 PolarHBondContact O-N 2.74Å
946K92Very high93.6Very high127 Ų127105.9 Ų105.955%0.55249%0.493SS*.Hα-helixtrans-57.3-42.7173.6-179.9-176.7174.8-175.70111.4I942 R944 Q950I942-K946 VanDerWaalsContact O-CB 3.23Å; I942-K946 WeakPolarHBondContact O-CB 3.26Å; I942-K946 PolarHBondContact O-N 3.42Å; R944-K946 PolarHBondContact O-N 3.35Å; K946-Q950 WeakPolarHBondContact O-CB 3.44Å; K946-Q950 VanDerWaalsContact O-CG 3.22Å; K946-Q950 WeakPolarHBondContact O-CG 3.25Å; K946-Q950 PolarHBondContact O-N 2.67Å
947G94.1Very high93.6Very high34 Ų34109.7 Ų109.735%0.35150%0.504SS..Hα-helixtrans-61.7-47.2175.800000112.8C943 R944 E945 Q950 Q951C943-G947 PolarHBondContact O-N 2.82Å; R944-G947 CarbonylContact O-C 3.39Å; R944-G947 WeakPolarHBondContact O-CA 3.29Å; R944-G947 PolarHBondContact O-N 2.82Å; R944-G947 VanDerWaalsContact O-N 3.07Å; E945-G947 VanDerWaalsContact C-N 3.28Å; E945-G947 PolarHBondContact O-N 2.84Å; G947-Q950 PolarHBondContact O-N 3.27Å; G947-Q951 PolarHBondContact O-N 2.61Å
948M92.6Very high93.5Very high128 Ų128110.6 Ų110.663%0.63151%0.513SS*.Hα-helixtrans-64.4-45.2177.8-64.5-151.3-55.200111.9R944 E945 Q950 Q951 E952R944-M948 WeakPolarHBondContact O-CG 3.33Å; R944-M948 PolarHBondContact O-N 3.35Å; E945-M948 PolarHBondContact O-N 2.78Å; M948-Q950 VanDerWaalsContact C-N 3.28Å; M948-Q950 PolarHBondContact O-N 2.65Å; M948-Q951 WeakPolarHBondContact O-CB 3.15Å; M948-Q951 PolarHBondContact O-N 2.66Å; M948-Q951 VanDerWaalsContact O-N 3.1Å; M948-E952 WeakPolarHBondContact O-CB 3.31Å; M948-E952 PolarHBondContact O-N 3.5Å
949L92.2Very high93.4Very high114 Ų114107.7 Ų107.760%0.59751%0.506SS*.Hα-helixtrans-60.6-38.7175.6-73.1173.3000111.6E945 N953E945-L949 WeakPolarHBondContact O-CB 3.34Å; E945-L949 VanDerWaalsContact O-CG 3.31Å; E945-L949 WeakPolarHBondContact O-CG 3.47Å; E945-L949 PolarHBondContact O-N 2.74Å; L949-N953 WeakPolarHBondContact O-CB 3.34Å; L949-N953 PolarHBondContact O-N 2.66Å
950Q92.7Very high93.3Very high96 Ų96105.5 Ų105.545%0.44950%0.504SS..Hα-helixtrans-65.8-40.1173.9-76.9178.8-5.300112.3K946 G947 M948 R954K946-Q950 WeakPolarHBondContact O-CB 3.44Å; K946-Q950 VanDerWaalsContact O-CG 3.22Å; K946-Q950 WeakPolarHBondContact O-CG 3.25Å; K946-Q950 PolarHBondContact O-N 2.67Å; G947-Q950 PolarHBondContact O-N 3.27Å; M948-Q950 VanDerWaalsContact C-N 3.28Å; M948-Q950 PolarHBondContact O-N 2.65Å; Q950-R954 WeakPolarHBondContact O-CG 3.49Å; Q950-R954 PolarHBondContact O-N 2.63Å; Q950-R954 VanDerWaalsContact O-N 3.09Å
951Q92.3Very high93.2Very high139 Ų139106.2 Ų106.265%0.6551%0.51SS*.Hα-helixtrans-65.4-44175.9-175.7176.61200111.6G947 M948 R954 R955G947-Q951 PolarHBondContact O-N 2.61Å; M948-Q951 WeakPolarHBondContact O-CB 3.15Å; M948-Q951 PolarHBondContact O-N 2.66Å; M948-Q951 VanDerWaalsContact O-N 3.1Å; Q951-R954 WeakPolarHBondContact O-CB 3.48Å; Q951-R954 PolarHBondContact O-N 2.66Å; Q951-R955 PolarHBondContact O-N 2.85Å
952E92.5Very high93.1Very high91 Ų91103 Ų10343%0.42550%0.503SS..Hα-helixtrans-65.7-40177-176.8145.4-135.900111.8M948 R954 R955 L956M948-E952 WeakPolarHBondContact O-CB 3.31Å; M948-E952 PolarHBondContact O-N 3.5Å; E952-R954 VanDerWaalsContact C-N 3.29Å; E952-R954 PolarHBondContact O-N 3.22Å; E952-R955 WeakPolarHBondContact O-CB 3.48Å; E952-R955 PolarHBondContact O-N 3.46Å; E952-R955 VanDerWaalsContact O-N 3.13Å; E952-R955 IonicContact OE1-NH2 3.81Å; E952-R955 PolarHBondContact OE1-NH2 2.82Å; E952-L956 HydrophobicContact CG-CD1 4.04Å; E952-L956 HydrophobicContact CG-CG 4.25Å; E952-L956 WeakPolarHBondContact O-CB 3.46Å; E952-L956 WeakPolarHBondContact O-CG 3.46Å; E952-L956 PolarHBondContact O-N 3.37Å
953N90.8Very high93Very high84 Ų84100 Ų10045%0.44950%0.495SS..Hα-helixtrans-61.5-38.3173.9-142.4-71.8000111.6L949 R957L949-N953 WeakPolarHBondContact O-CB 3.34Å; L949-N953 PolarHBondContact O-N 2.66Å; N953-R957 WeakPolarHBondContact O-CB 3.31Å; N953-R957 WeakPolarHBondContact O-CG 3.26Å; N953-R957 PolarHBondContact O-N 2.71Å; N953-R957 PolarHBondContact OD1-NE 2.85Å; N953-R957 VanDerWaalsContact OD1-NE 3.07Å
954R94.2Very high93Very high171 Ų171102.5 Ų102.565%0.64550%0.501SS*.Hα-helixtrans-66.1-40.3173.4-70.3172.8-169.7167.84.7111.9Q950 Q951 E952 S958Q950-R954 WeakPolarHBondContact O-CG 3.49Å; Q950-R954 PolarHBondContact O-N 2.63Å; Q950-R954 VanDerWaalsContact O-N 3.09Å; Q951-R954 WeakPolarHBondContact O-CB 3.48Å; Q951-R954 PolarHBondContact O-N 2.66Å; E952-R954 VanDerWaalsContact C-N 3.29Å; E952-R954 PolarHBondContact O-N 3.22Å; R954-S958 PolarHBondContact O-N 3.16Å; R954-S958 PolarHBondContact O-OG 2.76Å
955R93.8Very high92.9Very high122 Ų122100.4 Ų100.446%0.4650%0.5SS..Hα-helixtrans-62.3-53.6175.9-176-17872.7101.2-7.7111.1Q951 E952 R957 S958 E959Q951-R955 PolarHBondContact O-N 2.85Å; E952-R955 WeakPolarHBondContact O-CB 3.48Å; E952-R955 PolarHBondContact O-N 3.46Å; E952-R955 VanDerWaalsContact O-N 3.13Å; E952-R955 IonicContact OE1-NH2 3.81Å; E952-R955 PolarHBondContact OE1-NH2 2.82Å; R955-R957 VanDerWaalsContact C-N 3.31Å; R955-R957 PolarHBondContact O-N 3.45Å; R955-S958 WeakPolarHBondContact O-CA 3.29Å; R955-S958 WeakPolarHBondContact O-CB 3.24Å; R955-S958 PolarHBondContact O-N 3.39Å; R955-E959 WeakPolarHBondContact CG-OE1 3.2Å; R955-E959 IonicContact CZ-OE1 3.59Å; R955-E959 IonicContact NE-OE1 2.71Å; R955-E959 IonicContact NH1-OE1 3.83Å; R955-E959 PolarHBondContact NH1-OE1 3.47Å; R955-E959 IonicContact NH1-OE2 2.8Å; R955-E959 PolarHBondContact NH1-OE2 3.47Å; R955-E959 PolarHBondContact O-N 3.3Å
956L94.6Very high92.9Very high87 Ų87102.4 Ų102.446%0.45551%0.507SS..Hα-helixtrans-59.8-39.5179.6-70.6174.2000112.1E952 S958 E959 L960E952-L956 HydrophobicContact CG-CD1 4.04Å; E952-L956 HydrophobicContact CG-CG 4.25Å; E952-L956 WeakPolarHBondContact O-CB 3.46Å; E952-L956 WeakPolarHBondContact O-CG 3.46Å; E952-L956 PolarHBondContact O-N 3.37Å; L956-S958 VanDerWaalsContact C-N 3.34Å; L956-S958 PolarHBondContact O-N 3.45Å; L956-E959 PolarHBondContact O-N 2.79Å; L956-L960 VanDerWaalsContact O-CB 3.28Å; L956-L960 WeakPolarHBondContact O-CB 3.27Å; L956-L960 PolarHBondContact O-N 2.94Å
957R94.8Very high92.9Very high162 Ų162100.6 Ų100.661%0.61151%0.506SS*.Hα-helixtrans-63.3-39173-74.8174.7-174.6-145.7-3.3112.5N953 R955 N961N953-R957 WeakPolarHBondContact O-CB 3.31Å; N953-R957 WeakPolarHBondContact O-CG 3.26Å; N953-R957 PolarHBondContact O-N 2.71Å; N953-R957 PolarHBondContact OD1-NE 2.85Å; N953-R957 VanDerWaalsContact OD1-NE 3.07Å; R955-R957 VanDerWaalsContact C-N 3.31Å; R955-R957 PolarHBondContact O-N 3.45Å; R957-N961 WeakPolarHBondContact O-CB 3.37Å; R957-N961 PolarHBondContact O-N 2.7Å; R957-N961 PolarHBondContact O-ND2 2.84Å; R957-N961 PolarHBondContact O-OD1 2.75Å
958S90.9Very high92.8Very high83 Ų83102.5 Ų102.558%0.5851%0.511SS*.Hα-helixtrans-69.3-40.1177.6-550000111.6R954 R955 L956 G962R954-S958 PolarHBondContact O-N 3.16Å; R954-S958 PolarHBondContact O-OG 2.76Å; R955-S958 WeakPolarHBondContact O-CA 3.29Å; R955-S958 WeakPolarHBondContact O-CB 3.24Å; R955-S958 PolarHBondContact O-N 3.39Å; L956-S958 VanDerWaalsContact C-N 3.34Å; L956-S958 PolarHBondContact O-N 3.45Å; S958-G962 PolarHBondContact O-N 2.86Å
959E93.4Very high92.8Very high101 Ų101101.3 Ų101.347%0.47250%0.504SS..Hα-helixtrans-65.2-41.9174.1-72.6173.5-172.100111.9R955 L956 G962 G963R955-E959 WeakPolarHBondContact CG-OE1 3.2Å; R955-E959 IonicContact CZ-OE1 3.59Å; R955-E959 IonicContact NE-OE1 2.71Å; R955-E959 IonicContact NH1-OE1 3.83Å; R955-E959 PolarHBondContact NH1-OE1 3.47Å; R955-E959 IonicContact NH1-OE2 2.8Å; R955-E959 PolarHBondContact NH1-OE2 3.47Å; R955-E959 PolarHBondContact O-N 3.3Å; L956-E959 PolarHBondContact O-N 2.79Å; E959-G962 PolarHBondContact O-N 3.29Å; E959-G963 PolarHBondContact O-N 3.42Å
960L93.5Very high92.7Very high102 Ų10298.6 Ų98.653%0.53450%0.498SS..Hα-helixtrans-60.9-52.6174.718066.2000111.1L956 G962 G963 E964L956-L960 VanDerWaalsContact O-CB 3.28Å; L956-L960 WeakPolarHBondContact O-CB 3.27Å; L956-L960 PolarHBondContact O-N 2.94Å; L960-G962 VanDerWaalsContact C-N 3.26Å; L960-G962 PolarHBondContact O-N 2.87Å; L960-G963 CarbonylContact O-C 3.59Å; L960-G963 WeakPolarHBondContact O-CA 3.45Å; L960-G963 PolarHBondContact O-N 3.44Å; L960-E964 WeakPolarHBondContact O-CG 3.49Å; L960-E964 PolarHBondContact O-N 2.98Å
961N91.6Very high92.8Very high89 Ų8999 Ų9948%0.47650%0.503SS..Hα-helixtrans-58.9-40.2177.6-67.7-11.1000111.3R957 E964 L965R957-N961 WeakPolarHBondContact O-CB 3.37Å; R957-N961 PolarHBondContact O-N 2.7Å; R957-N961 PolarHBondContact O-ND2 2.84Å; R957-N961 PolarHBondContact O-OD1 2.75Å; N961-E964 PolarHBondContact O-N 2.74Å; N961-L965 WeakPolarHBondContact O-CB 3.24Å; N961-L965 PolarHBondContact O-N 2.9Å
962G92.2Very high92.8Very high28 Ų2896.2 Ų96.229%0.28950%0.495SS..Hα-helixtrans-64.8-37.6174.500000113.1S958 E959 L960 K966S958-G962 PolarHBondContact O-N 2.86Å; E959-G962 PolarHBondContact O-N 3.29Å; L960-G962 VanDerWaalsContact C-N 3.26Å; L960-G962 PolarHBondContact O-N 2.87Å; G962-K966 WeakPolarHBondContact O-CG 3.49Å; G962-K966 PolarHBondContact O-N 3.18Å
963G91.5Very high92.9Very high31 Ų3198.9 Ų98.932%0.3251%0.505SS..Hα-helixtrans-65-47.4173.500000112.5E959 L960 L965 K966 V967E959-G963 PolarHBondContact O-N 3.42Å; L960-G963 CarbonylContact O-C 3.59Å; L960-G963 WeakPolarHBondContact O-CA 3.45Å; L960-G963 PolarHBondContact O-N 3.44Å; G963-L965 VanDerWaalsContact C-N 3.31Å; G963-L965 PolarHBondContact O-N 2.78Å; G963-K966 PolarHBondContact O-N 2.93Å; G963-K966 VanDerWaalsContact O-N 3.11Å; G963-V967 WeakPolarHBondContact O-CG2 3.29Å; G963-V967 PolarHBondContact O-N 2.73Å
964E94.9Very high93Very high109 Ų10999.5 Ų99.551%0.50951%0.508SS..Hα-helixtrans-59-40.9175.7-70.1176.8166.300111.8L960 N961 V967 T968L960-E964 WeakPolarHBondContact O-CG 3.49Å; L960-E964 PolarHBondContact O-N 2.98Å; N961-E964 PolarHBondContact O-N 2.74Å; E964-V967 PolarHBondContact O-N 2.86Å; E964-T968 WeakPolarHBondContact O-CB 3.48Å; E964-T968 WeakPolarHBondContact O-CG2 3.46Å; E964-T968 PolarHBondContact O-N 3.18Å; E964-T968 PolarHBondContact O-OG1 2.67Å
965L91.9Very high93Very high100 Ų10097 Ų9752%0.52450%0.503SS..Hα-helixtrans-62.8-41.8172.6-95149.8000112.8N961 G963 T968 Q969N961-L965 WeakPolarHBondContact O-CB 3.24Å; N961-L965 PolarHBondContact O-N 2.9Å; G963-L965 VanDerWaalsContact C-N 3.31Å; G963-L965 PolarHBondContact O-N 2.78Å; L965-T968 VanDerWaalsContact CA-OG1 3.28Å; L965-T968 WeakPolarHBondContact CA-OG1 3.26Å; L965-T968 PolarHBondContact O-OG1 2.8Å; L965-Q969 WeakPolarHBondContact O-CB 3.45Å; L965-Q969 WeakPolarHBondContact O-CG 3.38Å; L965-Q969 PolarHBondContact O-N 2.67Å
966K93.5Very high93Very high153 Ų15395.2 Ų95.267%0.66550%0.503SS*.Hα-helixtrans-66.6-40.5176.2-74172.9-177.1177.90111.9G962 G963 Q969 A970G962-K966 WeakPolarHBondContact O-CG 3.49Å; G962-K966 PolarHBondContact O-N 3.18Å; G963-K966 PolarHBondContact O-N 2.93Å; G963-K966 VanDerWaalsContact O-N 3.11Å; K966-Q969 PolarHBondContact O-N 3.48Å; K966-A970 WeakPolarHBondContact O-CB 3.45Å; K966-A970 PolarHBondContact O-N 2.7Å
967V92.5Very high92.9Very high88 Ų8893.5 Ų93.553%0.53350%0.502SS..Hα-helixtrans-63.8-48176.6170.60000110.5G963 E964 Q969 A970 L971G963-V967 WeakPolarHBondContact O-CG2 3.29Å; G963-V967 PolarHBondContact O-N 2.73Å; E964-V967 PolarHBondContact O-N 2.86Å; V967-Q969 PolarHBondContact O-N 2.69Å; V967-A970 PolarHBondContact O-N 2.95Å; V967-L971 HydrophobicContact CG1-CD1 4.11Å; V967-L971 HydrophobicContact CG1-CG 4.47Å; V967-L971 WeakPolarHBondContact O-CG 3.21Å; V967-L971 PolarHBondContact O-N 2.97Å
968T92.6Very high92.9Very high75 Ų7589.1 Ų89.146%0.4649%0.488SS..Hα-helixtrans-61.5-41.6176.647.30000112.1E964 L965 A970 L971 V972E964-T968 WeakPolarHBondContact O-CB 3.48Å; E964-T968 WeakPolarHBondContact O-CG2 3.46Å; E964-T968 PolarHBondContact O-N 3.18Å; E964-T968 PolarHBondContact O-OG1 2.67Å; L965-T968 VanDerWaalsContact CA-OG1 3.28Å; L965-T968 WeakPolarHBondContact CA-OG1 3.26Å; L965-T968 PolarHBondContact O-OG1 2.8Å; T968-A970 PolarHBondContact O-N 3.5Å; T968-L971 PolarHBondContact O-N 3.3Å; T968-V972 WeakPolarHBondContact O-CG2 3.33Å; T968-V972 PolarHBondContact O-N 2.78Å
969Q92.5Very high93.1Very high103 Ų10388.2 Ų88.248%0.48148%0.477SS..Hα-helixtrans-62.8-39.4173.3-74.7174.613.400113.1L965 K966 V967 V972 K973L965-Q969 WeakPolarHBondContact O-CB 3.45Å; L965-Q969 WeakPolarHBondContact O-CG 3.38Å; L965-Q969 PolarHBondContact O-N 2.67Å; K966-Q969 PolarHBondContact O-N 3.48Å; V967-Q969 PolarHBondContact O-N 2.69Å; Q969-V972 PolarHBondContact O-N 2.75Å; Q969-K973 WeakPolarHBondContact O-CG 3.24Å; Q969-K973 PolarHBondContact O-N 2.7Å
970A90.8Very high93.1Very high57 Ų5789.5 Ų89.547%0.47148%0.483SS..Hα-helixtrans-67.4-41.1177.600000111.8K966 V967 T968 V972 K973 L974K966-A970 WeakPolarHBondContact O-CB 3.45Å; K966-A970 PolarHBondContact O-N 2.7Å; V967-A970 PolarHBondContact O-N 2.95Å; T968-A970 PolarHBondContact O-N 3.5Å; A970-V972 PolarHBondContact O-N 3.41Å; A970-K973 PolarHBondContact O-N 3.44Å; A970-L974 WeakPolarHBondContact O-CB 3.43Å; A970-L974 PolarHBondContact O-N 2.79Å
971L93.9Very high93.2Very high104 Ų10490.6 Ų90.655%0.54548%0.48SS..Hα-helixtrans-59.9-44.4174.4-71.6172000111.5V967 T968 K973 L974 E975V967-L971 HydrophobicContact CG1-CD1 4.11Å; V967-L971 HydrophobicContact CG1-CG 4.47Å; V967-L971 WeakPolarHBondContact O-CG 3.21Å; V967-L971 PolarHBondContact O-N 2.97Å; T968-L971 PolarHBondContact O-N 3.3Å; L971-K973 PolarHBondContact O-N 2.71Å; L971-L974 WeakPolarHBondContact O-CB 3.31Å; L971-L974 PolarHBondContact O-N 2.61Å; L971-E975 PolarHBondContact O-N 2.69Å
972V92.8Very high93.4Very high80 Ų8091.2 Ų91.249%0.48548%0.475SS..Hα-helixtrans-63.3-40.2175.8171.60000111.7T968 Q969 A970 L974 N976T968-V972 WeakPolarHBondContact O-CG2 3.33Å; T968-V972 PolarHBondContact O-N 2.78Å; Q969-V972 PolarHBondContact O-N 2.75Å; A970-V972 PolarHBondContact O-N 3.41Å; V972-L974 VanDerWaalsContact C-N 3.35Å; V972-N976 PolarHBondContact O-N 3.49Å; V972-N976 VanDerWaalsContact O-N 3.12Å; V972-N976 PolarHBondContact O-ND2 3.35Å
973K94.8Very high93.5Very high148 Ų14898.2 Ų98.264%0.64349%0.493SS*.Hα-helixtrans-64.8-39.4175.8-74.3176.3-1781800112.2Q969 A970 L971 A977Q969-K973 WeakPolarHBondContact O-CG 3.24Å; Q969-K973 PolarHBondContact O-N 2.7Å; A970-K973 PolarHBondContact O-N 3.44Å; L971-K973 PolarHBondContact O-N 2.71Å; K973-A977 WeakPolarHBondContact O-CB 3.39Å; K973-A977 PolarHBondContact O-N 3.5Å
974L92.8Very high93.7Very high96 Ų96102.3 Ų102.350%0.50351%0.507SS..Hα-helixtrans-63-48.8176.7-17967.1000110.9A970 L971 V972 N976 A977 E978A970-L974 WeakPolarHBondContact O-CB 3.43Å; A970-L974 PolarHBondContact O-N 2.79Å; L971-L974 WeakPolarHBondContact O-CB 3.31Å; L971-L974 PolarHBondContact O-N 2.61Å; V972-L974 VanDerWaalsContact C-N 3.35Å; L974-N976 VanDerWaalsContact C-N 3.32Å; L974-N976 PolarHBondContact O-N 3.39Å; L974-A977 PolarHBondContact O-N 2.84Å; L974-A977 VanDerWaalsContact O-N 3.13Å; L974-E978 WeakPolarHBondContact O-CG 3.29Å; L974-E978 PolarHBondContact O-N 3.31Å
975E94.2Very high93.7Very high118 Ų118101.2 Ų101.255%0.55150%0.502SS*.Hα-helixtrans-58.1-43.6178.3-172.1174.3-162.300111.9L971 A977 E978 D979L971-E975 PolarHBondContact O-N 2.69Å; E975-A977 PolarHBondContact O-N 2.76Å; E975-E978 PolarHBondContact O-N 3.22Å; E975-D979 PolarHBondContact O-N 2.95Å
976N94.1Very high93.8Very high86 Ų86101.4 Ų101.446%0.4650%0.503SS..Hα-helixtrans-62.8-41.4175.4-74.9-52.3000113.1V972 L974 D979 Q980V972-N976 PolarHBondContact O-N 3.49Å; V972-N976 VanDerWaalsContact O-N 3.12Å; V972-N976 PolarHBondContact O-ND2 3.35Å; L974-N976 VanDerWaalsContact C-N 3.32Å; L974-N976 PolarHBondContact O-N 3.39Å; N976-D979 PolarHBondContact O-N 3.19Å; N976-Q980 WeakPolarHBondContact O-CG 3.43Å; N976-Q980 PolarHBondContact O-N 2.74Å
977A92.5Very high93.8Very high51 Ų5197.7 Ų97.742%0.42149%0.49SS..Hα-helixtrans-67.8-38.2177.300000111.6K973 L974 E975 Q980 R981K973-A977 WeakPolarHBondContact O-CB 3.39Å; K973-A977 PolarHBondContact O-N 3.5Å; L974-A977 PolarHBondContact O-N 2.84Å; L974-A977 VanDerWaalsContact O-N 3.13Å; E975-A977 PolarHBondContact O-N 2.76Å; A977-Q980 PolarHBondContact O-N 2.83Å; A977-R981 PolarHBondContact O-N 2.82Å
978E94.9Very high94Very high69 Ų6997.1 Ų97.132%0.32249%0.487SS..Hα-helixtrans-62.8-41.5173.4-72-177.6178.100111.9L974 E975 R981 R982L974-E978 WeakPolarHBondContact O-CG 3.29Å; L974-E978 PolarHBondContact O-N 3.31Å; E975-E978 PolarHBondContact O-N 3.22Å; E978-R981 PolarHBondContact O-N 3.39Å; E978-R982 VanDerWaalsContact O-CG 3.28Å; E978-R982 WeakPolarHBondContact O-CG 3.44Å; E978-R982 PolarHBondContact O-N 3.33Å; E978-R982 IonicContact OE2-CZ 3.22Å; E978-R982 IonicContact OE2-NH1 2.79Å; E978-R982 IonicContact OE2-NH2 3.7Å; E978-R982 PolarHBondContact OE2-NH2 3.32Å
979D94.2Very high94.1Very high65 Ų6597.3 Ų97.335%0.34848%0.484SS..Hα-helixtrans-65.4-38.5175.5-81.3-12.4000112.8E975 N976 R982 R983E975-D979 PolarHBondContact O-N 2.95Å; N976-D979 PolarHBondContact O-N 3.19Å; D979-R982 PolarHBondContact O-N 2.74Å; D979-R982 IonicContact OD1-CZ 3.81Å; D979-R982 IonicContact OD1-NH1 3.33Å; D979-R982 PolarHBondContact OD1-NH1 2.88Å; D979-R983 VanDerWaalsContact O-CG 3.28Å; D979-R983 WeakPolarHBondContact O-CG 3.42Å; D979-R983 PolarHBondContact O-N 2.9Å
980Q93.9Very high94.2Very high127 Ų12797.5 Ų97.559%0.59348%0.484SS*.Hα-helixtrans-63.5-43.5173-73.1175.76.200111.5N976 A977 R983 L984N976-Q980 WeakPolarHBondContact O-CG 3.43Å; N976-Q980 PolarHBondContact O-N 2.74Å; A977-Q980 PolarHBondContact O-N 2.83Å; Q980-R983 PolarHBondContact O-N 3.2Å; Q980-L984 WeakPolarHBondContact O-CG 3.23Å; Q980-L984 PolarHBondContact O-N 2.86Å
981R94.8Very high94.4Very high125 Ų12599.8 Ų99.847%0.47249%0.487SS..Hα-helixtrans-60-48.2174.5-175.2-1746489.81.7111.3A977 E978 R983 L984 E985A977-R981 PolarHBondContact O-N 2.82Å; E978-R981 PolarHBondContact O-N 3.39Å; R981-R983 VanDerWaalsContact C-N 3.28Å; R981-R983 PolarHBondContact O-N 2.95Å; R981-L984 PolarHBondContact O-N 3.41Å; R981-E985 IonicContact CZ-OE1 3.87Å; R981-E985 IonicContact CZ-OE2 3.62Å; R981-E985 VanDerWaalsContact NH1-CD 3.26Å; R981-E985 IonicContact NH1-OE1 2.72Å; R981-E985 PolarHBondContact NH1-OE1 2.75Å; R981-E985 IonicContact NH1-OE2 2.8Å; R981-E985 PolarHBondContact NH1-OE2 3.33Å; R981-E985 WeakPolarHBondContact O-CG 3.47Å; R981-E985 PolarHBondContact O-N 2.72Å
982R95.7Very high94.5Very high102 Ų10299.9 Ų99.939%0.38549%0.485SS..Hα-helixtrans-58.2-38.6177-70.8171.8-166.9118.58.4111.9E978 D979 L986E978-R982 VanDerWaalsContact O-CG 3.28Å; E978-R982 WeakPolarHBondContact O-CG 3.44Å; E978-R982 PolarHBondContact O-N 3.33Å; E978-R982 IonicContact OE2-CZ 3.22Å; E978-R982 IonicContact OE2-NH1 2.79Å; E978-R982 IonicContact OE2-NH2 3.7Å; E978-R982 PolarHBondContact OE2-NH2 3.32Å; D979-R982 PolarHBondContact O-N 2.74Å; D979-R982 IonicContact OD1-CZ 3.81Å; D979-R982 IonicContact OD1-NH1 3.33Å; D979-R982 PolarHBondContact OD1-NH1 2.88Å; R982-L986 WeakPolarHBondContact O-CG 3.48Å; R982-L986 PolarHBondContact O-N 3.41Å
983R95.3Very high94.5Very high175 Ų175101.5 Ų101.566%0.6649%0.487SS*.Hα-helixtrans-65.6-46.8175.7-74.1169.7-172.4-125.12.9112.2D979 Q980 R981 E985 L986 D987D979-R983 VanDerWaalsContact O-CG 3.28Å; D979-R983 WeakPolarHBondContact O-CG 3.42Å; D979-R983 PolarHBondContact O-N 2.9Å; Q980-R983 PolarHBondContact O-N 3.2Å; R981-R983 VanDerWaalsContact C-N 3.28Å; R981-R983 PolarHBondContact O-N 2.95Å; R983-E985 VanDerWaalsContact C-N 3.34Å; R983-E985 PolarHBondContact O-N 3.49Å; R983-L986 PolarHBondContact O-N 2.92Å; R983-D987 PolarHBondContact O-N 3.5Å; R983-D987 VanDerWaalsContact O-N 3.12Å
984L94.6Very high94.5Very high118 Ų118100.5 Ų100.562%0.61848%0.483SS*.Hα-helixtrans-64.3-39.3178.5-70.5173.8000111.8Q980 R981 L986 D987 V988Q980-L984 WeakPolarHBondContact O-CG 3.23Å; Q980-L984 PolarHBondContact O-N 2.86Å; R981-L984 PolarHBondContact O-N 3.41Å; L984-L986 VanDerWaalsContact C-N 3.34Å; L984-L986 PolarHBondContact O-N 2.91Å; L984-D987 PolarHBondContact O-N 3.33Å; L984-D987 VanDerWaalsContact O-N 3.16Å; L984-V988 WeakPolarHBondContact O-CG2 3.18Å; L984-V988 PolarHBondContact O-N 2.72Å
985E96Very high94.4Very high86 Ų8699.3 Ų99.340%0.40248%0.482SS..Hα-helixtrans-59.4-43.8174.4-76.9171.2-179.900112R981 R983 D987 V988 I989R981-E985 IonicContact CZ-OE1 3.87Å; R981-E985 IonicContact CZ-OE2 3.62Å; R981-E985 VanDerWaalsContact NH1-CD 3.26Å; R981-E985 IonicContact NH1-OE1 2.72Å; R981-E985 PolarHBondContact NH1-OE1 2.75Å; R981-E985 IonicContact NH1-OE2 2.8Å; R981-E985 PolarHBondContact NH1-OE2 3.33Å; R981-E985 WeakPolarHBondContact O-CG 3.47Å; R981-E985 PolarHBondContact O-N 2.72Å; R983-E985 VanDerWaalsContact C-N 3.34Å; R983-E985 PolarHBondContact O-N 3.49Å; E985-D987 VanDerWaalsContact C-N 3.3Å; E985-D987 PolarHBondContact O-N 2.71Å; E985-V988 PolarHBondContact O-N 2.73Å; E985-I989 VanDerWaalsContact O-CG1 3.29Å; E985-I989 WeakPolarHBondContact O-CG1 3.5Å; E985-I989 PolarHBondContact O-N 3.26Å
986L93.2Very high94.4Very high103 Ų10397.9 Ų97.954%0.53948%0.475SS..Hα-helixtrans-63-35.8175.3-74.2171.1000112.7R982 R983 L984 K990R982-L986 WeakPolarHBondContact O-CG 3.48Å; R982-L986 PolarHBondContact O-N 3.41Å; R983-L986 PolarHBondContact O-N 2.92Å; L984-L986 VanDerWaalsContact C-N 3.34Å; L984-L986 PolarHBondContact O-N 2.91Å; L986-K990 VanDerWaalsContact O-CG 3.24Å; L986-K990 WeakPolarHBondContact O-CG 3.35Å; L986-K990 PolarHBondContact O-N 2.66Å; L986-K990 VanDerWaalsContact O-N 3.09Å
987D94.7Very high94.3Very high76 Ų7697.8 Ų97.841%0.40648%0.478SS..Hα-helixtrans-76-34.8178.9-70.9-21000112.5R983 L984 E985 K990 L991R983-D987 PolarHBondContact O-N 3.5Å; R983-D987 VanDerWaalsContact O-N 3.12Å; L984-D987 PolarHBondContact O-N 3.33Å; L984-D987 VanDerWaalsContact O-N 3.16Å; E985-D987 VanDerWaalsContact C-N 3.3Å; E985-D987 PolarHBondContact O-N 2.71Å; D987-K990 PolarHBondContact O-N 3.47Å; D987-K990 IonicContact OD1-NZ 3.09Å; D987-K990 PolarHBondContact OD1-NZ 2.81Å; D987-L991 WeakPolarHBondContact O-CG 3.31Å; D987-L991 PolarHBondContact O-N 3.35Å
988V94.7Very high94.4Very high76 Ų76100.7 Ų100.746%0.46149%0.485SS..Hα-helixtrans-59.4-50.5169.6170.10000110L984 E985 K990 L991 E992L984-V988 WeakPolarHBondContact O-CG2 3.18Å; L984-V988 PolarHBondContact O-N 2.72Å; E985-V988 PolarHBondContact O-N 2.73Å; V988-K990 VanDerWaalsContact C-N 3.29Å; V988-K990 PolarHBondContact O-N 2.77Å; V988-L991 PolarHBondContact O-N 2.85Å; V988-E992 HydrophobicContact CG1-CG 4.33Å; V988-E992 WeakPolarHBondContact O-CG 3.41Å; V988-E992 PolarHBondContact O-N 2.77Å
989I95Very high94.3Very high78 Ų78102.7 Ų102.740%0.450%0.498SS..Hα-helixtrans-58.7-40.2177.8-67.4164.5000111.4E985 L991 E992 H993E985-I989 VanDerWaalsContact O-CG1 3.29Å; E985-I989 WeakPolarHBondContact O-CG1 3.5Å; E985-I989 PolarHBondContact O-N 3.26Å; I989-L991 VanDerWaalsContact C-N 3.35Å; I989-L991 PolarHBondContact O-N 3.39Å; I989-E992 PolarHBondContact O-N 2.73Å; I989-H993 PolarHBondContact O-N 3.25Å
990K95.7Very high94.2Very high108 Ų108107 Ų10747%0.4751%0.51SS..Hα-helixtrans-64.8-37.3176-73169.7-156.5158.30112.5L986 D987 V988 K994L986-K990 VanDerWaalsContact O-CG 3.24Å; L986-K990 WeakPolarHBondContact O-CG 3.35Å; L986-K990 PolarHBondContact O-N 2.66Å; L986-K990 VanDerWaalsContact O-N 3.09Å; D987-K990 PolarHBondContact O-N 3.47Å; D987-K990 IonicContact OD1-NZ 3.09Å; D987-K990 PolarHBondContact OD1-NZ 2.81Å; V988-K990 VanDerWaalsContact C-N 3.29Å; V988-K990 PolarHBondContact O-N 2.77Å; K990-K994 VanDerWaalsContact O-CG 3.31Å; K990-K994 WeakPolarHBondContact O-CG 3.28Å; K990-K994 PolarHBondContact O-N 3.42Å
991L94.2Very high94.2Very high104 Ų104105.7 Ų105.755%0.54551%0.506SS..Hα-helixtrans-71.4-41.5177.4-75170.2000111.2D987 V988 I989 H993 K994 C995D987-L991 WeakPolarHBondContact O-CG 3.31Å; D987-L991 PolarHBondContact O-N 3.35Å; V988-L991 PolarHBondContact O-N 2.85Å; I989-L991 VanDerWaalsContact C-N 3.35Å; I989-L991 PolarHBondContact O-N 3.39Å; L991-H993 PolarHBondContact O-N 2.87Å; L991-K994 HydrophobicContact CD2-CD 4.5Å; L991-K994 WeakPolarHBondContact O-CB 3.38Å; L991-K994 PolarHBondContact O-N 2.96Å; L991-K994 VanDerWaalsContact O-N 3.14Å; L991-C995 PolarHBondContact O-N 3.22Å; L991-C995 PolarHBondContact O-SG 2.77Å; L991-C995 VanDerWaalsContact O-SG 3.38Å
992E96Very high94.1Very high107 Ų107104.4 Ų104.450%0.551%0.508SS..Hα-helixtrans-56.6-50.5174.1-72.6174.116500111.1V988 I989 K994 C995 E996V988-E992 HydrophobicContact CG1-CG 4.33Å; V988-E992 WeakPolarHBondContact O-CG 3.41Å; V988-E992 PolarHBondContact O-N 2.77Å; I989-E992 PolarHBondContact O-N 2.73Å; E992-K994 VanDerWaalsContact C-N 3.29Å; E992-K994 PolarHBondContact O-N 3.18Å; E992-C995 PolarHBondContact O-N 3.48Å; E992-C995 VanDerWaalsContact O-N 3.17Å; E992-E996 PolarHBondContact O-N 2.83Å
993H92.6Very high94Very high114 Ų114101 Ų10153%0.52851%0.506SS..Hα-helixtrans-58.2-38.6175.4-71.8157.1000113.2I989 L991 E996 T997I989-H993 PolarHBondContact O-N 3.25Å; L991-H993 PolarHBondContact O-N 2.87Å; H993-E996 PolarHBondContact O-N 2.75Å; H993-T997 WeakPolarHBondContact O-CG2 3.34Å; H993-T997 PolarHBondContact O-N 2.78Å; H993-T997 PolarHBondContact O-OG1 3.47Å
994K94.8Very high93.9Very high127 Ų12795.8 Ų95.855%0.55249%0.493SS*.Hα-helixtrans-65.4-45.4176.4-74.6171.6-177.51790111.5K990 L991 E992 E996 T997 L998K990-K994 VanDerWaalsContact O-CG 3.31Å; K990-K994 WeakPolarHBondContact O-CG 3.28Å; K990-K994 PolarHBondContact O-N 3.42Å; L991-K994 HydrophobicContact CD2-CD 4.5Å; L991-K994 WeakPolarHBondContact O-CB 3.38Å; L991-K994 PolarHBondContact O-N 2.96Å; L991-K994 VanDerWaalsContact O-N 3.14Å; E992-K994 VanDerWaalsContact C-N 3.29Å; E992-K994 PolarHBondContact O-N 3.18Å; K994-E996 VanDerWaalsContact C-N 3.33Å; K994-E996 PolarHBondContact O-N 2.84Å; K994-T997 WeakPolarHBondContact CA-OG1 3.22Å; K994-T997 PolarHBondContact O-N 2.92Å; K994-T997 PolarHBondContact O-OG1 2.74Å; K994-L998 PolarHBondContact O-N 2.73Å
995C91.8Very high93.7Very high71 Ų7194.7 Ų94.748%0.4849%0.488SS..Hα-helixtrans-58.5-46.6175.9-68.90000110.9L991 E992 T997 L998 D999L991-C995 PolarHBondContact O-N 3.22Å; L991-C995 PolarHBondContact O-SG 2.77Å; L991-C995 VanDerWaalsContact O-SG 3.38Å; E992-C995 PolarHBondContact O-N 3.48Å; E992-C995 VanDerWaalsContact O-N 3.17Å; C995-T997 VanDerWaalsContact C-N 3.29Å; C995-T997 PolarHBondContact O-N 3.04Å; C995-L998 WeakPolarHBondContact O-CB 3.24Å; C995-L998 PolarHBondContact O-N 3.3Å; C995-L998 VanDerWaalsContact O-N 3.09Å; C995-D999 PolarHBondContact O-N 3.44Å
996E93.5Very high93.6Very high88 Ų8893 Ų9341%0.41148%0.483SS..Hα-helixtrans-61.3-35.9177-69-173.3-168.600113.4E992 H993 K994 R1000E992-E996 PolarHBondContact O-N 2.83Å; H993-E996 PolarHBondContact O-N 2.75Å; K994-E996 VanDerWaalsContact C-N 3.33Å; K994-E996 PolarHBondContact O-N 2.84Å; E996-R1000 WeakPolarHBondContact O-CG 3.27Å; E996-R1000 PolarHBondContact O-N 2.68Å; E996-R1000 PolarHBondContact O-NH1 3.11Å; E996-R1000 IonicContact OE2-CZ 2.8Å; E996-R1000 IonicContact OE2-NH1 3.64Å; E996-R1000 PolarHBondContact OE2-NH1 2.85Å; E996-R1000 IonicContact OE2-NH2 3.58Å; E996-R1000 PolarHBondContact OE2-NH2 3.28Å; E996-R1000 VanDerWaalsContact OE2-NH2 3.09Å
997T92.9Very high93.6Very high84 Ų8494.4 Ų94.452%0.51549%0.487SS..Hα-helixtrans-67.8-37.6175.355.30000112.4H993 K994 C995 L1001H993-T997 WeakPolarHBondContact O-CG2 3.34Å; H993-T997 PolarHBondContact O-N 2.78Å; H993-T997 PolarHBondContact O-OG1 3.47Å; K994-T997 WeakPolarHBondContact CA-OG1 3.22Å; K994-T997 PolarHBondContact O-N 2.92Å; K994-T997 PolarHBondContact O-OG1 2.74Å; C995-T997 VanDerWaalsContact C-N 3.29Å; C995-T997 PolarHBondContact O-N 3.04Å; T997-L1001 WeakPolarHBondContact O-CB 3.17Å; T997-L1001 PolarHBondContact O-N 2.85Å
998L93.7Very high93.3Very high111 Ų11196.6 Ų96.658%0.58150%0.495SS*.Hα-helixtrans-67.5-40.4175.2-73.1172.7000111.4K994 C995 L1001 N1002K994-L998 PolarHBondContact O-N 2.73Å; C995-L998 WeakPolarHBondContact O-CB 3.24Å; C995-L998 PolarHBondContact O-N 3.3Å; C995-L998 VanDerWaalsContact O-N 3.09Å; L998-L1001 PolarHBondContact O-N 3.4Å; L998-N1002 VanDerWaalsContact O-CB 3.26Å; L998-N1002 WeakPolarHBondContact O-CB 3.41Å; L998-N1002 PolarHBondContact O-N 3.2Å
999D93.3Very high93.2Very high112 Ų11299.9 Ų99.960%0.59950%0.499SS*.Hα-helixtrans-63.8-42.8176.6-75.3-30.4000111.7C995 L1001 N1002 G1003C995-D999 PolarHBondContact O-N 3.44Å; D999-L1001 PolarHBondContact O-N 3.29Å; D999-N1002 PolarHBondContact O-N 2.85Å; D999-G1003 PolarHBondContact O-N 3.4Å
1000R92.2Very high93.1Very high156 Ų156100 Ų10059%0.58950%0.497SS*.Hα-helixtrans-59.9-46.5173.7-73.9-178.9-170.496.81.6111.6E996 G1003 T1004E996-R1000 WeakPolarHBondContact O-CG 3.27Å; E996-R1000 PolarHBondContact O-N 2.68Å; E996-R1000 PolarHBondContact O-NH1 3.11Å; E996-R1000 IonicContact OE2-CZ 2.8Å; E996-R1000 IonicContact OE2-NH1 3.64Å; E996-R1000 PolarHBondContact OE2-NH1 2.85Å; E996-R1000 IonicContact OE2-NH2 3.58Å; E996-R1000 PolarHBondContact OE2-NH2 3.28Å; E996-R1000 VanDerWaalsContact OE2-NH2 3.09Å; R1000-G1003 PolarHBondContact O-N 2.79Å; R1000-T1004 PolarHBondContact O-N 3.3Å
1001L94.6Very high93Very high99 Ų9996.3 Ų96.352%0.51849%0.487SS..Hα-helixtrans-63.5-45.3178.3-178.366.6000111.7T997 L998 D999 G1003 T1004 L1005T997-L1001 WeakPolarHBondContact O-CB 3.17Å; T997-L1001 PolarHBondContact O-N 2.85Å; L998-L1001 PolarHBondContact O-N 3.4Å; D999-L1001 PolarHBondContact O-N 3.29Å; L1001-G1003 VanDerWaalsContact C-N 3.28Å; L1001-G1003 PolarHBondContact O-N 2.78Å; L1001-T1004 PolarHBondContact O-N 2.88Å; L1001-T1004 VanDerWaalsContact O-N 3.16Å; L1001-T1004 PolarHBondContact O-OG1 3.2Å; L1001-L1005 PolarHBondContact O-N 2.95Å; L1001-L1005 VanDerWaalsContact O-N 3.12Å
1002N92.3Very high92.9Very high97 Ų9796.7 Ų96.752%0.51949%0.489SS..Hα-helixtrans-61.5-39.4178.3-168.838.2000111.3L998 D999 T1004 L1005 V1006L998-N1002 VanDerWaalsContact O-CB 3.26Å; L998-N1002 WeakPolarHBondContact O-CB 3.41Å; L998-N1002 PolarHBondContact O-N 3.2Å; D999-N1002 PolarHBondContact O-N 2.85Å; N1002-T1004 PolarHBondContact O-N 3.38Å; N1002-L1005 PolarHBondContact O-N 3.48Å; N1002-V1006 WeakPolarHBondContact O-CG2 3.48Å; N1002-V1006 PolarHBondContact O-N 3.18Å; N1002-V1006 VanDerWaalsContact O-N 3.1Å
1003G92.9Very high92.7Very high32 Ų3295.3 Ų95.333%0.3348%0.484SS..Hα-helixtrans-54.3-50.5171.200000112.6D999 R1000 L1001 L1005 V1006 E1007D999-G1003 PolarHBondContact O-N 3.4Å; R1000-G1003 PolarHBondContact O-N 2.79Å; L1001-G1003 VanDerWaalsContact C-N 3.28Å; L1001-G1003 PolarHBondContact O-N 2.78Å; G1003-L1005 PolarHBondContact O-N 3.34Å; G1003-V1006 PolarHBondContact O-N 2.83Å; G1003-E1007 WeakPolarHBondContact O-CG 3.5Å; G1003-E1007 PolarHBondContact O-N 3.26Å; G1003-E1007 VanDerWaalsContact O-N 3.07Å
1004T92.7Very high92.5Very high65 Ų6597.4 Ų97.440%0.39949%0.488SS..Hα-helixtrans-62.1-40.8-179.958.90000113.4R1000 L1001 N1002 V1006 E1007 E1008R1000-T1004 PolarHBondContact O-N 3.3Å; L1001-T1004 PolarHBondContact O-N 2.88Å; L1001-T1004 VanDerWaalsContact O-N 3.16Å; L1001-T1004 PolarHBondContact O-OG1 3.2Å; N1002-T1004 PolarHBondContact O-N 3.38Å; T1004-V1006 VanDerWaalsContact C-N 3.34Å; T1004-V1006 PolarHBondContact O-N 3.33Å; T1004-E1007 PolarHBondContact O-N 3.11Å; T1004-E1008 WeakPolarHBondContact O-CG 3.23Å; T1004-E1008 PolarHBondContact O-N 3.28Å
1005L92.1Very high92.3Very high95 Ų9597.5 Ų97.550%0.49749%0.49SS..Hα-helixtrans-66.3-35.9177.8-70.6174.1000112.4L1001 N1002 G1003 R1009L1001-L1005 PolarHBondContact O-N 2.95Å; L1001-L1005 VanDerWaalsContact O-N 3.12Å; N1002-L1005 PolarHBondContact O-N 3.48Å; G1003-L1005 PolarHBondContact O-N 3.34Å; L1005-R1009 WeakPolarHBondContact O-CB 3.09Å; L1005-R1009 PolarHBondContact O-N 3.5Å
1006V93.9Very high92.3Very high49 Ų4999.2 Ų99.230%0.29749%0.494SS..Hα-helixtrans-66.7-41.2175.5169.80000110.9N1002 G1003 T1004 R1009 H1010N1002-V1006 WeakPolarHBondContact O-CG2 3.48Å; N1002-V1006 PolarHBondContact O-N 3.18Å; N1002-V1006 VanDerWaalsContact O-N 3.1Å; G1003-V1006 PolarHBondContact O-N 2.83Å; T1004-V1006 VanDerWaalsContact C-N 3.34Å; T1004-V1006 PolarHBondContact O-N 3.33Å; V1006-R1009 PolarHBondContact O-N 3.4Å; V1006-H1010 WeakPolarHBondContact CG1-CE1 3.35Å; V1006-H1010 PolarHBondContact O-N 2.95Å; V1006-H1010 PolarHBondContact O-ND1 2.82Å; V1006-H1010 VanDerWaalsContact O-ND1 3.1Å
1007E91.4Very high92.2Very high134 Ų13499.4 Ų99.463%0.62650%0.497SS*.Hα-helixtrans-61.6-45.3175.8-71.9175.8-178.400112.1G1003 T1004 H1010 A1011G1003-E1007 WeakPolarHBondContact O-CG 3.5Å; G1003-E1007 PolarHBondContact O-N 3.26Å; G1003-E1007 VanDerWaalsContact O-N 3.07Å; T1004-E1007 PolarHBondContact O-N 3.11Å; E1007-H1010 PolarHBondContact O-N 3.37Å; E1007-A1011 WeakPolarHBondContact O-CB 3.32Å; E1007-A1011 PolarHBondContact O-N 3.38Å
1008E90Very high92Very high122 Ų12297 Ų9757%0.5749%0.49SS*.Hα-helixtrans-61.7-43.9175.3-72.3-177.7167.600112.1T1004 H1010 A1011 L1012T1004-E1008 WeakPolarHBondContact O-CG 3.23Å; T1004-E1008 PolarHBondContact O-N 3.28Å; E1008-H1010 VanDerWaalsContact C-N 3.33Å; E1008-H1010 PolarHBondContact O-N 3.42Å; E1008-A1011 WeakPolarHBondContact O-CB 3.24Å; E1008-A1011 PolarHBondContact O-N 3.14Å; E1008-A1011 VanDerWaalsContact O-N 3.13Å; E1008-L1012 WeakPolarHBondContact O-CG 3.38Å; E1008-L1012 PolarHBondContact O-N 3.18Å
1009R92.2Very high91.7Very high145 Ų14597 Ų9755%0.54749%0.49SS..Hα-helixtrans-58-46.5175.9-167.6-172.885.9-160.13.9111.3L1005 V1006 A1011 L1012 I1013L1005-R1009 WeakPolarHBondContact O-CB 3.09Å; L1005-R1009 PolarHBondContact O-N 3.5Å; V1006-R1009 PolarHBondContact O-N 3.4Å; R1009-A1011 VanDerWaalsContact C-N 3.32Å; R1009-A1011 PolarHBondContact O-N 2.83Å; R1009-L1012 PolarHBondContact O-N 3.43Å; R1009-I1013 HydrophobicContact CG-CD1 4.21Å; R1009-I1013 VanDerWaalsContact O-CG1 3.3Å; R1009-I1013 WeakPolarHBondContact O-CG1 3.27Å; R1009-I1013 PolarHBondContact O-N 3.49Å
1010H93.3Very high91.5Very high80 Ų8095.8 Ų95.837%0.3748%0.483SS..Hα-helixtrans-65.8-34.2177.1-68.6136.7000112.5V1006 E1007 E1008 R1014V1006-H1010 WeakPolarHBondContact CG1-CE1 3.35Å; V1006-H1010 PolarHBondContact O-N 2.95Å; V1006-H1010 PolarHBondContact O-ND1 2.82Å; V1006-H1010 VanDerWaalsContact O-ND1 3.1Å; E1007-H1010 PolarHBondContact O-N 3.37Å; E1008-H1010 VanDerWaalsContact C-N 3.33Å; E1008-H1010 PolarHBondContact O-N 3.42Å; H1010-R1014 WeakPolarHBondContact O-CG 3.2Å; H1010-R1014 PolarHBondContact O-N 2.75Å; H1010-R1014 VanDerWaalsContact O-N 3.1Å; H1010-R1014 PolarHBondContact O-NE 3.03Å
1011A92Very high91.3Very high31 Ų3191.1 Ų91.126%0.25648%0.478SS..Hα-helixtrans-65.4-43175.300000112.3E1007 E1008 R1009 R1014 Q1015E1007-A1011 WeakPolarHBondContact O-CB 3.32Å; E1007-A1011 PolarHBondContact O-N 3.38Å; E1008-A1011 WeakPolarHBondContact O-CB 3.24Å; E1008-A1011 PolarHBondContact O-N 3.14Å; E1008-A1011 VanDerWaalsContact O-N 3.13Å; R1009-A1011 VanDerWaalsContact C-N 3.32Å; R1009-A1011 PolarHBondContact O-N 2.83Å; A1011-R1014 PolarHBondContact O-N 3.24Å; A1011-Q1015 WeakPolarHBondContact O-CG 3.34Å; A1011-Q1015 PolarHBondContact O-N 2.85Å
1012L92.2Very high91Very high111 Ų11192.4 Ų92.458%0.58148%0.481SS*.Hα-helixtrans-65.4-40.4176.2-71.6172.2000112.3E1008 R1009 R1014 Q1015 L1016E1008-L1012 WeakPolarHBondContact O-CG 3.38Å; E1008-L1012 PolarHBondContact O-N 3.18Å; R1009-L1012 PolarHBondContact O-N 3.43Å; L1012-R1014 PolarHBondContact O-N 2.86Å; L1012-Q1015 PolarHBondContact O-N 3.43Å; L1012-L1016 WeakPolarHBondContact O-CB 3.43Å; L1012-L1016 PolarHBondContact O-N 3.32Å
1013I93Very high90.7Very high78 Ų7892.6 Ų92.640%0.448%0.482SS..Hα-helixtrans-60.3-46.2175-68.9165.9000110.4R1009 Q1015 L1016 D1017R1009-I1013 HydrophobicContact CG-CD1 4.21Å; R1009-I1013 VanDerWaalsContact O-CG1 3.3Å; R1009-I1013 WeakPolarHBondContact O-CG1 3.27Å; R1009-I1013 PolarHBondContact O-N 3.49Å; I1013-Q1015 VanDerWaalsContact C-N 3.31Å; I1013-Q1015 PolarHBondContact O-N 3.12Å; I1013-L1016 WeakPolarHBondContact O-CB 3.16Å; I1013-L1016 PolarHBondContact O-N 2.74Å; I1013-L1016 VanDerWaalsContact O-N 3.1Å; I1013-D1017 PolarHBondContact O-N 2.97Å
1014R88.8Confident90.5Very high159 Ų15997.2 Ų97.260%0.650%0.495SS*.Hα-helixtrans-59.7-39.2176.1-78.1-178.7-98.1115-4.6113H1010 A1011 L1012 G1018H1010-R1014 WeakPolarHBondContact O-CG 3.2Å; H1010-R1014 PolarHBondContact O-N 2.75Å; H1010-R1014 VanDerWaalsContact O-N 3.1Å; H1010-R1014 PolarHBondContact O-NE 3.03Å; A1011-R1014 PolarHBondContact O-N 3.24Å; L1012-R1014 PolarHBondContact O-N 2.86Å; R1014-G1018 PolarHBondContact O-N 3.36Å; R1014-G1018 VanDerWaalsContact O-N 3.13Å
1015Q90.3Very high90.2Very high129 Ų129101.1 Ų101.160%0.60351%0.509SS*.Hα-helixtrans-66.2-40.6174.5-72.8178.62.500112A1011 L1012 I1013 G1018 L1019A1011-Q1015 WeakPolarHBondContact O-CG 3.34Å; A1011-Q1015 PolarHBondContact O-N 2.85Å; L1012-Q1015 PolarHBondContact O-N 3.43Å; I1013-Q1015 VanDerWaalsContact C-N 3.31Å; I1013-Q1015 PolarHBondContact O-N 3.12Å; Q1015-G1018 PolarHBondContact O-N 2.89Å; Q1015-L1019 PolarHBondContact O-N 3.33Å
1016L90.8Very high89.8Confident106 Ų106101.4 Ų101.456%0.55551%0.514SS*.Hα-helixtrans-62.4-46.1177.4-162.586.8000111.5L1012 I1013 G1018 L1019 L1020L1012-L1016 WeakPolarHBondContact O-CB 3.43Å; L1012-L1016 PolarHBondContact O-N 3.32Å; I1013-L1016 WeakPolarHBondContact O-CB 3.16Å; I1013-L1016 PolarHBondContact O-N 2.74Å; I1013-L1016 VanDerWaalsContact O-N 3.1Å; L1016-G1018 VanDerWaalsContact C-N 3.31Å; L1016-G1018 PolarHBondContact O-N 2.81Å; L1016-L1019 PolarHBondContact O-N 2.88Å; L1016-L1020 HydrophobicContact CD2-CD1 4.43Å; L1016-L1020 HydrophobicContact CG-CD1 4.42Å; L1016-L1020 WeakPolarHBondContact O-CG 3.31Å; L1016-L1020 PolarHBondContact O-N 3.35Å
1017D91.2Very high89.4Confident92 Ų92103.2 Ų103.249%0.49252%0.522SS..Hα-helixtrans-61.8-39.9177.2-70.2-27.9000111.5I1013 L1020 A1021I1013-D1017 PolarHBondContact O-N 2.97Å; D1017-L1020 PolarHBondContact O-N 2.88Å; D1017-A1021 WeakPolarHBondContact O-CB 3.32Å; D1017-A1021 PolarHBondContact O-N 3.27Å
1018G88.9Confident89.2Confident35 Ų35100 Ų10036%0.36151%0.514SS..Hα-helixtrans-61.6-42.7174.100000113.1R1014 Q1015 L1016 A1021 Q1022R1014-G1018 PolarHBondContact O-N 3.36Å; R1014-G1018 VanDerWaalsContact O-N 3.13Å; Q1015-G1018 PolarHBondContact O-N 2.89Å; L1016-G1018 VanDerWaalsContact C-N 3.31Å; L1016-G1018 PolarHBondContact O-N 2.81Å; G1018-A1021 PolarHBondContact O-N 2.68Å; G1018-Q1022 WeakPolarHBondContact O-CG 3.19Å; G1018-Q1022 PolarHBondContact O-N 3.11Å; G1018-Q1022 VanDerWaalsContact O-N 3.09Å
1019L88Confident88.9Confident110 Ų110101 Ų10158%0.57652%0.516SS*.Hα-helixtrans-68.2-38.9175.9-74.1172.2000112.3Q1015 L1016 Q1022 N1023Q1015-L1019 PolarHBondContact O-N 3.33Å; L1016-L1019 PolarHBondContact O-N 2.88Å; L1019-Q1022 PolarHBondContact O-N 3.43Å; L1019-N1023 WeakPolarHBondContact O-CB 3.39Å; L1019-N1023 PolarHBondContact O-N 2.85Å
1020L88.5Confident88.5Confident86 Ų8696.9 Ų96.945%0.4551%0.513SS..Hα-helixtrans-61-44.7174.3-80.7166000111.1L1016 D1017 N1023 H1024L1016-L1020 HydrophobicContact CD2-CD1 4.43Å; L1016-L1020 HydrophobicContact CG-CD1 4.42Å; L1016-L1020 WeakPolarHBondContact O-CG 3.31Å; L1016-L1020 PolarHBondContact O-N 3.35Å; D1017-L1020 PolarHBondContact O-N 2.88Å; L1020-N1023 PolarHBondContact O-N 3.34Å; L1020-H1024 PolarHBondContact O-CD2 2.8Å; L1020-H1024 PolarHBondContact O-N 2.81Å
1021A89Confident88.1Confident59 Ų5999.3 Ų99.349%0.48852%0.523SS..Hα-helixtrans-60.6-46.7176.500000112.3D1017 G1018 N1023 H1024 E1025D1017-A1021 WeakPolarHBondContact O-CB 3.32Å; D1017-A1021 PolarHBondContact O-N 3.27Å; G1018-A1021 PolarHBondContact O-N 2.68Å; A1021-N1023 VanDerWaalsContact C-N 3.3Å; A1021-N1023 PolarHBondContact O-N 3.27Å; A1021-H1024 PolarHBondContact O-N 3.38Å; A1021-E1025 PolarHBondContact O-N 3.45Å
1022Q87.4Confident87.7Confident125 Ų125103.6 Ų103.658%0.58454%0.539SS*.Hα-helixtrans-60-39.1176.2-75.4179.4-2.600112.5G1018 L1019 E1025 V1026G1018-Q1022 WeakPolarHBondContact O-CG 3.19Å; G1018-Q1022 PolarHBondContact O-N 3.11Å; G1018-Q1022 VanDerWaalsContact O-N 3.09Å; L1019-Q1022 PolarHBondContact O-N 3.43Å; Q1022-E1025 PolarHBondContact O-N 2.88Å; Q1022-V1026 WeakPolarHBondContact O-CG2 3.47Å; Q1022-V1026 PolarHBondContact O-N 3.37Å; Q1022-V1026 VanDerWaalsContact O-N 3.08Å
1023N87Confident87.2Confident101 Ų101102.3 Ų102.354%0.5453%0.533SS..Hα-helixtrans-66.2-42.1179-139-26000111.5L1019 L1020 A1021 E1025 V1026 L1027L1019-N1023 WeakPolarHBondContact O-CB 3.39Å; L1019-N1023 PolarHBondContact O-N 2.85Å; L1020-N1023 PolarHBondContact O-N 3.34Å; A1021-N1023 VanDerWaalsContact C-N 3.3Å; A1021-N1023 PolarHBondContact O-N 3.27Å; N1023-E1025 VanDerWaalsContact C-N 3.33Å; N1023-E1025 PolarHBondContact O-N 3.43Å; N1023-V1026 PolarHBondContact O-N 2.84Å; N1023-L1027 WeakPolarHBondContact O-CB 3.29Å; N1023-L1027 PolarHBondContact O-N 3.38Å
1024H86.9Confident86.6Confident130 Ų130104.5 Ų104.560%0.60254%0.54SS*.Hα-helixtrans-61.9-39174.2-77.3-56.6000112.6L1020 A1021 L1027 S1028L1020-H1024 PolarHBondContact O-CD2 2.8Å; L1020-H1024 PolarHBondContact O-N 2.81Å; A1021-H1024 PolarHBondContact O-N 3.38Å; H1024-L1027 PolarHBondContact O-N 3.29Å; H1024-S1028 WeakPolarHBondContact O-CB 3.34Å; H1024-S1028 PolarHBondContact O-N 3.39Å
1025E88Confident86.4Confident147 Ų147103.5 Ų103.569%0.68754%0.542SS*.Hα-helixtrans-66.4-43177.9-170.2164.1-174.800112.4A1021 Q1022 N1023 S1028 K1029A1021-E1025 PolarHBondContact O-N 3.45Å; Q1022-E1025 PolarHBondContact O-N 2.88Å; N1023-E1025 VanDerWaalsContact C-N 3.33Å; N1023-E1025 PolarHBondContact O-N 3.43Å; E1025-S1028 PolarHBondContact O-N 3.48Å; E1025-K1029 PolarHBondContact O-N 3.07Å
1026V82.9Confident86Confident100 Ų100104.3 Ų104.361%0.60655%0.545SS*.Hα-helixtrans-63.3-42.8174.5173.50000111.4Q1022 N1023 K1029 A1030Q1022-V1026 WeakPolarHBondContact O-CG2 3.47Å; Q1022-V1026 PolarHBondContact O-N 3.37Å; Q1022-V1026 VanDerWaalsContact O-N 3.08Å; N1023-V1026 PolarHBondContact O-N 2.84Å; V1026-K1029 PolarHBondContact O-N 3.45Å; V1026-A1030 WeakPolarHBondContact O-CB 3.29Å; V1026-A1030 PolarHBondContact O-N 2.76Å
1027L86.3Confident85.6Confident88 Ų88105.8 Ų105.846%0.46155%0.547SS..Hα-helixtrans-61.6-44.2175.7-107.5132000111.9N1023 H1024 K1029 A1030 F1031N1023-L1027 WeakPolarHBondContact O-CB 3.29Å; N1023-L1027 PolarHBondContact O-N 3.38Å; H1024-L1027 PolarHBondContact O-N 3.29Å; L1027-K1029 VanDerWaalsContact C-N 3.35Å; L1027-K1029 PolarHBondContact O-N 2.94Å; L1027-A1030 PolarHBondContact O-N 3.18Å; L1027-F1031 HydrophobicContact CD2-CD2 4.44Å; L1027-F1031 HydrophobicContact CD2-CE2 3.72Å; L1027-F1031 HydrophobicContact CD2-CZ 4.46Å; L1027-F1031 WeakPolarHBondContact O-CD2 3.36Å; L1027-F1031 PolarHBondContact O-N 2.82Å
1028S86.3Confident85Confident66 Ų66106.5 Ų106.546%0.46255%0.547SS..Hα-helixtrans-60.8-44.4177.4-176.70000111.5H1024 E1025 A1030 F1031 M1032H1024-S1028 WeakPolarHBondContact O-CB 3.34Å; H1024-S1028 PolarHBondContact O-N 3.39Å; E1025-S1028 PolarHBondContact O-N 3.48Å; S1028-A1030 PolarHBondContact O-N 2.9Å; S1028-F1031 PolarHBondContact O-N 3.49Å; S1028-M1032 PolarHBondContact O-N 3.36Å
1029K83.7Confident84.7Confident143 Ų143108.6 Ų108.662%0.62256%0.556SS**Hα-helixtrans-61.5-42.7176.2-158.5172.3-172178.50112.3E1025 V1026 L1027 F1031 M1032 D1033E1025-K1029 PolarHBondContact O-N 3.07Å; V1026-K1029 PolarHBondContact O-N 3.45Å; L1027-K1029 VanDerWaalsContact C-N 3.35Å; L1027-K1029 PolarHBondContact O-N 2.94Å; K1029-F1031 VanDerWaalsContact C-N 3.32Å; K1029-F1031 PolarHBondContact O-N 3.33Å; K1029-M1032 PolarHBondContact O-N 2.82Å; K1029-D1033 PolarHBondContact O-N 2.74Å
1030A84.8Confident84.2Confident58 Ų58108.8 Ų108.848%0.47956%0.555SS.*Hα-helixtrans-64-33.717600000113.3V1026 L1027 S1028 K1034V1026-A1030 WeakPolarHBondContact O-CB 3.29Å; V1026-A1030 PolarHBondContact O-N 2.76Å; L1027-A1030 PolarHBondContact O-N 3.18Å; S1028-A1030 PolarHBondContact O-N 2.9Å; A1030-K1034 WeakPolarHBondContact O-CB 3.48Å; A1030-K1034 PolarHBondContact O-N 2.78Å
1031F83.1Confident83.9Confident132 Ų132110.4 Ų110.458%0.57956%0.56SS**Hα-helixtrans-68.2-43.8173.2-81.5-65.1000112.1L1027 S1028 K1029 D1033 K1034 E1035L1027-F1031 HydrophobicContact CD2-CD2 4.44Å; L1027-F1031 HydrophobicContact CD2-CE2 3.72Å; L1027-F1031 HydrophobicContact CD2-CZ 4.46Å; L1027-F1031 WeakPolarHBondContact O-CD2 3.36Å; L1027-F1031 PolarHBondContact O-N 2.82Å; S1028-F1031 PolarHBondContact O-N 3.49Å; K1029-F1031 VanDerWaalsContact C-N 3.32Å; K1029-F1031 PolarHBondContact O-N 3.33Å; F1031-D1033 PolarHBondContact O-N 2.87Å; F1031-K1034 PolarHBondContact O-N 3.5Å; F1031-E1035 PolarHBondContact O-N 2.86Å; F1031-E1035 VanDerWaalsContact O-N 3.09Å
1032M85Confident83.5Confident121 Ų121114.5 Ų114.560%0.59657%0.566SS**Hα-helixtrans-60.6-44.7177.1-70.7-176.562.400112.2S1028 K1029 K1034 E1035 H1036S1028-M1032 PolarHBondContact O-N 3.36Å; K1029-M1032 PolarHBondContact O-N 2.82Å; M1032-K1034 VanDerWaalsContact C-N 3.29Å; M1032-K1034 PolarHBondContact O-N 3.45Å; M1032-E1035 PolarHBondContact O-N 3.47Å; M1032-H1036 PolarHBondContact O-N 2.91Å; M1032-H1036 VanDerWaalsContact O-N 3.12Å
1033D81.3Confident83.2Confident84 Ų84113.4 Ų113.445%0.44956%0.562SS.*Hα-helixtrans-60.8-40.8177.4-70.1-19.8000111.3K1029 F1031 H1036 F1037K1029-D1033 PolarHBondContact O-N 2.74Å; F1031-D1033 PolarHBondContact O-N 2.87Å; D1033-H1036 VanDerWaalsContact O-CB 3.3Å; D1033-H1036 WeakPolarHBondContact O-CB 3.41Å; D1033-H1036 PolarHBondContact O-N 3.36Å; D1033-F1037 HydrophobicContact CB-CE2 4.32Å; D1033-F1037 WeakPolarHBondContact O-CD2 3.4Å; D1033-F1037 PolarHBondContact O-N 3.29Å
1034K81.4Confident82.9Confident124 Ų124113.6 Ų113.654%0.53956%0.562SS.*Hα-helixtrans-66.7-38.7-179.6-160.7-178.8-178-173.70113A1030 F1031 M1032 H1036 F1037 H1038A1030-K1034 WeakPolarHBondContact O-CB 3.48Å; A1030-K1034 PolarHBondContact O-N 2.78Å; F1031-K1034 PolarHBondContact O-N 3.5Å; M1032-K1034 VanDerWaalsContact C-N 3.29Å; M1032-K1034 PolarHBondContact O-N 3.45Å; K1034-H1036 VanDerWaalsContact C-N 3.3Å; K1034-F1037 PolarHBondContact O-N 3.49Å; K1034-H1038 PolarHBondContact O-N 2.87Å; K1034-H1038 VanDerWaalsContact O-N 3.1Å
1035E83.9Confident82.7Confident138 Ų138112.7 Ų112.765%0.64556%0.558SS**Hα-helixtrans-64.6-36.8172.6-75-175.7162.200111.9F1031 M1032 H1038 S1039F1031-E1035 PolarHBondContact O-N 2.86Å; F1031-E1035 VanDerWaalsContact O-N 3.09Å; M1032-E1035 PolarHBondContact O-N 3.47Å; E1035-H1038 PolarHBondContact O-N 3.18Å; E1035-S1039 WeakPolarHBondContact O-CB 3.42Å; E1035-S1039 PolarHBondContact O-N 3.34Å; E1035-S1039 PolarHBondContact O-OG 3.11Å
1036H81.1Confident82.2Confident145 Ų145111.2 Ų111.267%0.67155%0.551SS**Hα-helixtrans-61.9-49.4174.4-120.7-65.8000111.8M1032 D1033 K1034 H1038 S1039 E1040M1032-H1036 PolarHBondContact O-N 2.91Å; M1032-H1036 VanDerWaalsContact O-N 3.12Å; D1033-H1036 VanDerWaalsContact O-CB 3.3Å; D1033-H1036 WeakPolarHBondContact O-CB 3.41Å; D1033-H1036 PolarHBondContact O-N 3.36Å; K1034-H1036 VanDerWaalsContact C-N 3.3Å; H1036-H1038 PolarHBondContact O-N 2.99Å; H1036-S1039 PolarHBondContact O-N 3.26Å; H1036-E1040 PolarHBondContact O-N 2.79Å; H1036-E1040 VanDerWaalsContact O-N 3.1Å
1037F83.3Confident82.3Confident137 Ų137111.4 Ų111.460%0.60154%0.544SS*.Hα-helixtrans-61.4-40.9177.6-73.6-61.5000112.8D1033 K1034 S1039 E1040 E1041D1033-F1037 HydrophobicContact CB-CE2 4.32Å; D1033-F1037 WeakPolarHBondContact O-CD2 3.4Å; D1033-F1037 PolarHBondContact O-N 3.29Å; K1034-F1037 PolarHBondContact O-N 3.49Å; F1037-S1039 VanDerWaalsContact C-N 3.34Å; F1037-E1040 PolarHBondContact O-N 2.81Å; F1037-E1041 WeakPolarHBondContact O-CB 3.23Å; F1037-E1041 PolarHBondContact O-N 3.17Å
1038H79Confident82Confident107 Ų107110.4 Ų110.450%0.49554%0.541SS..Hα-helixtrans-66.5-35.8176.7-81.7-13.7000113.1K1034 E1035 H1036 E1040 E1041 K1042K1034-H1038 PolarHBondContact O-N 2.87Å; K1034-H1038 VanDerWaalsContact O-N 3.1Å; E1035-H1038 PolarHBondContact O-N 3.18Å; H1036-H1038 PolarHBondContact O-N 2.99Å; H1038-E1040 VanDerWaalsContact C-N 3.35Å; H1038-E1041 IonicContact ND1-OE2 3.92Å; H1038-K1042 WeakPolarHBondContact O-CB 3.23Å; H1038-K1042 PolarHBondContact O-N 2.85Å; H1038-K1042 VanDerWaalsContact O-N 3.1Å
1039S80.8Confident81.7Confident79 Ų79110.3 Ų110.355%0.55254%0.535SS*.Hα-helixtrans-64.3-43176.2-59.20000111E1035 H1036 F1037 K1042 E1043E1035-S1039 WeakPolarHBondContact O-CB 3.42Å; E1035-S1039 PolarHBondContact O-N 3.34Å; E1035-S1039 PolarHBondContact O-OG 3.11Å; H1036-S1039 PolarHBondContact O-N 3.26Å; F1037-S1039 VanDerWaalsContact C-N 3.34Å; S1039-K1042 PolarHBondContact O-N 3.29Å; S1039-E1043 PolarHBondContact O-N 2.85Å
1040E79.3Confident81.5Confident115 Ų115109.2 Ų109.254%0.53753%0.532SS..Hα-helixtrans-68.2-42.2178.5-153.7175.8-151.500112.4H1036 F1037 H1038 K1042 E1043 L1044H1036-E1040 PolarHBondContact O-N 2.79Å; H1036-E1040 VanDerWaalsContact O-N 3.1Å; F1037-E1040 PolarHBondContact O-N 2.81Å; H1038-E1040 VanDerWaalsContact C-N 3.35Å; E1040-K1042 VanDerWaalsContact C-N 3.33Å; E1040-K1042 PolarHBondContact O-N 3.44Å; E1040-E1043 PolarHBondContact O-N 3.41Å; E1040-L1044 PolarHBondContact O-N 2.91Å; E1040-L1044 VanDerWaalsContact O-N 3.1Å
1041E81.1Confident81.2Confident119 Ų119111.9 Ų111.956%0.55654%0.538SS*.Hα-helixtrans-59-43174.7-176.3178.3-170.300111.7F1037 H1038 E1043 L1044 Q1045F1037-E1041 WeakPolarHBondContact O-CB 3.23Å; F1037-E1041 PolarHBondContact O-N 3.17Å; H1038-E1041 IonicContact ND1-OE2 3.92Å; E1041-E1043 VanDerWaalsContact C-N 3.32Å; E1041-E1043 PolarHBondContact O-N 2.71Å; E1041-L1044 PolarHBondContact O-N 3.14Å; E1041-Q1045 WeakPolarHBondContact O-CB 3.39Å; E1041-Q1045 PolarHBondContact O-N 3.15Å
1042K81.8Confident81Confident145 Ų145111.9 Ų111.963%0.6354%0.538SS*.Hα-helixtrans-63.4-39.4179.7-155.8179.5-175.1-175.20111.8H1038 S1039 E1040 Q1045 E1046H1038-K1042 WeakPolarHBondContact O-CB 3.23Å; H1038-K1042 PolarHBondContact O-N 2.85Å; H1038-K1042 VanDerWaalsContact O-N 3.1Å; S1039-K1042 PolarHBondContact O-N 3.29Å; E1040-K1042 VanDerWaalsContact C-N 3.33Å; E1040-K1042 PolarHBondContact O-N 3.44Å; K1042-Q1045 PolarHBondContact O-N 2.7Å; K1042-E1046 PolarHBondContact O-N 3.36Å; K1042-E1046 VanDerWaalsContact O-N 3.08Å
1043E80Confident80.7Confident103 Ų103113.8 Ų113.848%0.48154%0.538SS..Hα-helixtrans-66.7-41177.8-142.5-158.6130.200112.1S1039 E1040 E1041 K1047S1039-E1043 PolarHBondContact O-N 2.85Å; E1040-E1043 PolarHBondContact O-N 3.41Å; E1041-E1043 VanDerWaalsContact C-N 3.32Å; E1041-E1043 PolarHBondContact O-N 2.71Å; E1043-K1047 WeakPolarHBondContact O-CG 3.29Å; E1043-K1047 PolarHBondContact O-N 3.18Å; E1043-K1047 IonicContact OE1-NZ 3.99Å; E1043-K1047 PolarHBondContact OE1-NZ 2.9Å
1044L81.1Confident80.5Confident104 Ų104115.9 Ų115.955%0.54555%0.545SS..Hα-helixtrans-67.2-39.7174.4-70.1174.8000112E1040 E1041 E1046 K1047 V1048E1040-L1044 PolarHBondContact O-N 2.91Å; E1040-L1044 VanDerWaalsContact O-N 3.1Å; E1041-L1044 PolarHBondContact O-N 3.14Å; L1044-E1046 VanDerWaalsContact C-N 3.32Å; L1044-E1046 PolarHBondContact O-N 3.48Å; L1044-K1047 PolarHBondContact O-N 2.86Å; L1044-V1048 WeakPolarHBondContact O-CG2 3.21Å; L1044-V1048 PolarHBondContact O-N 3Å
1045Q81.9Confident80.4Confident111 Ų111115.9 Ų115.952%0.51955%0.545SS..Hα-helixtrans-61.7-40.2177.4-164.175.7-11.600111.7E1041 K1042 V1048 N1049E1041-Q1045 WeakPolarHBondContact O-CB 3.39Å; E1041-Q1045 PolarHBondContact O-N 3.15Å; K1042-Q1045 PolarHBondContact O-N 2.7Å; Q1045-V1048 PolarHBondContact O-N 2.79Å; Q1045-N1049 VanDerWaalsContact O-CG 3.28Å; Q1045-N1049 PolarHBondContact O-N 3.44Å; Q1045-N1049 PolarHBondContact O-ND2 2.84Å
1046E79.1Confident80.1Confident117 Ų117115 Ų11555%0.54754%0.541SS..Hα-helixtrans-63.5-42.6174.5-76.7179.6179.800112.4K1042 L1044 V1048 N1049 Q1050K1042-E1046 PolarHBondContact O-N 3.36Å; K1042-E1046 VanDerWaalsContact O-N 3.08Å; L1044-E1046 VanDerWaalsContact C-N 3.32Å; L1044-E1046 PolarHBondContact O-N 3.48Å; E1046-V1048 PolarHBondContact O-N 2.88Å; E1046-N1049 PolarHBondContact O-N 3.37Å; E1046-Q1050 PolarHBondContact O-N 3.19Å
1047K83.1Confident79.8Confident104 Ų104114.8 Ų114.845%0.45254%0.538SS..Hα-helixtrans-61.2-42.9175.4-71.2168.9-173.6159.10112E1043 L1044 Q1050 L1051E1043-K1047 WeakPolarHBondContact O-CG 3.29Å; E1043-K1047 PolarHBondContact O-N 3.18Å; E1043-K1047 IonicContact OE1-NZ 3.99Å; E1043-K1047 PolarHBondContact OE1-NZ 2.9Å; L1044-K1047 PolarHBondContact O-N 2.86Å; K1047-Q1050 PolarHBondContact O-N 2.84Å; K1047-L1051 PolarHBondContact O-N 3.39Å; K1047-L1051 VanDerWaalsContact O-N 3.1Å
1048V81.8Confident79.4Confident66 Ų66113.3 Ų113.340%0.454%0.536SS..Hα-helixtrans-63.9-42176.1170.40000111.7L1044 Q1045 E1046 Q1050 L1051 K1052L1044-V1048 WeakPolarHBondContact O-CG2 3.21Å; L1044-V1048 PolarHBondContact O-N 3Å; Q1045-V1048 PolarHBondContact O-N 2.79Å; E1046-V1048 PolarHBondContact O-N 2.88Å; V1048-Q1050 VanDerWaalsContact C-N 3.33Å; V1048-Q1050 PolarHBondContact O-N 3.32Å; V1048-L1051 PolarHBondContact O-N 2.74Å; V1048-K1052 PolarHBondContact O-N 3.32Å
1049N79.9Confident79Confident64 Ų64112.3 Ų112.334%0.34253%0.532SS..Hα-helixtrans-65.7-35.5178.8-73.6-29.3000112.4Q1045 E1046 K1052 R1053Q1045-N1049 VanDerWaalsContact O-CG 3.28Å; Q1045-N1049 PolarHBondContact O-N 3.44Å; Q1045-N1049 PolarHBondContact O-ND2 2.84Å; E1046-N1049 PolarHBondContact O-N 3.37Å; N1049-K1052 PolarHBondContact O-N 2.81Å; N1049-R1053 WeakPolarHBondContact O-CG 3.41Å; N1049-R1053 PolarHBondContact O-N 2.82Å; N1049-R1053 VanDerWaalsContact O-N 3.07Å
1050Q79.3Confident78.4Confident121 Ų121114.2 Ų114.257%0.56553%0.532SS*.Hα-helixtrans-64.8-44.5171.9-86.6166.4-14.500112.4E1046 K1047 V1048 K1052 R1053 Q1054E1046-Q1050 PolarHBondContact O-N 3.19Å; K1047-Q1050 PolarHBondContact O-N 2.84Å; V1048-Q1050 VanDerWaalsContact C-N 3.33Å; V1048-Q1050 PolarHBondContact O-N 3.32Å; Q1050-K1052 VanDerWaalsContact C-N 3.34Å; Q1050-K1052 PolarHBondContact O-N 3.35Å; Q1050-R1053 PolarHBondContact O-N 3.16Å; Q1050-Q1054 WeakPolarHBondContact O-CG 3.31Å; Q1050-Q1054 PolarHBondContact O-N 2.78Å
1051L78.8Confident78.2Confident113 Ų113115.7 Ų115.759%0.59254%0.537SS*.Hα-helixtrans-62.6-40.1175.4-72.7172.8000112.2K1047 V1048 Q1054 K1055K1047-L1051 PolarHBondContact O-N 3.39Å; K1047-L1051 VanDerWaalsContact O-N 3.1Å; V1048-L1051 PolarHBondContact O-N 2.74Å; L1051-Q1054 PolarHBondContact O-N 3.45Å; L1051-K1055 WeakPolarHBondContact O-CB 3.25Å; L1051-K1055 PolarHBondContact O-N 3.42Å
1052K79Confident77.5Confident133 Ų133114.3 Ų114.358%0.57853%0.532SS*.Hα-helixtrans-60.5-45.6174.2-81.5-177.2177.4176.70112.3V1048 N1049 Q1050 Q1054 K1055 E1056V1048-K1052 PolarHBondContact O-N 3.32Å; N1049-K1052 PolarHBondContact O-N 2.81Å; Q1050-K1052 VanDerWaalsContact C-N 3.34Å; Q1050-K1052 PolarHBondContact O-N 3.35Å; K1052-Q1054 VanDerWaalsContact C-N 3.29Å; K1052-Q1054 PolarHBondContact O-N 2.85Å; K1052-K1055 WeakPolarHBondContact O-CB 3.42Å; K1052-K1055 PolarHBondContact O-N 2.76Å; K1052-E1056 WeakPolarHBondContact O-CB 3.41Å; K1052-E1056 PolarHBondContact O-N 2.82Å
1053R77.3Confident76.5Confident160 Ų160113.7 Ų113.760%0.60453%0.533SS*.Hα-helixtrans-63.7-33.8176-72.8175.7-178.3141.6-1.1112.6N1049 Q1050 K1057N1049-R1053 WeakPolarHBondContact O-CG 3.41Å; N1049-R1053 PolarHBondContact O-N 2.82Å; N1049-R1053 VanDerWaalsContact O-N 3.07Å; Q1050-R1053 PolarHBondContact O-N 3.16Å; R1053-K1057 VanDerWaalsContact O-CG 3.32Å; R1053-K1057 WeakPolarHBondContact O-CG 3.17Å; R1053-K1057 PolarHBondContact O-N 2.84Å
1054Q78.3Confident75.4Confident129 Ų129115.7 Ų115.760%0.60354%0.542SS*.Hα-helixtrans-71-40173.9-73.8-168.5-14.600112Q1050 L1051 K1052 K1057 L1058Q1050-Q1054 WeakPolarHBondContact O-CG 3.31Å; Q1050-Q1054 PolarHBondContact O-N 2.78Å; L1051-Q1054 PolarHBondContact O-N 3.45Å; K1052-Q1054 VanDerWaalsContact C-N 3.29Å; K1052-Q1054 PolarHBondContact O-N 2.85Å; Q1054-K1057 PolarHBondContact O-N 3.39Å; Q1054-L1058 WeakPolarHBondContact O-CG 3.41Å; Q1054-L1058 PolarHBondContact O-N 2.96Å
1055K79.3Confident74.2Confident123 Ų123118 Ų11854%0.53555%0.55SS.*Hα-helixtrans-61.5-47.6174-177.8178.9-175.5-89.40111.6L1051 K1052 K1057 L1058 E1059L1051-K1055 WeakPolarHBondContact O-CB 3.25Å; L1051-K1055 PolarHBondContact O-N 3.42Å; K1052-K1055 WeakPolarHBondContact O-CB 3.42Å; K1052-K1055 PolarHBondContact O-N 2.76Å; K1055-K1057 VanDerWaalsContact C-N 3.31Å; K1055-K1057 PolarHBondContact O-N 2.91Å; K1055-L1058 WeakPolarHBondContact O-CB 3.32Å; K1055-L1058 PolarHBondContact O-N 3.47Å; K1055-E1059 WeakPolarHBondContact CE-OE1 3.27Å; K1055-E1059 IonicContact NZ-OE1 3.86Å; K1055-E1059 PolarHBondContact NZ-OE1 3.44Å; K1055-E1059 IonicContact NZ-OE2 2.61Å; K1055-E1059 PolarHBondContact O-N 2.81Å
1056E77.6Confident73Confident119 Ų119121.5 Ų121.556%0.55656%0.56SS**Hα-helixtrans-57.9-42.9178.7-172.8173.5-154.700111.8K1052 L1058 E1059 E1060K1052-E1056 WeakPolarHBondContact O-CB 3.41Å; K1052-E1056 PolarHBondContact O-N 2.82Å; E1056-L1058 VanDerWaalsContact C-N 3.28Å; E1056-L1058 PolarHBondContact O-N 2.75Å; E1056-E1059 PolarHBondContact O-N 3.24Å; E1056-E1060 PolarHBondContact O-N 2.96Å
1057K74.8Confident72.1Confident141 Ų141124.8 Ų124.861%0.61357%0.573SS**Hα-helixtrans-65.1-27.4174.7-73.3177.4179.2-173.30114.1R1053 Q1054 K1055 K1061R1053-K1057 VanDerWaalsContact O-CG 3.32Å; R1053-K1057 WeakPolarHBondContact O-CG 3.17Å; R1053-K1057 PolarHBondContact O-N 2.84Å; Q1054-K1057 PolarHBondContact O-N 3.39Å; K1055-K1057 VanDerWaalsContact C-N 3.31Å; K1055-K1057 PolarHBondContact O-N 2.91Å; K1057-K1061 WeakPolarHBondContact O-CG 3.5Å
1058L73.1Confident70.7Confident106 Ų106127 Ų12756%0.55559%0.587SS**Hα-helixtrans-80-37.3174-72.3170.4000111.2Q1054 K1055 E1056 K1061 I1062Q1054-L1058 WeakPolarHBondContact O-CG 3.41Å; Q1054-L1058 PolarHBondContact O-N 2.96Å; K1055-L1058 WeakPolarHBondContact O-CB 3.32Å; K1055-L1058 PolarHBondContact O-N 3.47Å; E1056-L1058 VanDerWaalsContact C-N 3.28Å; E1056-L1058 PolarHBondContact O-N 2.75Å; L1058-K1061 PolarHBondContact O-N 3.48Å; L1058-I1062 WeakPolarHBondContact O-CG1 3.22Å; L1058-I1062 PolarHBondContact O-N 3.33Å; L1058-I1062 VanDerWaalsContact O-N 3.09Å
1059E70.9Confident68.6Low86 Ų86132 Ų13240%0.40261%0.609SS.*Hα-helixtrans-64.5-40.2174.4-73.5177.5174.700111.7K1055 E1056 K1061 I1062 M1063K1055-E1059 WeakPolarHBondContact CE-OE1 3.27Å; K1055-E1059 IonicContact NZ-OE1 3.86Å; K1055-E1059 PolarHBondContact NZ-OE1 3.44Å; K1055-E1059 IonicContact NZ-OE2 2.61Å; K1055-E1059 PolarHBondContact O-N 2.81Å; E1056-E1059 PolarHBondContact O-N 3.24Å; E1059-K1061 VanDerWaalsContact C-N 3.34Å; E1059-K1061 PolarHBondContact O-N 2.79Å; E1059-I1062 PolarHBondContact O-N 3.36Å; E1059-M1063 WeakPolarHBondContact O-CB 3.2Å; E1059-M1063 WeakPolarHBondContact O-CG 3.41Å; E1059-M1063 PolarHBondContact O-N 2.88Å
1060E68.7Low66.2Low120 Ų120137.6 Ų137.656%0.56163%0.633SS**Hα-helixtrans-56.5-46.7171.9-86.8-174.4146.300112E1056 I1062 M1063 E1064E1056-E1060 PolarHBondContact O-N 2.96Å; E1060-I1062 VanDerWaalsContact C-N 3.3Å; E1060-I1062 PolarHBondContact O-N 2.75Å; E1060-M1063 PolarHBondContact O-N 2.82Å; E1060-E1064 PolarHBondContact O-N 2.79Å
1061K74.5Confident63.7Low146 Ų146136.9 Ų136.964%0.63564%0.641SS**Hα-helixtrans-62.9-35.4178.7-73.6179.1178.4-1750113.2K1057 L1058 E1059K1057-K1061 WeakPolarHBondContact O-CG 3.5Å; L1058-K1061 PolarHBondContact O-N 3.48Å; E1059-K1061 VanDerWaalsContact C-N 3.34Å; E1059-K1061 PolarHBondContact O-N 2.79Å
1062I66.7Low61.4Low90 Ų90136.4 Ų136.446%0.46265%0.645SS.*Hα-helixtrans-76.5-42.8178.2-66.7167.9000110L1058 E1059 E1060 E1064 Q1065 Y1066L1058-I1062 WeakPolarHBondContact O-CG1 3.22Å; L1058-I1062 PolarHBondContact O-N 3.33Å; L1058-I1062 VanDerWaalsContact O-N 3.09Å; E1059-I1062 PolarHBondContact O-N 3.36Å; E1060-I1062 VanDerWaalsContact C-N 3.3Å; E1060-I1062 PolarHBondContact O-N 2.75Å; I1062-E1064 VanDerWaalsContact C-N 3.31Å; I1062-E1064 PolarHBondContact O-N 3.43Å; I1062-Q1065 WeakPolarHBondContact O-CB 3.46Å; I1062-Q1065 PolarHBondContact O-N 3.35Å; I1062-Y1066 HydrophobicContact CG2-CD2 3.81Å; I1062-Y1066 HydrophobicContact CG2-CE2 3.77Å; I1062-Y1066 WeakPolarHBondContact O-CD2 3.31Å; I1062-Y1066 PolarHBondContact O-N 3.46Å
1063M60.9Low58.9Low131 Ų131139.3 Ų139.365%0.64566%0.657SS**Hα-helixtrans-66.5-30.7179.6-73.3-155.4-63.900112.8E1059 E1060 Q1065 Y1066 K1067E1059-M1063 WeakPolarHBondContact O-CB 3.2Å; E1059-M1063 WeakPolarHBondContact O-CG 3.41Å; E1059-M1063 PolarHBondContact O-N 2.88Å; E1060-M1063 PolarHBondContact O-N 2.82Å; M1063-Q1065 VanDerWaalsContact C-N 3.29Å; M1063-Q1065 PolarHBondContact O-N 3.22Å; M1063-Y1066 PolarHBondContact O-N 3.48Å; M1063-K1067 PolarHBondContact O-N 2.91Å
1064E58Low56.4Low146 Ų146143.3 Ų143.368%0.68267%0.673SS**Hα-helixtrans-64.4-31.9170.6-92.7173.8155.200113E1060 I1062E1060-E1064 PolarHBondContact O-N 2.79Å; I1062-E1064 VanDerWaalsContact C-N 3.31Å; I1062-E1064 PolarHBondContact O-N 3.43Å
1065Q54.6Low53.9Low151 Ų151147 Ų14771%0.70669%0.686SS**Hα-helixtrans-72.7-35.2174.2-79.9-169.2-31.700113.3I1062 M1063I1062-Q1065 WeakPolarHBondContact O-CB 3.46Å; I1062-Q1065 PolarHBondContact O-N 3.35Å; M1063-Q1065 VanDerWaalsContact C-N 3.29Å; M1063-Q1065 PolarHBondContact O-N 3.22Å
1066Y56.6Low51.4Low186 Ų186149.8 Ų149.873%0.72970%0.702SS**Hα-helixtrans-81.8-9.7-178-80.2-79.8000114.4I1062 M1063 I1068I1062-Y1066 HydrophobicContact CG2-CD2 3.81Å; I1062-Y1066 HydrophobicContact CG2-CE2 3.77Å; I1062-Y1066 WeakPolarHBondContact O-CD2 3.31Å; I1062-Y1066 PolarHBondContact O-N 3.46Å; M1063-Y1066 PolarHBondContact O-N 3.48Å; Y1066-I1068 VanDerWaalsContact C-N 3.29Å; Y1066-I1068 PolarHBondContact O-N 2.74Å
1067K60.9Low49Very low186 Ų186155.6 Ų155.681%0.80972%0.718SS**THydrogen-bonded Turntrans-78.7-4.2-177.1-161.3171.8178.1-177.40114.7M1063M1063-K1067 PolarHBondContact O-N 2.91Å
1068I53.3Low46.8Very low149 Ų149158.1 Ų158.176%0.76473%0.732SS**THydrogen-bonded Turntrans-88-3.9-173-65.1171.2000113.8Y1066Y1066-I1068 VanDerWaalsContact C-N 3.29Å; Y1066-I1068 PolarHBondContact O-N 2.74Å
1069M38.8Very low44.7Very low171 Ų171157.4 Ų157.484%0.84274%0.742SS**SBendtrans-137.2111.7179.6-152.5111.263.400113.1
1070E29.1Very low42.8Very low183 Ų183162 Ų16286%0.85576%0.761SS**  trans13.5117.7167.8-72.2178.1141.800124.1
1071S26.9Very low40.7Very low105 Ų105162.9 Ų162.973%0.73477%0.767SS**  34.8145.6104.9166.70000120.9
1072P30.6Very low38.4Very low104 Ų104165 Ų16568%0.67578%0.776SS**  cis-147.1167.5-13.642.5-22.1000118.7
1073K25.5Very low36.6Very low193 Ų193172 Ų17284%0.83980%0.797SS**  trans74.2120151.4-46-154.1-180172.40123.1
1074R26.1Very low35Very low244 Ų244171.1 Ų171.192%0.92181%0.81SS**  151.5112.6123.3-87.9176.4167150.4-4.1110.1
1075K25.5Very low33.8Very low206 Ų206168.7 Ų168.790%0.89682%0.815SS**  52.9111.180.8-103.5-176.7179.5177.90114.7
1076E25.9Very low32.5Very low182 Ų182172 Ų17285%0.8583%0.827SS**  trans149.6104.4140.8-163.2157.8-151.400112
1077R27Very low31.2Very low241 Ų241167 Ų16791%0.90982%0.824SS**  48.8114.8103.9-62.2-174.1174.4-158.9-1116.9
1078Q29.8Very low29.6Very low194 Ų194167.4 Ų167.491%0.90783%0.826SS**  trans-159.4139.2137-152166.1900112.6
1079A28.7Very low28.3Very low92 Ų92167 Ų16776%0.7682%0.824SS**  trans-100.1137.6173.200000110.3
1080F30.2Very low28.1Very low182 Ų182165 Ų16580%0.79882%0.824SS**  trans-139.798.6164.6-147.4-92.3000106.7
1081M24.9Very low28Very low138 Ų138167.6 Ų167.668%0.6883%0.826SS**  66.4101.2101.7-88-159.2-77.400117.4
1082K26.8Very low28.2Very low190 Ų190166.9 Ų166.983%0.82683%0.826SS**  47.5138.3117.4-71.5-178178.2176.60121.5
1083R28.2Very low28.2Very low238 Ų238166.7 Ų166.790%0.89883%0.827SS**  trans95.199.7146.6-77.9169.8175.7166.6-2.1119.2
1084A28.5Very low28.4Very low113 Ų113164.2 Ų164.293%0.93482%0.822SS**  trans-160.872.813200000109.1
1085A30.8Very low28.8Very low94 Ų94164.3 Ų164.378%0.77782%0.823SS**SBendtrans-129.8124165.500000107.2
1086K28Very low28.8Very low221 Ų221163.3 Ų163.396%0.96182%0.819SS**  trans58.385.5159.8-125.5126.4171.6176.90115.1
1087A29.5Very low29.2Very low81 Ų81161.8 Ų161.867%0.66982%0.822SS**  trans-129.8121.2166.600000108.5
1088F26.8Very low29.3Very low195 Ų195158.2 Ų158.286%0.85581%0.813SS**  trans57.8108.5158.7-59.5-81.8000118.2
1089I27.4Very low29.5Very low141 Ų141154.3 Ų154.372%0.72381%0.807SS**  49.8117.461.5-52.5-179000113.2
1090P34.1Very low29.5Very low128 Ų128159.8 Ų159.883%0.83181%0.808SS**  -127.1100.7115.132-20.4000111.4
1091R27.3Very low29.8Very low238 Ų238156.2 Ų156.290%0.89880%0.803SS**  trans-109.682.8138.3-89.7-176.1160.8171.9-4.5105.6
1092A30.8Very low29.9Very low89 Ų89158.2 Ų158.274%0.73682%0.815SS**  trans-76.9116.4148.300000105.1
1093S29.5Very low30Very low100 Ų100157.3 Ų157.370%0.69981%0.814SS**  50.799.675.5-164.10000111.1
1094L30.6Very low30Very low142 Ų142150.8 Ų150.874%0.74381%0.805SS**  162.6118.4106.7-146.170.1000112.2
1095R33.7Very low30Very low246 Ų246150.9 Ų150.993%0.92880%0.799SS**  trans145.889.5157.4-84.5-173.6-144.7-157.77.9105.2
1096K26.1Very low29.9Very low185 Ų185150 Ų15080%0.80479%0.792SS**  52.177.652.6-95.5-171.4-177.4179.30112.4
1097T34.5Very low30.1Very low150 Ų150148 Ų14892%0.9279%0.786SS**  -120.9126.6125.851.40000107.1
1098K28.7Very low30Very low166 Ų166150.8 Ų150.872%0.72279%0.79SS**  trans-132.4110.4-174.6174.3176.8178.61780106.6
1099S33.5Very low30.2Very low112 Ų112147 Ų14778%0.78379%0.787SS**  trans-157.695.2153.448.60000103
1100R30.3Very low30.4Very low206 Ų206146.8 Ų146.878%0.77779%0.793SS**  36.8137.873.9-88.1-161.4179.9-155.8-1113.5
1101P36.1Very low30.4Very low107 Ų107147 Ų14770%0.69579%0.791SS**  cis-137.6160.8-33.931-10.9000113.6E1103P1101-E1103 PolarHBondContact O-N 3.35Å
1102L27.4Very low30.6Very low180 Ų180141.2 Ų141.294%0.94279%0.787SS**  trans-66.1117.7166-155.275.6000109.1
1103E27.7Very low30.8Very low171 Ų171140.4 Ų140.480%0.79978%0.781SS**  trans-141.491.8168.6-163.5163.6-152.900103.2P1101P1101-E1103 PolarHBondContact O-N 3.35Å
1104S29.2Very low31Very low102 Ų102143.1 Ų143.171%0.71379%0.788SS**  59.4131.683.274.50000114.4
1105S27.1Very low31.2Very low114 Ų114146.1 Ų146.180%0.79780%0.798SS**  trans87.1100.2171.5-139.30000113.9
1106A28.8Very low31.3Very low77 Ų77139.9 Ų139.964%0.63679%0.792SS**  64109.564.800000112.2
1107E32.1Very low31.6Very low178 Ų178134.7 Ų134.783%0.83279%0.791SS**  trans85.9141.8138.4-63.8173.9-172.400120.2
1108D27.9Very low31.2Very low140 Ų140136.2 Ų136.275%0.74979%0.785SS**  trans75.9100.1163.1-68.7-15.1000120.4
1109S32.4Very low31.6Very low114 Ų114137 Ų13780%0.79779%0.791SS**  -155.692.9128.8-69.80000109.5V1111S1109-V1111 PolarHBondContact O-N 3.46Å
1110T30.6Very low31.3Very low137 Ų137135.1 Ų135.184%0.8478%0.775SS**  trans-53.4121.6149.132.50000109.5
1111V34.9Very low31.4Very low132 Ų132132.1 Ų132.180%0.877%0.774SS**  trans-122.798.5157.4179.70000107.1S1109S1109-V1111 PolarHBondContact O-N 3.46Å
1112S30.4Very low31.2Very low117 Ų117132.2 Ų132.282%0.81878%0.778SS**  trans-69.2131.2149.4176.50000108.1
1113A35.6Very low31.5Very low73 Ų73126.7 Ų126.760%0.60376%0.764SS**  trans169.9102.3147.300000108.6
1114D33.9Very low31.6Very low157 Ų157124.5 Ų124.584%0.8477%0.766SS**  -174.574.4128.6-89.2-16.1000108.5
1115E33.6Very low31.6Very low204 Ų204127.3 Ų127.395%0.95377%0.773SS**  trans-119.4107.6143.8-82.9-145.215800107.5
1116S37.2Very low31.7Very low115 Ų115124.8 Ų124.880%0.80477%0.765SS**  trans-149116.5159.266.40000107.6
1117G32.7Very low32Very low77 Ų77127.4 Ų127.479%0.79477%0.773SS**  trans16847.7179.700000115.1H1119G1117-H1119 PolarHBondContact O-N 2.79Å
1118F25.8Very low31.9Very low182 Ų182124.5 Ų124.580%0.79877%0.773SS**  trans-76.3107.3170.3-175.2-111000109.9T1120F1118-T1120 HydrophobicContact CD1-CG2 3.39Å; F1118-T1120 HydrophobicContact CD2-CG2 4.38Å; F1118-T1120 HydrophobicContact CE1-CG2 2.96Å; F1118-T1120 HydrophobicContact CE2-CG2 4.03Å; F1118-T1120 HydrophobicContact CG-CG2 4.1Å; F1118-T1120 HydrophobicContact CZ-CG2 3.32Å
1119H36.6Very low32Very low182 Ų182121.7 Ų121.784%0.84378%0.777SS**  trans-126.393.8151-75.8-65.6000105G1117G1117-H1119 PolarHBondContact O-N 2.79Å
1120T27.8Very low31.8Very low73 Ų73125.6 Ų125.645%0.44878%0.78SS.*  41.6131.783.264.60000117.2F1118F1118-T1120 HydrophobicContact CD1-CG2 3.39Å; F1118-T1120 HydrophobicContact CD2-CG2 4.38Å; F1118-T1120 HydrophobicContact CE1-CG2 2.96Å; F1118-T1120 HydrophobicContact CE2-CG2 4.03Å; F1118-T1120 HydrophobicContact CG-CG2 4.1Å; F1118-T1120 HydrophobicContact CZ-CG2 3.32Å
1121N31.3Very low31.9Very low142 Ų142126.3 Ų126.376%0.75978%0.776SS**  trans94.788.8154-72.514.7000119.1
1122S32.9Very low31.7Very low110 Ų110126.5 Ų126.577%0.76977%0.773SS**  55.5100.5106.669.70000118.7
1123G33Very low31.5Very low63 Ų63126 Ų12665%0.64977%0.77SS**  -156.9109.5129.800000106.1
1124C30.4Very low31.3Very low125 Ų125128.8 Ų128.885%0.84578%0.779SS**  47.913374.388.60000111.1
1125D28.3Very low31.1Very low161 Ų161129.3 Ų129.386%0.86178%0.781SS**  cis-170.9159-6.4-146.3-18.9000105.5
1126G28.8Very low30.9Very low61 Ų61128.8 Ų128.863%0.62978%0.778SS**  trans26.7114.215900000122.8
1127T35.6Very low30.6Very low132 Ų132130.5 Ų130.581%0.8178%0.778SS**  -156.7103.4108.448.10000107.1
1128S29.6Very low30.5Very low118 Ų118131.6 Ų131.683%0.82577%0.774SS**  58.1122.883.470.90000113.9
1129G30Very low30.7Very low80 Ų80126.2 Ų126.283%0.82577%0.77SS**  trans140.968.4163.700000116
1130K28.5Very low30.4Very low197 Ų197129.3 Ų129.386%0.85777%0.774SS**  trans-50.1150.9160.8-67.3166.4173.61740110.8
1131I33.4Very low30.5Very low151 Ų151134.2 Ų134.277%0.77479%0.79SS**  -177.7115.2119.2-86.1151.5000110.5
1132N30.4Very low30.4Very low136 Ų136134 Ų13473%0.72779%0.794SS**  trans55.8104.5140.1-57.1-8.7000122.1
1133S26.2Very low30.5Very low108 Ų108134.3 Ų134.376%0.75579%0.786SS**  trans-53.8130130.352.80000112.4
1134T31.3Very low30.4Very low130 Ų130142.1 Ų142.180%0.79880%0.796SS**  trans174.4105.4131.730.20000109.3
1135L29.9Very low30.4Very low169 Ų169148 Ų14889%0.88580%0.801SS**  trans-161.592.9152.3-123.2147.6000109.8
1136H29.1Very low30.9Very low193 Ų193146.1 Ų146.189%0.89480%0.797SS**  trans-127.2101.2156.1-121.7-75.2000104.4
1137D31.2Very low31Very low150 Ų150153.2 Ų153.280%0.80281%0.811SS**  trans-139.7136.4157-162.59.4000109
1138S30.6Very low30.9Very low100 Ų100155.4 Ų155.470%0.69981%0.814SS**  trans-129.6117.3-166.6460000106.7
1139G29.8Very low31.2Very low70 Ų70155.5 Ų155.572%0.72281%0.812SS**  trans153.8117.1160.600000116.8
1140R29.7Very low31.2Very low246 Ų246161.5 Ų161.593%0.92882%0.815SS**  trans72.7114.5150.5-54.5178.4-169.2-112.61.1116.8
1141F30Very low31.7Very low176 Ų176161.1 Ų161.177%0.77282%0.819SS**  -167.2123.1103.3-148.8-117.6000110.5D1143F1141-D1143 HydrophobicContact CD1-CB 3.99Å; F1141-D1143 HydrophobicContact CE1-CB 3.69Å; F1141-D1143 WeakPolarHBondContact CE1-OD2 3.21Å; F1141-D1143 VanDerWaalsContact CZ-OD2 3.24Å; F1141-D1143 WeakPolarHBondContact CZ-OD2 3.31Å
1142V29.1Very low31.7Very low139 Ų139157.6 Ų157.684%0.84282%0.82SS**  trans-104.6112.7168.3167.90000105.1
1143D35.8Very low31.7Very low115 Ų115159.3 Ų159.362%0.61583%0.828SS**  trans-142.6101.8162.3-105.8-25.1000111.8F1141F1141-D1143 HydrophobicContact CD1-CB 3.99Å; F1141-D1143 HydrophobicContact CE1-CB 3.69Å; F1141-D1143 WeakPolarHBondContact CE1-OD2 3.21Å; F1141-D1143 VanDerWaalsContact CZ-OD2 3.24Å; F1141-D1143 WeakPolarHBondContact CZ-OD2 3.31Å
1144R31.8Very low32Very low227 Ų227159.9 Ų159.986%0.85783%0.832SS**  5096.8123.1-161.1170.3-116.2-113.41.2118.3
1145W28.7Very low32.2Very low248 Ų248158.8 Ų158.894%0.93983%0.827SS**PPolyproline II helixtrans-64.4135.3159.6-75.9-8.1000113.8
1146P38.6Very low32.1Very low122 Ų122158.5 Ų158.579%0.79283%0.826SS**PPolyproline II helixtrans-93.5137.7162.319.7-3.6000111.9
1147K32.8Very low32.5Very low211 Ų211157.5 Ų157.592%0.91783%0.826SS**PPolyproline II helixtrans-70.1128.7-179-68.4170.1175.61740111.7
1148M31.6Very low32.5Very low178 Ų178155.9 Ų155.988%0.87783%0.827SS**PPolyproline II helixtrans-83.4140.7168.4-76.3-76.4-13400111.5
1149P36Very low32.4Very low119 Ų119156.6 Ų156.677%0.77383%0.831SS**PPolyproline II helixtrans-85.6140.9-1803.715.1000112.5
1150K31.2Very low32.5Very low207 Ų207164.7 Ų164.790%0.984%0.84SS**PPolyproline II helixtrans-73.1129.7172.9-62.3170.4177.7176.30109.9
1151M38.7Very low32.5Very low189 Ų189161.8 Ų161.893%0.93183%0.834SS**  trans-125.3140.7161.2-75.8-72.6-95.300109
1152G33.9Very low32.5Very low77 Ų77157.6 Ų157.679%0.79483%0.832SS**  trans-85.9160.8-151.600000115.9
1153L29.7Very low32.8Very low172 Ų172158.9 Ų158.990%0.90183%0.828SS**  trans-63.9139.7166.1-63.4154.1000110.6
1154S32.3Very low32.4Very low120 Ų120158.9 Ų158.984%0.83983%0.833SS**  -174.6148.8125.5-76.50000112.1
1155P35.8Very low32.4Very low107 Ų107155.9 Ų155.970%0.69583%0.833SS**  trans-120.6168.6-158.335.1-16.3000115.4
1156L28.7Very low32.4Very low162 Ų162149.6 Ų149.685%0.84883%0.827SS**  trans51.5106.2144.5-71.1162.6000119.2
1157L37.5Very low32.1Very low173 Ų173148.1 Ų148.191%0.90683%0.825SS**  trans-147.3118.3140.4-88.2179.5000112.6
1158S30Very low32Very low116 Ų116144.3 Ų144.381%0.81183%0.825SS**  trans66.9116.3138.7-91.30000123.3
1159S28.9Very low32.1Very low114 Ų114139.5 Ų139.580%0.79782%0.821SS**  trans-63155161-48.30000115.6
1160R31.8Very low31.9Very low240 Ų240138 Ų13891%0.90683%0.827SS**  trans133.2131.4155.9-82.3176.1-158.5-1511.7107.2
1161K30.7Very low32.1Very low186 Ų186131.3 Ų131.381%0.80982%0.817SS**  cis-165.3141.629.7-145172.5179.6-176.40106.6
1162A29.1Very low31.7Very low87 Ų87128.3 Ų128.372%0.71981%0.814SS**  trans-81.2139.4174.800000111.6
1163H35.4Very low31.6Very low166 Ų166134.3 Ų134.377%0.76982%0.819SS**  trans-166.297.5149.1-82.9-63.8000105.2
1164T28.2Very low31.7Very low116 Ų116131.5 Ų131.571%0.71281%0.813SS**  56.8130.89359.40000115.6
1165L32Very low31.8Very low164 Ų164129.5 Ų129.586%0.85981%0.812SS**  trans94.5100.7166.8-50.3176.5000113.5
1166S27.4Very low31.5Very low116 Ų116132.3 Ų132.381%0.81182%0.821SS**  97.3136.662.4175.70000111.2
1167A31.8Very low31.5Very low91 Ų91128.1 Ų128.175%0.75282%0.817SS**  trans88.489.4166.300000117.9
1168S32.3Very low31.3Very low131 Ų131125.5 Ų125.592%0.91681%0.813SS**  167.1118.2125.348.10000108.8
1169G33.1Very low31.5Very low77 Ų77126.5 Ų126.579%0.79482%0.815SS**  trans-169.766.1-178.400000109.3G1171G1169-G1171 PolarHBondContact O-N 3.49Å
1170G31.5Very low31.6Very low87 Ų87130.8 Ų130.890%0.89782%0.819SS**  trans-70.6103.1169.100000108.8
1171G34.7Very low31.8Very low67 Ų67124.8 Ų124.869%0.69181%0.812SS**  trans-99.5108.5169.100000109.4G1169 F1173G1169-G1171 PolarHBondContact O-N 3.49Å; G1171-F1173 PolarHBondContact O-N 2.81Å
1172S30.4Very low32Very low125 Ų125127.6 Ų127.687%0.87482%0.817SS**  trans-62.5116.4166-55.70000109.4
1173F31.9Very low32.3Very low204 Ų204132.2 Ų132.290%0.89583%0.829SS**  trans-117.5101.3168-115.7-91.5000108.3G1171 G1175G1171-F1173 PolarHBondContact O-N 2.81Å; F1173-G1175 PolarHBondContact O-N 3.33Å
1174S33.3Very low32.2Very low112 Ų112129.4 Ų129.478%0.78383%0.828SS**  trans-61.1111.3158.241.40000108.6
1175G34.1Very low32.6Very low78 Ų78128 Ų12880%0.80483%0.828SS**  trans-95.8101.2174.100000110.6F1173F1173-G1175 PolarHBondContact O-N 3.33Å
1176D29.7Very low32.6Very low166 Ų166130.2 Ų130.289%0.88883%0.831SS**  trans-82.6140.4160-84.3-35.1000110.3
1177G28.2Very low32.7Very low74 Ų74133 Ų13376%0.76383%0.831SS**  trans86.8110.2149.900000117.9
1178S33.5Very low32.9Very low118 Ų118136.8 Ų136.883%0.82584%0.835SS**  -163.4115.9123.244.30000112.6
1179T33.5Very low32.8Very low138 Ų138135.4 Ų135.485%0.84783%0.826SS**PPolyproline II helixtrans-57.5132.8171-37.40000111.6
1180F30.3Very low32.8Very low203 Ų203139.7 Ų139.789%0.8983%0.83SS**PPolyproline II helixtrans-65.9126.3174.3-102.4-99000111.9
1181P36.9Very low32.7Very low115 Ų115145.7 Ų145.775%0.74783%0.825SS**PPolyproline II helixtrans-90125.9172.432.1-27.5000111.5L1183P1181-L1183 PolarHBondContact O-N 2.87Å
1182R34.1Very low32.7Very low244 Ų244151.6 Ų151.692%0.92183%0.834SS**PPolyproline II helixtrans-56.9125.3168.2-85.3175.5161.6159.4-5.1111.3S1184R1182-S1184 PolarHBondContact O-N 2.9Å
1183L36.7Very low32.7Very low184 Ų184152.3 Ų152.396%0.96383%0.828SS**PPolyproline II helixtrans-70.9117.7161.4-84.8151.3000108.9P1181P1181-L1183 PolarHBondContact O-N 2.87Å
1184S32Very low32.9Very low107 Ų107150.4 Ų150.475%0.74883%0.827SS**  trans-110.6155.9172.755.20000109.7R1182R1182-S1184 PolarHBondContact O-N 2.9Å
1185A36.3Very low32.7Very low87 Ų87153.7 Ų153.772%0.71983%0.83SS**  trans77.486.316300000117.9
1186F32.1Very low32.4Very low210 Ų210154 Ų15492%0.92183%0.825SS**  trans-119.9111.8136.7-130-96.3000108.7
1187Q31.3Very low32.8Very low176 Ų176151.3 Ų151.382%0.82282%0.816SS**  trans-101.6108.8-170.2-174.7-179.92.900107.6
1188M34.3Very low32.7Very low169 Ų169153.2 Ų153.283%0.83382%0.818SS**  trans-115.8111.7164.9-89.9-92179.600107.5
1189S30Very low32.6Very low103 Ų103153 Ų15372%0.7282%0.816SS**  trans-88.2115.4-179.1-160.20000108.4
1190L33.8Very low32.3Very low166 Ų166152 Ų15287%0.86982%0.815SS**  trans-131.5101.9164.1-94.5152.8000107.5
1191R29.1Very low32.4Very low214 Ų214148.4 Ų148.481%0.80881%0.81SS**  trans-68.8133.7165-74.9-178.9179.2-172.6-1.5108.9
1192H36.1Very low32.1Very low190 Ų190147.1 Ų147.188%0.8881%0.809SS**  trans-154.2125.4135.9-115.3-74.8000109.7
1193D29.5Very low32.1Very low140 Ų140141.7 Ų141.775%0.74980%0.802SS**  trans-69.3132.1178.2-59.9-63.9000111.9
1194L35.5Very low31.6Very low164 Ų164141.9 Ų141.986%0.85980%0.798SS**  trans-144.992.2153.4-78.8178.4000110
1195Q30.5Very low31.6Very low182 Ų182144 Ų14485%0.8580%0.796SS**  trans43.7105.7131-126.7141.9-0.800119.6
1196A26.9Very low31.3Very low84 Ų84148.2 Ų148.269%0.69480%0.798SS**  trans-72175.514500000109.9
1197P37.5Very low31Very low109 Ų109145.3 Ų145.371%0.70880%0.797SS**  cis-144.5-175.66.442.3-21.9000115.7
1198S26.7Very low30.9Very low114 Ų114140.7 Ų140.780%0.79779%0.789SS**  trans74.2101.5144.9-52.80000120.9
1199S31.7Very low30.7Very low114 Ų114140.3 Ų140.380%0.79779%0.791SS**  trans-150.797.5134.463.60000110.4
1200S27.5Very low30.6Very low118 Ų118141.8 Ų141.883%0.82580%0.795SS**  trans-71.8121160.860.30000108.6
1201V32.2Very low30.4Very low127 Ų127141.3 Ų141.377%0.7779%0.793SS**  trans-126101.3158.6179.30000106.3V1203V1201-V1203 HydrophobicContact CG1-CG2 4.35Å
1202A30.2Very low30.6Very low88 Ų88139.3 Ų139.373%0.72779%0.792SS**  trans-69.3129.7167.700000108.8
1203V33.4Very low30.3Very low130 Ų130135.6 Ų135.679%0.78879%0.786SS**  trans-128.294.4159.1-179.70000106V1201V1201-V1203 HydrophobicContact CG1-CG2 4.35Å
1204E27.7Very low30.2Very low188 Ų188134.7 Ų134.788%0.87979%0.786SS**  trans-80.2120.9161.5-72.3177.214400107.8
1205E31.6Very low29.8Very low150 Ų150134.1 Ų134.170%0.70178%0.784SS**  trans-147112.4152.2-130.5-169.4161.200112.2
1206K30.7Very low30.2Very low177 Ų177130.5 Ų130.577%0.7779%0.785SS**  trans63.8108.5141.1-73.6171-171.5153.10121.5
1207V24.6Very low30.4Very low148 Ų148132.6 Ų132.690%0.89779%0.789SS**  trans-54.5130.2148175.20000113.1
1208A30.2Very low30Very low79 Ų79133.2 Ų133.265%0.65380%0.796SS**  trans172.3134.2152.200000105.8
1209D30.1Very low30.2Very low161 Ų161131.2 Ų131.286%0.86179%0.793SS**  cis-150.8141.12.9-85.4-40.9000106.3
1210V27.2Very low30.1Very low134 Ų134133.4 Ų133.481%0.81280%0.796SS**  trans-110.3127.6160.51670000104.9
1211L29.1Very low30.4Very low157 Ų157135.3 Ų135.382%0.82280%0.797SS**  trans168.6151.2140.8-89.7160.8000112.9
1212H33.7Very low30.3Very low172 Ų172133.8 Ų133.880%0.79679%0.792SS**  trans86.3133.5172.3-68.8-20.3000118.4
1213C29.5Very low30.2Very low112 Ų112135.1 Ų135.176%0.75780%0.796SS**  cis-173.1152.3-21.2-113.90000105.2
1214T28.3Very low30.4Very low120 Ų120134.5 Ų134.574%0.73679%0.794SS**  trans-93.1153.4-172.644.80000113.5
1215D26.4Very low30.5Very low153 Ų153132.5 Ų132.582%0.81880%0.795SS**  trans65.9125.4144.8-58.4-20.3000122.8
1216A38.2Very low30.3Very low106 Ų106131.3 Ų131.388%0.87680%0.798SS**  trans-147135.4153.100000110.4
1217T31.4Very low29.9Very low128 Ų128131.3 Ų131.379%0.78580%0.798SS**  trans-107.7145.8-165.143.20000113.9
1218S29.2Very low30.2Very low122 Ų122131.1 Ų131.185%0.85380%0.797SS**  trans24.6141.8143.763.20000125.1
1219G31.1Very low30Very low71 Ų71134.6 Ų134.673%0.73280%0.8SS**  trans144.293.1154.600000113.1
1220D29.1Very low30.2Very low161 Ų161132.1 Ų132.186%0.86179%0.793SS**  58.1113.896-79.2-15.3000117.1
1221D33.7Very low30.2Very low158 Ų158130.3 Ų130.385%0.84579%0.786SS**  176115.1125-97.8-20000115.2
1222S31.4Very low30.2Very low95 Ų95129.2 Ų129.266%0.66478%0.781SS**  trans34.3121.8138.454.50000125
1223S27.2Very low29.9Very low115 Ų115130.2 Ų130.280%0.80479%0.786SS**  93.8148.1124.379.70000120.6
1224P37.7Very low30Very low117 Ų117128.6 Ų128.676%0.7679%0.788SS**  trans-117.7159.5-131.841.4-32.9000114.5
1225T30.7Very low30Very low146 Ų146131.6 Ų131.690%0.89679%0.794SS**  trans-145.6128.3159.7-610000112.4
1226V26.3Very low30.4Very low125 Ų125127.8 Ų127.876%0.75879%0.791SS**  trans-41.5130.6173.21730000115.9
1227F23.4Very low30Very low177 Ų177131.5 Ų131.578%0.77679%0.787SS**  trans35.4110.1131.9-124.3-96.9000119.3Q1229F1227-Q1229 HydrophobicContact CE1-CG 4.44Å
1228V30.6Very low29.9Very low144 Ų144133.3 Ų133.387%0.87379%0.79SS**  trans-135.7109156.8176.20000108.4
1229Q25Very low30Very low152 Ų152132.9 Ų132.971%0.7178%0.782SS**  trans-73.4173152.3-94.4179.6-50.800109.1F1227F1227-Q1229 HydrophobicContact CE1-CG 4.44Å
1230P34.7Very low30.1Very low109 Ų109135.3 Ų135.371%0.70879%0.785SS**  cis-133.1-178.9-20.232.1-11.2000111.7
1231S28.5Very low30.2Very low97 Ų97133.4 Ų133.468%0.67878%0.78SS**  trans160.1121.1130.7-93.30000113.4
1232D27.3Very low30Very low133 Ų133135.3 Ų135.371%0.71178%0.78SS**  70.7121128.7-59.1-35.2000123.1
1233E28.3Very low29.8Very low194 Ų194142.6 Ų142.691%0.90779%0.794SS**  trans84.3129.3137.6-69.8-169-163.800121.5
1234G32.4Very low29.9Very low78 Ų78144.4 Ų144.480%0.80479%0.792SS**  trans157.175.117000000113.4
1235E28.4Very low29.3Very low183 Ų183143 Ų14386%0.85579%0.791SS**  trans-57.8137172.9-61.3-172.9131.200112.9
1236G33Very low29.2Very low73 Ų73144 Ų14475%0.75379%0.791SS**  trans-151.973.8172.100000111.2I1238G1236-I1238 PolarHBondContact O-N 3.21Å
1237K30.2Very low29.1Very low183 Ų183143.7 Ų143.780%0.79679%0.794SS**  trans-68.8116.8174.2-78.2170177.7159.60110.2
1238I30.6Very low29.3Very low167 Ų167139.9 Ų139.986%0.85680%0.796SS**  trans-120.7110.8161.7-61176.1000107.3G1236G1236-I1238 PolarHBondContact O-N 3.21Å
1239V30.9Very low29Very low113 Ų113138.9 Ų138.969%0.68580%0.795SS**PPolyproline II helixtrans-89.1134.6-177.6173.90000109.8
1240P32.4Very low29.2Very low122 Ų122137.2 Ų137.279%0.79280%0.8SS**PPolyproline II helixtrans-87.8118.6173.13.715.1000111
1241T31.9Very low28.6Very low121 Ų121143.9 Ų143.974%0.74281%0.811SS**PPolyproline II helixtrans-89.6119.9177.426.10000111.8
1242K28.8Very low28.4Very low198 Ų198145 Ų14586%0.86181%0.814SS**PPolyproline II helixtrans-68.3131.5164.6-73174.5174176.60109.7
1243W27.2Very low28.6Very low248 Ų248145 Ų14594%0.93982%0.819SS**  trans-107.3126.4166.4-91.940.9000110.2
1244I29.9Very low28.4Very low152 Ų152141.5 Ų141.578%0.77982%0.816SS**  trans-95.3141.5-173.4-73.6168.3000108.9
1245A24Very low28.4Very low89 Ų89143.2 Ų143.274%0.73682%0.816SS**  trans-60.1137170.800000112.1
1246N29.2Very low28.2Very low165 Ų165139.6 Ų139.688%0.88281%0.811SS**  trans-145.1133160.7-115.2-1.6000111.4
1247S24.3Very low28Very low120 Ų120144.8 Ų144.884%0.83982%0.815SS**  trans-67.1145.1-177.8-46.70000113.5
1248A27.9Very low27.7Very low97 Ų97140.8 Ų140.880%0.80281%0.81SS**  trans-162.3121.9146.600000111.8
1249S23.7Very low27.7Very low122 Ų122137.7 Ų137.785%0.85380%0.804SS**  trans-53.1141.4168-69.60000113.7
1250S30.2Very low27.5Very low117 Ų117139.7 Ų139.782%0.81881%0.81SS**  trans-163.496.4145.621.30000109.5
1251R22.6Very low27.3Very low250 Ų250138.2 Ų138.294%0.94381%0.809SS**  trans-104.388.3170.9-174-173.3-85.2-141.2-1107
1252T23.9Very low27.1Very low120 Ų120138.3 Ų138.374%0.73681%0.809SS**  trans-160.6128.5160.546.30000108
1253T31.9Very low27.2Very low132 Ų132134.7 Ų134.781%0.8181%0.807SS**  trans167.2104.6140.435.10000109.4
1254S23.8Very low27.2Very low121 Ų121129.3 Ų129.385%0.84680%0.795SS**  trans-57.9131144.846.90000110.3
1255S31Very low27.3Very low115 Ų115127.1 Ų127.180%0.80480%0.799SS**  trans-148.8107.2156.155.50000110.9
1256S24.9Very low27.5Very low107 Ų107127.6 Ų127.675%0.74879%0.794SS**  trans-69.1137.8153.545.70000111.1
1257Q29.6Very low27.3Very low181 Ų181127 Ų12785%0.84679%0.786SS**  trans164.4102.3148.3-93.2166.424.600106.7
1258S23.9Very low27.5Very low99 Ų99128.3 Ų128.369%0.69278%0.782SS**  68.6143.982.472.60000114.5
1259S29.4Very low27.7Very low103 Ų103128.6 Ų128.672%0.7278%0.776SS**  trans82.7133.8176.5-40000114.4
1260D27.3Very low27.7Very low155 Ų155126.7 Ų126.783%0.82978%0.775SS**  cis-173.1160-1.6-105.7-25.8000108.4
1261A28.4Very low27.8Very low91 Ų91126.4 Ų126.475%0.75277%0.771SS**  trans68.1102.5156.100000119.5
1262V27.4Very low28.6Very low123 Ų123120 Ų12075%0.74576%0.762SS**  90.7107.476.5168.30000113.8I1264V1262-I1264 HydrophobicContact CG1-CD1 4.43Å
1263C30.5Very low28.7Very low121 Ų121125.6 Ų125.682%0.81877%0.769SS**  trans170.180.2142.3-88.40000106.2
1264I28.3Very low28.8Very low136 Ų136126.4 Ų126.470%0.69777%0.769SS**  53.888.488.1-51.6-179.3000112.9V1262 T1266V1262-I1264 HydrophobicContact CG1-CD1 4.43Å; I1264-T1266 HydrophobicContact CG2-CG2 4.2Å
1265A31.1Very low29Very low105 Ų105127.3 Ų127.387%0.86877%0.769SS**  trans-127.983.7144.300000107.1
1266T27.8Very low28.9Very low100 Ų100127.4 Ų127.461%0.61376%0.764SS**  trans-54.514915535.50000109.8I1264I1264-T1266 HydrophobicContact CG2-CG2 4.2Å
1267E25.7Very low28.8Very low153 Ų153127.2 Ų127.272%0.71576%0.763SS**  cis-173.5125.512.3-110.3-179.7-162.200106
1268L28.6Very low28.7Very low146 Ų146126.4 Ų126.476%0.76476%0.763SS**  98.2151.9100.5-84173.2000113.5
1269P32.3Very low28.9Very low103 Ų103127.5 Ų127.567%0.66977%0.771SS**  trans-121.5160-133.826.6-4.3000112.4P1271P1269-P1271 WeakPolarHBondContact O-CD 3.27Å
1270G23.7Very low28.8Very low82 Ų82125.7 Ų125.785%0.84577%0.769SS**  trans-86.9122.3168.500000112.1
1271P31.3Very low28.9Very low112 Ų112123.9 Ų123.973%0.72777%0.768SS**  trans-119-177151.543.4-32.6000109.2P1269P1269-P1271 WeakPolarHBondContact O-CD 3.27Å
1272P39.8Very low29Very low116 Ų116128.8 Ų128.875%0.75378%0.776SS**  -116.1176.9-83.430.4-12.1000112.4D1274P1272-D1274 PolarHBondContact O-N 3.46Å
1273R27.2Very low29.2Very low237 Ų237134 Ų13489%0.89478%0.782SS**  trans-47.3118.5175-61.4173.5175-159.8-3.2112.7
1274D32.1Very low29.2Very low149 Ų149133 Ų13380%0.79778%0.782SS**  trans-125.9109154.2-86.7-32.2000109.2P1272 V1276P1272-D1274 PolarHBondContact O-N 3.46Å; D1274-V1276 PolarHBondContact O-N 2.92Å
1275V27.9Very low29.5Very low140 Ų140134.1 Ų134.185%0.84879%0.788SS**  trans-81.793.1172.3178.60000106.3
1276V28.9Very low29.4Very low117 Ų117136.5 Ų136.571%0.70979%0.786SS**  trans-119.2101.3168.3-179.10000108.2D1274 L1278D1274-V1276 PolarHBondContact O-N 2.92Å; V1276-L1278 PolarHBondContact O-N 2.9Å
1277S24.8Very low29.7Very low102 Ų102138 Ų13871%0.71380%0.795SS**  trans-47.7125.2160.5-48.10000109.8
1278L26.5Very low30Very low164 Ų164136.5 Ų136.586%0.85980%0.798SS**  trans173.8106.7152.3-94.8156.5000110.2V1276V1276-L1278 PolarHBondContact O-N 2.9Å
1279S28.8Very low30Very low123 Ų123133.2 Ų133.286%0.8680%0.8SS**  trans160.9121.7142.747.10000106.8
1280G27Very low29.8Very low65 Ų65137.5 Ų137.567%0.6781%0.811SS**  cis97.685.530.800000108.4
1281S29.8Very low30.4Very low117 Ų117139 Ų13982%0.81881%0.805SS**  trans53.395.7147.762.80000118.3
1282E30.6Very low30.6Very low194 Ų194139.1 Ų139.191%0.90781%0.806SS**  trans-129.898.8144.2-94.8-170.4153.100111
1283R30.2Very low30.2Very low233 Ų233140.5 Ų140.588%0.87981%0.812SS**  trans35.298.4141-73.7176.9173.1174.2-2.2117.1I1285R1283-I1285 PolarHBondContact O-N 2.94Å
1284A30.8Very low30.5Very low98 Ų98138.2 Ų138.281%0.8181%0.809SS**  trans-52.2123.3151.400000110.4
1285I34.4Very low30.3Very low161 Ų161136.3 Ų136.383%0.82681%0.807SS**  trans-95.6111.2162.8-66.4176000106.2R1283R1283-I1285 PolarHBondContact O-N 2.94Å
1286D30.2Very low30.7Very low154 Ų154135.1 Ų135.182%0.82480%0.802SS**  trans-62.6120.2170.6-85.3-45000111.4
1287V33.2Very low30.9Very low132 Ų132134.7 Ų134.780%0.880%0.802SS**  trans-141.3133.5146.2-177.90000107.9
1288P31.6Very low31.4Very low122 Ų122136 Ų13679%0.79281%0.808SS**  trans-98.1142.7-151.936.3-31.7000114.9
1289G29.3Very low31.7Very low77 Ų77138.5 Ų138.579%0.79481%0.807SS**  69.788.7129.500000119.6
1290E28.2Very low31.9Very low193 Ų193141 Ų14190%0.90281%0.806SS**  trans-123131.9140.2-98.1-171.1163.900109.9
1291P34.9Very low32.1Very low112 Ų112143.7 Ų143.773%0.72781%0.814SS**  trans-82.8160-168.533.8-32.6000112.6
1292P35.8Very low32.2Very low116 Ų116145.3 Ų145.375%0.75381%0.813SS**  trans-75.1132-164.429.8-34.4000112.4K1294P1292-K1294 PolarHBondContact O-N 2.8Å
1293V32.6Very low32.2Very low144 Ų144141 Ų14187%0.87380%0.804SS**  trans-57.797.2169.5178.80000109
1294K33.6Very low32.3Very low190 Ų190136.9 Ų136.983%0.82680%0.796SS**PPolyproline II helixtrans-75.1118.5160.2-78.5-178.2176.3178.80107.4P1292P1292-K1294 PolarHBondContact O-N 2.8Å
1295S28.2Very low32.2Very low108 Ų108140.7 Ų140.776%0.75580%0.798SS**PPolyproline II helixtrans-51.6122.1170.237.30000110.5
1296P34.6Very low32.2Very low115 Ų115142.7 Ų142.775%0.74780%0.796SS**PPolyproline II helixtrans-80.6141.1179.229.7-30000111.1
1297P33.8Very low32.2Very low109 Ų109139 Ų13971%0.70879%0.794SS**PPolyproline II helixtrans-75.2166.11663.214.4000111.3
1298P34.5Very low31.9Very low129 Ų129137.5 Ų137.584%0.83880%0.796SS**PPolyproline II helixtrans-76135-163.531.4-33.6000112.6
1299Y32.9Very low32.1Very low216 Ų216139.7 Ų139.785%0.84780%0.799SS**PPolyproline II helixtrans-86.8119.3174.9-106.5-96.8000110.6
1300E32.8Very low32.1Very low176 Ų176140.8 Ų140.882%0.82280%0.795SS**PPolyproline II helixtrans-64.8143.2164.7-73.9-178.9155.500111L1302E1300-L1302 PolarHBondContact O-N 3.34Å
1301S32.5Very low32.2Very low121 Ų121137.7 Ų137.785%0.84679%0.792SS**  trans-47.3107.7176.941.60000114
1302L30.8Very low32Very low152 Ų152140.2 Ų140.280%0.79680%0.798SS**  trans-85.5110.9163-86.1159.1000109.5E1300 M1304E1300-L1302 PolarHBondContact O-N 3.34Å; L1302-M1304 PolarHBondContact O-N 3.42Å
1303S31.8Very low31.7Very low102 Ų102144 Ų14471%0.71380%0.803SS**  trans-66.9115.7168.154.80000109.8Q1305S1303-Q1305 PolarHBondContact O-N 2.76Å
1304M31.6Very low31.9Very low147 Ų147142.2 Ų142.272%0.72479%0.794SS**  trans-78.9102.4166.9-85.6-130.673.100109.3L1302 Y1306L1302-M1304 PolarHBondContact O-N 3.42Å; M1304-Y1306 HydrophobicContact CE-CD2 3.89Å; M1304-Y1306 HydrophobicContact CE-CE2 3.24Å; M1304-Y1306 HydrophobicContact SD-CE2 4.02Å
1305Q29.1Very low31.7Very low179 Ų179140.5 Ų140.584%0.83679%0.793SS**  trans-87.5107.4175.4-162.4170.412.800108.2S1303S1303-Q1305 PolarHBondContact O-N 2.76Å
1306Y33.5Very low31.7Very low202 Ų202140.7 Ų140.779%0.79279%0.789SS**  trans-113120.7168-90.8-77000110.5M1304M1304-Y1306 HydrophobicContact CE-CD2 3.89Å; M1304-Y1306 HydrophobicContact CE-CE2 3.24Å; M1304-Y1306 HydrophobicContact SD-CE2 4.02Å
1307G30.5Very low31.3Very low76 Ų76143 Ų14378%0.78480%0.795SS**  trans90.774.3137.400000117.9
1308A27.5Very low31.2Very low102 Ų102141.2 Ų141.284%0.84380%0.797SS**  trans-83.7122.5155.700000109.9
1309I34.7Very low30.9Very low167 Ų167140.4 Ų140.486%0.85680%0.801SS**  trans-127.1104.6159.3-61.5-178.5000108.8
1310S30.4Very low30.8Very low101 Ų101134 Ų13471%0.70680%0.801SS**  trans2.1128.3160.6-55.20000121.9
1311P30.6Very low30.5Very low128 Ų128130.4 Ų130.483%0.83180%0.795SS**  trans-96.2128.2158.433.2-24.1000111.8
1312L30.4Very low30.3Very low165 Ų165134.1 Ų134.186%0.86480%0.797SS**  trans-129.1113.3168.2-79.2169.6000109.8
1313K28.7Very low30.3Very low196 Ų196132.3 Ų132.385%0.85279%0.794SS**  trans-2.5165.6149.4-77178.7-178.7178.80119.1
1314P37.5Very low30.2Very low106 Ų106136.3 Ų136.369%0.68881%0.806SS**  cis-146.2-176.5-3.630.3-4.9000116.9
1315L28.4Very low30.1Very low153 Ų153132.9 Ų132.980%0.80181%0.809SS**  trans102.3100.8131.6-124.868000121.6
1316V29.6Very low30Very low112 Ų112130.1 Ų130.168%0.67981%0.809SS**  69.1113.1123-179.40000121.6
1317N26.8Very low29.9Very low163 Ų163125.8 Ų125.887%0.87281%0.809SS**  trans36126.7133.7-58.7-13.9000122.4
1318G30.6Very low29.8Very low72 Ų72127.5 Ų127.574%0.74280%0.804SS**  trans170.489153.900000110.2
1319A28.5Very low29.8Very low113 Ų113133.6 Ų133.693%0.93481%0.805SS**  70118.9102.200000114.9
1320G31.2Very low30.1Very low82 Ų82131.2 Ų131.285%0.84580%0.8SS**  trans148.681.2163.200000115.9
1321S26.7Very low30.1Very low100 Ų100131 Ų13170%0.69981%0.805SS**  trans-62.5141.3158.6520000111.7
1322F26.6Very low30.3Very low199 Ų199134.2 Ų134.287%0.87381%0.811SS**  -179.5134.2129.9-100-72000111.1
1323P31.4Very low30.4Very low113 Ų113135.7 Ų135.773%0.73481%0.81SS**  trans-100.3137.7178.735.9-28.1000112.4
1324L31Very low30.7Very low186 Ų186136.4 Ų136.497%0.97481%0.813SS**  trans-149.6136.8169-83.1169.5000109.7
1325G29.2Very low30.5Very low76 Ų76139.1 Ų139.178%0.78482%0.821SS**  trans124.871.9151.200000117.2
1326S26.4Very low30.8Very low121 Ų121137 Ų13785%0.84682%0.817SS**  trans-61.8127.615153.50000111.1
1327S31.3Very low31.2Very low111 Ų111137.7 Ų137.778%0.77682%0.823SS**  trans-14595.1165.2178.90000107.9
1328V28.6Very low31.5Very low112 Ų112135 Ų13568%0.67982%0.815SS**  81.112284.3168.30000112.8
1329R27.2Very low31.4Very low230 Ų230142 Ų14287%0.86882%0.82SS**  trans109.9147.9154.1-78.5152.6-173-1112.9118
1330P42Very low31.7Very low116 Ų116142.4 Ų142.475%0.75381%0.813SS**  cis-138.1156.5-32.333.8-15.8000115.2
1331A29.4Very low31.7Very low97 Ų97141.7 Ų141.780%0.80281%0.807SS**  trans-69.4135.9170.500000112.9
1332M34.4Very low32Very low195 Ų195147.1 Ų147.196%0.96182%0.818SS**  trans-117130156.3-84.9-156.2150.100110.6
1333K32.3Very low32.2Very low196 Ų196143.4 Ų143.485%0.85281%0.813SS**  trans-71.3130.7-170.9-61165.2174.5177.20111.5
1334K36.2Very low32.3Very low211 Ų211146.5 Ų146.592%0.91782%0.82SS**  trans-139118.2145.3-82.9-170.2176.9176.50109.2
1335L31.7Very low32.1Very low163 Ų163145.4 Ų145.485%0.85381%0.812SS**PPolyproline II helixtrans-75.1147-179.5-88.3128.6000111.7
1336P34.9Very low32.4Very low109 Ų109150.9 Ų150.971%0.70882%0.817SS**PPolyproline II helixtrans-89.2149.2170.234.1-32.1000112.7
1337P38.1Very low32.5Very low126 Ų126151.4 Ų151.482%0.81882%0.815SS**PPolyproline II helixtrans-88.1146.6169.733.2-29.6000112.3
1338P33.1Very low32.7Very low106 Ų106153 Ų15369%0.68881%0.813SS**  trans-107.1144.717936.1-26.1000113.6
1339Y29.7Very low32.7Very low219 Ų219150.7 Ų150.786%0.85981%0.813SS**  157.8142121.4-103-92.8000113.1
1340P34.3Very low33.1Very low122 Ų122148 Ų14879%0.79281%0.809SS**  trans-102.8163.3-18039.2-31.8000113.4
1341G32.1Very low32.6Very low68 Ų68147.9 Ų147.970%0.70181%0.811SS**  trans146.1110.5154.300000116
1342K31.7Very low32.7Very low214 Ų214153 Ų15393%0.9382%0.816SS**  trans-175.3111.6136.1-100.9169.3-171.9-1730110.9
1343P31.4Very low32.6Very low120 Ų120147.6 Ų147.678%0.77980%0.802SS**  trans-102.8177.1168.837.7-28.3000112.2
1344M32.9Very low32.7Very low178 Ų178147.1 Ų147.188%0.87780%0.802SS**  trans99.698.9176-62.3-176.186.500114.3
1345M28Very low32.3Very low163 Ų163148.2 Ų148.280%0.80380%0.801SS**  60.195.983.8-76.2-73.2-169.100112.5
1346H34.3Very low32.3Very low192 Ų192151.8 Ų151.889%0.88980%0.803SS**  trans-148.7118.9144.3-100.818000111
1347T28.3Very low32.3Very low131 Ų131151.8 Ų151.880%0.80480%0.803SS**  trans-77.3117.6172.4-48.20000108.8
1348I35.2Very low32.1Very low144 Ų144151.4 Ų151.474%0.73880%0.801SS**  trans-139.7109.9156.1-61.2-176.9000107.5
1349G28.9Very low32Very low65 Ų65151.3 Ų151.367%0.6780%0.802SS**  trans-75.5127.7169.400000110.3
1350H36.1Very low32.3Very low173 Ų173146.4 Ų146.480%0.80180%0.797SS**  trans-126.1114.9152.8-85.8-11.8000109F1352H1350-F1352 PolarHBondContact O-N 3.48Å
1351S30.6Very low32.3Very low114 Ų114148.5 Ų148.580%0.79780%0.8SS**  trans-52.4120.217348.80000111.7
1352F31.8Very low32.2Very low205 Ų205150.3 Ų150.390%0.89980%0.8SS**  trans-110.3112.5154.6-114.6-93.1000108.5H1350 H1354H1350-F1352 PolarHBondContact O-N 3.48Å; F1352-H1354 PolarHBondContact O-N 2.79Å
1353A32.3Very low32.1Very low80 Ų80145.9 Ų145.966%0.66179%0.791SS**  trans-68.6102.7-178.100000110.3W1355A1353-W1355 PolarHBondContact O-N 3.42Å
1354H35Very low32.2Very low186 Ų186147.3 Ų147.386%0.86180%0.797SS**  trans-8698157.7-91.9-62.6000108.8F1352 R1356F1352-H1354 PolarHBondContact O-N 2.79Å; H1354-R1356 PolarHBondContact O-N 3.4Å
1355W27.8Very low32.1Very low235 Ų235147 Ų14789%0.8979%0.793SS**  trans-54.9114.4160.9-87.878.7000109.7A1353A1353-W1355 PolarHBondContact O-N 3.42Å
1356R31.8Very low32.3Very low238 Ų238144 Ų14490%0.89879%0.785SS**  trans-124.6111.4163.9-146.3-178.3-162.6-1424.2106.8H1354H1354-R1356 PolarHBondContact O-N 3.4Å
1357P35Very low32.2Very low108 Ų108141.8 Ų141.870%0.70179%0.786SS**PPolyproline II helixtrans-75.3164.317731.5-32000111.1
1358P32.8Very low32.4Very low119 Ų119139.5 Ų139.577%0.77379%0.788SS**PPolyproline II helixtrans-94.8158.9-139.535.2-34.8000115.3
1359S31.8Very low32Very low104 Ų104138.3 Ų138.373%0.72779%0.792SS**PPolyproline II helixtrans-49.2142.117143.60000115.8
1360P37.1Very low32.3Very low116 Ų116143.1 Ų143.175%0.75380%0.802SS**PPolyproline II helixtrans-76.3142165.631.8-30.7000111P1362P1360-P1362 VanDerWaalsContact O-CD 3.26Å; P1360-P1362 WeakPolarHBondContact O-CD 3.45Å
1361I32.5Very low32Very low165 Ų165138.6 Ų138.685%0.84680%0.795SS**PPolyproline II helixtrans-67124.8176.8-65.2163.1000109.8
1362P30.1Very low31.9Very low107 Ų107138.6 Ų138.670%0.69579%0.794SS**  trans-128.3102.8170.233.3-13.1000110.3P1360P1360-P1362 VanDerWaalsContact O-CD 3.26Å; P1360-P1362 WeakPolarHBondContact O-CD 3.45Å
1363T30.8Very low31.8Very low121 Ų121135.3 Ų135.374%0.74279%0.794SS**  trans-178.7108.1159.810.50000110.6
1364V33.6Very low31.7Very low150 Ų150136.4 Ų136.491%0.90980%0.796SS**  -158.3139.4127.6175.50000107.7
1365H30.3Very low31.4Very low171 Ų171131.9 Ų131.979%0.79279%0.786SS**  trans-70.6169.1-166.3-92.1-91.7000117.2
1366P32.7Very low31.6Very low99 Ų99131.9 Ų131.964%0.64379%0.787SS**  trans-97.6-176-174.539.1-30.9000113.3
1367T31.8Very low31.4Very low147 Ų147127.1 Ų127.190%0.90278%0.78SS**  trans111.1112.2162.369.20000115.6
1368G32.3Very low31.2Very low82 Ų82130 Ų13085%0.84579%0.788SS**  trans17863.2177.600000110.4
1369S27.5Very low31.2Very low119 Ų119129.9 Ų129.983%0.83279%0.788SS**  trans-85.1107170.1177.60000108.5
1370L34.1Very low31Very low167 Ų167134.5 Ų134.587%0.87480%0.795SS**  trans-145.8100.4161.9-76.8173000105.1
1371A29.5Very low30.7Very low78 Ų78133.9 Ų133.965%0.64580%0.8SS**  77.5109.889.600000112.9
1372S28.7Very low30.4Very low113 Ų113130.7 Ų130.779%0.7979%0.792SS**  trans63.6116.5151.548.50000120.2
1373P30.4Very low30.4Very low136 Ų136132.4 Ų132.488%0.88380%0.801SS**  trans-85.8130.2163.933.9-26.5000110.2
1374S29.8Very low30.7Very low103 Ų103132.4 Ų132.472%0.7280%0.803SS**  trans-119.9112.9165.966.10000109.6
1375S28.7Very low30.6Very low92 Ų92134.5 Ų134.564%0.64380%0.8SS**  trans26106.8137.360.50000117.1
1376Y32.1Very low30.7Very low235 Ų235131.3 Ų131.392%0.92279%0.794SS**  trans-136.3117.6134.5-105.1-82.8000109
1377D28.6Very low30.7Very low137 Ų137133.3 Ų133.373%0.73380%0.799SS**  trans-59.8129.8-179.9-63.9-63.1000112.4
1378L29.9Very low30.5Very low168 Ų168133.5 Ų133.588%0.8879%0.794SS**  trans-133.3100.3152.5-87.3169.5000107.2K1380L1378-K1380 PolarHBondContact O-N 3.39Å
1379P32.9Very low30.5Very low118 Ų118134.7 Ų134.777%0.76679%0.79SS**  trans-76.8119.7175.60.216.4000109.3A1381P1379-A1381 PolarHBondContact O-N 3.37Å
1380K27.5Very low30.5Very low200 Ų200133.9 Ų133.987%0.8778%0.784SS**  trans-67.2119.2156.6-70.1173.5176.3176.60107.9L1378L1378-K1380 PolarHBondContact O-N 3.39Å
1381A31.8Very low30.2Very low104 Ų104131 Ų13186%0.8678%0.778SS**  trans-118.195.1158.400000107.7P1379P1379-A1381 PolarHBondContact O-N 3.37Å
1382S25.4Very low30.2Very low97 Ų97132.7 Ų132.768%0.67879%0.785SS**  trans-130.2110.416954.40000105.7
1383T30.7Very low30.1Very low144 Ų144131.8 Ų131.888%0.88379%0.785SS**  trans-154.2152.9155.935.60000110.8
1384P36.8Very low30.1Very low121 Ų121131.4 Ų131.479%0.78678%0.78SS**  trans-107.5174.7-156.137.5-24.1000113.9
1385K30.4Very low30.1Very low194 Ų194132.1 Ų132.184%0.84378%0.78SS**  trans-50.8163.8154-69.6-178.5175.4-179.10110.7
1386P33.9Very low29.9Very low103 Ų103133 Ų13367%0.66979%0.786SS**  cis-148.2-17027.433.1-6.6000115.4
1387D32.2Very low29.8Very low141 Ų141126.9 Ų126.975%0.75478%0.778SS**  trans124.2125.9139.5-65.6-24.2000118.9
1388D27.5Very low29.8Very low151 Ų151125 Ų12581%0.80778%0.776SS**  trans-64.8151.7178.2-62-61.1000113.6
1389S31.4Very low29.6Very low108 Ų108121.3 Ų121.376%0.75577%0.769SS**  trans-178.5109.714327.10000109
1390S28.5Very low29.3Very low101 Ų101123.8 Ų123.871%0.70678%0.775SS**  81.4106.299.879.70000111.9
1391S27.7Very low29.5Very low106 Ų106118.5 Ų118.574%0.74177%0.769SS**  96.8127.685.268.50000112.4
1392S29.9Very low29.4Very low114 Ų114120.1 Ų120.180%0.79776%0.763SS**  trans156.1107.4148.945.80000107.5
1393A26.9Very low29.5Very low95 Ų95122.3 Ų122.379%0.78577%0.766SS**  71.7109.566.900000112.8
1394T30.4Very low29.6Very low127 Ų127124.8 Ų124.878%0.77977%0.768SS**  trans-164.3113.9149.140.20000110.1
1395T28.5Very low29.3Very low118 Ų118124.5 Ų124.572%0.72477%0.765SS**  80.6111.1112.5640000113.7
1396S25.3Very low29.3Very low110 Ų110118.5 Ų118.577%0.76976%0.759SS**  117.912865.6570000108.8
1397S29.5Very low29.1Very low107 Ų107121.1 Ų121.175%0.74877%0.767SS**  trans159.7121.8131.7-165.20000112.9
1398S28.2Very low29.2Very low99 Ų99121.1 Ų121.169%0.69277%0.767SS**  trans45.4113.8141.264.60000119.9
1399A26.1Very low29.2Very low89 Ų89118.3 Ų118.374%0.73676%0.759SS**  67.9127.664.700000115.6
1400L26.9Very low29.1Very low171 Ų171120.6 Ų120.690%0.89576%0.762SS**  trans109.8139.7150.6-74.7155.3000120.2
1401A31Very low29.3Very low89 Ų89121.8 Ų121.874%0.73677%0.765SS**  trans82.3140.9163.500000117.3
1402N29.2Very low29.3Very low137 Ų137121.6 Ų121.673%0.73376%0.764SS**  cis170.6123.8-25.4-111.1-21.2000104.1
1403L27.7Very low29.5Very low144 Ų144122.2 Ų122.275%0.75477%0.768SS**  trans43111.4136.3-63.6162.9000119.8
1404H33.6Very low29.6Very low196 Ų196126.7 Ų126.791%0.90777%0.773SS**  trans-143.4122.5130.6-115.2-43.6000111.2
1405P31Very low29.7Very low114 Ų114126.9 Ų126.974%0.7478%0.776SS**  trans-105.6154.7169.236.8-27.8000111.8
1406G30.7Very low29.9Very low69 Ų69126.7 Ų126.771%0.71178%0.779SS**  trans168.7100.8167.300000110.6
1407N29.3Very low30.1Very low158 Ų158126.4 Ų126.485%0.84578%0.778SS**  88.613782-103.13.7000114
1408N33.2Very low30.2Very low140 Ų140130.6 Ų130.675%0.74979%0.785SS**  trans102.794.2164.7-61.6-7000114.8
1409S27.8Very low30.2Very low92 Ų92130.5 Ų130.564%0.64378%0.784SS**  82.4125.565.672.90000113.4
1410L30.3Very low30.3Very low156 Ų156131.5 Ų131.582%0.81779%0.786SS**  trans125132.2142.4-78.3143.9000116.4
1411V33Very low30.4Very low127 Ų127127.2 Ų127.277%0.7778%0.783SS**  trans84.187.2174.7-162.30000113
1412S27.7Very low30.4Very low102 Ų102128.6 Ų128.671%0.71379%0.787SS**  63.510052.9-45.80000113.7
1413S33.6Very low30.2Very low126 Ų126126.3 Ų126.388%0.88179%0.788SS**  trans-173.7126.1144.7-76.40000109.8
1414E28.9Very low30.7Very low190 Ų190124.4 Ų124.489%0.88878%0.784SS**  trans-73.1165.2-169.8-69.8171.5141.500115.2
1415P32.5Very low30.3Very low130 Ų130122.6 Ų122.684%0.84478%0.78SS**  trans-91.1132.1168.635.3-27.7000110.8
1416S32.4Very low30.3Very low114 Ų114123.6 Ų123.680%0.79778%0.784SS**  trans-120.8112.2170.664.30000111.3
1417S28.8Very low30.1Very low105 Ų105130.4 Ų130.473%0.73479%0.794SS**  trans-43.9129.5160.250.20000114.2
1418H32.7Very low30.1Very low195 Ų195126.3 Ų126.390%0.90379%0.789SS**  trans-135.3112.3138.5-93.6-59.9000109.5
1419S28Very low30.1Very low97 Ų97125.6 Ų125.668%0.67880%0.795SS**  trans-76.6157.4170.856.40000111.6
1420S28.1Very low30Very low109 Ų109133 Ų13376%0.76281%0.809SS**  trans60.3100.2143.262.90000118.4
1421G30Very low30.1Very low82 Ų82134.1 Ų134.185%0.84581%0.81SS**  trans-141.291.3156.100000109.2
1422S29.2Very low30.1Very low117 Ų117136 Ų13682%0.81882%0.816SS**  trans-63.2153.5-179.6-44.20000113
1423A26.8Very low30.1Very low90 Ų90138.7 Ų138.774%0.74482%0.82SS**  trans-55.2177.2158.700000111.5
1424P37.7Very low30Very low104 Ų104139.2 Ų139.268%0.67582%0.818SS**  cis-146.7-168.35.842.8-22000115.5
1425L25.8Very low30Very low157 Ų157134.2 Ų134.282%0.82281%0.809SS**  trans68.4124.7154.7-92.2108.8000119.3
1426V30Very low29.9Very low136 Ų136131.8 Ų131.882%0.82480%0.8SS**  -169.8121.7110.9164.30000109.5
1427K27.1Very low29.7Very low212 Ų212134.8 Ų134.892%0.92280%0.801SS**  trans-77.6132.4156.4-79.5175.7172.5175.30108.5
1428G28.8Very low29.9Very low71 Ų71135.3 Ų135.373%0.73281%0.805SS**  trans-175118.6162.500000105.2
1429S32.7Very low29.8Very low125 Ų125133 Ų13387%0.87480%0.798SS**  -157.5134.759.533.80000109.9
1430R26.6Very low29.7Very low249 Ų249134.2 Ų134.294%0.9480%0.801SS**  trans-127.192.8171.6-160.9-173.2-164.3-173.64.1105.1
1431E32.2Very low30.2Very low179 Ų179133.9 Ų133.984%0.83680%0.796SS**  trans-154.997176-103.3172.5-153.800108.1
1432N33Very low30Very low167 Ų167135.7 Ų135.789%0.89379%0.791SS**  -177.2126126.3-92.7-23.8000110.9
1433I26.5Very low30Very low157 Ų157138.2 Ų138.281%0.80579%0.787SS**  trans-102128.7178.1-69.5164.9000106.7
1434V32.8Very low29.9Very low138 Ų138141.4 Ų141.484%0.83679%0.787SS**  trans-153.5101149.5-176.20000104.1
1435A28.4Very low29.3Very low85 Ų85147.2 Ų147.270%0.70280%0.795SS**  55.7137.977.800000111.6
1436A29.7Very low29.5Very low79 Ų79145.9 Ų145.965%0.65379%0.794SS**  cis-163.7139.111.500000106.1
1437E28.3Very low29.3Very low176 Ų176146.3 Ų146.382%0.82280%0.796SS**  75.3112.1104.3-67.3-177.6157.700118.1
1438S32.7Very low29.4Very low116 Ų116140.7 Ų140.781%0.81178%0.784SS**  trans-177.497.4133.439.50000107.1
1439I31.2Very low29.3Very low147 Ų147143 Ų14375%0.75478%0.784SS**  63.393.487.9-57.7173.3000112.9
1440T26.7Very low29.2Very low122 Ų122148.1 Ų148.175%0.74878%0.784SS**  17.1171.8125.354.60000120.6
1441P38.2Very low29.2Very low102 Ų102147.1 Ų147.166%0.66278%0.78SS**  cis-145.8173.3-39.240.7-22.4000114.9
1442V25.4Very low28.8Very low120 Ų120147.1 Ų147.173%0.72778%0.78SS**  trans66.6134.5132.9170.10000122.7
1443K28.6Very low29Very low171 Ų171144.2 Ų144.274%0.74377%0.77SS**  trans99.1106.3146.9-91.7163.3-166.1-177.10121.4
1444Q25.2Very low29Very low157 Ų157143.1 Ų143.173%0.73477%0.77SS**  74.2145.6115.3-78.3-177.9-21.200122.2
1445R25.1Very low28.9Very low226 Ų226145.6 Ų145.685%0.85377%0.77SS**  trans81.1129.2164.9-72.5169.4171.3167.9-3.5113.6
1446T30.8Very low28.8Very low129 Ų129145.6 Ų145.679%0.79177%0.765SS**  cis-165.2136.636.8-9.20000109.2
1447V24.7Very low28.9Very low144 Ų144151.3 Ų151.387%0.87378%0.775SS**  trans-79.6125.4159.8171.60000107.2
1448S28.8Very low28.8Very low95 Ų95152.6 Ų152.666%0.66477%0.774SS**  trans-165.7110.1150.1-151.10000113.3
1449T28.1Very low28.9Very low119 Ų119153.7 Ų153.773%0.7377%0.771SS**  57.8111.3129.962.40000121.3
1450R30.8Very low29Very low233 Ų233154.5 Ų154.588%0.87978%0.777SS**  -178.9110.7119.9-104.4178.1170.8-151.7-2109.1
1451R26.1Very low29.1Very low227 Ų227154 Ų15486%0.85777%0.774SS**  56.498.999.6-75.3-172.7174.9176.2-1.1112.1
1452E24.8Very low29Very low180 Ų180157.3 Ų157.384%0.84179%0.786SS**  69.9152.194.5-87.6-166.4-160.400114
1453P37Very low29Very low105 Ų105156.5 Ų156.568%0.68278%0.784SS**  cis-138.4178-13.634.2-12.5000114.8
1454V25.1Very low29.3Very low134 Ų134154.4 Ų154.481%0.81279%0.786SS**  trans-34.2131.1165.2178.60000115.2
1455F30.7Very low29.6Very low190 Ų190155.7 Ų155.783%0.83379%0.789SS**  trans-126.2118152.4-109.4-85000109.6
1456S26.6Very low29.8Very low85 Ų85152.8 Ų152.859%0.59479%0.785SS**  trans-62.8138.1164.454.30000111.3
1457F32.2Very low29.9Very low199 Ų199154.1 Ų154.187%0.87379%0.787SS**  trans-130.8111.6152.2-109.4-89000108.9
1458Y26.3Very low30.2Very low203 Ų203150.5 Ų150.580%0.79678%0.779SS**  trans-67.7167.4158.4-97-102.4000109.7
1459D33.6Very low30.4Very low139 Ų139153.6 Ų153.674%0.74379%0.789SS**  trans99.195.5166.9-53.6-25.1000116.3
1460N34.7Very low30.5Very low164 Ų164152.4 Ų152.488%0.87779%0.791SS**  -169.813596.8-110.8-37.1000112.8
1461V29Very low30.8Very low113 Ų113153 Ų15369%0.68579%0.793SS**  trans-87.8132.1177.2169.10000107.8
1462D35Very low31.3Very low171 Ų171147.5 Ų147.591%0.91479%0.787SS**  trans-136.2109.8151.8-107.8-27.8000110.2
1463C25.9Very low32Very low102 Ų102144.2 Ų144.269%0.68978%0.784SS**  trans-89.6122.6177.4-70.20000109.4
1464T34.4Very low32.1Very low128 Ų128146.4 Ų146.479%0.78579%0.789SS**  trans-149.5113.7148.943.70000113.7
1465K31.5Very low33Very low184 Ų184144.4 Ų144.480%0.878%0.782SS**  trans69.8104.4133.3-64.7-177.6178.4179.20121.3
1466Q28.9Very low33.9Very low164 Ų164139.1 Ų139.177%0.76677%0.768SS**  58.6104.1114-72.7-174.6-1100119.4
1467N33.9Very low35Very low157 Ų157141 Ų14184%0.8477%0.771SS**  155.8134100-88.5-19.6000111.9
1468G31Very low35.8Very low68 Ų68139.3 Ų139.370%0.70177%0.766SS**  trans104.883.7140.700000118.6
1469D33.1Very low37.1Very low161 Ų161136.3 Ų136.386%0.86176%0.76SS**  trans5994.8132.1-60.1-23.8000121.9
1470A31Very low38.3Very low94 Ų94134 Ų13478%0.77775%0.751SS**  trans-3.1124.6133.900000119.5
1471R35Very low39.4Very low244 Ų244131.7 Ų131.792%0.92174%0.738SS**  -157121.3125.8-104.5178.8-167.6-149.12.4110
1472P38Very low41.3Very low112 Ų112129.8 Ų129.873%0.72773%0.726SS**  trans-92.2136.8174.234.7-27.9000110.2
1473S38.8Very low43Very low111 Ų111126.2 Ų126.278%0.77670%0.704SS**  trans-129.686.8163.9530000107.8S1475S1473-S1475 PolarHBondContact O-N 2.94Å
1474D40Very low45.1Very low151 Ų151123.9 Ų123.981%0.80769%0.693SS**  trans-68.6104.4170-69.7-40.9000109
1475S43Very low47Very low93 Ų93123.3 Ų123.365%0.6568%0.684SS**  trans-138.62.2166.351.60000113.4S1473 N1477S1473-S1475 PolarHBondContact O-N 2.94Å; S1475-N1477 PolarHBondContact O-N 2.83Å
1476S49.3Very low48.9Very low78 Ų78121 Ų12155%0.54567%0.67SS.*Hα-helixtrans-85.9-3.7-175.5600000115.4
1477N50.2Low51.2Low124 Ų124119.8 Ų119.866%0.66367%0.665SS**Hα-helixtrans-99.1-12.7-177.7-74.3-4.7000114.3S1475 T1480S1475-N1477 PolarHBondContact O-N 2.83Å; N1477-T1480 PolarHBondContact O-OG1 3.35Å
1478E49.2Very low53.1Low164 Ų164116.2 Ų116.277%0.76665%0.651SS**Hα-helixtrans-84.9-29.3172.4-75.8-166.4158.400112.6L1481 T1482E1478-L1481 PolarHBondContact O-N 2.81Å; E1478-T1482 PolarHBondContact O-N 2.79Å; E1478-T1482 VanDerWaalsContact O-N 3.12Å; E1478-T1482 PolarHBondContact O-OG1 3.37Å
1479E54.1Low55.4Low141 Ų141119.4 Ų119.466%0.65965%0.645SS**Hα-helixtrans-67.1-39.1176.9-73-175.3161.600111.8L1481 T1482 E1483E1479-L1481 VanDerWaalsContact C-N 3.34Å; E1479-L1481 PolarHBondContact O-N 3.37Å; E1479-T1482 WeakPolarHBondContact CA-OG1 3.44Å; E1479-T1482 PolarHBondContact O-N 3.34Å; E1479-T1482 PolarHBondContact O-OG1 2.82Å; E1479-T1482 VanDerWaalsContact O-OG1 3.05Å; E1479-E1483 WeakPolarHBondContact O-CB 3.28Å; E1479-E1483 PolarHBondContact O-N 3.43Å
1480T59.5Low57.3Low91 Ų91114 Ų11456%0.55862%0.623SS**Hα-helixtrans-69.2-30.7179.548.20000113.4N1477 A1484N1477-T1480 PolarHBondContact O-OG1 3.35Å; T1480-A1484 PolarHBondContact O-N 3.03Å
1481L57.2Low59.4Low115 Ų115116.2 Ų116.260%0.60262%0.618SS**Hα-helixtrans-79.1-33.2178.2-126.7152.8000112E1478 E1479 L1485E1478-L1481 PolarHBondContact O-N 2.81Å; E1479-L1481 VanDerWaalsContact C-N 3.34Å; E1479-L1481 PolarHBondContact O-N 3.37Å; L1481-L1485 HydrophobicContact CD2-CD1 4.49Å; L1481-L1485 PolarHBondContact O-N 2.84Å
1482T68.6Low61.1Low72 Ų72111.3 Ų111.344%0.44261%0.605SS.*Hα-helixtrans-74.8-34174.647.10000112.5E1478 E1479 R1486E1478-T1482 PolarHBondContact O-N 2.79Å; E1478-T1482 VanDerWaalsContact O-N 3.12Å; E1478-T1482 PolarHBondContact O-OG1 3.37Å; E1479-T1482 WeakPolarHBondContact CA-OG1 3.44Å; E1479-T1482 PolarHBondContact O-N 3.34Å; E1479-T1482 PolarHBondContact O-OG1 2.82Å; E1479-T1482 VanDerWaalsContact O-OG1 3.05Å; T1482-R1486 PolarHBondContact O-N 3.37Å; T1482-R1486 VanDerWaalsContact O-N 3.09Å
1483E70.4Confident62.7Low96 Ų96111.3 Ų111.345%0.44960%0.595SS.*Hα-helixtrans-62.6-46.8171.9-136.372.9-160.900111.1E1479 L1485 R1486 E1487E1479-E1483 WeakPolarHBondContact O-CB 3.28Å; E1479-E1483 PolarHBondContact O-N 3.43Å; E1483-L1485 PolarHBondContact O-N 3.31Å; E1483-R1486 WeakPolarHBondContact O-CB 3.31Å; E1483-R1486 PolarHBondContact O-N 2.88Å; E1483-R1486 IonicContact OE1-CZ 3.38Å; E1483-R1486 IonicContact OE1-NH1 3.12Å; E1483-R1486 PolarHBondContact OE1-NH1 3.32Å; E1483-R1486 IonicContact OE1-NH2 3.57Å; E1483-R1486 IonicContact OE2-CZ 2.79Å; E1483-R1486 IonicContact OE2-NH1 3.92Å; E1483-R1486 PolarHBondContact OE2-NH1 2.84Å; E1483-R1486 VanDerWaalsContact OE2-NH1 3.08Å; E1483-R1486 IonicContact OE2-NH2 3Å; E1483-R1486 PolarHBondContact OE2-NH2 3.13Å; E1483-E1487 PolarHBondContact O-N 3.49Å
1484A70.3Confident63.9Low54 Ų54111.4 Ų111.445%0.44659%0.587SS.*Hα-helixtrans-63.9-37.2179.500000112.9T1480 R1486 C1488T1480-A1484 PolarHBondContact O-N 3.03Å; A1484-R1486 VanDerWaalsContact C-N 3.33Å; A1484-C1488 WeakPolarHBondContact O-CB 3.26Å; A1484-C1488 PolarHBondContact O-N 2.76Å
1485L74Confident64.9Low116 Ų116107 Ų10761%0.60757%0.572SS**Hα-helixtrans-68.9-30.6173.4-80.2168.3000112.6L1481 E1483 K1489L1481-L1485 HydrophobicContact CD2-CD1 4.49Å; L1481-L1485 PolarHBondContact O-N 2.84Å; E1483-L1485 PolarHBondContact O-N 3.31Å; L1485-K1489 WeakPolarHBondContact O-CB 3.46Å; L1485-K1489 PolarHBondContact O-N 3.44Å; L1485-K1489 VanDerWaalsContact O-N 3.12Å
1486R72Confident65.7Low136 Ų136106.2 Ų106.251%0.51356%0.563SS.*Hα-helixtrans-71.4-42.1176-130.5-178.8-60.5116.43.8111.5T1482 E1483 A1484 K1489 A1490T1482-R1486 PolarHBondContact O-N 3.37Å; T1482-R1486 VanDerWaalsContact O-N 3.09Å; E1483-R1486 WeakPolarHBondContact O-CB 3.31Å; E1483-R1486 PolarHBondContact O-N 2.88Å; E1483-R1486 IonicContact OE1-CZ 3.38Å; E1483-R1486 IonicContact OE1-NH1 3.12Å; E1483-R1486 PolarHBondContact OE1-NH1 3.32Å; E1483-R1486 IonicContact OE1-NH2 3.57Å; E1483-R1486 IonicContact OE2-CZ 2.79Å; E1483-R1486 IonicContact OE2-NH1 3.92Å; E1483-R1486 PolarHBondContact OE2-NH1 2.84Å; E1483-R1486 VanDerWaalsContact OE2-NH1 3.08Å; E1483-R1486 IonicContact OE2-NH2 3Å; E1483-R1486 PolarHBondContact OE2-NH2 3.13Å; A1484-R1486 VanDerWaalsContact C-N 3.33Å; R1486-K1489 PolarHBondContact O-N 2.83Å; R1486-A1490 WeakPolarHBondContact O-CB 2.98Å; R1486-A1490 PolarHBondContact O-N 3.02Å
1487E76.4Confident65.7Low138 Ų138112.1 Ų112.165%0.64557%0.573SS**Hα-helixtrans-63.3-45.9174-83.6-174.7153.600111.8E1483 K1489 A1490 E1491E1483-E1487 PolarHBondContact O-N 3.49Å; E1487-K1489 VanDerWaalsContact C-N 3.25Å; E1487-K1489 PolarHBondContact O-N 3.37Å; E1487-A1490 PolarHBondContact O-N 3.04Å; E1487-A1490 VanDerWaalsContact O-N 3.17Å; E1487-E1491 PolarHBondContact O-N 3.47Å
1488C75.1Confident65.6Low81 Ų81114.7 Ų114.755%0.54758%0.579SS.*Hα-helixtrans-59.3-37.4176.1-115.60000112.2A1484 Q1492A1484-C1488 WeakPolarHBondContact O-CB 3.26Å; A1484-C1488 PolarHBondContact O-N 2.76Å; C1488-Q1492 WeakPolarHBondContact O-CB 3.18Å; C1488-Q1492 PolarHBondContact O-N 2.83Å; C1488-Q1492 VanDerWaalsContact O-N 3.13Å
1489K77.6Confident65.5Low136 Ų136114.3 Ų114.359%0.59158%0.577SS**Hα-helixtrans-72.1-37.1177.9-158.8176-176.7-175.80112.4L1485 R1486 E1487 Q1492 E1493L1485-K1489 WeakPolarHBondContact O-CB 3.46Å; L1485-K1489 PolarHBondContact O-N 3.44Å; L1485-K1489 VanDerWaalsContact O-N 3.12Å; R1486-K1489 PolarHBondContact O-N 2.83Å; E1487-K1489 VanDerWaalsContact C-N 3.25Å; E1487-K1489 PolarHBondContact O-N 3.37Å; K1489-Q1492 PolarHBondContact O-N 3.44Å; K1489-E1493 PolarHBondContact O-N 2.9Å
1490A73.4Confident65Low48 Ų48116 Ų11640%0.39758%0.579SS.*Hα-helixtrans-67.6-38.4175.300000112.3R1486 E1487 Q1492 E1493 N1494R1486-A1490 WeakPolarHBondContact O-CB 2.98Å; R1486-A1490 PolarHBondContact O-N 3.02Å; E1487-A1490 PolarHBondContact O-N 3.04Å; E1487-A1490 VanDerWaalsContact O-N 3.17Å; A1490-Q1492 VanDerWaalsContact C-N 3.33Å; A1490-E1493 PolarHBondContact O-N 3.46Å; A1490-N1494 WeakPolarHBondContact O-CB 3.24Å; A1490-N1494 PolarHBondContact O-N 3.5Å
1491E74.8Confident64.2Low140 Ų140114.7 Ų114.765%0.65458%0.583SS**Hα-helixtrans-64.6-38.4173.1-74.7-174.3160.300111.8E1487 N1494 A1495E1487-E1491 PolarHBondContact O-N 3.47Å; E1491-N1494 PolarHBondContact O-N 3.18Å; E1491-A1495 WeakPolarHBondContact O-CB 3.47Å; E1491-A1495 PolarHBondContact O-N 2.93Å
1492Q71.3Confident63.3Low140 Ų140114.8 Ų114.865%0.65459%0.592SS**Hα-helixtrans-68.3-39.8177.1-142.5172.811.700112.1C1488 K1489 A1490 A1495 V1496C1488-Q1492 WeakPolarHBondContact O-CB 3.18Å; C1488-Q1492 PolarHBondContact O-N 2.83Å; C1488-Q1492 VanDerWaalsContact O-N 3.13Å; K1489-Q1492 PolarHBondContact O-N 3.44Å; A1490-Q1492 VanDerWaalsContact C-N 3.33Å; Q1492-A1495 PolarHBondContact O-N 2.85Å; Q1492-V1496 WeakPolarHBondContact O-CG2 3.07Å; Q1492-V1496 PolarHBondContact O-N 3.19Å; Q1492-V1496 VanDerWaalsContact O-N 3.17Å
1493E70.8Confident62Low112 Ų112120.2 Ų120.252%0.52362%0.624SS.*Hα-helixtrans-65.4-42.9174-76.7177-175.900111.5K1489 A1490 A1495 V1496 W1497K1489-E1493 PolarHBondContact O-N 2.9Å; A1490-E1493 PolarHBondContact O-N 3.46Å; E1493-A1495 VanDerWaalsContact C-N 3.33Å; E1493-A1495 PolarHBondContact O-N 2.83Å; E1493-V1496 PolarHBondContact O-N 3.13Å; E1493-W1497 VanDerWaalsContact O-CD1 3.23Å; E1493-W1497 PolarHBondContact O-N 3.41Å
1494N65.7Low61.6Low114 Ų114121.4 Ų121.461%0.6163%0.633SS**Hα-helixtrans-64.5-34.6175.8-85.9-12.1000113.1A1490 E1491 V1496 W1497 F1498A1490-N1494 WeakPolarHBondContact O-CB 3.24Å; A1490-N1494 PolarHBondContact O-N 3.5Å; E1491-N1494 PolarHBondContact O-N 3.18Å; N1494-V1496 VanDerWaalsContact C-N 3.34Å; N1494-W1497 PolarHBondContact O-N 3.22Å; N1494-F1498 PolarHBondContact O-N 3.32Å; N1494-F1498 VanDerWaalsContact O-N 3.08Å
1495A59.3Low61.1Low58 Ų58124.9 Ų124.948%0.47964%0.643SS.*Hα-helixtrans-64.8-38.617400000111.9E1491 Q1492 E1493 F1498 E1499E1491-A1495 WeakPolarHBondContact O-CB 3.47Å; E1491-A1495 PolarHBondContact O-N 2.93Å; Q1492-A1495 PolarHBondContact O-N 2.85Å; E1493-A1495 VanDerWaalsContact C-N 3.33Å; E1493-A1495 PolarHBondContact O-N 2.83Å; A1495-F1498 PolarHBondContact O-N 3.4Å; A1495-E1499 PolarHBondContact O-N 3.18Å
1496V60.1Low60.4Low77 Ų77125.4 Ų125.447%0.46765%0.645SS.*Hα-helixtrans-67.1-38.5175.3174.70000111.3Q1492 E1493 N1494 F1498 E1499 Y1500Q1492-V1496 WeakPolarHBondContact O-CG2 3.07Å; Q1492-V1496 PolarHBondContact O-N 3.19Å; Q1492-V1496 VanDerWaalsContact O-N 3.17Å; E1493-V1496 PolarHBondContact O-N 3.13Å; N1494-V1496 VanDerWaalsContact C-N 3.34Å; V1496-F1498 VanDerWaalsContact C-N 3.3Å; V1496-F1498 PolarHBondContact O-N 2.81Å; V1496-E1499 PolarHBondContact O-N 3.25Å; V1496-Y1500 HydrophobicContact CG1-CD2 4.14Å; V1496-Y1500 HydrophobicContact CG1-CE2 4.37Å; V1496-Y1500 WeakPolarHBondContact O-CD2 3.22Å; V1496-Y1500 PolarHBondContact O-N 2.95Å
1497W50.7Low59.7Low202 Ų202124.8 Ų124.877%0.76565%0.653SS**Hα-helixtrans-66.2-30.7175-82.498.8000113.2E1493 N1494 G1501E1493-W1497 VanDerWaalsContact O-CD1 3.23Å; E1493-W1497 PolarHBondContact O-N 3.41Å; N1494-W1497 PolarHBondContact O-N 3.22Å; W1497-G1501 PolarHBondContact O-N 3.49Å
1498F47.3Very low58.7Low177 Ų177124 Ų12478%0.77665%0.653SS**Hα-helixtrans-73.8-32.4176.3-126.9-84.2000113N1494 A1495 V1496N1494-F1498 PolarHBondContact O-N 3.32Å; N1494-F1498 VanDerWaalsContact O-N 3.08Å; A1495-F1498 PolarHBondContact O-N 3.4Å; V1496-F1498 VanDerWaalsContact C-N 3.3Å; V1496-F1498 PolarHBondContact O-N 2.81Å
1499E46.3Very low57.6Low156 Ų156126.9 Ų126.973%0.72966%0.66SS**Hα-helixtrans-71.3-31.4173.3-88.3-168.9154.400112.8A1495 V1496A1495-E1499 PolarHBondContact O-N 3.18Å; V1496-E1499 PolarHBondContact O-N 3.25Å
1500Y45.2Very low56.2Low178 Ų178126.2 Ų126.270%0.69867%0.665SS**Hα-helixtrans-84.7-5.4177.7-85.5-84.7000114.8V1496V1496-Y1500 HydrophobicContact CG1-CD2 4.14Å; V1496-Y1500 HydrophobicContact CG1-CE2 4.37Å; V1496-Y1500 WeakPolarHBondContact O-CD2 3.22Å; V1496-Y1500 PolarHBondContact O-N 2.95Å
1501G41.7Very low54.8Low62 Ų62132.2 Ų132.264%0.63969%0.686SS**THydrogen-bonded Turntrans-84.7-4.3175.300000115.3W1497W1497-G1501 PolarHBondContact O-N 3.49Å
1502C38.6Very low53.2Low117 Ų117131.6 Ų131.679%0.79169%0.688SS**THydrogen-bonded Turntrans-111.617.6-178.9-80.80000114.1
1503V40.9Very low51.5Low186 Ų186130.8 Ų130.8100%1.12769%0.691SS**  trans-124.80169.8-175.70000108.4

Retrieved 1,503 of 1,503 residues in 2918.1 ms (Link to these results)