A0A087XER3_POEFO Loading...

Coiled-coil domain-containing protein 39

Required for assembly of dynein regulatory complex (DRC) and inner dynein arm (IDA) complexes, which are responsible for ciliary beat regulation, thereby playing a central role in motility in cilia and flagella. Probably acts together with CCDC40 to form a molecular ruler that determines the 96 nanometer (nm) repeat length and arrangements of components in cilia and flagella. Not required for outer dynein arm complexes assembly.

AlphaFold DB , UniProt , Accession A0A087XER3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 601 aa.

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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
1D54.3Low53.6Low209 Ų209164 Ų164100%1.11879%0.789SS**  038.60-60.2-11000116.9
2K59.3Low53.2Low191 Ų191160.3 Ų160.383%0.8379%0.785SS**  trans-139.9-4.5170.7-122.8177.7-178.1-178.60115.3
3I56.8Low52.3Low137 Ų137160.8 Ų160.870%0.70378%0.781SS**SBendtrans-102.1-17.9-173.3-62.4172.6000111.9
4L50.8Low51.4Low132 Ų132155.8 Ų155.869%0.69178%0.778SS**SBendtrans-85-10.8-173.9-77.1161.6000115.4
5Y58.7Low50.8Low224 Ų224154.2 Ų154.288%0.87877%0.772SS**SBendtrans-91.9-20.3-177.6-155.1-95.6000113.7I7Y5-I7 VanDerWaalsContact C-N 3.33Å; Y5-I7 PolarHBondContact O-N 3.45Å
6E61.1Low50.4Low177 Ų177150.8 Ų150.883%0.82776%0.764SS**THydrogen-bonded Turntrans-82.9-6.1-176.6-75.6-179.216100114
7I52.5Low50Low124 Ų124153.1 Ų153.164%0.63677%0.771SS**THydrogen-bonded Turntrans-103.72.8-172.5-47.6175.8000112.8Y5 W9Y5-I7 VanDerWaalsContact C-N 3.33Å; Y5-I7 PolarHBondContact O-N 3.45Å; I7-W9 PolarHBondContact O-N 3.47Å
8G52Low50Low74 Ų74148.1 Ų148.176%0.76375%0.747SS**  trans65.836.5170.200000115.4
9W48.8Very low50.4Low189 Ų189146 Ų14672%0.71674%0.738SS**  trans-93.4114.1178.1-112.63.2000111.8I7I7-W9 PolarHBondContact O-N 3.47Å
10D42.4Very low51.3Low111 Ų111145.2 Ų145.259%0.59474%0.736SS**  trans-87.1135.2177.2-158.9-7.5000110.8T12 F13D10-T12 PolarHBondContact O-N 3.44Å; D10-F13 PolarHBondContact O-N 3.48Å
11Y52.7Low52.2Low236 Ų236140.7 Ų140.793%0.92572%0.721SS**THydrogen-bonded Turntrans-70.112.3-169.7-95.9-92.5000115
12T48.5Very low53Low120 Ų120135 Ų13574%0.73669%0.69SS**THydrogen-bonded Turntrans-118.43.5179.948.40000113.5D10D10-T12 PolarHBondContact O-N 3.44Å
13F41.7Very low53.5Low167 Ų167133 Ų13373%0.73268%0.678SS**SBendtrans-82.4116165.5-92.7-96.7000109.8D10 L15D10-F13 PolarHBondContact O-N 3.48Å; F13-L15 PolarHBondContact O-N 3.24Å
14A40.4Very low54.5Low90 Ų90128.9 Ų128.974%0.74466%0.664SS**  trans-50.3118.3168.400000108.5P16A14-P16 WeakPolarHBondContact O-CD 3.5Å
15L42.4Very low55.9Low132 Ų132126.9 Ų126.969%0.69165%0.653SS**  trans-40.6118.6163.9-87.8151.8000106.4F13 E17F13-L15 PolarHBondContact O-N 3.24Å; L15-E17 PolarHBondContact O-N 3.19Å
16P43.3Very low56.8Low99 Ų99121.7 Ų121.764%0.64364%0.64SS**  trans-48.5125.8173.3-23.631.7000106.1A14 L18A14-P16 WeakPolarHBondContact O-CD 3.5Å; P16-L18 PolarHBondContact O-N 3.48Å
17E43.6Very low57.6Low190 Ų190119 Ų11989%0.88863%0.628SS**  trans-41.5109.5174.1-73.1-178.2154.900106.3L15 N19L15-E17 PolarHBondContact O-N 3.19Å; E17-N19 VanDerWaalsContact C-N 3.32Å; E17-N19 PolarHBondContact O-N 3.33Å
18L51.3Low58.9Low63 Ų63119 Ų11933%0.3363%0.625SS.*  trans-57.2108.9-177.3-94.292.4000104.3P16 D20 N22P16-L18 PolarHBondContact O-N 3.48Å; L18-D20 PolarHBondContact O-N 2.83Å; L18-N22 HydrophobicContact CB-CB 4.33Å; L18-N22 HydrophobicContact CD2-CB 3.69Å; L18-N22 HydrophobicContact CG-CB 4.11Å
19N56.4Low60.3Low109 Ų109118.9 Ų118.958%0.58361%0.609SS**  trans-42.8136.2166.2-178.80.8000106.5E17 A21 N22E17-N19 VanDerWaalsContact C-N 3.32Å; E17-N19 PolarHBondContact O-N 3.33Å; N19-A21 CarbonylContact O-C 3.56Å; N19-A21 PolarHBondContact O-N 3.49Å; N19-N22 PolarHBondContact O-N 3Å
20D67.8Low61.9Low130 Ų130117 Ų11770%0.69560%0.603SS**Hα-helixtrans-48.4-28.7-175.2-70.4-40.8000112.2L18 N22 R23 A24L18-D20 PolarHBondContact O-N 2.83Å; D20-N22 PolarHBondContact O-N 3.37Å; D20-R23 PolarHBondContact O-N 3.35Å; D20-A24 WeakPolarHBondContact O-CB 3.49Å; D20-A24 PolarHBondContact O-N 3.43Å
21A71.3Confident63.8Low50 Ų50117.7 Ų117.741%0.41360%0.601SS.*Hα-helixtrans-56.1-43.7170.900000115.3N19 L25N19-A21 CarbonylContact O-C 3.56Å; N19-A21 PolarHBondContact O-N 3.49Å; A21-L25 WeakPolarHBondContact O-CB 3.37Å; A21-L25 PolarHBondContact O-N 3.44Å
22N69.9Low65.3Low89 Ų89108.6 Ų108.648%0.47657%0.574SS.*Hα-helixtrans-77.4-28.8-176.6-73-7.6000112.3L18 N19 D20 L26L18-N22 HydrophobicContact CB-CB 4.33Å; L18-N22 HydrophobicContact CD2-CB 3.69Å; L18-N22 HydrophobicContact CG-CB 4.11Å; N19-N22 PolarHBondContact O-N 3Å; D20-N22 PolarHBondContact O-N 3.37Å; N22-L26 PolarHBondContact O-N 3.21Å
23R71.1Confident66.7Low151 Ų151108.4 Ų108.457%0.5757%0.565SS**Hα-helixtrans-72.5-39.8173-163.9-178.6-58.1177.36.7110.9D20 L25 L26 E27D20-R23 PolarHBondContact O-N 3.35Å; R23-L25 VanDerWaalsContact C-N 3.35Å; R23-L26 PolarHBondContact O-N 3.34Å; R23-E27 PolarHBondContact O-N 3.42Å; R23-E27 VanDerWaalsContact O-N 3.16Å
24A78.1Confident68.8Low49 Ų49104.1 Ų104.141%0.40555%0.548SS..Hα-helixtrans-60.7-42.5171.900000112D20 L26 E27 E28D20-A24 WeakPolarHBondContact O-CB 3.49Å; D20-A24 PolarHBondContact O-N 3.43Å; A24-L26 PolarHBondContact O-N 3.24Å; A24-E27 PolarHBondContact O-N 3.23Å; A24-E28 WeakPolarHBondContact O-CG 3.47Å; A24-E28 PolarHBondContact O-N 3.08Å
25L78.6Confident70.9Confident90 Ų90104.9 Ų104.947%0.47154%0.536SS..Hα-helixtrans-61.9-39.2176.5-105.5157.2000113.2A21 R23 E28 V29A21-L25 WeakPolarHBondContact O-CB 3.37Å; A21-L25 PolarHBondContact O-N 3.44Å; R23-L25 VanDerWaalsContact C-N 3.35Å; L25-E28 PolarHBondContact O-N 3.48Å; L25-V29 VanDerWaalsContact O-CG2 3.27Å; L25-V29 WeakPolarHBondContact O-CG2 3.47Å; L25-V29 PolarHBondContact O-N 3.39Å
26L77.8Confident72.9Confident116 Ų116103.6 Ų103.661%0.60753%0.534SS*.Hα-helixtrans-69.4-38.3177.6-112.3159.2000112.3N22 R23 A24 V29 Y30N22-L26 PolarHBondContact O-N 3.21Å; R23-L26 PolarHBondContact O-N 3.34Å; A24-L26 PolarHBondContact O-N 3.24Å; L26-V29 PolarHBondContact O-N 3.35Å; L26-Y30 WeakPolarHBondContact O-CB 3.31Å; L26-Y30 PolarHBondContact O-N 3.27Å
27E78.7Confident75Confident121 Ų121103.7 Ų103.757%0.56553%0.528SS*.Hα-helixtrans-66.1-37171.1-78.6-174.9-179.100112.1R23 A24 K31R23-E27 PolarHBondContact O-N 3.42Å; R23-E27 VanDerWaalsContact O-N 3.16Å; A24-E27 PolarHBondContact O-N 3.23Å; E27-K31 WeakPolarHBondContact O-CB 3.42Å; E27-K31 VanDerWaalsContact O-CG 3.29Å; E27-K31 WeakPolarHBondContact O-CG 3.44Å; E27-K31 PolarHBondContact O-N 3.34Å
28E80.8Confident77Confident124 Ų124100 Ų10058%0.57951%0.511SS*.Hα-helixtrans-64-44.5172.3-81.4-176.917000111.9A24 L25 K31 A32A24-E28 WeakPolarHBondContact O-CG 3.47Å; A24-E28 PolarHBondContact O-N 3.08Å; L25-E28 PolarHBondContact O-N 3.48Å; E28-K31 PolarHBondContact O-N 3.13Å; E28-A32 WeakPolarHBondContact O-CB 3.45Å; E28-A32 PolarHBondContact O-N 3.19Å
29V80.5Confident78.7Confident70 Ų70101.9 Ų101.942%0.42452%0.518SS..Hα-helixtrans-64.2-44176.7170.30000110.7L25 L26 K31 A32 E33L25-V29 VanDerWaalsContact O-CG2 3.27Å; L25-V29 WeakPolarHBondContact O-CG2 3.47Å; L25-V29 PolarHBondContact O-N 3.39Å; L26-V29 PolarHBondContact O-N 3.35Å; V29-K31 VanDerWaalsContact C-N 3.35Å; V29-K31 PolarHBondContact O-N 3.39Å; V29-A32 PolarHBondContact O-N 3.13Å; V29-E33 HydrophobicContact CG1-CG 4.35Å; V29-E33 WeakPolarHBondContact O-CB 3.44Å; V29-E33 WeakPolarHBondContact O-CG 3.46Å; V29-E33 PolarHBondContact O-N 3.38Å
30Y82.5Confident80.2Confident149 Ų14998 Ų9858%0.58450%0.504SS*.Hα-helixtrans-64.9-38.8177.5-170.8-96.5000112.1L26 E33 M34L26-Y30 WeakPolarHBondContact O-CB 3.31Å; L26-Y30 PolarHBondContact O-N 3.27Å; Y30-E33 PolarHBondContact O-N 3.15Å; Y30-M34 HydrophobicContact CD1-CG 4.22Å; Y30-M34 HydrophobicContact CE1-CG 3.86Å; Y30-M34 WeakPolarHBondContact O-CB 3.44Å; Y30-M34 WeakPolarHBondContact O-CG 3.44Å; Y30-M34 PolarHBondContact O-N 3.2Å
31K83.2Confident81.2Confident127 Ų12795.7 Ų95.755%0.55249%0.491SS*.Hα-helixtrans-61.7-47171.5-79174.5-177.2170.50111.3E27 E28 V29 E33 M34 E35E27-K31 WeakPolarHBondContact O-CB 3.42Å; E27-K31 VanDerWaalsContact O-CG 3.29Å; E27-K31 WeakPolarHBondContact O-CG 3.44Å; E27-K31 PolarHBondContact O-N 3.34Å; E28-K31 PolarHBondContact O-N 3.13Å; V29-K31 VanDerWaalsContact C-N 3.35Å; V29-K31 PolarHBondContact O-N 3.39Å; K31-E33 VanDerWaalsContact C-N 3.34Å; K31-E33 PolarHBondContact O-N 3.17Å; K31-M34 PolarHBondContact O-N 3.05Å; K31-E35 WeakPolarHBondContact O-CB 3.46Å; K31-E35 VanDerWaalsContact O-CG 3.29Å; K31-E35 WeakPolarHBondContact O-CG 3.49Å; K31-E35 PolarHBondContact O-N 3.1Å
32A82.3Confident82Confident45 Ų4598 Ų9837%0.37249%0.493SS..Hα-helixtrans-62.5-39.6177.600000112.1E28 V29 E35 V36E28-A32 WeakPolarHBondContact O-CB 3.45Å; E28-A32 PolarHBondContact O-N 3.19Å; V29-A32 PolarHBondContact O-N 3.13Å; A32-E35 PolarHBondContact O-N 3.48Å; A32-V36 WeakPolarHBondContact O-CB 3.45Å; A32-V36 VanDerWaalsContact O-CG2 3.23Å; A32-V36 WeakPolarHBondContact O-CG2 3.47Å; A32-V36 PolarHBondContact O-N 3.11Å
33E79.6Confident82.9Confident116 Ų11699 Ų9954%0.54250%0.498SS..Hα-helixtrans-65.1-41.9175.3-76.9-178.9166.800111.8V29 Y30 K31 V36 L37V29-E33 HydrophobicContact CG1-CG 4.35Å; V29-E33 WeakPolarHBondContact O-CB 3.44Å; V29-E33 WeakPolarHBondContact O-CG 3.46Å; V29-E33 PolarHBondContact O-N 3.38Å; Y30-E33 PolarHBondContact O-N 3.15Å; K31-E33 VanDerWaalsContact C-N 3.34Å; K31-E33 PolarHBondContact O-N 3.17Å; E33-V36 PolarHBondContact O-N 2.91Å; E33-L37 WeakPolarHBondContact O-CB 3.37Å; E33-L37 PolarHBondContact O-N 3.4Å
34M84.3Confident83.8Confident76 Ų7698.2 Ų98.237%0.37450%0.498SS..Hα-helixtrans-65.9-39.3174.5-76.9-56.7-39.900112.5Y30 K31 L37 Q38Y30-M34 HydrophobicContact CD1-CG 4.22Å; Y30-M34 HydrophobicContact CE1-CG 3.86Å; Y30-M34 WeakPolarHBondContact O-CB 3.44Å; Y30-M34 WeakPolarHBondContact O-CG 3.44Å; Y30-M34 PolarHBondContact O-N 3.2Å; K31-M34 PolarHBondContact O-N 3.05Å; M34-L37 PolarHBondContact O-N 3.45Å; M34-Q38 WeakPolarHBondContact O-CB 3.42Å; M34-Q38 WeakPolarHBondContact O-CG 3.36Å; M34-Q38 PolarHBondContact O-N 3.09Å
35E84.7Confident84.3Confident107 Ų107100.9 Ų100.950%0.550%0.502SS..Hα-helixtrans-63.8-42.5173.6-75.5171.8-174.700111.3K31 A32 L37 Q38 H39K31-E35 WeakPolarHBondContact O-CB 3.46Å; K31-E35 VanDerWaalsContact O-CG 3.29Å; K31-E35 WeakPolarHBondContact O-CG 3.49Å; K31-E35 PolarHBondContact O-N 3.1Å; A32-E35 PolarHBondContact O-N 3.48Å; E35-L37 VanDerWaalsContact C-N 3.33Å; E35-L37 PolarHBondContact O-N 3.27Å; E35-Q38 PolarHBondContact O-N 2.96Å; E35-H39 WeakPolarHBondContact O-CB 3.29Å; E35-H39 PolarHBondContact O-CD2 2.96Å; E35-H39 VanDerWaalsContact O-CD2 3.25Å; E35-H39 PolarHBondContact O-N 3.47Å
36V84.4Confident84.8Confident105 Ų105101.5 Ų101.564%0.63651%0.505SS*.Hα-helixtrans-63.2-39.3174.5168.20000111.3A32 E33 G40A32-V36 WeakPolarHBondContact O-CB 3.45Å; A32-V36 VanDerWaalsContact O-CG2 3.23Å; A32-V36 WeakPolarHBondContact O-CG2 3.47Å; A32-V36 PolarHBondContact O-N 3.11Å; E33-V36 PolarHBondContact O-N 2.91Å; V36-G40 WeakPolarHBondContact O-CA 3.47Å; V36-G40 PolarHBondContact O-N 3.38Å
37L87.4Confident85.5Confident100 Ų100102.7 Ų102.752%0.52451%0.505SS..Hα-helixtrans-66.3-42.1174.7-109.8154.1000112E33 M34 E35 G40 N41E33-L37 WeakPolarHBondContact O-CB 3.37Å; E33-L37 PolarHBondContact O-N 3.4Å; M34-L37 PolarHBondContact O-N 3.45Å; E35-L37 VanDerWaalsContact C-N 3.33Å; E35-L37 PolarHBondContact O-N 3.27Å; L37-G40 PolarHBondContact O-N 2.98Å; L37-N41 VanDerWaalsContact O-CG 3.32Å; L37-N41 PolarHBondContact O-N 3.45Å; L37-N41 PolarHBondContact O-ND2 3.11Å
38Q86.9Confident86Confident113 Ų113101.5 Ų101.553%0.52850%0.503SS..Hα-helixtrans-62.4-53.4175.1-78.7-179.4-7.300111.2M34 E35 G40 N41 E42M34-Q38 WeakPolarHBondContact O-CB 3.42Å; M34-Q38 WeakPolarHBondContact O-CG 3.36Å; M34-Q38 PolarHBondContact O-N 3.09Å; E35-Q38 PolarHBondContact O-N 2.96Å; Q38-G40 VanDerWaalsContact C-N 3.26Å; Q38-G40 PolarHBondContact O-N 3.39Å; Q38-N41 PolarHBondContact O-N 2.91Å; Q38-N41 VanDerWaalsContact O-N 3.07Å; Q38-E42 WeakPolarHBondContact O-CG 3.46Å; Q38-E42 PolarHBondContact O-N 3.12Å
39H86.4Confident86.5Confident103 Ų103102.8 Ų102.848%0.47750%0.502SS..Hα-helixtrans-61.5-35.6175.9-70.7-41.4000112.3E35 N41 E42 I43E35-H39 WeakPolarHBondContact O-CB 3.29Å; E35-H39 PolarHBondContact O-CD2 2.96Å; E35-H39 VanDerWaalsContact O-CD2 3.25Å; E35-H39 PolarHBondContact O-N 3.47Å; H39-N41 VanDerWaalsContact C-N 3.33Å; H39-N41 PolarHBondContact O-N 3.47Å; H39-E42 IonicContact CE1-OE2 2.72Å; H39-E42 IonicContact CG-OE2 3.94Å; H39-E42 IonicContact ND1-OE2 2.89Å; H39-E42 PolarHBondContact ND1-OE2 2.93Å; H39-E42 PolarHBondContact O-N 3.48Å; H39-I43 WeakPolarHBondContact O-CB 3.24Å; H39-I43 WeakPolarHBondContact O-CD1 3.29Å; H39-I43 WeakPolarHBondContact O-CG1 3.38Å; H39-I43 PolarHBondContact O-N 3.47Å
40G88.8Confident87Confident27 Ų27104.9 Ų104.928%0.27851%0.508SS..Hα-helixtrans-62.3-39.2173.800000112.7V36 L37 Q38 K44V36-G40 WeakPolarHBondContact O-CA 3.47Å; V36-G40 PolarHBondContact O-N 3.38Å; L37-G40 PolarHBondContact O-N 2.98Å; Q38-G40 VanDerWaalsContact C-N 3.26Å; Q38-G40 PolarHBondContact O-N 3.39Å; G40-K44 WeakPolarHBondContact O-CG 3.4Å; G40-K44 PolarHBondContact O-N 3.44Å; G40-K44 VanDerWaalsContact O-N 3.13Å
41N87.8Confident87.4Confident81 Ų81103 Ų10343%0.43350%0.504SS..Hα-helixtrans-71.5-41.9174-71.4-22.6000111.8L37 Q38 H39 I43 K44 E45L37-N41 VanDerWaalsContact O-CG 3.32Å; L37-N41 PolarHBondContact O-N 3.45Å; L37-N41 PolarHBondContact O-ND2 3.11Å; Q38-N41 PolarHBondContact O-N 2.91Å; Q38-N41 VanDerWaalsContact O-N 3.07Å; H39-N41 VanDerWaalsContact C-N 3.33Å; H39-N41 PolarHBondContact O-N 3.47Å; N41-I43 VanDerWaalsContact C-N 3.33Å; N41-I43 PolarHBondContact O-N 3.21Å; N41-K44 WeakPolarHBondContact O-CB 3.41Å; N41-K44 PolarHBondContact O-N 2.87Å; N41-K44 VanDerWaalsContact O-N 3.15Å; N41-E45 PolarHBondContact O-N 3.45Å
42E88.7Confident87.9Confident98 Ų98101.9 Ų101.946%0.45850%0.504SS..Hα-helixtrans-59.4-42.6174.1-70.4173.5164.800111.7Q38 H39 K44 E45 I46Q38-E42 WeakPolarHBondContact O-CG 3.46Å; Q38-E42 PolarHBondContact O-N 3.12Å; H39-E42 IonicContact CE1-OE2 2.72Å; H39-E42 IonicContact CG-OE2 3.94Å; H39-E42 IonicContact ND1-OE2 2.89Å; H39-E42 PolarHBondContact ND1-OE2 2.93Å; H39-E42 PolarHBondContact O-N 3.48Å; E42-K44 VanDerWaalsContact C-N 3.34Å; E42-K44 PolarHBondContact O-N 3.41Å; E42-E45 PolarHBondContact O-N 3.06Å; E42-I46 WeakPolarHBondContact O-CB 3.44Å; E42-I46 VanDerWaalsContact O-CG1 3.24Å; E42-I46 WeakPolarHBondContact O-CG1 3.49Å; E42-I46 PolarHBondContact O-N 3.22Å
43I88.1Confident88.3Confident111 Ų111104.8 Ų104.857%0.56951%0.512SS*.Hα-helixtrans-62.7-41.9175.6-71.8165.8000110.6H39 N41 I46 K47H39-I43 WeakPolarHBondContact O-CB 3.24Å; H39-I43 WeakPolarHBondContact O-CD1 3.29Å; H39-I43 WeakPolarHBondContact O-CG1 3.38Å; H39-I43 PolarHBondContact O-N 3.47Å; N41-I43 VanDerWaalsContact C-N 3.33Å; N41-I43 PolarHBondContact O-N 3.21Å; I43-I46 PolarHBondContact O-N 2.95Å; I43-K47 VanDerWaalsContact O-CB 3.28Å; I43-K47 WeakPolarHBondContact O-CB 3.4Å; I43-K47 PolarHBondContact O-N 3.37Å
44K89.5Confident88.9Confident135 Ų135103.3 Ų103.359%0.58751%0.508SS*.Hα-helixtrans-63-46.8175.1-76.5175.9-177.1173.20111.4G40 N41 E42 I46 K47 D48G40-K44 WeakPolarHBondContact O-CG 3.4Å; G40-K44 PolarHBondContact O-N 3.44Å; G40-K44 VanDerWaalsContact O-N 3.13Å; N41-K44 WeakPolarHBondContact O-CB 3.41Å; N41-K44 PolarHBondContact O-N 2.87Å; N41-K44 VanDerWaalsContact O-N 3.15Å; E42-K44 VanDerWaalsContact C-N 3.34Å; E42-K44 PolarHBondContact O-N 3.41Å; K44-I46 VanDerWaalsContact C-N 3.34Å; K44-I46 PolarHBondContact O-N 3.46Å; K44-K47 PolarHBondContact O-N 2.97Å; K44-K47 VanDerWaalsContact O-N 3.15Å; K44-D48 VanDerWaalsContact O-CG 3.3Å; K44-D48 PolarHBondContact O-N 3.2Å
45E89.5Confident89.3Confident104 Ų104103.4 Ų103.449%0.48651%0.507SS..Hα-helixtrans-59.6-43.6176.3-74.5-169.7-16500112.4N41 E42 K47 D48 R49N41-E45 PolarHBondContact O-N 3.45Å; E42-E45 PolarHBondContact O-N 3.06Å; E45-K47 VanDerWaalsContact C-N 3.32Å; E45-K47 PolarHBondContact O-N 3.43Å; E45-D48 PolarHBondContact O-N 3Å; E45-R49 WeakPolarHBondContact O-CB 3.49Å; E45-R49 VanDerWaalsContact O-CG 3.26Å; E45-R49 WeakPolarHBondContact O-CG 3.46Å; E45-R49 PolarHBondContact O-N 2.97Å; E45-R49 IonicContact OE2-NH2 3.71Å; E45-R49 PolarHBondContact OE2-NH2 2.74Å; E45-R49 VanDerWaalsContact OE2-NH2 3.17Å
46I88.1Confident89.6Confident104 Ų104100.9 Ų100.953%0.53350%0.502SS..Hα-helixtrans-63-41.8176.5-70.4167.3000110.3E42 I43 K44 R49 Q50E42-I46 WeakPolarHBondContact O-CB 3.44Å; E42-I46 VanDerWaalsContact O-CG1 3.24Å; E42-I46 WeakPolarHBondContact O-CG1 3.49Å; E42-I46 PolarHBondContact O-N 3.22Å; I43-I46 PolarHBondContact O-N 2.95Å; K44-I46 VanDerWaalsContact C-N 3.34Å; K44-I46 PolarHBondContact O-N 3.46Å; I46-R49 PolarHBondContact O-N 2.76Å; I46-Q50 VanDerWaalsContact O-CB 3.31Å; I46-Q50 WeakPolarHBondContact O-CB 3.44Å; I46-Q50 PolarHBondContact O-N 3.47Å
47K92.6Very high90.1Very high140 Ų140100.8 Ų100.861%0.60950%0.497SS*.Hα-helixtrans-65.9-42.1179-167176.5-177.7-178.90112I43 K44 E45 Q50 Q51I43-K47 VanDerWaalsContact O-CB 3.28Å; I43-K47 WeakPolarHBondContact O-CB 3.4Å; I43-K47 PolarHBondContact O-N 3.37Å; K44-K47 PolarHBondContact O-N 2.97Å; K44-K47 VanDerWaalsContact O-N 3.15Å; E45-K47 VanDerWaalsContact C-N 3.32Å; E45-K47 PolarHBondContact O-N 3.43Å; K47-Q50 PolarHBondContact O-N 3.44Å; K47-Q51 WeakPolarHBondContact O-CB 3.45Å; K47-Q51 PolarHBondContact O-N 2.93Å
48D89.9Confident90.4Very high96 Ų96102.7 Ų102.751%0.51350%0.503SS..Hα-helixtrans-65.9-41.6175.9-67.4-15.6000110.9K44 E45 Q51 L52K44-D48 VanDerWaalsContact O-CG 3.3Å; K44-D48 PolarHBondContact O-N 3.2Å; E45-D48 PolarHBondContact O-N 3Å; D48-Q51 PolarHBondContact O-N 3.37Å; D48-L52 WeakPolarHBondContact O-CG 3.41Å; D48-L52 PolarHBondContact O-N 3.42Å
49R90.9Very high90.7Very high151 Ų151104.4 Ų104.457%0.5751%0.505SS*.Hα-helixtrans-61.9-43.4172.2-73.5176.6-163.3-179.611.5111.9E45 I46 Q51 L52 I53E45-R49 WeakPolarHBondContact O-CB 3.49Å; E45-R49 VanDerWaalsContact O-CG 3.26Å; E45-R49 WeakPolarHBondContact O-CG 3.46Å; E45-R49 PolarHBondContact O-N 2.97Å; E45-R49 IonicContact OE2-NH2 3.71Å; E45-R49 PolarHBondContact OE2-NH2 2.74Å; E45-R49 VanDerWaalsContact OE2-NH2 3.17Å; I46-R49 PolarHBondContact O-N 2.76Å; R49-Q51 VanDerWaalsContact C-N 3.31Å; R49-Q51 PolarHBondContact O-N 2.86Å; R49-L52 PolarHBondContact O-N 3.4Å; R49-I53 VanDerWaalsContact O-CG1 3.29Å; R49-I53 WeakPolarHBondContact O-CG1 3.45Å; R49-I53 PolarHBondContact O-N 2.84Å
50Q90.8Very high91.1Very high115 Ų115102.6 Ų102.654%0.53750%0.504SS..Hα-helixtrans-63.2-39.9177.4-172179.86.100111I46 K47 I53 N54I46-Q50 VanDerWaalsContact O-CB 3.31Å; I46-Q50 WeakPolarHBondContact O-CB 3.44Å; I46-Q50 PolarHBondContact O-N 3.47Å; K47-Q50 PolarHBondContact O-N 3.44Å; Q50-I53 PolarHBondContact O-N 2.89Å; Q50-N54 WeakPolarHBondContact O-CB 3.36Å; Q50-N54 VanDerWaalsContact O-CG 3.25Å; Q50-N54 PolarHBondContact O-N 3.49Å; Q50-N54 PolarHBondContact O-ND2 3.17Å
51Q92Very high91.3Very high109 Ų109104.6 Ų104.651%0.50951%0.511SS..Hα-helixtrans-62.9-47.8174.4-173.4177.7-21.400111.4K47 D48 R49 I53 N54 E55K47-Q51 WeakPolarHBondContact O-CB 3.45Å; K47-Q51 PolarHBondContact O-N 2.93Å; D48-Q51 PolarHBondContact O-N 3.37Å; R49-Q51 VanDerWaalsContact C-N 3.31Å; R49-Q51 PolarHBondContact O-N 2.86Å; Q51-I53 VanDerWaalsContact C-N 3.32Å; Q51-I53 PolarHBondContact O-N 3.31Å; Q51-N54 PolarHBondContact O-N 2.9Å; Q51-E55 WeakPolarHBondContact CG-OE1 3.42Å; Q51-E55 PolarHBondContact NE2-OE1 3.11Å; Q51-E55 WeakPolarHBondContact O-CB 3.41Å; Q51-E55 WeakPolarHBondContact O-CG 3.38Å; Q51-E55 PolarHBondContact O-N 3.41Å
52L92.2Very high91.7Very high104 Ų104105.7 Ų105.755%0.54551%0.513SS..Hα-helixtrans-59.3-40.9175.9-73.2169.2000112.5D48 R49 E55 S56D48-L52 WeakPolarHBondContact O-CG 3.41Å; D48-L52 PolarHBondContact O-N 3.42Å; R49-L52 PolarHBondContact O-N 3.4Å; L52-E55 PolarHBondContact O-N 3.36Å; L52-S56 WeakPolarHBondContact O-CB 3.49Å; L52-S56 PolarHBondContact O-N 3.45Å; L52-S56 PolarHBondContact O-OG 3.35Å
53I91.3Very high91.9Very high105 Ų105107 Ų10754%0.53852%0.52SS..Hα-helixtrans-65.5-45.9176.6-69.6167.8000110.1R49 Q50 Q51 E55 S56 L57R49-I53 VanDerWaalsContact O-CG1 3.29Å; R49-I53 WeakPolarHBondContact O-CG1 3.45Å; R49-I53 PolarHBondContact O-N 2.84Å; Q50-I53 PolarHBondContact O-N 2.89Å; Q51-I53 VanDerWaalsContact C-N 3.32Å; Q51-I53 PolarHBondContact O-N 3.31Å; I53-E55 VanDerWaalsContact C-N 3.35Å; I53-E55 PolarHBondContact O-N 2.88Å; I53-S56 WeakPolarHBondContact CA-OG 3.46Å; I53-S56 PolarHBondContact O-N 3.47Å; I53-S56 VanDerWaalsContact O-N 3.14Å; I53-S56 PolarHBondContact O-OG 2.91Å; I53-L57 WeakPolarHBondContact O-CB 3.47Å; I53-L57 PolarHBondContact O-N 3.33Å
54N93Very high92.2Very high86 Ų86106.4 Ų106.446%0.4652%0.517SS..Hα-helixtrans-61.3-42.8177-74.8-20.6000111.9Q50 Q51 S56 L57 Q58Q50-N54 WeakPolarHBondContact O-CB 3.36Å; Q50-N54 VanDerWaalsContact O-CG 3.25Å; Q50-N54 PolarHBondContact O-N 3.49Å; Q50-N54 PolarHBondContact O-ND2 3.17Å; Q51-N54 PolarHBondContact O-N 2.9Å; N54-S56 VanDerWaalsContact C-N 3.32Å; N54-S56 PolarHBondContact O-N 3.43Å; N54-L57 PolarHBondContact O-N 3.22Å; N54-Q58 VanDerWaalsContact O-CB 3.29Å; N54-Q58 WeakPolarHBondContact O-CB 3.48Å; N54-Q58 PolarHBondContact O-N 3.49Å
55E92.6Very high92.5Very high77 Ų77103.5 Ų103.536%0.3651%0.51SS..Hα-helixtrans-64.1-35.6175-72.7173.6-168.600112.2Q51 L52 I53 R59Q51-E55 WeakPolarHBondContact CG-OE1 3.42Å; Q51-E55 PolarHBondContact NE2-OE1 3.11Å; Q51-E55 WeakPolarHBondContact O-CB 3.41Å; Q51-E55 WeakPolarHBondContact O-CG 3.38Å; Q51-E55 PolarHBondContact O-N 3.41Å; L52-E55 PolarHBondContact O-N 3.36Å; I53-E55 VanDerWaalsContact C-N 3.35Å; I53-E55 PolarHBondContact O-N 2.88Å; E55-R59 WeakPolarHBondContact O-CB 3.48Å; E55-R59 VanDerWaalsContact O-CG 3.3Å; E55-R59 WeakPolarHBondContact O-CG 3.48Å; E55-R59 PolarHBondContact O-N 3.33Å; E55-R59 PolarHBondContact O-NE 2.89Å
56S91.4Very high92.7Very high55 Ų55102.2 Ų102.239%0.38551%0.507SS..Hα-helixtrans-74.4-37.5175.769.50000112.7L52 I53 N54 R59 S60L52-S56 WeakPolarHBondContact O-CB 3.49Å; L52-S56 PolarHBondContact O-N 3.45Å; L52-S56 PolarHBondContact O-OG 3.35Å; I53-S56 WeakPolarHBondContact CA-OG 3.46Å; I53-S56 PolarHBondContact O-N 3.47Å; I53-S56 VanDerWaalsContact O-N 3.14Å; I53-S56 PolarHBondContact O-OG 2.91Å; N54-S56 VanDerWaalsContact C-N 3.32Å; N54-S56 PolarHBondContact O-N 3.43Å; S56-R59 PolarHBondContact O-N 3.42Å; S56-S60 WeakPolarHBondContact O-CB 3.42Å; S56-S60 PolarHBondContact O-N 2.89Å
57L93.3Very high93Very high102 Ų102100.6 Ų100.653%0.53450%0.502SS..Hα-helixtrans-65.7-41.3172.6-176.766.3000110.8I53 N54 S60 T61I53-L57 WeakPolarHBondContact O-CB 3.47Å; I53-L57 PolarHBondContact O-N 3.33Å; N54-L57 PolarHBondContact O-N 3.22Å; L57-S60 PolarHBondContact O-N 3.34Å; L57-T61 HydrophobicContact CD1-CG2 4.34Å; L57-T61 HydrophobicContact CG-CG2 4.41Å; L57-T61 WeakPolarHBondContact O-CB 3.42Å; L57-T61 VanDerWaalsContact O-CG2 3.31Å; L57-T61 WeakPolarHBondContact O-CG2 3.31Å; L57-T61 PolarHBondContact O-N 3.12Å; L57-T61 PolarHBondContact O-OG1 2.88Å
58Q94.5Very high93.2Very high141 Ų14198.1 Ų98.166%0.65949%0.492SS*.Hα-helixtrans-63.4-42.1174.2-170.4177.90.800111.1N54 T61 Q62N54-Q58 VanDerWaalsContact O-CB 3.29Å; N54-Q58 WeakPolarHBondContact O-CB 3.48Å; N54-Q58 PolarHBondContact O-N 3.49Å; Q58-T61 VanDerWaalsContact CA-OG1 3.31Å; Q58-T61 WeakPolarHBondContact CA-OG1 3.39Å; Q58-T61 PolarHBondContact O-OG1 3.12Å; Q58-Q62 VanDerWaalsContact O-CB 3.3Å; Q58-Q62 WeakPolarHBondContact O-CB 3.33Å; Q58-Q62 PolarHBondContact O-N 3.45Å
59R94.4Very high93.4Very high148 Ų14897.3 Ų97.356%0.55849%0.491SS*.Hα-helixtrans-61.9-44.5172.4-79.8-179.7-82.1166.5-11.4112.1E55 S56 Q62 Q63E55-R59 WeakPolarHBondContact O-CB 3.48Å; E55-R59 VanDerWaalsContact O-CG 3.3Å; E55-R59 WeakPolarHBondContact O-CG 3.48Å; E55-R59 PolarHBondContact O-N 3.33Å; E55-R59 PolarHBondContact O-NE 2.89Å; S56-R59 PolarHBondContact O-N 3.42Å; R59-Q62 PolarHBondContact O-N 3.5Å; R59-Q63 WeakPolarHBondContact O-CB 3.45Å; R59-Q63 VanDerWaalsContact O-CG 3.26Å; R59-Q63 WeakPolarHBondContact O-CG 3.38Å; R59-Q63 PolarHBondContact O-N 3.47Å
60S93.4Very high93.6Very high66 Ų6695.3 Ų95.346%0.46249%0.491SS..Hα-helixtrans-68-41.8-179.3-178.10000112.5S56 L57 Q63 L64S56-S60 WeakPolarHBondContact O-CB 3.42Å; S56-S60 PolarHBondContact O-N 2.89Å; L57-S60 PolarHBondContact O-N 3.34Å; S60-Q63 WeakPolarHBondContact O-CB 3.34Å; S60-Q63 PolarHBondContact O-N 2.99Å; S60-L64 PolarHBondContact O-N 2.82Å
61T94Very high93.9Very high69 Ų6994.8 Ų94.842%0.42349%0.491SS..Hα-helixtrans-65.3-42.9174.648.10000111.5L57 Q58 Q63 L64 V65L57-T61 HydrophobicContact CD1-CG2 4.34Å; L57-T61 HydrophobicContact CG-CG2 4.41Å; L57-T61 WeakPolarHBondContact O-CB 3.42Å; L57-T61 VanDerWaalsContact O-CG2 3.31Å; L57-T61 WeakPolarHBondContact O-CG2 3.31Å; L57-T61 PolarHBondContact O-N 3.12Å; L57-T61 PolarHBondContact O-OG1 2.88Å; Q58-T61 VanDerWaalsContact CA-OG1 3.31Å; Q58-T61 WeakPolarHBondContact CA-OG1 3.39Å; Q58-T61 PolarHBondContact O-OG1 3.12Å; T61-Q63 VanDerWaalsContact C-N 3.33Å; T61-Q63 PolarHBondContact O-N 3.39Å; T61-L64 PolarHBondContact O-N 3.46Å; T61-V65 WeakPolarHBondContact O-CG2 3.41Å; T61-V65 PolarHBondContact O-N 2.88Å
62Q94.6Very high94.1Very high104 Ų10495.2 Ų95.249%0.48649%0.492SS..Hα-helixtrans-62.3-40.5173-17362.152.900111.8Q58 R59 V65 N66Q58-Q62 VanDerWaalsContact O-CB 3.3Å; Q58-Q62 WeakPolarHBondContact O-CB 3.33Å; Q58-Q62 PolarHBondContact O-N 3.45Å; R59-Q62 PolarHBondContact O-N 3.5Å; Q62-V65 PolarHBondContact O-N 3.07Å; Q62-N66 PolarHBondContact NE2-OD1 2.94Å; Q62-N66 WeakPolarHBondContact O-CB 3.48Å; Q62-N66 PolarHBondContact O-N 3.26Å; Q62-N66 PolarHBondContact O-ND2 3.46Å; Q62-N66 PolarHBondContact O-OD1 3.5Å
63Q93.8Very high94.2Very high126 Ų12692.3 Ų92.359%0.58948%0.482SS*.Hα-helixtrans-61.5-43.5174.2-78.9176.2-10.200111.9R59 S60 T61 N66 T67R59-Q63 WeakPolarHBondContact O-CB 3.45Å; R59-Q63 VanDerWaalsContact O-CG 3.26Å; R59-Q63 WeakPolarHBondContact O-CG 3.38Å; R59-Q63 PolarHBondContact O-N 3.47Å; S60-Q63 WeakPolarHBondContact O-CB 3.34Å; S60-Q63 PolarHBondContact O-N 2.99Å; T61-Q63 VanDerWaalsContact C-N 3.33Å; T61-Q63 PolarHBondContact O-N 3.39Å; Q63-N66 PolarHBondContact O-N 2.77Å; Q63-T67 WeakPolarHBondContact O-CG2 3.39Å; Q63-T67 PolarHBondContact O-N 3.39Å; Q63-T67 PolarHBondContact O-OG1 3.43Å
64L94.3Very high94.4Very high98 Ų9891.4 Ų91.451%0.51348%0.479SS..Hα-helixtrans-62.1-45.5177-175.569.9000111.6S60 T61 N66 T67 E68S60-L64 PolarHBondContact O-N 2.82Å; T61-L64 PolarHBondContact O-N 3.46Å; L64-N66 VanDerWaalsContact C-N 3.3Å; L64-N66 PolarHBondContact O-N 2.95Å; L64-T67 WeakPolarHBondContact CA-OG1 3.5Å; L64-T67 PolarHBondContact O-N 3.41Å; L64-T67 PolarHBondContact O-OG1 2.86Å; L64-E68 WeakPolarHBondContact O-CB 3.25Å; L64-E68 WeakPolarHBondContact O-CG 3.47Å; L64-E68 PolarHBondContact O-N 3.49Å
65V95.8Very high94.5Very high73 Ų7393.1 Ų93.144%0.44248%0.484SS..Hα-helixtrans-62.2-40.7176173.10000110.8T61 Q62 E68 T69T61-V65 WeakPolarHBondContact O-CG2 3.41Å; T61-V65 PolarHBondContact O-N 2.88Å; Q62-V65 PolarHBondContact O-N 3.07Å; V65-E68 PolarHBondContact O-N 2.85Å; V65-T69 VanDerWaalsContact O-CG2 3.32Å; V65-T69 WeakPolarHBondContact O-CG2 3.5Å; V65-T69 PolarHBondContact O-N 2.93Å; V65-T69 PolarHBondContact O-OG1 3.26Å
66N94.8Very high94.7Very high77 Ų7796.3 Ų96.341%0.41250%0.497SS..Hα-helixtrans-64.1-41.1176.4-69.3-5.5000111.8Q62 Q63 L64 T69 L70Q62-N66 PolarHBondContact NE2-OD1 2.94Å; Q62-N66 WeakPolarHBondContact O-CB 3.48Å; Q62-N66 PolarHBondContact O-N 3.26Å; Q62-N66 PolarHBondContact O-ND2 3.46Å; Q62-N66 PolarHBondContact O-OD1 3.5Å; Q63-N66 PolarHBondContact O-N 2.77Å; L64-N66 VanDerWaalsContact C-N 3.3Å; L64-N66 PolarHBondContact O-N 2.95Å; N66-T69 WeakPolarHBondContact CA-OG1 3.39Å; N66-T69 PolarHBondContact O-OG1 3.28Å; N66-L70 VanDerWaalsContact O-CG 3.31Å; N66-L70 WeakPolarHBondContact O-CG 3.5Å; N66-L70 PolarHBondContact O-N 2.92Å; N66-L70 VanDerWaalsContact O-N 3.08Å
67T94.3Very high94.8Very high71 Ų7199.6 Ų99.644%0.43651%0.506SS..Hα-helixtrans-71.1-39177.454.50000112.2Q63 L64 T69 L70 L71Q63-T67 WeakPolarHBondContact O-CG2 3.39Å; Q63-T67 PolarHBondContact O-N 3.39Å; Q63-T67 PolarHBondContact O-OG1 3.43Å; L64-T67 WeakPolarHBondContact CA-OG1 3.5Å; L64-T67 PolarHBondContact O-N 3.41Å; L64-T67 PolarHBondContact O-OG1 2.86Å; T67-T69 VanDerWaalsContact C-N 3.35Å; T67-T69 PolarHBondContact O-N 3.31Å; T67-L70 PolarHBondContact O-N 3.05Å; T67-L71 WeakPolarHBondContact O-CG 3.43Å; T67-L71 PolarHBondContact O-N 2.88Å
68E95.3Very high95Very high88 Ų8899.1 Ų99.141%0.41150%0.503SS..Hα-helixtrans-62.2-40.7174.6-77.1-177.9-176.200112.4L64 V65 L71 K72L64-E68 WeakPolarHBondContact O-CB 3.25Å; L64-E68 WeakPolarHBondContact O-CG 3.47Å; L64-E68 PolarHBondContact O-N 3.49Å; V65-E68 PolarHBondContact O-N 2.85Å; E68-L71 PolarHBondContact O-N 2.89Å; E68-K72 WeakPolarHBondContact O-CG 3.35Å; E68-K72 PolarHBondContact O-N 3.46Å
69T95.3Very high95Very high79 Ų7998.7 Ų98.749%0.48550%0.501SS..Hα-helixtrans-67.4-38.9176.251.70000111.9V65 N66 T67 K72 A73V65-T69 VanDerWaalsContact O-CG2 3.32Å; V65-T69 WeakPolarHBondContact O-CG2 3.5Å; V65-T69 PolarHBondContact O-N 2.93Å; V65-T69 PolarHBondContact O-OG1 3.26Å; N66-T69 WeakPolarHBondContact CA-OG1 3.39Å; N66-T69 PolarHBondContact O-OG1 3.28Å; T67-T69 VanDerWaalsContact C-N 3.35Å; T67-T69 PolarHBondContact O-N 3.31Å; T69-K72 PolarHBondContact O-N 2.9Å; T69-A73 WeakPolarHBondContact O-CB 3.47Å; T69-A73 PolarHBondContact O-N 3.08Å
70L95.7Very high95.1Very high108 Ų10895.6 Ų95.657%0.56550%0.499SS*.Hα-helixtrans-64.1-42.4172.1-74.8170.9000112.5N66 T67 A73 N74N66-L70 VanDerWaalsContact O-CG 3.31Å; N66-L70 WeakPolarHBondContact O-CG 3.5Å; N66-L70 PolarHBondContact O-N 2.92Å; N66-L70 VanDerWaalsContact O-N 3.08Å; T67-L70 PolarHBondContact O-N 3.05Å; L70-A73 WeakPolarHBondContact O-CB 3.41Å; L70-A73 PolarHBondContact O-N 3.18Å; L70-N74 WeakPolarHBondContact O-CB 3.48Å; L70-N74 PolarHBondContact O-N 3.26Å
71L95.4Very high95.3Very high104 Ų10496.1 Ų96.155%0.54550%0.499SS..Hα-helixtrans-61.4-46.4176.2-76173.2000111.2T67 E68 A73 N74 E75T67-L71 WeakPolarHBondContact O-CG 3.43Å; T67-L71 PolarHBondContact O-N 2.88Å; E68-L71 PolarHBondContact O-N 2.89Å; L71-A73 VanDerWaalsContact C-N 3.27Å; L71-A73 PolarHBondContact O-N 2.91Å; L71-N74 PolarHBondContact O-N 2.98Å; L71-E75 WeakPolarHBondContact O-CG 3.4Å; L71-E75 PolarHBondContact O-N 2.92Å
72K96Very high95.4Very high119 Ų11998.8 Ų98.852%0.51751%0.505SS..Hα-helixtrans-61.8-34.2175.4-73.3172.6-178.8167.50112.6E68 T69 K76E68-K72 WeakPolarHBondContact O-CG 3.35Å; E68-K72 PolarHBondContact O-N 3.46Å; T69-K72 PolarHBondContact O-N 2.9Å; K72-K76 WeakPolarHBondContact O-CG 3.33Å; K72-K76 PolarHBondContact O-N 3.41Å
73A95.5Very high95.5Very high42 Ų4299.1 Ų99.135%0.34751%0.506SS..Hα-helixtrans-67.5-47173.400000111.2T69 L70 L71 E75 K76 E77T69-A73 WeakPolarHBondContact O-CB 3.47Å; T69-A73 PolarHBondContact O-N 3.08Å; L70-A73 WeakPolarHBondContact O-CB 3.41Å; L70-A73 PolarHBondContact O-N 3.18Å; L71-A73 VanDerWaalsContact C-N 3.27Å; L71-A73 PolarHBondContact O-N 2.91Å; A73-E75 VanDerWaalsContact C-N 3.33Å; A73-E75 PolarHBondContact O-N 2.86Å; A73-K76 WeakPolarHBondContact O-CB 3.35Å; A73-K76 PolarHBondContact O-N 3.27Å; A73-E77 WeakPolarHBondContact O-CG 3.49Å; A73-E77 PolarHBondContact O-N 3.41Å
74N95.6Very high95.6Very high87 Ų8797.8 Ų97.847%0.46550%0.503SS..Hα-helixtrans-62.2-36.6177-72.3-11.7000112.7L70 L71 E77 L78L70-N74 WeakPolarHBondContact O-CB 3.48Å; L70-N74 PolarHBondContact O-N 3.26Å; L71-N74 PolarHBondContact O-N 2.98Å; N74-E77 PolarHBondContact O-N 3.45Å; N74-L78 WeakPolarHBondContact O-CB 3.4Å; N74-L78 PolarHBondContact O-N 2.9Å
75E95.6Very high95.8Very high121 Ų12199.5 Ų99.557%0.56551%0.506SS*.Hα-helixtrans-61.8-46.1173.8-76.5174.5168.400111.3L71 A73 E77 L78 E79L71-E75 WeakPolarHBondContact O-CG 3.4Å; L71-E75 PolarHBondContact O-N 2.92Å; A73-E75 VanDerWaalsContact C-N 3.33Å; A73-E75 PolarHBondContact O-N 2.86Å; E75-E77 PolarHBondContact O-N 3.31Å; E75-L78 WeakPolarHBondContact O-CB 3.5Å; E75-L78 PolarHBondContact O-N 3.27Å; E75-E79 WeakPolarHBondContact O-CG 3.46Å; E75-E79 PolarHBondContact O-N 3.4Å
76K95.4Very high95.8Very high145 Ų14598.7 Ų98.763%0.6350%0.502SS*.Hα-helixtrans-63.1-41.1174.9-70.7176.3-179.2-1780111.9K72 A73 L78 E79 V80K72-K76 WeakPolarHBondContact O-CG 3.33Å; K72-K76 PolarHBondContact O-N 3.41Å; A73-K76 WeakPolarHBondContact O-CB 3.35Å; A73-K76 PolarHBondContact O-N 3.27Å; K76-L78 VanDerWaalsContact C-N 3.31Å; K76-L78 PolarHBondContact O-N 2.98Å; K76-E79 PolarHBondContact O-N 3.35Å; K76-V80 WeakPolarHBondContact O-CG2 3.47Å; K76-V80 PolarHBondContact O-N 2.81Å
77E94.5Very high95.9Very high123 Ų12398.8 Ų98.858%0.57550%0.501SS*.Hα-helixtrans-62.3-38.7174-72.4-176.9-178.300111.8A73 N74 E75 E79 V80 T81A73-E77 WeakPolarHBondContact O-CG 3.49Å; A73-E77 PolarHBondContact O-N 3.41Å; N74-E77 PolarHBondContact O-N 3.45Å; E75-E77 PolarHBondContact O-N 3.31Å; E77-E79 PolarHBondContact O-N 2.9Å; E77-V80 PolarHBondContact O-N 3.47Å; E77-T81 WeakPolarHBondContact O-CG2 3.37Å; E77-T81 PolarHBondContact O-N 3.05Å; E77-T81 PolarHBondContact O-OG1 3.48Å; E77-T81 VanDerWaalsContact O-OG1 3.07Å
78L96.1Very high96Very high93 Ų9398.2 Ų98.249%0.48750%0.504SS..Hα-helixtrans-64.3-39.2174.6-174.567.4000111.9N74 E75 K76 T81 K82N74-L78 WeakPolarHBondContact O-CB 3.4Å; N74-L78 PolarHBondContact O-N 2.9Å; E75-L78 WeakPolarHBondContact O-CB 3.5Å; E75-L78 PolarHBondContact O-N 3.27Å; K76-L78 VanDerWaalsContact C-N 3.31Å; K76-L78 PolarHBondContact O-N 2.98Å; L78-T81 VanDerWaalsContact CA-OG1 3.3Å; L78-T81 WeakPolarHBondContact CA-OG1 3.34Å; L78-T81 PolarHBondContact O-OG1 2.86Å; L78-K82 WeakPolarHBondContact O-CB 3.49Å; L78-K82 VanDerWaalsContact O-CG 3.27Å; L78-K82 WeakPolarHBondContact O-CG 3.29Å; L78-K82 PolarHBondContact O-N 3.22Å
79E96Very high96.1Very high131 Ų13198.2 Ų98.261%0.61250%0.504SS*.Hα-helixtrans-63.9-44.3173.8-71.1176.8175.800111.8E75 K76 E77 K82 H83E75-E79 WeakPolarHBondContact O-CG 3.46Å; E75-E79 PolarHBondContact O-N 3.4Å; K76-E79 PolarHBondContact O-N 3.35Å; E77-E79 PolarHBondContact O-N 2.9Å; E79-K82 PolarHBondContact O-N 2.86Å; E79-H83 PolarHBondContact O-N 3.16Å
80V96.6Very high96.1Very high84 Ų84102.5 Ų102.551%0.50951%0.512SS..Hα-helixtrans-62.5-44.8176.5172.20000111K76 E77 K82 H83 L84K76-V80 WeakPolarHBondContact O-CG2 3.47Å; K76-V80 PolarHBondContact O-N 2.81Å; E77-V80 PolarHBondContact O-N 3.47Å; V80-K82 PolarHBondContact O-N 3.18Å; V80-H83 PolarHBondContact O-N 2.85Å; V80-L84 HydrophobicContact CG1-CD1 4Å; V80-L84 HydrophobicContact CG1-CG 4.33Å; V80-L84 WeakPolarHBondContact O-CG 3.42Å; V80-L84 PolarHBondContact O-N 3.17Å
81T95.9Very high96.1Very high77 Ų77100.5 Ų100.547%0.47250%0.499SS..Hα-helixtrans-65.3-38.4178.1530000112.3E77 L78 L84 K85E77-T81 WeakPolarHBondContact O-CG2 3.37Å; E77-T81 PolarHBondContact O-N 3.05Å; E77-T81 PolarHBondContact O-OG1 3.48Å; E77-T81 VanDerWaalsContact O-OG1 3.07Å; L78-T81 VanDerWaalsContact CA-OG1 3.3Å; L78-T81 WeakPolarHBondContact CA-OG1 3.34Å; L78-T81 PolarHBondContact O-OG1 2.86Å; T81-L84 PolarHBondContact O-N 2.85Å; T81-K85 WeakPolarHBondContact O-CB 3.34Å; T81-K85 PolarHBondContact O-N 3.2Å
82K96.9Very high96.1Very high124 Ų124101.5 Ų101.554%0.53950%0.501SS..Hα-helixtrans-59.8-47.3170.9-76.2170.9-178.51720111.2L78 E79 V80 K85 T86L78-K82 WeakPolarHBondContact O-CB 3.49Å; L78-K82 VanDerWaalsContact O-CG 3.27Å; L78-K82 WeakPolarHBondContact O-CG 3.29Å; L78-K82 PolarHBondContact O-N 3.22Å; E79-K82 PolarHBondContact O-N 2.86Å; V80-K82 PolarHBondContact O-N 3.18Å; K82-K85 PolarHBondContact O-N 3.16Å; K82-T86 WeakPolarHBondContact O-CG2 3.4Å; K82-T86 PolarHBondContact O-N 3.43Å
83H96.6Very high96.2Very high112 Ų112100.5 Ų100.552%0.51950%0.501SS..Hα-helixtrans-60.1-48.6176.9177-88.7000111.6E79 V80 K85 T86 L87E79-H83 PolarHBondContact O-N 3.16Å; V80-H83 PolarHBondContact O-N 2.85Å; H83-K85 VanDerWaalsContact C-N 3.29Å; H83-K85 PolarHBondContact O-N 2.96Å; H83-T86 PolarHBondContact O-N 2.87Å; H83-T86 VanDerWaalsContact O-N 3.15Å; H83-T86 PolarHBondContact O-OG1 2.67Å; H83-L87 PolarHBondContact O-N 3.29Å
84L96.9Very high96.3Very high98 Ų98105.2 Ų105.251%0.51351%0.51SS..Hα-helixtrans-59.1-39.7177.1-72174.5000112.2V80 T81 L87 A88V80-L84 HydrophobicContact CG1-CD1 4Å; V80-L84 HydrophobicContact CG1-CG 4.33Å; V80-L84 WeakPolarHBondContact O-CG 3.42Å; V80-L84 PolarHBondContact O-N 3.17Å; T81-L84 PolarHBondContact O-N 2.85Å; L84-L87 PolarHBondContact O-N 2.81Å; L84-A88 WeakPolarHBondContact O-CB 3.46Å; L84-A88 PolarHBondContact O-N 3.24Å
85K96.9Very high96.3Very high133 Ų133107.9 Ų107.958%0.57852%0.515SS*.Hα-helixtrans-61.4-48.6173.9180177.7171.6179.70111.5T81 K82 H83 L87 A88 E89T81-K85 WeakPolarHBondContact O-CB 3.34Å; T81-K85 PolarHBondContact O-N 3.2Å; K82-K85 PolarHBondContact O-N 3.16Å; H83-K85 VanDerWaalsContact C-N 3.29Å; H83-K85 PolarHBondContact O-N 2.96Å; K85-L87 VanDerWaalsContact C-N 3.25Å; K85-L87 PolarHBondContact O-N 3.45Å; K85-A88 PolarHBondContact O-N 2.94Å; K85-A88 VanDerWaalsContact O-N 3.16Å; K85-E89 WeakPolarHBondContact CE-OE1 3.33Å; K85-E89 IonicContact NZ-OE1 3.17Å; K85-E89 WeakPolarHBondContact O-CG 3.32Å; K85-E89 PolarHBondContact O-N 3.41Å
86T96.8Very high96.4Very high57 Ų57105.2 Ų105.235%0.3551%0.51SS..Hα-helixtrans-62.6-33.6177.961.10000112.5K82 H83 R90K82-T86 WeakPolarHBondContact O-CG2 3.4Å; K82-T86 PolarHBondContact O-N 3.43Å; H83-T86 PolarHBondContact O-N 2.87Å; H83-T86 VanDerWaalsContact O-N 3.15Å; H83-T86 PolarHBondContact O-OG1 2.67Å; T86-R90 VanDerWaalsContact O-CG 3.28Å; T86-R90 WeakPolarHBondContact O-CG 3.5Å; T86-R90 PolarHBondContact O-N 3.35Å; T86-R90 VanDerWaalsContact O-N 3.08Å
87L96.9Very high96.4Very high78 Ų78105 Ų10541%0.40851%0.511SS..Hα-helixtrans-68.3-43174.8-17169.5000111.1H83 L84 K85 R90 E91H83-L87 PolarHBondContact O-N 3.29Å; L84-L87 PolarHBondContact O-N 2.81Å; K85-L87 VanDerWaalsContact C-N 3.25Å; K85-L87 PolarHBondContact O-N 3.45Å; L87-R90 PolarHBondContact O-N 2.95Å; L87-E91 PolarHBondContact O-N 3.2Å
88A95.8Very high96.6Very high60 Ų60103.2 Ų103.250%0.49651%0.505SS..Hα-helixtrans-62.9-41.9176.300000112.3L84 K85 E91 Q92L84-A88 WeakPolarHBondContact O-CB 3.46Å; L84-A88 PolarHBondContact O-N 3.24Å; K85-A88 PolarHBondContact O-N 2.94Å; K85-A88 VanDerWaalsContact O-N 3.16Å; A88-E91 PolarHBondContact O-N 3.28Å; A88-Q92 WeakPolarHBondContact O-CB 3.32Å; A88-Q92 PolarHBondContact O-N 3.34Å
89E96.9Very high96.6Very high88 Ų88102.7 Ų102.741%0.41151%0.506SS..Hα-helixtrans-61.8-44.5175-73170.6171.200111.4K85 E91 Q92 D93K85-E89 WeakPolarHBondContact CE-OE1 3.33Å; K85-E89 IonicContact NZ-OE1 3.17Å; K85-E89 WeakPolarHBondContact O-CG 3.32Å; K85-E89 PolarHBondContact O-N 3.41Å; E89-E91 PolarHBondContact O-N 3.45Å; E89-Q92 WeakPolarHBondContact O-CB 3.34Å; E89-Q92 PolarHBondContact O-N 2.99Å; E89-D93 PolarHBondContact O-N 3.08Å
90R96.6Very high96.6Very high169 Ų16998.7 Ų98.764%0.63850%0.495SS*.Hα-helixtrans-61.7-42.5175.7-74.2173.7-175.8176.73.2112.7T86 L87 D93 R94T86-R90 VanDerWaalsContact O-CG 3.28Å; T86-R90 WeakPolarHBondContact O-CG 3.5Å; T86-R90 PolarHBondContact O-N 3.35Å; T86-R90 VanDerWaalsContact O-N 3.08Å; L87-R90 PolarHBondContact O-N 2.95Å; R90-D93 PolarHBondContact O-N 3.48Å; R90-R94 WeakPolarHBondContact O-CB 3.27Å; R90-R94 PolarHBondContact O-N 2.88Å
91E94.6Very high96.6Very high66 Ų6699.7 Ų99.731%0.30849%0.494SS..Hα-helixtrans-67.4-39.2176.1-73-59.9141.400111.3L87 A88 E89 D93 R94 Y95L87-E91 PolarHBondContact O-N 3.2Å; A88-E91 PolarHBondContact O-N 3.28Å; E89-E91 PolarHBondContact O-N 3.45Å; E91-D93 PolarHBondContact O-N 2.91Å; E91-R94 WeakPolarHBondContact O-CB 3.46Å; E91-R94 PolarHBondContact O-N 3.49Å; E91-R94 IonicContact OE1-NH1 3.41Å; E91-R94 IonicContact OE2-NH1 2.7Å; E91-Y95 HydrophobicContact CB-CD2 4.47Å; E91-Y95 HydrophobicContact CB-CE2 4.21Å; E91-Y95 WeakPolarHBondContact O-CD2 3.49Å; E91-Y95 PolarHBondContact O-N 3.32Å
92Q96.6Very high96.7Very high125 Ų12598 Ų9858%0.58449%0.488SS*.Hα-helixtrans-59.9-44.2173.3-179.6179.5-5.200111.9A88 E89 Y95 S96A88-Q92 WeakPolarHBondContact O-CB 3.32Å; A88-Q92 PolarHBondContact O-N 3.34Å; E89-Q92 WeakPolarHBondContact O-CB 3.34Å; E89-Q92 PolarHBondContact O-N 2.99Å; Q92-Y95 PolarHBondContact O-N 2.97Å; Q92-S96 WeakPolarHBondContact O-CB 3.31Å; Q92-S96 PolarHBondContact O-N 3.36Å; Q92-S96 PolarHBondContact O-OG 3.37Å
93D96.9Very high96.6Very high97 Ų9796 Ų9652%0.51948%0.483SS..Hα-helixtrans-63.6-43.1176.3-74.6-21.8000111.3E89 R90 E91 S96 Q97E89-D93 PolarHBondContact O-N 3.08Å; R90-D93 PolarHBondContact O-N 3.48Å; E91-D93 PolarHBondContact O-N 2.91Å; D93-S96 PolarHBondContact O-N 3.37Å; D93-Q97 WeakPolarHBondContact O-CG 3.49Å; D93-Q97 PolarHBondContact O-N 2.84Å
94R97.5Very high96.7Very high141 Ų14198 Ų9853%0.53249%0.49SS..Hα-helixtrans-59.4-48.4174.9-178.4-173174.7-172.2-0.5111.5R90 E91 S96 Q97 L98R90-R94 WeakPolarHBondContact O-CB 3.27Å; R90-R94 PolarHBondContact O-N 2.88Å; E91-R94 WeakPolarHBondContact O-CB 3.46Å; E91-R94 PolarHBondContact O-N 3.49Å; E91-R94 IonicContact OE1-NH1 3.41Å; E91-R94 IonicContact OE2-NH1 2.7Å; R94-S96 VanDerWaalsContact C-N 3.32Å; R94-S96 PolarHBondContact O-N 3.32Å; R94-Q97 PolarHBondContact O-N 2.86Å; R94-L98 HydrophobicContact CG-CD1 4.33Å; R94-L98 WeakPolarHBondContact O-CG 3.48Å; R94-L98 PolarHBondContact O-N 2.86Å
95Y96.4Very high96.7Very high143 Ų14398.4 Ų98.456%0.56149%0.49SS*.Hα-helixtrans-62.4-41176.4-73-57.5000111.5E91 Q92 Q97 L98 T99E91-Y95 HydrophobicContact CB-CD2 4.47Å; E91-Y95 HydrophobicContact CB-CE2 4.21Å; E91-Y95 WeakPolarHBondContact O-CD2 3.49Å; E91-Y95 PolarHBondContact O-N 3.32Å; Q92-Y95 PolarHBondContact O-N 2.97Å; Y95-Q97 VanDerWaalsContact C-N 3.31Å; Y95-Q97 PolarHBondContact O-N 3.49Å; Y95-L98 PolarHBondContact O-N 3.46Å; Y95-T99 WeakPolarHBondContact O-CB 3.42Å; Y95-T99 PolarHBondContact O-N 2.91Å; Y95-T99 PolarHBondContact O-OG1 3.46Å
96S97.1Very high96.7Very high66 Ų6696.2 Ų96.246%0.46248%0.483SS..Hα-helixtrans-60.9-40.4177.2-59.20000111.9Q92 D93 R94 A100Q92-S96 WeakPolarHBondContact O-CB 3.31Å; Q92-S96 PolarHBondContact O-N 3.36Å; Q92-S96 PolarHBondContact O-OG 3.37Å; D93-S96 PolarHBondContact O-N 3.37Å; R94-S96 VanDerWaalsContact C-N 3.32Å; R94-S96 PolarHBondContact O-N 3.32Å; S96-A100 WeakPolarHBondContact O-CB 3.48Å; S96-A100 PolarHBondContact O-N 3.41Å
97Q96.7Very high96.7Very high139 Ų139100.2 Ų100.265%0.6550%0.496SS*.Hα-helixtrans-65.5-45.4174.2-70.7174.218.900112.1D93 R94 Y95 T99 A100 Q101D93-Q97 WeakPolarHBondContact O-CG 3.49Å; D93-Q97 PolarHBondContact O-N 2.84Å; R94-Q97 PolarHBondContact O-N 2.86Å; Y95-Q97 VanDerWaalsContact C-N 3.31Å; Y95-Q97 PolarHBondContact O-N 3.49Å; Q97-T99 PolarHBondContact O-N 3.22Å; Q97-A100 PolarHBondContact O-N 3.24Å; Q97-Q101 PolarHBondContact O-N 2.9Å
98L96.9Very high96.7Very high87 Ų8798.7 Ų98.746%0.45549%0.492SS..Hα-helixtrans-61.8-43176.8-71.8172.9000111.7R94 Y95 Q101 A102R94-L98 HydrophobicContact CG-CD1 4.33Å; R94-L98 WeakPolarHBondContact O-CG 3.48Å; R94-L98 PolarHBondContact O-N 2.86Å; Y95-L98 PolarHBondContact O-N 3.46Å; L98-Q101 PolarHBondContact O-N 3.48Å; L98-A102 WeakPolarHBondContact O-CB 3.35Å; L98-A102 PolarHBondContact O-N 2.82Å
99T96.4Very high96.7Very high82 Ų8299.2 Ų99.250%0.50349%0.492SS..Hα-helixtrans-63.4-41174.7-58.70000111.5Y95 Q97 Q101 A102 N103Y95-T99 WeakPolarHBondContact O-CB 3.42Å; Y95-T99 PolarHBondContact O-N 2.91Å; Y95-T99 PolarHBondContact O-OG1 3.46Å; Q97-T99 PolarHBondContact O-N 3.22Å; T99-Q101 VanDerWaalsContact C-N 3.35Å; T99-A102 PolarHBondContact O-N 2.92Å; T99-N103 WeakPolarHBondContact O-CB 3.45Å; T99-N103 VanDerWaalsContact O-CG 3.26Å; T99-N103 PolarHBondContact O-N 3.4Å; T99-N103 PolarHBondContact O-ND2 3.27Å
100A96.9Very high96.7Very high47 Ų47101.7 Ų101.739%0.38850%0.498SS..Hα-helixtrans-64.5-39.417600000112.2S96 Q97 K104S96-A100 WeakPolarHBondContact O-CB 3.48Å; S96-A100 PolarHBondContact O-N 3.41Å; Q97-A100 PolarHBondContact O-N 3.24Å; A100-K104 WeakPolarHBondContact O-CG 3.29Å; A100-K104 PolarHBondContact O-N 2.89Å; A100-K104 VanDerWaalsContact O-N 3.08Å
101Q97.2Very high96.7Very high104 Ų10498.6 Ų98.649%0.48649%0.491SS..Hα-helixtrans-64.6-50.6174.5-177.5178.2-12.200111.3Q97 L98 T99 N103 K104 E105Q97-Q101 PolarHBondContact O-N 2.9Å; L98-Q101 PolarHBondContact O-N 3.48Å; T99-Q101 VanDerWaalsContact C-N 3.35Å; Q101-N103 VanDerWaalsContact C-N 3.29Å; Q101-N103 PolarHBondContact O-N 2.91Å; Q101-K104 WeakPolarHBondContact O-CB 3.49Å; Q101-K104 PolarHBondContact O-N 2.92Å; Q101-E105 WeakPolarHBondContact CG-OE1 3.42Å; Q101-E105 PolarHBondContact NE2-OE1 3.45Å; Q101-E105 PolarHBondContact O-N 2.83Å
102A96.2Very high96.8Very high41 Ų41101.6 Ų101.634%0.33950%0.503SS..Hα-helixtrans-57.2-42.3177.200000111.7L98 T99 K104 E105 I106L98-A102 WeakPolarHBondContact O-CB 3.35Å; L98-A102 PolarHBondContact O-N 2.82Å; T99-A102 PolarHBondContact O-N 2.92Å; A102-K104 VanDerWaalsContact C-N 3.34Å; A102-K104 PolarHBondContact O-N 3.41Å; A102-E105 PolarHBondContact O-N 2.79Å; A102-I106 WeakPolarHBondContact O-CB 3.5Å; A102-I106 VanDerWaalsContact O-CG1 3.26Å; A102-I106 WeakPolarHBondContact O-CG1 3.31Å; A102-I106 PolarHBondContact O-N 2.88Å
103N96.6Very high96.8Very high83 Ų8399.6 Ų99.644%0.44450%0.495SS..Hα-helixtrans-63.6-36.1175.9-77.9-29.7000113T99 Q101 K107T99-N103 WeakPolarHBondContact O-CB 3.45Å; T99-N103 VanDerWaalsContact O-CG 3.26Å; T99-N103 PolarHBondContact O-N 3.4Å; T99-N103 PolarHBondContact O-ND2 3.27Å; Q101-N103 VanDerWaalsContact C-N 3.29Å; Q101-N103 PolarHBondContact O-N 2.91Å; N103-K107 WeakPolarHBondContact O-CB 3.29Å; N103-K107 VanDerWaalsContact O-CG 3.3Å; N103-K107 WeakPolarHBondContact O-CG 3.38Å; N103-K107 PolarHBondContact O-N 3.4Å
104K97.2Very high96.8Very high155 Ų15598.4 Ų98.467%0.67449%0.489SS*.Hα-helixtrans-66.8-43.2173.7-74.8175.2-178.6178.90111.2A100 Q101 A102 K107 S108A100-K104 WeakPolarHBondContact O-CG 3.29Å; A100-K104 PolarHBondContact O-N 2.89Å; A100-K104 VanDerWaalsContact O-N 3.08Å; Q101-K104 WeakPolarHBondContact O-CB 3.49Å; Q101-K104 PolarHBondContact O-N 2.92Å; A102-K104 VanDerWaalsContact C-N 3.34Å; A102-K104 PolarHBondContact O-N 3.41Å; K104-K107 PolarHBondContact O-N 3.26Å; K104-S108 WeakPolarHBondContact O-CB 3.37Å; K104-S108 PolarHBondContact O-N 2.94Å
105E97.3Very high96.8Very high106 Ų10699.8 Ų99.850%0.49549%0.494SS..Hα-helixtrans-62.4-46.3177.3-71.2173.2-165.900111.1Q101 A102 K107 S108 S109Q101-E105 WeakPolarHBondContact CG-OE1 3.42Å; Q101-E105 PolarHBondContact NE2-OE1 3.45Å; Q101-E105 PolarHBondContact O-N 2.83Å; A102-E105 PolarHBondContact O-N 2.79Å; E105-K107 PolarHBondContact O-N 3Å; E105-S108 PolarHBondContact O-N 3.42Å; E105-S108 PolarHBondContact O-OG 2.82Å; E105-S109 PolarHBondContact O-N 3.22Å
106I96.6Very high96.8Very high86 Ų8698 Ų9844%0.44149%0.493SS..Hα-helixtrans-56.2-50174.4-71.5167.6000110.9A102 S108 S109 Y110A102-I106 WeakPolarHBondContact O-CB 3.5Å; A102-I106 VanDerWaalsContact O-CG1 3.26Å; A102-I106 WeakPolarHBondContact O-CG1 3.31Å; A102-I106 PolarHBondContact O-N 2.88Å; I106-S108 VanDerWaalsContact C-N 3.35Å; I106-S108 PolarHBondContact O-N 3.33Å; I106-S109 WeakPolarHBondContact O-CB 3.33Å; I106-S109 PolarHBondContact O-N 3.18Å; I106-S109 VanDerWaalsContact O-N 3.11Å; I106-Y110 HydrophobicContact CG2-CD2 3.6Å; I106-Y110 HydrophobicContact CG2-CE2 3.4Å; I106-Y110 VanDerWaalsContact O-CD2 3.28Å; I106-Y110 WeakPolarHBondContact O-CD2 3.46Å; I106-Y110 PolarHBondContact O-N 2.81Å
107K97.4Very high96.7Very high141 Ų14199.3 Ų99.361%0.61349%0.492SS*.Hα-helixtrans-58.7-45.5177-75.4177.4-178.9-174.50112N103 K104 E105 S109 Y110 E111N103-K107 WeakPolarHBondContact O-CB 3.29Å; N103-K107 VanDerWaalsContact O-CG 3.3Å; N103-K107 WeakPolarHBondContact O-CG 3.38Å; N103-K107 PolarHBondContact O-N 3.4Å; K104-K107 PolarHBondContact O-N 3.26Å; E105-K107 PolarHBondContact O-N 3Å; K107-S109 PolarHBondContact O-N 3.42Å; K107-Y110 PolarHBondContact O-N 2.92Å; K107-E111 WeakPolarHBondContact O-CG 3.38Å; K107-E111 PolarHBondContact O-N 3.27Å
108S97.2Very high96.8Very high47 Ų4799.2 Ų99.233%0.32949%0.489SS..Hα-helixtrans-62.4-32.7177.181.70000112.6K104 E105 I106 K112K104-S108 WeakPolarHBondContact O-CB 3.37Å; K104-S108 PolarHBondContact O-N 2.94Å; E105-S108 PolarHBondContact O-N 3.42Å; E105-S108 PolarHBondContact O-OG 2.82Å; I106-S108 VanDerWaalsContact C-N 3.35Å; I106-S108 PolarHBondContact O-N 3.33Å; S108-K112 VanDerWaalsContact O-CG 3.27Å; S108-K112 WeakPolarHBondContact O-CG 3.36Å; S108-K112 PolarHBondContact O-N 3.26Å; S108-K112 VanDerWaalsContact O-N 3.09Å
109S95.4Very high96.8Very high71 Ų7198.3 Ų98.350%0.49749%0.49SS..Hα-helixtrans-70.4-44.7175.9-168.50000111.3E105 I106 K107 E111 K112 M113E105-S109 PolarHBondContact O-N 3.22Å; I106-S109 WeakPolarHBondContact O-CB 3.33Å; I106-S109 PolarHBondContact O-N 3.18Å; I106-S109 VanDerWaalsContact O-N 3.11Å; K107-S109 PolarHBondContact O-N 3.42Å; S109-E111 PolarHBondContact O-N 3.31Å; S109-K112 WeakPolarHBondContact O-CB 3.45Å; S109-K112 PolarHBondContact O-N 3.03Å; S109-M113 WeakPolarHBondContact O-CB 3.44Å; S109-M113 PolarHBondContact O-N 2.92Å
110Y96.8Very high96.8Very high139 Ų13999.9 Ų99.955%0.54549%0.492SS..Hα-helixtrans-61-43.5174.4-80.5-64.8000111.9I106 K107 K112 M113 D114I106-Y110 HydrophobicContact CG2-CD2 3.6Å; I106-Y110 HydrophobicContact CG2-CE2 3.4Å; I106-Y110 VanDerWaalsContact O-CD2 3.28Å; I106-Y110 WeakPolarHBondContact O-CD2 3.46Å; I106-Y110 PolarHBondContact O-N 2.81Å; K107-Y110 PolarHBondContact O-N 2.92Å; Y110-K112 VanDerWaalsContact C-N 3.29Å; Y110-K112 PolarHBondContact O-N 3.45Å; Y110-M113 HydrophobicContact CD1-CE 3.77Å; Y110-M113 HydrophobicContact CE1-CE 4.11Å; Y110-M113 WeakPolarHBondContact O-CB 3.47Å; Y110-M113 PolarHBondContact O-N 3.48Å; Y110-M113 VanDerWaalsContact O-N 3.13Å; Y110-D114 PolarHBondContact O-N 2.95Å
111E96.6Very high96.8Very high105 Ų105102.5 Ų102.549%0.49150%0.499SS..Hα-helixtrans-62-36.1175.4-72.1176.5-162.800112.8K107 S109 R115K107-E111 WeakPolarHBondContact O-CG 3.38Å; K107-E111 PolarHBondContact O-N 3.27Å; S109-E111 PolarHBondContact O-N 3.31Å; E111-R115 VanDerWaalsContact O-CG 3.25Å; E111-R115 WeakPolarHBondContact O-CG 3.47Å; E111-R115 PolarHBondContact O-N 3.47Å; E111-R115 IonicContact OE2-NH2 2.88Å
112K97Very high96.8Very high128 Ų128104.5 Ų104.556%0.55751%0.506SS*.Hα-helixtrans-67.3-42.7173.4-74.9170.4-176.4175.70111.1S108 S109 Y110 R115 I116S108-K112 VanDerWaalsContact O-CG 3.27Å; S108-K112 WeakPolarHBondContact O-CG 3.36Å; S108-K112 PolarHBondContact O-N 3.26Å; S108-K112 VanDerWaalsContact O-N 3.09Å; S109-K112 WeakPolarHBondContact O-CB 3.45Å; S109-K112 PolarHBondContact O-N 3.03Å; Y110-K112 VanDerWaalsContact C-N 3.29Å; Y110-K112 PolarHBondContact O-N 3.45Å; K112-R115 PolarHBondContact O-N 2.93Å; K112-I116 WeakPolarHBondContact O-CG1 3.43Å; K112-I116 PolarHBondContact O-N 3.3Å
113M97.3Very high96.8Very high83 Ų83105.1 Ų105.141%0.40951%0.511SS..Hα-helixtrans-58.8-49.4176.5-168.218081.600110.7S109 Y110 R115 I116 E117S109-M113 WeakPolarHBondContact O-CB 3.44Å; S109-M113 PolarHBondContact O-N 2.92Å; Y110-M113 HydrophobicContact CD1-CE 3.77Å; Y110-M113 HydrophobicContact CE1-CE 4.11Å; Y110-M113 WeakPolarHBondContact O-CB 3.47Å; Y110-M113 PolarHBondContact O-N 3.48Å; Y110-M113 VanDerWaalsContact O-N 3.13Å; M113-R115 VanDerWaalsContact C-N 3.28Å; M113-R115 PolarHBondContact O-N 3.21Å; M113-I116 PolarHBondContact O-N 3.36Å; M113-E117 WeakPolarHBondContact O-CG 3.5Å; M113-E117 PolarHBondContact O-N 2.92Å
114D96.3Very high96.8Very high73 Ų73106.7 Ų106.739%0.3952%0.517SS..Hα-helixtrans-58.2-38.4177.1-73.7-2.7000112.6Y110 K118Y110-D114 PolarHBondContact O-N 2.95Å; D114-K118 WeakPolarHBondContact O-CB 3.48Å; D114-K118 WeakPolarHBondContact O-CD 3.24Å; D114-K118 WeakPolarHBondContact O-CG 3.43Å; D114-K118 PolarHBondContact O-N 3.44Å
115R96.9Very high96.8Very high170 Ų170105.1 Ų105.164%0.64251%0.512SS*.Hα-helixtrans-66.7-43.4176.3-71.1173-155.5-165.26.9111.2E111 K112 M113 S119E111-R115 VanDerWaalsContact O-CG 3.25Å; E111-R115 WeakPolarHBondContact O-CG 3.47Å; E111-R115 PolarHBondContact O-N 3.47Å; E111-R115 IonicContact OE2-NH2 2.88Å; K112-R115 PolarHBondContact O-N 2.93Å; M113-R115 VanDerWaalsContact C-N 3.28Å; M113-R115 PolarHBondContact O-N 3.21Å; R115-S119 WeakPolarHBondContact O-CB 3.49Å; R115-S119 PolarHBondContact O-N 3.02Å; R115-S119 PolarHBondContact O-OG 2.88Å
116I96.5Very high96.8Very high105 Ų105103.5 Ų103.554%0.53851%0.509SS..Hα-helixtrans-64.5-49.5178.1-68.3167.8000109.8K112 M113 K118 S119 Q120K112-I116 WeakPolarHBondContact O-CG1 3.43Å; K112-I116 PolarHBondContact O-N 3.3Å; M113-I116 PolarHBondContact O-N 3.36Å; I116-K118 VanDerWaalsContact C-N 3.34Å; I116-K118 PolarHBondContact O-N 2.95Å; I116-S119 WeakPolarHBondContact CA-OG 3.47Å; I116-S119 CarbonylContact O-C 3.59Å; I116-S119 PolarHBondContact O-N 3.29Å; I116-S119 PolarHBondContact O-OG 3.42Å; I116-Q120 WeakPolarHBondContact O-CB 3.32Å; I116-Q120 PolarHBondContact O-N 3.5Å
117E96.2Very high96.8Very high94 Ų94103.3 Ų103.344%0.43951%0.509SS..Hα-helixtrans-57-45.8177.9-74.1-179.1-17600111.9M113 S119 Q120 L121M113-E117 WeakPolarHBondContact O-CG 3.5Å; M113-E117 PolarHBondContact O-N 2.92Å; E117-S119 VanDerWaalsContact C-N 3.33Å; E117-S119 PolarHBondContact O-N 3Å; E117-Q120 PolarHBondContact O-N 3.34Å; E117-L121 WeakPolarHBondContact O-CB 3.39Å; E117-L121 WeakPolarHBondContact O-CG 3.33Å; E117-L121 PolarHBondContact O-N 2.98Å
118K97.4Very high96.8Very high136 Ų136101.2 Ų101.259%0.59150%0.501SS*.Hα-helixtrans-62.2-40175.3-73.6171.7-173.2172.30112.3D114 I116 K122D114-K118 WeakPolarHBondContact O-CB 3.48Å; D114-K118 WeakPolarHBondContact O-CD 3.24Å; D114-K118 WeakPolarHBondContact O-CG 3.43Å; D114-K118 PolarHBondContact O-N 3.44Å; I116-K118 VanDerWaalsContact C-N 3.34Å; I116-K118 PolarHBondContact O-N 2.95Å; K118-K122 WeakPolarHBondContact O-CG 3.23Å; K118-K122 PolarHBondContact O-N 3.48Å; K118-K122 VanDerWaalsContact O-N 3.15Å
119S96.7Very high96.8Very high69 Ų69105.1 Ų105.148%0.48351%0.514SS..Hα-helixtrans-67.6-38.5176.874.70000112.1R115 I116 E117 K122 A123R115-S119 WeakPolarHBondContact O-CB 3.49Å; R115-S119 PolarHBondContact O-N 3.02Å; R115-S119 PolarHBondContact O-OG 2.88Å; I116-S119 WeakPolarHBondContact CA-OG 3.47Å; I116-S119 CarbonylContact O-C 3.59Å; I116-S119 PolarHBondContact O-N 3.29Å; I116-S119 PolarHBondContact O-OG 3.42Å; E117-S119 VanDerWaalsContact C-N 3.33Å; E117-S119 PolarHBondContact O-N 3Å; S119-K122 PolarHBondContact O-N 3.32Å; S119-A123 WeakPolarHBondContact O-CB 3.4Å; S119-A123 PolarHBondContact O-N 3.38Å
120Q96.8Very high96.8Very high114 Ų114107.7 Ų107.753%0.53352%0.522SS..Hα-helixtrans-67.1-43.6177.7-175.7177.7-4.900111I116 E117 K122 A123 M124I116-Q120 WeakPolarHBondContact O-CB 3.32Å; I116-Q120 PolarHBondContact O-N 3.5Å; E117-Q120 PolarHBondContact O-N 3.34Å; Q120-K122 PolarHBondContact O-N 2.85Å; Q120-A123 PolarHBondContact O-N 2.97Å; Q120-M124 HydrophobicContact CG-SD 4.39Å; Q120-M124 WeakPolarHBondContact O-CB 3.42Å; Q120-M124 WeakPolarHBondContact O-CG 3.49Å; Q120-M124 PolarHBondContact O-N 2.85Å
121L97.5Very high96.8Very high103 Ų103107.4 Ų107.454%0.53952%0.52SS..Hα-helixtrans-60.1-44.1175.1-75.5169.9000111.9E117 M124 Q125E117-L121 WeakPolarHBondContact O-CB 3.39Å; E117-L121 WeakPolarHBondContact O-CG 3.33Å; E117-L121 PolarHBondContact O-N 2.98Å; L121-M124 PolarHBondContact O-N 3.43Å; L121-Q125 WeakPolarHBondContact O-CG 3.44Å; L121-Q125 PolarHBondContact O-N 3.4Å
122K97.4Very high96.8Very high146 Ų146107.4 Ų107.464%0.63552%0.522SS*.Hα-helixtrans-61.8-45.7174.7-73.2178.5-179.9-1740111.7K118 S119 Q120 M124 Q125 T126K118-K122 WeakPolarHBondContact O-CG 3.23Å; K118-K122 PolarHBondContact O-N 3.48Å; K118-K122 VanDerWaalsContact O-N 3.15Å; S119-K122 PolarHBondContact O-N 3.32Å; Q120-K122 PolarHBondContact O-N 2.85Å; K122-M124 VanDerWaalsContact C-N 3.31Å; K122-M124 PolarHBondContact O-N 3.07Å; K122-Q125 PolarHBondContact O-N 2.93Å; K122-T126 WeakPolarHBondContact O-CG2 3.46Å; K122-T126 PolarHBondContact O-N 2.97Å; K122-T126 PolarHBondContact O-OG1 3.08Å
123A95.9Very high96.8Very high53 Ų53105.9 Ų105.944%0.43852%0.517SS..Hα-helixtrans-60.4-41.1177.100000111.8S119 Q120 T126 L127S119-A123 WeakPolarHBondContact O-CB 3.4Å; S119-A123 PolarHBondContact O-N 3.38Å; Q120-A123 PolarHBondContact O-N 2.97Å; A123-T126 WeakPolarHBondContact CA-OG1 3.48Å; A123-T126 PolarHBondContact O-N 3.44Å; A123-T126 PolarHBondContact O-OG1 3.31Å; A123-L127 WeakPolarHBondContact O-CB 3.3Å; A123-L127 PolarHBondContact O-N 2.95Å
124M96.3Very high96.8Very high116 Ų116107.3 Ų107.357%0.57152%0.524SS*.Hα-helixtrans-63.3-42.5175.4-74.1-18069.800112.2Q120 L121 K122 L127 E128Q120-M124 HydrophobicContact CG-SD 4.39Å; Q120-M124 WeakPolarHBondContact O-CB 3.42Å; Q120-M124 WeakPolarHBondContact O-CG 3.49Å; Q120-M124 PolarHBondContact O-N 2.85Å; L121-M124 PolarHBondContact O-N 3.43Å; K122-M124 VanDerWaalsContact C-N 3.31Å; K122-M124 PolarHBondContact O-N 3.07Å; M124-L127 PolarHBondContact O-N 2.9Å; M124-E128 PolarHBondContact O-N 2.9Å
125Q97.1Very high96.8Very high122 Ų122107.3 Ų107.357%0.5752%0.524SS*.Hα-helixtrans-61.1-48.2175.1-73.1171.8-14.700111.4L121 K122 L127 E128 E129L121-Q125 WeakPolarHBondContact O-CG 3.44Å; L121-Q125 PolarHBondContact O-N 3.4Å; K122-Q125 PolarHBondContact O-N 2.93Å; Q125-L127 PolarHBondContact O-N 3.4Å; Q125-E128 PolarHBondContact O-N 3.36Å; Q125-E129 WeakPolarHBondContact O-CG 3.28Å; Q125-E129 PolarHBondContact O-N 3.31Å
126T97.1Very high96.8Very high72 Ų72103.7 Ų103.744%0.44252%0.517SS..Hα-helixtrans-62.4-33.6177.754.80000112.6K122 A123 L130K122-T126 WeakPolarHBondContact O-CG2 3.46Å; K122-T126 PolarHBondContact O-N 2.97Å; K122-T126 PolarHBondContact O-OG1 3.08Å; A123-T126 WeakPolarHBondContact CA-OG1 3.48Å; A123-T126 PolarHBondContact O-N 3.44Å; A123-T126 PolarHBondContact O-OG1 3.31Å; T126-L130 VanDerWaalsContact O-CG 3.3Å; T126-L130 WeakPolarHBondContact O-CG 3.38Å; T126-L130 PolarHBondContact O-N 2.93Å; T126-L130 VanDerWaalsContact O-N 3.08Å
127L96.7Very high96.8Very high83 Ų83102.7 Ų102.744%0.43551%0.513SS..Hα-helixtrans-68.8-41.9177.1-168.8158.7000110.9A123 M124 Q125 L130 R131A123-L127 WeakPolarHBondContact O-CB 3.3Å; A123-L127 PolarHBondContact O-N 2.95Å; M124-L127 PolarHBondContact O-N 2.9Å; Q125-L127 PolarHBondContact O-N 3.4Å; L127-L130 PolarHBondContact O-N 3.5Å; L127-R131 HydrophobicContact CD2-CG 4.11Å; L127-R131 VanDerWaalsContact CD2-NE 3.26Å; L127-R131 WeakPolarHBondContact O-CG 3.38Å; L127-R131 PolarHBondContact O-N 2.98Å
128E96.9Very high96.8Very high97 Ų97103 Ų10345%0.45351%0.514SS..Hα-helixtrans-67.5-38.5177.7-159.768.3-178.900112M124 Q125 L130 R131 L132M124-E128 PolarHBondContact O-N 2.9Å; Q125-E128 PolarHBondContact O-N 3.36Å; E128-L130 VanDerWaalsContact C-N 3.34Å; E128-L130 PolarHBondContact O-N 3.14Å; E128-R131 PolarHBondContact O-N 2.98Å; E128-R131 IonicContact OE2-NH1 3.49Å; E128-R131 PolarHBondContact OE2-NH1 3.41Å; E128-L132 WeakPolarHBondContact O-CG 3.41Å; E128-L132 PolarHBondContact O-N 3.36Å
129E97.1Very high96.8Very high129 Ų129101.7 Ų101.760%0.60351%0.51SS*.Hα-helixtrans-58.8-44.8171.3-72.5172-177.600111.8Q125 R131 L132 Q133Q125-E129 WeakPolarHBondContact O-CG 3.28Å; Q125-E129 PolarHBondContact O-N 3.31Å; E129-R131 VanDerWaalsContact C-N 3.35Å; E129-R131 PolarHBondContact O-N 2.87Å; E129-L132 PolarHBondContact O-N 2.92Å; E129-Q133 WeakPolarHBondContact O-CB 3.33Å; E129-Q133 PolarHBondContact O-N 2.95Å
130L96.1Very high96.7Very high124 Ų124102 Ų10265%0.64951%0.509SS*.Hα-helixtrans-65.6-35.8176.7-72.8172.9000112.7T126 L127 E128 Q133 M134T126-L130 VanDerWaalsContact O-CG 3.3Å; T126-L130 WeakPolarHBondContact O-CG 3.38Å; T126-L130 PolarHBondContact O-N 2.93Å; T126-L130 VanDerWaalsContact O-N 3.08Å; L127-L130 PolarHBondContact O-N 3.5Å; E128-L130 VanDerWaalsContact C-N 3.34Å; E128-L130 PolarHBondContact O-N 3.14Å; L130-Q133 PolarHBondContact O-N 2.93Å; L130-M134 WeakPolarHBondContact O-CB 3.45Å; L130-M134 PolarHBondContact O-N 3.18Å
131R97.3Very high96.7Very high134 Ų134102.2 Ų102.251%0.50651%0.512SS..Hα-helixtrans-63.9-48.8174.2-78.5176.3174.1163.7-2.3111.6L127 E128 E129 Q133 M134 D135L127-R131 HydrophobicContact CD2-CG 4.11Å; L127-R131 VanDerWaalsContact CD2-NE 3.26Å; L127-R131 WeakPolarHBondContact O-CG 3.38Å; L127-R131 PolarHBondContact O-N 2.98Å; E128-R131 PolarHBondContact O-N 2.98Å; E128-R131 IonicContact OE2-NH1 3.49Å; E128-R131 PolarHBondContact OE2-NH1 3.41Å; E129-R131 VanDerWaalsContact C-N 3.35Å; E129-R131 PolarHBondContact O-N 2.87Å; R131-Q133 VanDerWaalsContact C-N 3.27Å; R131-Q133 PolarHBondContact O-N 2.91Å; R131-M134 WeakPolarHBondContact O-CB 3.5Å; R131-M134 PolarHBondContact O-N 2.91Å; R131-M134 VanDerWaalsContact O-N 3.13Å; R131-D135 PolarHBondContact O-N 3.44Å
132L97.1Very high96.6Very high104 Ų104101.8 Ų101.855%0.54551%0.507SS..Hα-helixtrans-60.2-40.2177.2-70.5171.6000111.4E128 E129 D135 L136E128-L132 WeakPolarHBondContact O-CG 3.41Å; E128-L132 PolarHBondContact O-N 3.36Å; E129-L132 PolarHBondContact O-N 2.92Å; L132-D135 PolarHBondContact O-N 3.2Å; L132-L136 VanDerWaalsContact O-CG 3.32Å; L132-L136 WeakPolarHBondContact O-CG 3.35Å; L132-L136 PolarHBondContact O-N 3.4Å
133Q97Very high96.6Very high97 Ų9799.7 Ų99.745%0.45350%0.503SS..Hα-helixtrans-62.5-45174.5-176.560.137.300111.7E129 L130 R131 D135 L136 D137E129-Q133 WeakPolarHBondContact O-CB 3.33Å; E129-Q133 PolarHBondContact O-N 2.95Å; L130-Q133 PolarHBondContact O-N 2.93Å; R131-Q133 VanDerWaalsContact C-N 3.27Å; R131-Q133 PolarHBondContact O-N 2.91Å; Q133-D135 VanDerWaalsContact C-N 3.35Å; Q133-D135 PolarHBondContact O-N 2.86Å; Q133-L136 PolarHBondContact O-N 3.16Å; Q133-D137 PolarHBondContact NE2-OD1 2.88Å; Q133-D137 PolarHBondContact NE2-OD2 2.9Å; Q133-D137 WeakPolarHBondContact O-CB 3.26Å; Q133-D137 VanDerWaalsContact O-CG 3.23Å; Q133-D137 PolarHBondContact O-N 3.43Å
134M96.1Very high96.6Very high113 Ų113102.1 Ų102.156%0.55751%0.508SS*.Hα-helixtrans-61.2-42.2177.5-174.9-177.371.500112L130 R131 D137 Q138L130-M134 WeakPolarHBondContact O-CB 3.45Å; L130-M134 PolarHBondContact O-N 3.18Å; R131-M134 WeakPolarHBondContact O-CB 3.5Å; R131-M134 PolarHBondContact O-N 2.91Å; R131-M134 VanDerWaalsContact O-N 3.13Å; M134-D137 PolarHBondContact O-N 2.74Å; M134-Q138 WeakPolarHBondContact O-CB 3.41Å; M134-Q138 PolarHBondContact O-N 3.38Å
135D97.3Very high96.6Very high73 Ų73101.7 Ų101.739%0.3951%0.508SS..Hα-helixtrans-64.3-40.9177.2-68.5-20.7000111.5R131 L132 Q133 Q138 Q139R131-D135 PolarHBondContact O-N 3.44Å; L132-D135 PolarHBondContact O-N 3.2Å; Q133-D135 VanDerWaalsContact C-N 3.35Å; Q133-D135 PolarHBondContact O-N 2.86Å; D135-Q138 PolarHBondContact O-N 3.46Å; D135-Q139 WeakPolarHBondContact O-CG 3.41Å; D135-Q139 PolarHBondContact O-N 3.44Å
136L97.1Very high96.6Very high94 Ų9499.5 Ų99.549%0.49250%0.502SS..Hα-helixtrans-65.2-43.3175-73.7170.3000112L132 Q133 Q138 Q139 T140L132-L136 VanDerWaalsContact O-CG 3.32Å; L132-L136 WeakPolarHBondContact O-CG 3.35Å; L132-L136 PolarHBondContact O-N 3.4Å; Q133-L136 PolarHBondContact O-N 3.16Å; L136-Q138 VanDerWaalsContact C-N 3.33Å; L136-Q139 PolarHBondContact O-N 2.9Å; L136-T140 WeakPolarHBondContact O-CB 3.35Å; L136-T140 PolarHBondContact O-N 3.21Å; L136-T140 PolarHBondContact O-OG1 3.47Å
137D95.7Very high96.5Very high84 Ų84101.7 Ų101.745%0.44951%0.507SS..Hα-helixtrans-64.7-40.6177.8-70.9-23.2000110.6Q133 M134 T140 M141Q133-D137 PolarHBondContact NE2-OD1 2.88Å; Q133-D137 PolarHBondContact NE2-OD2 2.9Å; Q133-D137 WeakPolarHBondContact O-CB 3.26Å; Q133-D137 VanDerWaalsContact O-CG 3.23Å; Q133-D137 PolarHBondContact O-N 3.43Å; M134-D137 PolarHBondContact O-N 2.74Å; D137-T140 PolarHBondContact O-N 3.34Å; D137-M141 WeakPolarHBondContact O-CB 3.46Å; D137-M141 PolarHBondContact O-N 2.82Å
138Q96.7Very high96.4Very high99 Ų99100 Ų10046%0.46351%0.505SS..Hα-helixtrans-61.4-50.7174.5179.8175.4-14.300111.6M134 D135 L136 T140 M141 E142M134-Q138 WeakPolarHBondContact O-CB 3.41Å; M134-Q138 PolarHBondContact O-N 3.38Å; D135-Q138 PolarHBondContact O-N 3.46Å; L136-Q138 VanDerWaalsContact C-N 3.33Å; Q138-T140 VanDerWaalsContact C-N 3.27Å; Q138-T140 PolarHBondContact O-N 2.88Å; Q138-M141 PolarHBondContact O-N 3.36Å; Q138-M141 VanDerWaalsContact O-N 3.15Å; Q138-E142 WeakPolarHBondContact CG-OE1 3.44Å; Q138-E142 PolarHBondContact NE2-OE1 2.92Å; Q138-E142 WeakPolarHBondContact O-CG 3.4Å; Q138-E142 PolarHBondContact O-N 3.49Å
139Q96.4Very high96.3Very high109 Ų10997.8 Ų97.851%0.50950%0.503SS..Hα-helixtrans-60.3-39.1177.5-73.3176.111.100111.9D135 L136 E142 N143D135-Q139 WeakPolarHBondContact O-CG 3.41Å; D135-Q139 PolarHBondContact O-N 3.44Å; L136-Q139 PolarHBondContact O-N 2.9Å; Q139-E142 PolarHBondContact O-N 3.24Å; Q139-N143 WeakPolarHBondContact O-CB 3.46Å; Q139-N143 PolarHBondContact O-N 2.92Å; Q139-N143 PolarHBondContact O-ND2 2.86Å; Q139-N143 VanDerWaalsContact O-ND2 3.11Å
140T95.3Very high96.2Very high76 Ų7697.6 Ų97.647%0.46650%0.501SS..Hα-helixtrans-63-44176.2-57.70000110.8L136 D137 Q138 N143 L144L136-T140 WeakPolarHBondContact O-CB 3.35Å; L136-T140 PolarHBondContact O-N 3.21Å; L136-T140 PolarHBondContact O-OG1 3.47Å; D137-T140 PolarHBondContact O-N 3.34Å; Q138-T140 VanDerWaalsContact C-N 3.27Å; Q138-T140 PolarHBondContact O-N 2.88Å; T140-N143 PolarHBondContact O-N 3.42Å; T140-L144 HydrophobicContact CG2-CD1 4.38Å; T140-L144 WeakPolarHBondContact O-CG 3.4Å; T140-L144 PolarHBondContact O-N 3.01Å
141M96.1Very high96.1Very high118 Ų11898.4 Ų98.458%0.58150%0.499SS*.Hα-helixtrans-63.8-45.5176.9-168.8175.984.200112D137 Q138 N143 L144 L145D137-M141 WeakPolarHBondContact O-CB 3.46Å; D137-M141 PolarHBondContact O-N 2.82Å; Q138-M141 PolarHBondContact O-N 3.36Å; Q138-M141 VanDerWaalsContact O-N 3.15Å; M141-N143 VanDerWaalsContact C-N 3.32Å; M141-N143 PolarHBondContact O-N 3.24Å; M141-L144 PolarHBondContact O-N 3.44Å; M141-L145 HydrophobicContact CG-CD1 4.47Å; M141-L145 WeakPolarHBondContact O-CG 3.33Å; M141-L145 PolarHBondContact O-N 3.47Å
142E96.6Very high96.1Very high94 Ų9496.8 Ų96.844%0.43950%0.5SS..Hα-helixtrans-59.1-43.2176.9-73.4173.6-17100111.6Q138 Q139 L145 V146Q138-E142 WeakPolarHBondContact CG-OE1 3.44Å; Q138-E142 PolarHBondContact NE2-OE1 2.92Å; Q138-E142 WeakPolarHBondContact O-CG 3.4Å; Q138-E142 PolarHBondContact O-N 3.49Å; Q139-E142 PolarHBondContact O-N 3.24Å; E142-L145 PolarHBondContact O-N 2.98Å; E142-V146 WeakPolarHBondContact O-CG2 3.46Å; E142-V146 PolarHBondContact O-N 2.95Å
143N96.9Very high96Very high102 Ų10297.1 Ų97.155%0.54550%0.503SS..Hα-helixtrans-62.3-44.4175.8-72.7-31.3000112.2Q139 T140 M141 L145 V146 E147Q139-N143 WeakPolarHBondContact O-CB 3.46Å; Q139-N143 PolarHBondContact O-N 2.92Å; Q139-N143 PolarHBondContact O-ND2 2.86Å; Q139-N143 VanDerWaalsContact O-ND2 3.11Å; T140-N143 PolarHBondContact O-N 3.42Å; M141-N143 VanDerWaalsContact C-N 3.32Å; M141-N143 PolarHBondContact O-N 3.24Å; N143-L145 VanDerWaalsContact C-N 3.33Å; N143-L145 PolarHBondContact O-N 3.47Å; N143-V146 PolarHBondContact O-N 3.35Å; N143-E147 WeakPolarHBondContact O-CG 3.4Å; N143-E147 PolarHBondContact O-N 3.34Å
144L96.6Very high96Very high104 Ų10496.8 Ų96.855%0.54550%0.504SS..Hα-helixtrans-63-38.3177-71.8173.7000112.1T140 M141 E147 A148T140-L144 HydrophobicContact CG2-CD1 4.38Å; T140-L144 WeakPolarHBondContact O-CG 3.4Å; T140-L144 PolarHBondContact O-N 3.01Å; M141-L144 PolarHBondContact O-N 3.44Å; L144-E147 PolarHBondContact O-N 3.15Å; L144-A148 WeakPolarHBondContact O-CB 3.41Å; L144-A148 PolarHBondContact O-N 2.86Å
145L96.4Very high96Very high108 Ų10895.7 Ų95.757%0.56550%0.5SS*.Hα-helixtrans-65.3-42175.6-71.6174.1000111.9M141 E142 N143 A148 A149M141-L145 HydrophobicContact CG-CD1 4.47Å; M141-L145 WeakPolarHBondContact O-CG 3.33Å; M141-L145 PolarHBondContact O-N 3.47Å; E142-L145 PolarHBondContact O-N 2.98Å; N143-L145 VanDerWaalsContact C-N 3.33Å; N143-L145 PolarHBondContact O-N 3.47Å; L145-A148 PolarHBondContact O-N 3.41Å; L145-A149 PolarHBondContact O-N 3.05Å
146V96.6Very high96Very high75 Ų7598.2 Ų98.246%0.45551%0.511SS..Hα-helixtrans-65.1-41175.61710000111.3E142 N143 A149 K150E142-V146 WeakPolarHBondContact O-CG2 3.46Å; E142-V146 PolarHBondContact O-N 2.95Å; N143-V146 PolarHBondContact O-N 3.35Å; V146-A149 PolarHBondContact O-N 3.46Å; V146-K150 HydrophobicContact CG1-CD 4.33Å; V146-K150 WeakPolarHBondContact O-CG 3.49Å; V146-K150 PolarHBondContact O-N 3.28Å
147E94.4Very high96Very high119 Ų11997.4 Ų97.456%0.55651%0.51SS*.Hα-helixtrans-64.6-41.1175-75-175.9178.200112.2N143 L144 K150 K151N143-E147 WeakPolarHBondContact O-CG 3.4Å; N143-E147 PolarHBondContact O-N 3.34Å; L144-E147 PolarHBondContact O-N 3.15Å; E147-K150 PolarHBondContact O-N 2.89Å; E147-K151 WeakPolarHBondContact O-CG 3.35Å; E147-K151 PolarHBondContact O-N 3.48Å
148A94.4Very high96.1Very high47 Ų4798.5 Ų98.539%0.38851%0.514SS..Hα-helixtrans-60.7-47.5174.900000111.5L144 L145 K150 K151 D152L144-A148 WeakPolarHBondContact O-CB 3.41Å; L144-A148 PolarHBondContact O-N 2.86Å; L145-A148 PolarHBondContact O-N 3.41Å; A148-K150 VanDerWaalsContact C-N 3.34Å; A148-K150 PolarHBondContact O-N 2.66Å; A148-K151 WeakPolarHBondContact O-CB 3.35Å; A148-K151 PolarHBondContact O-N 3.39Å; A148-K151 VanDerWaalsContact O-N 3.07Å; A148-D152 PolarHBondContact O-N 3.5Å
149A95.3Very high96.1Very high50 Ų5098.2 Ų98.241%0.41351%0.514SS..Hα-helixtrans-59.7-42.2177.200000112.4L145 V146 K151 D152 D153L145-A149 PolarHBondContact O-N 3.05Å; V146-A149 PolarHBondContact O-N 3.46Å; A149-K151 VanDerWaalsContact C-N 3.31Å; A149-K151 PolarHBondContact O-N 3.24Å; A149-D152 PolarHBondContact O-N 2.83Å; A149-D153 PolarHBondContact O-N 2.99Å
150K93.9Very high96.1Very high126 Ų12699.6 Ų99.655%0.54852%0.518SS..Hα-helixtrans-61.7-38.8174.4-72.9171.3-177.8171.70112.2V146 E147 A148 D152 D153 D154V146-K150 HydrophobicContact CG1-CD 4.33Å; V146-K150 WeakPolarHBondContact O-CG 3.49Å; V146-K150 PolarHBondContact O-N 3.28Å; E147-K150 PolarHBondContact O-N 2.89Å; A148-K150 VanDerWaalsContact C-N 3.34Å; A148-K150 PolarHBondContact O-N 2.66Å; K150-D152 VanDerWaalsContact C-N 3.35Å; K150-D153 PolarHBondContact O-N 2.87Å; K150-D154 PolarHBondContact O-N 3.19Å
151K95.9Very high96.2Very high141 Ų141102.8 Ų102.861%0.61352%0.523SS*.Hα-helixtrans-67.1-36.8176.7-71.5-68178.9-1670112.1E147 A148 A149 D154 L155E147-K151 WeakPolarHBondContact O-CG 3.35Å; E147-K151 PolarHBondContact O-N 3.48Å; A148-K151 WeakPolarHBondContact O-CB 3.35Å; A148-K151 PolarHBondContact O-N 3.39Å; A148-K151 VanDerWaalsContact O-N 3.07Å; A149-K151 VanDerWaalsContact C-N 3.31Å; A149-K151 PolarHBondContact O-N 3.24Å; K151-D154 PolarHBondContact O-N 2.86Å; K151-L155 WeakPolarHBondContact O-CB 3.27Å; K151-L155 PolarHBondContact O-N 3.47Å
152D95.6Very high96.3Very high100 Ų10099.8 Ų99.854%0.53552%0.517SS..Hα-helixtrans-65.7-41.6174.2-70.3-18.9000111.1A148 A149 K150 L155 M156A148-D152 PolarHBondContact O-N 3.5Å; A149-D152 PolarHBondContact O-N 2.83Å; K150-D152 VanDerWaalsContact C-N 3.35Å; D152-L155 WeakPolarHBondContact O-CB 3.42Å; D152-L155 PolarHBondContact O-N 2.86Å; D152-M156 VanDerWaalsContact O-CG 3.29Å; D152-M156 WeakPolarHBondContact O-CG 3.41Å; D152-M156 PolarHBondContact O-N 3.4Å
153D95.7Very high96.3Very high111 Ų111100.6 Ų100.659%0.59452%0.521SS*.Hα-helixtrans-60.9-46.3173.6-74.2-21.7000112A149 K150 L155 M156 V157A149-D153 PolarHBondContact O-N 2.99Å; K150-D153 PolarHBondContact O-N 2.87Å; D153-L155 VanDerWaalsContact C-N 3.31Å; D153-L155 PolarHBondContact O-N 3.27Å; D153-M156 WeakPolarHBondContact O-CB 3.5Å; D153-M156 PolarHBondContact O-N 3.39Å; D153-V157 WeakPolarHBondContact O-CG2 3.33Å; D153-V157 PolarHBondContact O-N 2.72Å; D153-V157 VanDerWaalsContact O-N 3.07Å
154D96.4Very high96.3Very high89 Ų89100.7 Ų100.748%0.47652%0.519SS..Hα-helixtrans-58.4-43.6175-76.3-19.6000111.1K150 K151 M156 V157 I158K150-D154 PolarHBondContact O-N 3.19Å; K151-D154 PolarHBondContact O-N 2.86Å; D154-M156 VanDerWaalsContact C-N 3.35Å; D154-M156 PolarHBondContact O-N 3.27Å; D154-V157 PolarHBondContact O-N 3.37Å; D154-I158 WeakPolarHBondContact O-CG1 3.32Å; D154-I158 PolarHBondContact O-N 3.01Å
155L97.4Very high96.4Very high91 Ų91100.4 Ų100.448%0.47652%0.518SS..Hα-helixtrans-62.4-42.4178.2-177.165.5000111.3K151 D152 D153 V157 I158 M159K151-L155 WeakPolarHBondContact O-CB 3.27Å; K151-L155 PolarHBondContact O-N 3.47Å; D152-L155 WeakPolarHBondContact O-CB 3.42Å; D152-L155 PolarHBondContact O-N 2.86Å; D153-L155 VanDerWaalsContact C-N 3.31Å; D153-L155 PolarHBondContact O-N 3.27Å; L155-V157 VanDerWaalsContact C-N 3.31Å; L155-V157 PolarHBondContact O-N 2.91Å; L155-I158 PolarHBondContact O-N 3Å; L155-M159 HydrophobicContact CG-CG 4.48Å; L155-M159 HydrophobicContact CG-SD 4.28Å; L155-M159 WeakPolarHBondContact O-CB 3.46Å; L155-M159 VanDerWaalsContact O-CG 3.3Å; L155-M159 WeakPolarHBondContact O-CG 3.41Å; L155-M159 PolarHBondContact O-N 3.43Å
156M96.3Very high96.4Very high125 Ų125100 Ų10062%0.61651%0.514SS*.Hα-helixtrans-61.3-39.6176.3-72.2-65.4-69.900112D152 D153 D154 K160D152-M156 VanDerWaalsContact O-CG 3.29Å; D152-M156 WeakPolarHBondContact O-CG 3.41Å; D152-M156 PolarHBondContact O-N 3.4Å; D153-M156 WeakPolarHBondContact O-CB 3.5Å; D153-M156 PolarHBondContact O-N 3.39Å; D154-M156 VanDerWaalsContact C-N 3.35Å; D154-M156 PolarHBondContact O-N 3.27Å; M156-K160 PolarHBondContact O-N 3.12Å
157V97.3Very high96.4Very high77 Ų77102.8 Ų102.847%0.46752%0.521SS..Hα-helixtrans-65.5-45.5174.7174.20000111.2D153 D154 L155 M159 K160 Y161D153-V157 WeakPolarHBondContact O-CG2 3.33Å; D153-V157 PolarHBondContact O-N 2.72Å; D153-V157 VanDerWaalsContact O-N 3.07Å; D154-V157 PolarHBondContact O-N 3.37Å; L155-V157 VanDerWaalsContact C-N 3.31Å; L155-V157 PolarHBondContact O-N 2.91Å; V157-M159 PolarHBondContact O-N 2.9Å; V157-K160 WeakPolarHBondContact O-CB 3.33Å; V157-K160 PolarHBondContact O-N 3.13Å; V157-Y161 HydrophobicContact CG1-CD2 3.78Å; V157-Y161 HydrophobicContact CG1-CE2 3.54Å; V157-Y161 VanDerWaalsContact O-CD2 3.24Å; V157-Y161 WeakPolarHBondContact O-CD2 3.31Å; V157-Y161 PolarHBondContact O-N 2.87Å
158I97.3Very high96.6Very high108 Ų108102.8 Ų102.855%0.55452%0.519SS*.Hα-helixtrans-61.2-44.5177-68.7167.3000110.8D154 L155 K160 Y161 A162D154-I158 WeakPolarHBondContact O-CG1 3.32Å; D154-I158 PolarHBondContact O-N 3.01Å; L155-I158 PolarHBondContact O-N 3Å; I158-K160 VanDerWaalsContact C-N 3.31Å; I158-K160 PolarHBondContact O-N 3.33Å; I158-Y161 PolarHBondContact O-N 3.15Å; I158-A162 WeakPolarHBondContact O-CB 3.36Å; I158-A162 PolarHBondContact O-N 2.85Å
159M96.8Very high96.8Very high93 Ų93106 Ų10646%0.45853%0.529SS..Hα-helixtrans-59.6-41.8176.9-75.7179.967.400111.7L155 V157 A162 Q163L155-M159 HydrophobicContact CG-CG 4.48Å; L155-M159 HydrophobicContact CG-SD 4.28Å; L155-M159 WeakPolarHBondContact O-CB 3.46Å; L155-M159 VanDerWaalsContact O-CG 3.3Å; L155-M159 WeakPolarHBondContact O-CG 3.41Å; L155-M159 PolarHBondContact O-N 3.43Å; V157-M159 PolarHBondContact O-N 2.9Å; M159-A162 PolarHBondContact O-N 2.91Å; M159-Q163 WeakPolarHBondContact O-CG 3.49Å; M159-Q163 PolarHBondContact O-N 3.34Å
160K97.5Very high96.9Very high137 Ų137109 Ų10960%0.59653%0.533SS*.Hα-helixtrans-61.4-45.3175.5-176.9-179.8177.2-1790111.7M156 V157 I158 Q163 M164M156-K160 PolarHBondContact O-N 3.12Å; V157-K160 WeakPolarHBondContact O-CB 3.33Å; V157-K160 PolarHBondContact O-N 3.13Å; I158-K160 VanDerWaalsContact C-N 3.31Å; I158-K160 PolarHBondContact O-N 3.33Å; K160-Q163 PolarHBondContact O-N 3.12Å; K160-M164 WeakPolarHBondContact O-CG 3.32Å; K160-M164 PolarHBondContact O-N 2.95Å
161Y97.7Very high97.1Very high144 Ų144105.4 Ų105.457%0.56552%0.523SS*.Hα-helixtrans-64.6-41.8176.3-78.6-64.5000112.2V157 I158 Q163 M164 D165V157-Y161 HydrophobicContact CG1-CD2 3.78Å; V157-Y161 HydrophobicContact CG1-CE2 3.54Å; V157-Y161 VanDerWaalsContact O-CD2 3.24Å; V157-Y161 WeakPolarHBondContact O-CD2 3.31Å; V157-Y161 PolarHBondContact O-N 2.87Å; I158-Y161 PolarHBondContact O-N 3.15Å; Y161-Q163 VanDerWaalsContact C-N 3.31Å; Y161-Q163 PolarHBondContact O-N 3.46Å; Y161-M164 WeakPolarHBondContact O-CB 3.44Å; Y161-M164 PolarHBondContact O-N 3.25Å; Y161-M164 VanDerWaalsContact O-N 3.14Å; Y161-D165 WeakPolarHBondContact O-CB 3.46Å; Y161-D165 PolarHBondContact O-N 3.47Å
162A97Very high97.1Very high55 Ų55102.7 Ų102.746%0.45552%0.515SS..Hα-helixtrans-59.5-41.6176.300000112I158 M159 D165 E166I158-A162 WeakPolarHBondContact O-CB 3.36Å; I158-A162 PolarHBondContact O-N 2.85Å; M159-A162 PolarHBondContact O-N 2.91Å; A162-D165 PolarHBondContact O-N 3.48Å; A162-E166 WeakPolarHBondContact O-CB 3.43Å; A162-E166 PolarHBondContact O-N 3.26Å
163Q97.3Very high97.2Very high111 Ų111104.5 Ų104.552%0.51952%0.518SS..Hα-helixtrans-63.9-43.7174.1-73176.7-2.500112.1M159 K160 Y161 D165 E166 H167M159-Q163 WeakPolarHBondContact O-CG 3.49Å; M159-Q163 PolarHBondContact O-N 3.34Å; K160-Q163 PolarHBondContact O-N 3.12Å; Y161-Q163 VanDerWaalsContact C-N 3.31Å; Y161-Q163 PolarHBondContact O-N 3.46Å; Q163-D165 VanDerWaalsContact C-N 3.33Å; Q163-D165 PolarHBondContact O-N 2.92Å; Q163-E166 PolarHBondContact O-N 2.92Å; Q163-H167 PolarHBondContact O-CD2 3.45Å; Q163-H167 PolarHBondContact O-N 3.44Å
164M97.1Very high97.3Very high104 Ų104104.5 Ų104.551%0.51252%0.517SS..Hα-helixtrans-60.9-43.1176.2-71.9178.962.500111.7K160 Y161 H167 K168K160-M164 WeakPolarHBondContact O-CG 3.32Å; K160-M164 PolarHBondContact O-N 2.95Å; Y161-M164 WeakPolarHBondContact O-CB 3.44Å; Y161-M164 PolarHBondContact O-N 3.25Å; Y161-M164 VanDerWaalsContact O-N 3.14Å; M164-H167 PolarHBondContact O-N 2.92Å; M164-K168 WeakPolarHBondContact O-CB 3.35Å; M164-K168 PolarHBondContact O-N 2.93Å
165D97.1Very high97.4Very high98 Ų98104.4 Ų104.452%0.52452%0.517SS..Hα-helixtrans-65-41.5176.5-73.8-17.5000111.2Y161 A162 Q163 H167 K168 I169Y161-D165 WeakPolarHBondContact O-CB 3.46Å; Y161-D165 PolarHBondContact O-N 3.47Å; A162-D165 PolarHBondContact O-N 3.48Å; Q163-D165 VanDerWaalsContact C-N 3.33Å; Q163-D165 PolarHBondContact O-N 2.92Å; D165-H167 PolarHBondContact O-N 3.38Å; D165-K168 CarbonylContact O-C 3.54Å; D165-K168 WeakPolarHBondContact O-CB 3.45Å; D165-K168 PolarHBondContact O-N 2.91Å; D165-K168 VanDerWaalsContact O-N 3.12Å; D165-I169 WeakPolarHBondContact O-CB 3.43Å; D165-I169 VanDerWaalsContact O-CG1 3.25Å; D165-I169 WeakPolarHBondContact O-CG1 3.37Å; D165-I169 PolarHBondContact O-N 3.09Å
166E97.6Very high97.4Very high100 Ų100105.3 Ų105.347%0.46752%0.521SS..Hα-helixtrans-61.7-42.9176.1-164.3-174.2158.900111.7A162 Q163 K168 I169 K170A162-E166 WeakPolarHBondContact O-CB 3.43Å; A162-E166 PolarHBondContact O-N 3.26Å; Q163-E166 PolarHBondContact O-N 2.92Å; E166-K168 VanDerWaalsContact C-N 3.34Å; E166-K168 PolarHBondContact O-N 3.37Å; E166-I169 PolarHBondContact O-N 2.67Å; E166-K170 WeakPolarHBondContact O-CB 3.43Å; E166-K170 VanDerWaalsContact O-CG 3.31Å; E166-K170 WeakPolarHBondContact O-CG 3.21Å; E166-K170 PolarHBondContact O-N 2.91Å; E166-K170 VanDerWaalsContact OE1-CE 3.24Å; E166-K170 WeakPolarHBondContact OE1-CE 3.39Å; E166-K170 IonicContact OE1-NZ 3.46Å; E166-K170 PolarHBondContact OE1-NZ 3.15Å
167H96.6Very high97.5Very high132 Ų132104.6 Ų104.661%0.61152%0.516SS*.Hα-helixtrans-61.8-41.7172.4-76.9-63.1000111.9Q163 M164 D165 K170 S171Q163-H167 PolarHBondContact O-CD2 3.45Å; Q163-H167 PolarHBondContact O-N 3.44Å; M164-H167 PolarHBondContact O-N 2.92Å; D165-H167 PolarHBondContact O-N 3.38Å; H167-K170 PolarHBondContact O-N 3.47Å; H167-S171 PolarHBondContact O-N 2.87Å
168K98.3Very high97.5Very high120 Ų120106.8 Ų106.852%0.52252%0.52SS..Hα-helixtrans-64.6-45.1178.2-173.860.5176.4179.30111.3M164 D165 E166 S171 L172M164-K168 WeakPolarHBondContact O-CB 3.35Å; M164-K168 PolarHBondContact O-N 2.93Å; D165-K168 CarbonylContact O-C 3.54Å; D165-K168 WeakPolarHBondContact O-CB 3.45Å; D165-K168 PolarHBondContact O-N 2.91Å; D165-K168 VanDerWaalsContact O-N 3.12Å; E166-K168 VanDerWaalsContact C-N 3.34Å; E166-K168 PolarHBondContact O-N 3.37Å; K168-S171 PolarHBondContact O-N 2.89Å; K168-S171 PolarHBondContact O-OG 2.85Å; K168-L172 HydrophobicContact CG-CD1 4.24Å; K168-L172 WeakPolarHBondContact O-CG 3.37Å; K168-L172 PolarHBondContact O-N 3.38Å
169I97.9Very high97.5Very high113 Ų113107.3 Ų107.358%0.57952%0.518SS*.Hα-helixtrans-58.3-49175.7-70.6165.7000110.1D165 E166 S171 L172 F173D165-I169 WeakPolarHBondContact O-CB 3.43Å; D165-I169 VanDerWaalsContact O-CG1 3.25Å; D165-I169 WeakPolarHBondContact O-CG1 3.37Å; D165-I169 PolarHBondContact O-N 3.09Å; E166-I169 PolarHBondContact O-N 2.67Å; I169-S171 VanDerWaalsContact C-N 3.3Å; I169-S171 PolarHBondContact O-N 2.96Å; I169-L172 PolarHBondContact O-N 3.29Å; I169-F173 WeakPolarHBondContact O-CB 3.3Å; I169-F173 PolarHBondContact O-N 2.71Å
170K97.9Very high97.5Very high115 Ų115106 Ų10650%0.552%0.515SS..Hα-helixtrans-56.7-43.2176.5-74170.8-176.31660111.9E166 H167 F173 L174E166-K170 WeakPolarHBondContact O-CB 3.43Å; E166-K170 VanDerWaalsContact O-CG 3.31Å; E166-K170 WeakPolarHBondContact O-CG 3.21Å; E166-K170 PolarHBondContact O-N 2.91Å; E166-K170 VanDerWaalsContact OE1-CE 3.24Å; E166-K170 WeakPolarHBondContact OE1-CE 3.39Å; E166-K170 IonicContact OE1-NZ 3.46Å; E166-K170 PolarHBondContact OE1-NZ 3.15Å; H167-K170 PolarHBondContact O-N 3.47Å; K170-F173 PolarHBondContact O-N 3.25Å; K170-L174 PolarHBondContact O-N 3.48Å; K170-L174 VanDerWaalsContact O-N 3.09Å
171S97.6Very high97.4Very high49 Ų49103.9 Ų103.934%0.34351%0.51SS..Hα-helixtrans-65.5-40.6177.678.60000113.2H167 K168 I169 N175H167-S171 PolarHBondContact O-N 2.87Å; K168-S171 PolarHBondContact O-N 2.89Å; K168-S171 PolarHBondContact O-OG 2.85Å; I169-S171 VanDerWaalsContact C-N 3.3Å; I169-S171 PolarHBondContact O-N 2.96Å; S171-N175 PolarHBondContact O-N 3.41Å; S171-N175 VanDerWaalsContact O-N 3.13Å
172L97.5Very high97.4Very high84 Ų8499.9 Ų99.944%0.4450%0.496SS..Hα-helixtrans-68.9-39.3178-72175000110.9K168 I169 N175 I176K168-L172 HydrophobicContact CG-CD1 4.24Å; K168-L172 WeakPolarHBondContact O-CG 3.37Å; K168-L172 PolarHBondContact O-N 3.38Å; I169-L172 PolarHBondContact O-N 3.29Å; L172-N175 PolarHBondContact O-N 3.35Å; L172-I176 WeakPolarHBondContact O-CG1 3.36Å; L172-I176 PolarHBondContact O-N 2.9Å
173F98Very high97.5Very high138 Ų138101.9 Ų101.961%0.60550%0.502SS*.Hα-helixtrans-59.7-47.5176-168-91.4000111.4I169 K170 N175 I176 E177I169-F173 WeakPolarHBondContact O-CB 3.3Å; I169-F173 PolarHBondContact O-N 2.71Å; K170-F173 PolarHBondContact O-N 3.25Å; F173-N175 VanDerWaalsContact C-N 3.31Å; F173-N175 PolarHBondContact O-N 2.81Å; F173-I176 PolarHBondContact O-N 2.97Å; F173-I176 VanDerWaalsContact O-N 3.16Å; F173-E177 PolarHBondContact O-N 3.38Å
174L97.8Very high97.4Very high111 Ų111102.8 Ų102.858%0.58151%0.505SS*.Hα-helixtrans-61.7-37.8176.6-171.3132.4000112.4K170 E177 K178K170-L174 PolarHBondContact O-N 3.48Å; K170-L174 VanDerWaalsContact O-N 3.09Å; L174-E177 PolarHBondContact O-N 3.01Å; L174-K178 WeakPolarHBondContact O-CB 3.47Å; L174-K178 PolarHBondContact O-N 2.68Å
175N97.8Very high97.4Very high88 Ų88104.2 Ų104.247%0.47151%0.51SS..Hα-helixtrans-66.6-40.8174.1-79-24.7000112.8S171 L172 F173 K178 K179S171-N175 PolarHBondContact O-N 3.41Å; S171-N175 VanDerWaalsContact O-N 3.13Å; L172-N175 PolarHBondContact O-N 3.35Å; F173-N175 VanDerWaalsContact C-N 3.31Å; F173-N175 PolarHBondContact O-N 2.81Å; N175-K178 PolarHBondContact O-N 3.32Å; N175-K179 WeakPolarHBondContact O-CB 3.28Å; N175-K179 WeakPolarHBondContact O-CG 3.37Å; N175-K179 PolarHBondContact O-N 3.34Å
176I97.4Very high97.4Very high110 Ų110107.1 Ų107.156%0.56452%0.518SS*.Hα-helixtrans-62.3-45.4175.2-71.4167.2000109.9L172 F173 K179 T180L172-I176 WeakPolarHBondContact O-CG1 3.36Å; L172-I176 PolarHBondContact O-N 2.9Å; F173-I176 PolarHBondContact O-N 2.97Å; F173-I176 VanDerWaalsContact O-N 3.16Å; I176-K179 PolarHBondContact O-N 2.89Å; I176-T180 WeakPolarHBondContact O-CB 3.46Å; I176-T180 PolarHBondContact O-N 3.25Å; I176-T180 PolarHBondContact O-OG1 3.45Å
177E97.2Very high97.4Very high110 Ų110110.5 Ų110.551%0.51453%0.527SS..Hα-helixtrans-60.7-47.1178.5-172.2172.4-168.300111.4F173 L174 K179 T180 L181F173-E177 PolarHBondContact O-N 3.38Å; L174-E177 PolarHBondContact O-N 3.01Å; E177-K179 PolarHBondContact O-N 3.42Å; E177-T180 WeakPolarHBondContact O-CB 3.47Å; E177-T180 PolarHBondContact O-N 2.66Å; E177-L181 PolarHBondContact O-N 3.49Å
178K97.7Very high97.4Very high122 Ų122111.8 Ų111.853%0.5353%0.531SS..Hα-helixtrans-57.3-48.5174.7-175.9177.5178.1177.50112L174 N175 T180 L181 E182L174-K178 WeakPolarHBondContact O-CB 3.47Å; L174-K178 PolarHBondContact O-N 2.68Å; N175-K178 PolarHBondContact O-N 3.32Å; K178-T180 VanDerWaalsContact C-N 3.29Å; K178-T180 PolarHBondContact O-N 3.23Å; K178-L181 PolarHBondContact O-N 3.5Å; K178-E182 WeakPolarHBondContact CE-OE1 3.28Å; K178-E182 WeakPolarHBondContact O-CG 3.47Å; K178-E182 PolarHBondContact O-N 3.31Å
179K97.3Very high97.3Very high120 Ų120108.7 Ų108.752%0.52253%0.527SS..Hα-helixtrans-65.3-34.1178.5-71.6-70.8163.9-157.80112.3N175 I176 E177 E182 V183N175-K179 WeakPolarHBondContact O-CB 3.28Å; N175-K179 WeakPolarHBondContact O-CG 3.37Å; N175-K179 PolarHBondContact O-N 3.34Å; I176-K179 PolarHBondContact O-N 2.89Å; E177-K179 PolarHBondContact O-N 3.42Å; K179-E182 WeakPolarHBondContact CD-OE2 3.42Å; K179-E182 IonicContact NZ-OE1 3.81Å; K179-E182 PolarHBondContact NZ-OE1 2.77Å; K179-E182 IonicContact NZ-OE2 2.84Å; K179-E182 PolarHBondContact NZ-OE2 2.98Å; K179-E182 PolarHBondContact O-N 3.31Å; K179-V183 VanDerWaalsContact O-CG2 3.28Å; K179-V183 WeakPolarHBondContact O-CG2 3.47Å; K179-V183 PolarHBondContact O-N 3.4Å
180T96.3Very high97.2Very high64 Ų64108.1 Ų108.139%0.39353%0.525SS..Hα-helixtrans-66.2-40.1175.4-57.30000111.2I176 E177 K178 V183 K184I176-T180 WeakPolarHBondContact O-CB 3.46Å; I176-T180 PolarHBondContact O-N 3.25Å; I176-T180 PolarHBondContact O-OG1 3.45Å; E177-T180 WeakPolarHBondContact O-CB 3.47Å; E177-T180 PolarHBondContact O-N 2.66Å; K178-T180 VanDerWaalsContact C-N 3.29Å; K178-T180 PolarHBondContact O-N 3.23Å; T180-V183 PolarHBondContact O-N 3.06Å; T180-K184 WeakPolarHBondContact O-CG 3.41Å; T180-K184 PolarHBondContact O-N 3.41Å
181L97.4Very high97.2Very high93 Ų93106.4 Ų106.449%0.48752%0.521SS..Hα-helixtrans-64.1-47.8172.9-74.1170.7000111.6E177 K178 V183 K184 E185E177-L181 PolarHBondContact O-N 3.49Å; K178-L181 PolarHBondContact O-N 3.5Å; L181-V183 VanDerWaalsContact C-N 3.28Å; L181-V183 PolarHBondContact O-N 2.88Å; L181-K184 WeakPolarHBondContact O-CB 3.49Å; L181-K184 PolarHBondContact O-N 2.71Å; L181-E185 PolarHBondContact O-N 2.87Å
182E97.2Very high97.2Very high60 Ų60109.8 Ų109.828%0.2853%0.53SS..Hα-helixtrans-56.4-41.6175.9-72.2174.9-16000111.8K178 K179 E185 K186K178-E182 WeakPolarHBondContact CE-OE1 3.28Å; K178-E182 WeakPolarHBondContact O-CG 3.47Å; K178-E182 PolarHBondContact O-N 3.31Å; K179-E182 WeakPolarHBondContact CD-OE2 3.42Å; K179-E182 IonicContact NZ-OE1 3.81Å; K179-E182 PolarHBondContact NZ-OE1 2.77Å; K179-E182 IonicContact NZ-OE2 2.84Å; K179-E182 PolarHBondContact NZ-OE2 2.98Å; K179-E182 PolarHBondContact O-N 3.31Å; E182-E185 PolarHBondContact O-N 3.27Å; E182-K186 WeakPolarHBondContact O-CG 3.34Å; E182-K186 PolarHBondContact O-N 3.4Å
183V97.6Very high97Very high97 Ų97110.8 Ų110.859%0.58853%0.532SS*.Hα-helixtrans-64.9-43175.8168.20000111.5K179 T180 L181 E185 K186 R187K179-V183 VanDerWaalsContact O-CG2 3.28Å; K179-V183 WeakPolarHBondContact O-CG2 3.47Å; K179-V183 PolarHBondContact O-N 3.4Å; T180-V183 PolarHBondContact O-N 3.06Å; L181-V183 VanDerWaalsContact C-N 3.28Å; L181-V183 PolarHBondContact O-N 2.88Å; V183-E185 VanDerWaalsContact C-N 3.35Å; V183-E185 PolarHBondContact O-N 3.45Å; V183-K186 PolarHBondContact O-N 3.21Å; V183-R187 WeakPolarHBondContact O-CB 3.34Å; V183-R187 PolarHBondContact O-N 3.01Å
184K96.1Very high97Very high131 Ų131109 Ų10957%0.5753%0.528SS*.Hα-helixtrans-61.6-42.9176.7-76.4175.5179178.60111.5T180 L181 R187 K188T180-K184 WeakPolarHBondContact O-CG 3.41Å; T180-K184 PolarHBondContact O-N 3.41Å; L181-K184 WeakPolarHBondContact O-CB 3.49Å; L181-K184 PolarHBondContact O-N 2.71Å; K184-R187 PolarHBondContact O-N 2.98Å; K184-K188 WeakPolarHBondContact O-CG 3.47Å; K184-K188 PolarHBondContact O-N 3.16Å
185E97.1Very high96.9Very high133 Ų133108.1 Ų108.162%0.62153%0.527SS*.Hα-helixtrans-63.6-48.1176.5-72.1179.816500111.8L181 E182 V183 R187 K188 A189L181-E185 PolarHBondContact O-N 2.87Å; E182-E185 PolarHBondContact O-N 3.27Å; V183-E185 VanDerWaalsContact C-N 3.35Å; V183-E185 PolarHBondContact O-N 3.45Å; E185-R187 VanDerWaalsContact C-N 3.28Å; E185-R187 PolarHBondContact O-N 3.45Å; E185-K188 PolarHBondContact O-N 2.83Å; E185-A189 PolarHBondContact O-N 2.84Å
186K96.9Very high96.9Very high159 Ų159107.7 Ų107.769%0.69152%0.523SS*.Hα-helixtrans-61.2-36.4176.6-74.8-168.4179.1-1730112.7E182 V183 A189 L190E182-K186 WeakPolarHBondContact O-CG 3.34Å; E182-K186 PolarHBondContact O-N 3.4Å; V183-K186 PolarHBondContact O-N 3.21Å; K186-A189 PolarHBondContact O-N 2.96Å; K186-L190 WeakPolarHBondContact O-CB 3.45Å; K186-L190 PolarHBondContact O-N 3.35Å
187R96.9Very high96.8Very high172 Ų172106.6 Ų106.665%0.64952%0.521SS*.Hα-helixtrans-67.2-43.5176.1-170.2157.5-175.6163.7-0.4112V183 K184 E185 A189 L190 D191V183-R187 WeakPolarHBondContact O-CB 3.34Å; V183-R187 PolarHBondContact O-N 3.01Å; K184-R187 PolarHBondContact O-N 2.98Å; E185-R187 VanDerWaalsContact C-N 3.28Å; E185-R187 PolarHBondContact O-N 3.45Å; R187-A189 VanDerWaalsContact C-N 3.31Å; R187-A189 PolarHBondContact O-N 3.45Å; R187-L190 PolarHBondContact O-N 3.33Å; R187-D191 VanDerWaalsContact O-CG 3.29Å; R187-D191 PolarHBondContact O-N 3.22Å
188K97Very high96.7Very high159 Ų159110 Ų11069%0.69153%0.529SS*.Hα-helixtrans-59-42.2172.7-73.9179.5178.3-176.60112K184 E185 D191 K192K184-K188 WeakPolarHBondContact O-CG 3.47Å; K184-K188 PolarHBondContact O-N 3.16Å; E185-K188 PolarHBondContact O-N 2.83Å; K188-D191 PolarHBondContact O-N 3.02Å; K188-K192 PolarHBondContact O-N 3.34Å
189A96.4Very high96.6Very high54 Ų54107.7 Ų107.745%0.44653%0.528SS..Hα-helixtrans-62.9-45.8175.900000111.5E185 K186 R187 D191 K192 E193E185-A189 PolarHBondContact O-N 2.84Å; K186-A189 PolarHBondContact O-N 2.96Å; R187-A189 VanDerWaalsContact C-N 3.31Å; R187-A189 PolarHBondContact O-N 3.45Å; A189-D191 PolarHBondContact O-N 3.23Å; A189-K192 WeakPolarHBondContact O-CB 3.47Å; A189-K192 PolarHBondContact O-N 2.95Å; A189-E193 WeakPolarHBondContact O-CG 3.45Å; A189-E193 PolarHBondContact O-N 2.9Å
190L96.9Very high96.5Very high101 Ų101104.4 Ų104.453%0.52952%0.524SS..Hα-helixtrans-60.8-45.1176.6178.364.2000112.4K186 R187 K192 E193 L194K186-L190 WeakPolarHBondContact O-CB 3.45Å; K186-L190 PolarHBondContact O-N 3.35Å; R187-L190 PolarHBondContact O-N 3.33Å; L190-K192 VanDerWaalsContact C-N 3.26Å; L190-K192 PolarHBondContact O-N 3.41Å; L190-E193 PolarHBondContact O-N 3.04Å; L190-L194 HydrophobicContact CD1-CD1 4.4Å; L190-L194 HydrophobicContact CD1-CG 4.36Å; L190-L194 HydrophobicContact CG-CD1 4.12Å; L190-L194 WeakPolarHBondContact O-CB 3.42Å; L190-L194 WeakPolarHBondContact O-CG 3.36Å; L190-L194 PolarHBondContact O-N 2.88Å
191D96.5Very high96.4Very high80 Ų80107 Ų10743%0.42853%0.531SS..Hα-helixtrans-61.1-39177.9-68.6-25.3000110.6R187 K188 A189 L194 T195R187-D191 VanDerWaalsContact O-CG 3.29Å; R187-D191 PolarHBondContact O-N 3.22Å; K188-D191 PolarHBondContact O-N 3.02Å; A189-D191 PolarHBondContact O-N 3.23Å; D191-L194 PolarHBondContact O-N 3.42Å; D191-T195 WeakPolarHBondContact O-CG2 3.27Å; D191-T195 PolarHBondContact O-N 2.92Å; D191-T195 PolarHBondContact O-OG1 2.88Å
192K97.1Very high96.4Very high120 Ų120107.9 Ų107.952%0.52254%0.536SS..Hα-helixtrans-61.5-53.3174-169.1-179-178.6-90.60111.5K188 A189 L190 L194 T195 E196K188-K192 PolarHBondContact O-N 3.34Å; A189-K192 WeakPolarHBondContact O-CB 3.47Å; A189-K192 PolarHBondContact O-N 2.95Å; L190-K192 VanDerWaalsContact C-N 3.26Å; L190-K192 PolarHBondContact O-N 3.41Å; K192-L194 VanDerWaalsContact C-N 3.28Å; K192-L194 PolarHBondContact O-N 2.92Å; K192-T195 PolarHBondContact O-N 3.49Å; K192-T195 VanDerWaalsContact O-N 3.09Å; K192-T195 PolarHBondContact O-OG1 3.42Å; K192-E196 VanDerWaalsContact CE-OE1 3.32Å; K192-E196 WeakPolarHBondContact CE-OE1 3.36Å; K192-E196 IonicContact NZ-OE1 2.66Å; K192-E196 PolarHBondContact NZ-OE1 3.47Å; K192-E196 WeakPolarHBondContact O-CG 3.45Å; K192-E196 PolarHBondContact O-N 2.83Å
193E95Very high96.2Very high105 Ų105107.8 Ų107.849%0.49155%0.546SS..Hα-helixtrans-59.3-37.7178.3-67.1-59.9144.900112.3A189 L190 E196 T197A189-E193 WeakPolarHBondContact O-CG 3.45Å; A189-E193 PolarHBondContact O-N 2.9Å; L190-E193 PolarHBondContact O-N 3.04Å; E193-E196 PolarHBondContact O-N 3.4Å; E193-T197 WeakPolarHBondContact O-CB 3.36Å; E193-T197 PolarHBondContact O-N 3.18Å; E193-T197 PolarHBondContact O-OG1 3.4Å
194L97.1Very high96.2Very high100 Ų100108.3 Ų108.352%0.52454%0.544SS..Hα-helixtrans-64.1-44174-80.6172000111.9L190 D191 K192 R198L190-L194 HydrophobicContact CD1-CD1 4.4Å; L190-L194 HydrophobicContact CD1-CG 4.36Å; L190-L194 HydrophobicContact CG-CD1 4.12Å; L190-L194 WeakPolarHBondContact O-CB 3.42Å; L190-L194 WeakPolarHBondContact O-CG 3.36Å; L190-L194 PolarHBondContact O-N 2.88Å; D191-L194 PolarHBondContact O-N 3.42Å; K192-L194 VanDerWaalsContact C-N 3.28Å; K192-L194 PolarHBondContact O-N 2.92Å; L194-R198 VanDerWaalsContact O-CB 3.26Å; L194-R198 WeakPolarHBondContact O-CB 3.46Å; L194-R198 PolarHBondContact O-N 3.48Å
195T96.4Very high96.2Very high92 Ų92105.6 Ų105.656%0.56454%0.536SS*.Hα-helixtrans-64.2-41.2176.756.40000111.9D191 K192 R198 S199D191-T195 WeakPolarHBondContact O-CG2 3.27Å; D191-T195 PolarHBondContact O-N 2.92Å; D191-T195 PolarHBondContact O-OG1 2.88Å; K192-T195 PolarHBondContact O-N 3.49Å; K192-T195 VanDerWaalsContact O-N 3.09Å; K192-T195 PolarHBondContact O-OG1 3.42Å; T195-R198 PolarHBondContact O-N 2.83Å; T195-S199 WeakPolarHBondContact O-CB 3.45Å; T195-S199 PolarHBondContact O-N 3.36Å
196E96.7Very high96.2Very high80 Ų80104.5 Ų104.537%0.37453%0.529SS..Hα-helixtrans-64-48.7176.6-70.7179.6-164.200110.9K192 E193 R198 S199 A200K192-E196 VanDerWaalsContact CE-OE1 3.32Å; K192-E196 WeakPolarHBondContact CE-OE1 3.36Å; K192-E196 IonicContact NZ-OE1 2.66Å; K192-E196 PolarHBondContact NZ-OE1 3.47Å; K192-E196 WeakPolarHBondContact O-CG 3.45Å; K192-E196 PolarHBondContact O-N 2.83Å; E193-E196 PolarHBondContact O-N 3.4Å; E196-R198 VanDerWaalsContact C-N 3.33Å; E196-R198 PolarHBondContact O-N 3.25Å; E196-S199 PolarHBondContact O-N 3.4Å; E196-S199 VanDerWaalsContact O-N 3.15Å; E196-S199 PolarHBondContact O-OG 2.68Å; E196-A200 PolarHBondContact O-N 3.1Å
197T95.8Very high96.2Very high86 Ų86100.1 Ų100.153%0.52852%0.516SS..Hα-helixtrans-58.9-44.4177.1-56.80000111.6E193 S199 A200 Q201E193-T197 WeakPolarHBondContact O-CB 3.36Å; E193-T197 PolarHBondContact O-N 3.18Å; E193-T197 PolarHBondContact O-OG1 3.4Å; T197-S199 VanDerWaalsContact C-N 3.34Å; T197-S199 PolarHBondContact O-N 2.69Å; T197-A200 PolarHBondContact O-N 2.98Å; T197-Q201 WeakPolarHBondContact O-CB 3.48Å; T197-Q201 PolarHBondContact O-N 2.89Å
198R95.4Very high96.1Very high183 Ų18395.9 Ų95.969%0.69151%0.505SS*.Hα-helixtrans-66.2-36.8178.4-166.3169.8-174.2162.21.1112L194 T195 E196 Q201 L202L194-R198 VanDerWaalsContact O-CB 3.26Å; L194-R198 WeakPolarHBondContact O-CB 3.46Å; L194-R198 PolarHBondContact O-N 3.48Å; T195-R198 PolarHBondContact O-N 2.83Å; E196-R198 VanDerWaalsContact C-N 3.33Å; E196-R198 PolarHBondContact O-N 3.25Å; R198-Q201 PolarHBondContact O-N 2.96Å; R198-L202 WeakPolarHBondContact O-CG 3.36Å; R198-L202 PolarHBondContact O-N 2.95Å
199S95.4Very high96.1Very high72 Ų7293.1 Ų93.150%0.50350%0.495SS..Hα-helixtrans-66.3-40.4174.576.70000112.2T195 E196 T197 L202 A203T195-S199 WeakPolarHBondContact O-CB 3.45Å; T195-S199 PolarHBondContact O-N 3.36Å; E196-S199 PolarHBondContact O-N 3.4Å; E196-S199 VanDerWaalsContact O-N 3.15Å; E196-S199 PolarHBondContact O-OG 2.68Å; T197-S199 VanDerWaalsContact C-N 3.34Å; T197-S199 PolarHBondContact O-N 2.69Å; S199-L202 PolarHBondContact O-N 3.45Å; S199-A203 PolarHBondContact O-N 3.01Å
200A95.6Very high96.1Very high52 Ų5294.3 Ų94.343%0.4349%0.494SS..Hα-helixtrans-65.3-40.217500000111.5E196 T197 A203 L204E196-A200 PolarHBondContact O-N 3.1Å; T197-A200 PolarHBondContact O-N 2.98Å; A200-A203 WeakPolarHBondContact O-CB 3.4Å; A200-A203 PolarHBondContact O-N 3.3Å; A200-L204 WeakPolarHBondContact O-CG 3.47Å; A200-L204 PolarHBondContact O-N 3.24Å
201Q93.9Very high96Very high117 Ų11793.7 Ų93.755%0.54749%0.49SS..Hα-helixtrans-62.9-44.9175.5-169.1170.96.400111.9T197 R198 A203 L204 D205T197-Q201 WeakPolarHBondContact O-CB 3.48Å; T197-Q201 PolarHBondContact O-N 2.89Å; R198-Q201 PolarHBondContact O-N 2.96Å; Q201-A203 VanDerWaalsContact C-N 3.3Å; Q201-A203 PolarHBondContact O-N 2.91Å; Q201-L204 WeakPolarHBondContact O-CB 3.44Å; Q201-L204 PolarHBondContact O-N 3.33Å; Q201-L204 VanDerWaalsContact O-N 3.15Å; Q201-D205 PolarHBondContact O-N 2.97Å
202L96.4Very high95.9Very high113 Ų11395.6 Ų95.659%0.59250%0.497SS*.Hα-helixtrans-60.6-39.1174.1-74.4169.3000112.4R198 S199 D205 K206R198-L202 WeakPolarHBondContact O-CG 3.36Å; R198-L202 PolarHBondContact O-N 2.95Å; S199-L202 PolarHBondContact O-N 3.45Å; L202-D205 PolarHBondContact O-N 3.07Å; L202-K206 WeakPolarHBondContact O-CB 3.46Å; L202-K206 PolarHBondContact O-N 3Å
203A94.8Very high95.9Very high58 Ų5895.3 Ų95.348%0.47950%0.497SS..Hα-helixtrans-64-42174.900000111.5S199 A200 Q201 K206 T207S199-A203 PolarHBondContact O-N 3.01Å; A200-A203 WeakPolarHBondContact O-CB 3.4Å; A200-A203 PolarHBondContact O-N 3.3Å; Q201-A203 VanDerWaalsContact C-N 3.3Å; Q201-A203 PolarHBondContact O-N 2.91Å; A203-K206 PolarHBondContact O-N 3.46Å; A203-T207 WeakPolarHBondContact O-CG2 3.49Å; A203-T207 PolarHBondContact O-N 3.21Å
204L96.4Very high95.9Very high108 Ų10892.3 Ų92.357%0.56549%0.49SS*.Hα-helixtrans-61.6-47.6174.6-73.7172.3000111.8A200 Q201 K206 T207 I208A200-L204 WeakPolarHBondContact O-CG 3.47Å; A200-L204 PolarHBondContact O-N 3.24Å; Q201-L204 WeakPolarHBondContact O-CB 3.44Å; Q201-L204 PolarHBondContact O-N 3.33Å; Q201-L204 VanDerWaalsContact O-N 3.15Å; L204-K206 VanDerWaalsContact C-N 3.28Å; L204-K206 PolarHBondContact O-N 3.5Å; L204-T207 WeakPolarHBondContact CA-OG1 3.34Å; L204-T207 CarbonylContact O-C 3.6Å; L204-T207 PolarHBondContact O-N 2.83Å; L204-T207 PolarHBondContact O-OG1 2.93Å; L204-I208 WeakPolarHBondContact O-CG1 3.49Å; L204-I208 PolarHBondContact O-N 3.47Å
205D96.5Very high95.8Very high74 Ų7495.4 Ų95.440%0.39650%0.495SS..Hα-helixtrans-58.2-42.7176.6-68-25.2000111Q201 L202 T207 I208 E209Q201-D205 PolarHBondContact O-N 2.97Å; L202-D205 PolarHBondContact O-N 3.07Å; D205-T207 VanDerWaalsContact C-N 3.33Å; D205-T207 PolarHBondContact O-N 3.18Å; D205-I208 WeakPolarHBondContact O-CB 3.47Å; D205-I208 PolarHBondContact O-N 3.43Å; D205-I208 VanDerWaalsContact O-N 3.15Å; D205-E209 WeakPolarHBondContact O-CG 3.33Å; D205-E209 PolarHBondContact O-N 3.39Å
206K97.3Very high95.8Very high109 Ų10993.6 Ų93.647%0.47449%0.489SS..Hα-helixtrans-61.7-40.5174.7-168.570.8-149.5158.20112.4L202 A203 L204 I208 E209 N210L202-K206 WeakPolarHBondContact O-CB 3.46Å; L202-K206 PolarHBondContact O-N 3Å; A203-K206 PolarHBondContact O-N 3.46Å; L204-K206 VanDerWaalsContact C-N 3.28Å; L204-K206 PolarHBondContact O-N 3.5Å; K206-I208 VanDerWaalsContact C-N 3.34Å; K206-E209 IonicContact NZ-OE2 3.06Å; K206-E209 PolarHBondContact NZ-OE2 3.06Å; K206-E209 PolarHBondContact O-N 2.72Å; K206-N210 PolarHBondContact O-N 2.94Å; K206-N210 PolarHBondContact O-ND2 2.94Å; K206-N210 PolarHBondContact O-OD1 2.88Å
207T96.1Very high95.7Very high67 Ų6794.8 Ų94.841%0.41150%0.495SS..Hα-helixtrans-66.9-35.7174.859.70000112.6A203 L204 D205 N210 I211A203-T207 WeakPolarHBondContact O-CG2 3.49Å; A203-T207 PolarHBondContact O-N 3.21Å; L204-T207 WeakPolarHBondContact CA-OG1 3.34Å; L204-T207 CarbonylContact O-C 3.6Å; L204-T207 PolarHBondContact O-N 2.83Å; L204-T207 PolarHBondContact O-OG1 2.93Å; D205-T207 VanDerWaalsContact C-N 3.33Å; D205-T207 PolarHBondContact O-N 3.18Å; T207-N210 PolarHBondContact O-N 3.34Å; T207-I211 VanDerWaalsContact O-CG1 3.28Å; T207-I211 WeakPolarHBondContact O-CG1 3.41Å; T207-I211 PolarHBondContact O-N 3.43Å
208I95.8Very high95.7Very high83 Ų8394.9 Ų94.943%0.42649%0.491SS..Hα-helixtrans-64.7-45.7175.2-69.4166.6000110L204 D205 K206 N210 I211 Q212L204-I208 WeakPolarHBondContact O-CG1 3.49Å; L204-I208 PolarHBondContact O-N 3.47Å; D205-I208 WeakPolarHBondContact O-CB 3.47Å; D205-I208 PolarHBondContact O-N 3.43Å; D205-I208 VanDerWaalsContact O-N 3.15Å; K206-I208 VanDerWaalsContact C-N 3.34Å; I208-N210 VanDerWaalsContact C-N 3.32Å; I208-N210 PolarHBondContact O-N 2.9Å; I208-I211 PolarHBondContact O-N 3.19Å; I208-I211 VanDerWaalsContact O-N 3.16Å; I208-Q212 HydrophobicContact CG2-CG 4.46Å; I208-Q212 WeakPolarHBondContact O-CG 3.49Å; I208-Q212 PolarHBondContact O-N 3.46Å
209E95.9Very high95.6Very high101 Ų10192.3 Ų92.347%0.47249%0.487SS..Hα-helixtrans-55.5-47.6173.5-74.6177.9-179.700111.3D205 K206 I211 Q212 Q213D205-E209 WeakPolarHBondContact O-CG 3.33Å; D205-E209 PolarHBondContact O-N 3.39Å; K206-E209 IonicContact NZ-OE2 3.06Å; K206-E209 PolarHBondContact NZ-OE2 3.06Å; K206-E209 PolarHBondContact O-N 2.72Å; E209-I211 VanDerWaalsContact C-N 3.32Å; E209-I211 PolarHBondContact O-N 3Å; E209-Q212 PolarHBondContact O-N 3.34Å; E209-Q213 PolarHBondContact O-N 3.03Å
210N96.3Very high95.6Very high79 Ų7995 Ų9542%0.42249%0.491SS..Hα-helixtrans-61.8-39.3177.7-66.5-12.9000111.9K206 T207 I208 Q213 A214K206-N210 PolarHBondContact O-N 2.94Å; K206-N210 PolarHBondContact O-ND2 2.94Å; K206-N210 PolarHBondContact O-OD1 2.88Å; T207-N210 PolarHBondContact O-N 3.34Å; I208-N210 VanDerWaalsContact C-N 3.32Å; I208-N210 PolarHBondContact O-N 2.9Å; N210-Q213 PolarHBondContact O-N 3.18Å; N210-A214 WeakPolarHBondContact O-CB 3.23Å; N210-A214 PolarHBondContact O-N 3.07Å
211I94.9Very high95.6Very high89 Ų8997.3 Ų97.346%0.45650%0.496SS..Hα-helixtrans-65.6-42175.5-71.3165.1000111T207 I208 E209 Q213 A214 R215T207-I211 VanDerWaalsContact O-CG1 3.28Å; T207-I211 WeakPolarHBondContact O-CG1 3.41Å; T207-I211 PolarHBondContact O-N 3.43Å; I208-I211 PolarHBondContact O-N 3.19Å; I208-I211 VanDerWaalsContact O-N 3.16Å; E209-I211 VanDerWaalsContact C-N 3.32Å; E209-I211 PolarHBondContact O-N 3Å; I211-Q213 VanDerWaalsContact C-N 3.34Å; I211-A214 PolarHBondContact O-N 2.92Å; I211-R215 HydrophobicContact CG2-CG 4.47Å; I211-R215 WeakPolarHBondContact O-CB 3.25Å; I211-R215 WeakPolarHBondContact O-CG 3.27Å; I211-R215 PolarHBondContact O-N 3.18Å
212Q96Very high95.6Very high120 Ų12098 Ų9856%0.56150%0.497SS*.Hα-helixtrans-63.1-42.5176.7-72.6177.8-1.300111.2I208 E209 R215 A216I208-Q212 HydrophobicContact CG2-CG 4.46Å; I208-Q212 WeakPolarHBondContact O-CG 3.49Å; I208-Q212 PolarHBondContact O-N 3.46Å; E209-Q212 PolarHBondContact O-N 3.34Å; Q212-R215 WeakPolarHBondContact O-CB 3.45Å; Q212-R215 PolarHBondContact O-N 3.29Å; Q212-A216 PolarHBondContact O-N 3.44Å
213Q96.3Very high95.5Very high114 Ų11498.3 Ų98.353%0.53350%0.495SS..Hα-helixtrans-60.5-50.2173.9-174.9-178.4-17.300111.4E209 N210 I211 R215 A216 E217E209-Q213 PolarHBondContact O-N 3.03Å; N210-Q213 PolarHBondContact O-N 3.18Å; I211-Q213 VanDerWaalsContact C-N 3.34Å; Q213-R215 VanDerWaalsContact C-N 3.27Å; Q213-R215 PolarHBondContact O-N 2.82Å; Q213-A216 WeakPolarHBondContact O-CB 3.38Å; Q213-A216 PolarHBondContact O-N 2.67Å; Q213-A216 VanDerWaalsContact O-N 3.08Å; Q213-E217 PolarHBondContact NE2-OE1 3.03Å; Q213-E217 VanDerWaalsContact NE2-OE1 3.07Å; Q213-E217 WeakPolarHBondContact O-CG 3.39Å; Q213-E217 PolarHBondContact O-N 3.47Å
214A94.9Very high95.5Very high41 Ų41100 Ų10034%0.33950%0.496SS..Hα-helixtrans-59.4-37.8177.100000112.2N210 I211 E217 I218N210-A214 WeakPolarHBondContact O-CB 3.23Å; N210-A214 PolarHBondContact O-N 3.07Å; I211-A214 PolarHBondContact O-N 2.92Å; A214-E217 PolarHBondContact O-N 3.37Å; A214-I218 WeakPolarHBondContact O-CB 3.45Å; A214-I218 VanDerWaalsContact O-CG1 3.24Å; A214-I218 WeakPolarHBondContact O-CG1 3.34Å; A214-I218 PolarHBondContact O-N 3.35Å
215R94.8Very high95.3Very high165 Ų16598.3 Ų98.362%0.62349%0.492SS*.Hα-helixtrans-63.2-42.9173.8-79.1177.5175.9-174.5-0.1112.2I211 Q212 Q213 E217 I218 Q219I211-R215 HydrophobicContact CG2-CG 4.47Å; I211-R215 WeakPolarHBondContact O-CB 3.25Å; I211-R215 WeakPolarHBondContact O-CG 3.27Å; I211-R215 PolarHBondContact O-N 3.18Å; Q212-R215 WeakPolarHBondContact O-CB 3.45Å; Q212-R215 PolarHBondContact O-N 3.29Å; Q213-R215 VanDerWaalsContact C-N 3.27Å; Q213-R215 PolarHBondContact O-N 2.82Å; R215-E217 VanDerWaalsContact C-N 3.34Å; R215-I218 PolarHBondContact O-N 3.17Å; R215-Q219 WeakPolarHBondContact O-CB 3.3Å; R215-Q219 WeakPolarHBondContact O-CG 3.4Å; R215-Q219 PolarHBondContact O-N 3.18Å
216A95.9Very high95.2Very high54 Ų5499.6 Ų99.645%0.44650%0.496SS..Hα-helixtrans-63-41.9176.600000111.5Q212 Q213 Q219 H220Q212-A216 PolarHBondContact O-N 3.44Å; Q213-A216 WeakPolarHBondContact O-CB 3.38Å; Q213-A216 PolarHBondContact O-N 2.67Å; Q213-A216 VanDerWaalsContact O-N 3.08Å; A216-Q219 PolarHBondContact O-N 2.95Å; A216-H220 WeakPolarHBondContact O-CB 3.4Å; A216-H220 PolarHBondContact O-N 3.42Å
217E95.4Very high95.1Very high106 Ų10698.1 Ų98.150%0.49549%0.493SS..Hα-helixtrans-62.2-44.9174.8-69.4171.5-166.800111.8Q213 A214 R215 H220 L221Q213-E217 PolarHBondContact NE2-OE1 3.03Å; Q213-E217 VanDerWaalsContact NE2-OE1 3.07Å; Q213-E217 WeakPolarHBondContact O-CG 3.39Å; Q213-E217 PolarHBondContact O-N 3.47Å; A214-E217 PolarHBondContact O-N 3.37Å; R215-E217 VanDerWaalsContact C-N 3.34Å; E217-H220 WeakPolarHBondContact O-CB 3.46Å; E217-H220 PolarHBondContact O-N 2.9Å; E217-L221 WeakPolarHBondContact O-CG 3.48Å; E217-L221 PolarHBondContact O-N 2.95Å
218I94.9Very high95Very high88 Ų8898 Ų9845%0.45149%0.492SS..Hα-helixtrans-61.3-45.1175.4-71.7166.3000111.2A214 R215 H220 L221 F222A214-I218 WeakPolarHBondContact O-CB 3.45Å; A214-I218 VanDerWaalsContact O-CG1 3.24Å; A214-I218 WeakPolarHBondContact O-CG1 3.34Å; A214-I218 PolarHBondContact O-N 3.35Å; R215-I218 PolarHBondContact O-N 3.17Å; I218-H220 VanDerWaalsContact C-N 3.31Å; I218-H220 PolarHBondContact O-N 2.83Å; I218-L221 PolarHBondContact O-N 3.41Å; I218-F222 HydrophobicContact CG2-CD2 3.61Å; I218-F222 HydrophobicContact CG2-CE2 3.37Å; I218-F222 HydrophobicContact CG2-CZ 4.43Å; I218-F222 VanDerWaalsContact O-CD2 3.29Å; I218-F222 WeakPolarHBondContact O-CD2 3.5Å; I218-F222 PolarHBondContact O-N 3.16Å
219Q95.1Very high94.8Very high128 Ų12898.6 Ų98.660%0.59850%0.495SS*.Hα-helixtrans-61.2-40.8177.1-77.2178-13.100112.1R215 A216 F222 H223R215-Q219 WeakPolarHBondContact O-CB 3.3Å; R215-Q219 WeakPolarHBondContact O-CG 3.4Å; R215-Q219 PolarHBondContact O-N 3.18Å; A216-Q219 PolarHBondContact O-N 2.95Å; Q219-F222 PolarHBondContact O-N 3.47Å; Q219-H223 PolarHBondContact O-N 2.98Å; Q219-H223 PolarHBondContact O-ND1 3.47Å
220H94.9Very high94.7Very high129 Ų129100 Ų10060%0.59750%0.5SS*.Hα-helixtrans-62.3-43.6174.2177.9-89.6000111.7A216 E217 I218 F222 H223 L224A216-H220 WeakPolarHBondContact O-CB 3.4Å; A216-H220 PolarHBondContact O-N 3.42Å; E217-H220 WeakPolarHBondContact O-CB 3.46Å; E217-H220 PolarHBondContact O-N 2.9Å; I218-H220 VanDerWaalsContact C-N 3.31Å; I218-H220 PolarHBondContact O-N 2.83Å; H220-F222 PolarHBondContact O-N 3.3Å; H220-H223 PolarHBondContact O-N 2.9Å; H220-L224 PolarHBondContact O-N 3.44Å
221L95.4Very high94.5Very high101 Ų101102.4 Ų102.453%0.52951%0.508SS..Hα-helixtrans-62.9-40.1174.5-72174.4000112.3E217 I218 L224 C225E217-L221 WeakPolarHBondContact O-CG 3.48Å; E217-L221 PolarHBondContact O-N 2.95Å; I218-L221 PolarHBondContact O-N 3.41Å; L221-L224 PolarHBondContact O-N 2.96Å; L221-C225 WeakPolarHBondContact O-CB 3.35Å; L221-C225 PolarHBondContact O-N 3.06Å
222F93.6Very high94.2Very high132 Ų132103.9 Ų103.958%0.57951%0.512SS*.Hα-helixtrans-60.3-45.3173.7-83-57.8000111.8I218 Q219 H220 L224 C225 E226I218-F222 HydrophobicContact CG2-CD2 3.61Å; I218-F222 HydrophobicContact CG2-CE2 3.37Å; I218-F222 HydrophobicContact CG2-CZ 4.43Å; I218-F222 VanDerWaalsContact O-CD2 3.29Å; I218-F222 WeakPolarHBondContact O-CD2 3.5Å; I218-F222 PolarHBondContact O-N 3.16Å; Q219-F222 PolarHBondContact O-N 3.47Å; H220-F222 PolarHBondContact O-N 3.3Å; F222-L224 VanDerWaalsContact C-N 3.31Å; F222-L224 PolarHBondContact O-N 2.77Å; F222-C225 PolarHBondContact O-N 3.27Å; F222-E226 WeakPolarHBondContact O-CB 3.31Å; F222-E226 WeakPolarHBondContact O-CG 3.42Å; F222-E226 PolarHBondContact O-N 2.9Å
223H93.9Very high93.9Very high118 Ų118105 Ų10555%0.54652%0.515SS..Hα-helixtrans-59.6-41.9175.5-81.657.9000111.9Q219 H220 E226 N227Q219-H223 PolarHBondContact O-N 2.98Å; Q219-H223 PolarHBondContact O-ND1 3.47Å; H220-H223 PolarHBondContact O-N 2.9Å; H223-E226 PolarHBondContact O-N 2.7Å; H223-N227 WeakPolarHBondContact O-CB 3.3Å; H223-N227 PolarHBondContact O-N 3.41Å; H223-N227 PolarHBondContact O-ND2 3.28Å
224L95Very high93.7Very high95 Ų95104.7 Ų104.750%0.49751%0.513SS..Hα-helixtrans-63.8-43.5176.6-17366.5000111.8H220 L221 F222 N227 T228H220-L224 PolarHBondContact O-N 3.44Å; L221-L224 PolarHBondContact O-N 2.96Å; F222-L224 VanDerWaalsContact C-N 3.31Å; F222-L224 PolarHBondContact O-N 2.77Å; L224-N227 PolarHBondContact O-N 3.01Å; L224-T228 WeakPolarHBondContact O-CB 3.49Å; L224-T228 PolarHBondContact O-N 3.27Å; L224-T228 PolarHBondContact O-OG1 2.96Å
225C93.3Very high93.5Very high71 Ų71107.7 Ų107.748%0.4852%0.523SS..Hα-helixtrans-62.2-46.5174.7-80.10000111.7L221 F222 N227 T228 I229L221-C225 WeakPolarHBondContact O-CB 3.35Å; L221-C225 PolarHBondContact O-N 3.06Å; F222-C225 PolarHBondContact O-N 3.27Å; C225-N227 VanDerWaalsContact C-N 3.32Å; C225-N227 PolarHBondContact O-N 3.45Å; C225-T228 PolarHBondContact O-N 2.85Å; C225-I229 WeakPolarHBondContact O-CB 3.36Å; C225-I229 VanDerWaalsContact O-CG1 3.27Å; C225-I229 WeakPolarHBondContact O-CG1 3.44Å; C225-I229 PolarHBondContact O-N 3.44Å
226E94.4Very high93.4Very high101 Ų101103.6 Ų103.647%0.47251%0.513SS..Hα-helixtrans-58.8-43.8176-77.3-176.618000111.9F222 H223 T228 I229 K230F222-E226 WeakPolarHBondContact O-CB 3.31Å; F222-E226 WeakPolarHBondContact O-CG 3.42Å; F222-E226 PolarHBondContact O-N 2.9Å; H223-E226 PolarHBondContact O-N 2.7Å; E226-T228 VanDerWaalsContact C-N 3.35Å; E226-I229 PolarHBondContact O-N 3.15Å; E226-K230 WeakPolarHBondContact O-CB 3.1Å; E226-K230 WeakPolarHBondContact O-CG 3.3Å; E226-K230 PolarHBondContact O-N 3.06Å
227N93.9Very high93.1Very high79 Ų79103.2 Ų103.242%0.42251%0.507SS..Hα-helixtrans-63.1-42.4175.9-73.1-19.6000111.6H223 L224 C225 K230 Q231H223-N227 WeakPolarHBondContact O-CB 3.3Å; H223-N227 PolarHBondContact O-N 3.41Å; H223-N227 PolarHBondContact O-ND2 3.28Å; L224-N227 PolarHBondContact O-N 3.01Å; C225-N227 VanDerWaalsContact C-N 3.32Å; C225-N227 PolarHBondContact O-N 3.45Å; N227-K230 PolarHBondContact O-N 3.44Å; N227-Q231 WeakPolarHBondContact O-CG 3.3Å; N227-Q231 PolarHBondContact O-N 3.36Å
228T93.7Very high92.9Very high64 Ų64101 Ų10139%0.39350%0.499SS..Hα-helixtrans-64.2-41176.4-54.20000111.3L224 C225 E226 Q231 K232L224-T228 WeakPolarHBondContact O-CB 3.49Å; L224-T228 PolarHBondContact O-N 3.27Å; L224-T228 PolarHBondContact O-OG1 2.96Å; C225-T228 PolarHBondContact O-N 2.85Å; E226-T228 VanDerWaalsContact C-N 3.35Å; T228-Q231 PolarHBondContact O-N 2.98Å; T228-K232 WeakPolarHBondContact O-CB 2.98Å; T228-K232 WeakPolarHBondContact O-CG 3.43Å; T228-K232 PolarHBondContact O-N 2.88Å
229I92.6Very high92.7Very high95 Ų95102.5 Ų102.549%0.48751%0.506SS..Hα-helixtrans-64.7-43.6175.6-69.2165.4000110.5C225 E226 Q231 K232 K233C225-I229 WeakPolarHBondContact O-CB 3.36Å; C225-I229 VanDerWaalsContact O-CG1 3.27Å; C225-I229 WeakPolarHBondContact O-CG1 3.44Å; C225-I229 PolarHBondContact O-N 3.44Å; E226-I229 PolarHBondContact O-N 3.15Å; I229-Q231 VanDerWaalsContact C-N 3.35Å; I229-Q231 PolarHBondContact O-N 3.3Å; I229-K232 PolarHBondContact O-N 3.09Å; I229-K233 HydrophobicContact CG2-CD 4.33Å; I229-K233 HydrophobicContact CG2-CG 4.43Å; I229-K233 WeakPolarHBondContact O-CG 3.24Å; I229-K233 PolarHBondContact O-N 2.85Å
230K93.1Very high92.5Very high131 Ų131102.5 Ų102.557%0.5751%0.506SS*.Hα-helixtrans-59.3-45.7174.8-74.8171.5-175.5168.80111.2E226 N227 K232 K233 Q234E226-K230 WeakPolarHBondContact O-CB 3.1Å; E226-K230 WeakPolarHBondContact O-CG 3.3Å; E226-K230 PolarHBondContact O-N 3.06Å; N227-K230 PolarHBondContact O-N 3.44Å; K230-K232 PolarHBondContact O-N 3.44Å; K230-K233 PolarHBondContact O-N 3.34Å; K230-Q234 PolarHBondContact O-N 3.18Å
231Q93Very high92.2Very high129 Ų129101.1 Ų101.160%0.60350%0.5SS*.Hα-helixtrans-60.5-43.5174.9-73.4176.3-0.400111.9N227 T228 I229 Q234 L235N227-Q231 WeakPolarHBondContact O-CG 3.3Å; N227-Q231 PolarHBondContact O-N 3.36Å; T228-Q231 PolarHBondContact O-N 2.98Å; I229-Q231 VanDerWaalsContact C-N 3.35Å; I229-Q231 PolarHBondContact O-N 3.3Å; Q231-Q234 PolarHBondContact O-N 3.24Å; Q231-L235 WeakPolarHBondContact O-CG 3.39Å; Q231-L235 PolarHBondContact O-N 2.92Å
232K87.9Confident91.9Very high121 Ų12199.6 Ų99.653%0.52650%0.497SS..Hα-helixtrans-63.3-45.4176.3-75.5-72-177.3179.70112.4T228 I229 K230 Q234 L235 D236T228-K232 WeakPolarHBondContact O-CB 2.98Å; T228-K232 WeakPolarHBondContact O-CG 3.43Å; T228-K232 PolarHBondContact O-N 2.88Å; I229-K232 PolarHBondContact O-N 3.09Å; K230-K232 PolarHBondContact O-N 3.44Å; K232-Q234 VanDerWaalsContact C-N 3.29Å; K232-Q234 PolarHBondContact O-N 3.13Å; K232-L235 PolarHBondContact O-N 3.47Å; K232-L235 VanDerWaalsContact O-N 3.17Å; K232-D236 PolarHBondContact O-N 3.22Å
233K90.4Very high91.6Very high144 Ų14496.5 Ų96.563%0.62649%0.491SS*.Hα-helixtrans-58.9-39.5174.5-75.2-177.4177-175.40112.3I229 K230 D236 S237I229-K233 HydrophobicContact CG2-CD 4.33Å; I229-K233 HydrophobicContact CG2-CG 4.43Å; I229-K233 WeakPolarHBondContact O-CG 3.24Å; I229-K233 PolarHBondContact O-N 2.85Å; K230-K233 PolarHBondContact O-N 3.34Å; K233-D236 PolarHBondContact O-N 3.05Å; K233-S237 WeakPolarHBondContact O-CB 3.18Å; K233-S237 PolarHBondContact O-N 3.47Å
234Q91.5Very high91.4Very high107 Ų10795.8 Ų95.850%0.549%0.491SS..Hα-helixtrans-64.2-47.4175-174.560.741.500111.2K230 Q231 K232 D236 S237 D238K230-Q234 PolarHBondContact O-N 3.18Å; Q231-Q234 PolarHBondContact O-N 3.24Å; K232-Q234 VanDerWaalsContact C-N 3.29Å; K232-Q234 PolarHBondContact O-N 3.13Å; Q234-D236 VanDerWaalsContact C-N 3.31Å; Q234-D236 PolarHBondContact O-N 2.94Å; Q234-S237 PolarHBondContact O-N 3.45Å; Q234-D238 PolarHBondContact NE2-OD1 3.24Å; Q234-D238 WeakPolarHBondContact O-CB 3.48Å; Q234-D238 PolarHBondContact O-N 2.82Å
235L90.6Very high91.2Very high103 Ų10397.7 Ų97.754%0.53950%0.495SS..Hα-helixtrans-60.6-39.5176.4-71.9172.1000112.3Q231 K232 D238 M239Q231-L235 WeakPolarHBondContact O-CG 3.39Å; Q231-L235 PolarHBondContact O-N 2.92Å; K232-L235 PolarHBondContact O-N 3.47Å; K232-L235 VanDerWaalsContact O-N 3.17Å; L235-D238 PolarHBondContact O-N 3.37Å; L235-M239 VanDerWaalsContact O-CB 3.25Å; L235-M239 WeakPolarHBondContact O-CB 3.36Å; L235-M239 PolarHBondContact O-N 3.42Å
236D92.2Very high90.9Very high79 Ų7999 Ų9942%0.42250%0.497SS..Hα-helixtrans-65.2-43175.7-70.6-26.9000110.9K232 K233 Q234 M239 E240K232-D236 PolarHBondContact O-N 3.22Å; K233-D236 PolarHBondContact O-N 3.05Å; Q234-D236 VanDerWaalsContact C-N 3.31Å; Q234-D236 PolarHBondContact O-N 2.94Å; D236-M239 WeakPolarHBondContact O-CB 3.45Å; D236-M239 PolarHBondContact O-N 2.79Å; D236-E240 WeakPolarHBondContact O-CG 3.46Å; D236-E240 PolarHBondContact O-N 3.42Å
237S90.9Very high90.6Very high46 Ų4696.9 Ų96.932%0.32250%0.496SS..Hα-helixtrans-62.7-43.2174.4-169.70000112.2K233 Q234 M239 E240 Q241K233-S237 WeakPolarHBondContact O-CB 3.18Å; K233-S237 PolarHBondContact O-N 3.47Å; Q234-S237 PolarHBondContact O-N 3.45Å; S237-M239 VanDerWaalsContact C-N 3.3Å; S237-M239 PolarHBondContact O-N 2.86Å; S237-E240 PolarHBondContact O-N 3.49Å; S237-Q241 WeakPolarHBondContact O-CG 3.31Å; S237-Q241 PolarHBondContact O-N 3.18Å
238D90.9Very high90.4Very high61 Ų6198 Ų9833%0.32650%0.499SS..Hα-helixtrans-64.1-38.2176-66.4-17.7000111Q234 L235 Q241 C242Q234-D238 PolarHBondContact NE2-OD1 3.24Å; Q234-D238 WeakPolarHBondContact O-CB 3.48Å; Q234-D238 PolarHBondContact O-N 2.82Å; L235-D238 PolarHBondContact O-N 3.37Å; D238-Q241 PolarHBondContact O-N 3.21Å; D238-C242 WeakPolarHBondContact O-CB 3.47Å; D238-C242 PolarHBondContact O-N 2.72Å; D238-C242 PolarHBondContact O-SG 3.47Å
239M90.3Very high90.1Very high118 Ų11896.5 Ų96.558%0.58150%0.496SS*.Hα-helixtrans-66.5-42.3175-177.7173.958.200111.6L235 D236 S237 C242 S243L235-M239 VanDerWaalsContact O-CB 3.25Å; L235-M239 WeakPolarHBondContact O-CB 3.36Å; L235-M239 PolarHBondContact O-N 3.42Å; D236-M239 WeakPolarHBondContact O-CB 3.45Å; D236-M239 PolarHBondContact O-N 2.79Å; S237-M239 VanDerWaalsContact C-N 3.3Å; S237-M239 PolarHBondContact O-N 2.86Å; M239-C242 PolarHBondContact O-N 2.88Å; M239-S243 WeakPolarHBondContact O-CB 3.35Å; M239-S243 PolarHBondContact O-N 2.68Å
240E90.6Very high89.9Confident129 Ų129100 Ų10060%0.60350%0.503SS*.Hα-helixtrans-60.1-46.6172.5-76.3178.1177.300110.9D236 S237 C242 S243 L244D236-E240 WeakPolarHBondContact O-CG 3.46Å; D236-E240 PolarHBondContact O-N 3.42Å; S237-E240 PolarHBondContact O-N 3.49Å; E240-C242 VanDerWaalsContact C-N 3.33Å; E240-C242 PolarHBondContact O-N 3.27Å; E240-S243 WeakPolarHBondContact O-CB 3.29Å; E240-S243 PolarHBondContact O-N 3.3Å; E240-S243 VanDerWaalsContact O-N 3.16Å; E240-S243 PolarHBondContact O-OG 3.11Å; E240-L244 PolarHBondContact O-N 2.99Å
241Q89.8Confident89.6Confident100 Ų10098 Ų9847%0.46750%0.496SS..Hα-helixtrans-59.8-42.4174.7-72.6-177.619.600112.1S237 D238 L244 K245S237-Q241 WeakPolarHBondContact O-CG 3.31Å; S237-Q241 PolarHBondContact O-N 3.18Å; D238-Q241 PolarHBondContact O-N 3.21Å; Q241-L244 PolarHBondContact O-N 2.88Å; Q241-K245 WeakPolarHBondContact O-CG 3.29Å; Q241-K245 PolarHBondContact O-N 3.2Å
242C89.3Confident89.4Confident69 Ų6998.3 Ų98.347%0.46650%0.495SS..Hα-helixtrans-63-43.2174.9-72.60000111.4D238 M239 E240 L244 K245 I246D238-C242 WeakPolarHBondContact O-CB 3.47Å; D238-C242 PolarHBondContact O-N 2.72Å; D238-C242 PolarHBondContact O-SG 3.47Å; M239-C242 PolarHBondContact O-N 2.88Å; E240-C242 VanDerWaalsContact C-N 3.33Å; E240-C242 PolarHBondContact O-N 3.27Å; C242-L244 VanDerWaalsContact C-N 3.29Å; C242-L244 PolarHBondContact O-N 2.83Å; C242-K245 PolarHBondContact O-N 3.49Å; C242-I246 VanDerWaalsContact O-CG1 3.31Å; C242-I246 WeakPolarHBondContact O-CG1 3.27Å; C242-I246 PolarHBondContact O-N 3.41Å
243S86.4Confident89.3Confident67 Ų6796.3 Ų96.347%0.46949%0.493SS..Hα-helixtrans-61-39.6176.883.30000111.7M239 E240 I246 A247M239-S243 WeakPolarHBondContact O-CB 3.35Å; M239-S243 PolarHBondContact O-N 2.68Å; E240-S243 WeakPolarHBondContact O-CB 3.29Å; E240-S243 PolarHBondContact O-N 3.3Å; E240-S243 VanDerWaalsContact O-N 3.16Å; E240-S243 PolarHBondContact O-OG 3.11Å; S243-I246 PolarHBondContact O-N 3.38Å; S243-A247 WeakPolarHBondContact O-CB 3.49Å; S243-A247 PolarHBondContact O-N 3.06Å
244L90.6Very high89.1Confident102 Ų10297.1 Ų97.153%0.53449%0.492SS..Hα-helixtrans-66.3-44.3176.9-164.4113.9000111.2E240 Q241 C242 I246 A247 Q248E240-L244 PolarHBondContact O-N 2.99Å; Q241-L244 PolarHBondContact O-N 2.88Å; C242-L244 VanDerWaalsContact C-N 3.29Å; C242-L244 PolarHBondContact O-N 2.83Å; L244-I246 VanDerWaalsContact C-N 3.32Å; L244-I246 PolarHBondContact O-N 2.97Å; L244-A247 PolarHBondContact O-N 3.36Å; L244-Q248 WeakPolarHBondContact O-CB 3.43Å; L244-Q248 WeakPolarHBondContact O-CG 3.49Å; L244-Q248 PolarHBondContact O-N 3Å
245K89.7Confident88.8Confident135 Ų13596.8 Ų96.859%0.58749%0.491SS*.Hα-helixtrans-60.4-41.1173.7-73.8175-178170.80111.8Q241 C242 Q248 G249Q241-K245 WeakPolarHBondContact O-CG 3.29Å; Q241-K245 PolarHBondContact O-N 3.2Å; C242-K245 PolarHBondContact O-N 3.49Å; K245-Q248 PolarHBondContact O-N 3.36Å; K245-G249 PolarHBondContact O-N 2.95Å
246I88.1Confident88.5Confident100 Ų10099.3 Ų99.351%0.51350%0.497SS..Hα-helixtrans-63.9-44.5174.9-69.2167.4000110.6C242 S243 L244 G249 R250C242-I246 VanDerWaalsContact O-CG1 3.31Å; C242-I246 WeakPolarHBondContact O-CG1 3.27Å; C242-I246 PolarHBondContact O-N 3.41Å; S243-I246 PolarHBondContact O-N 3.38Å; L244-I246 VanDerWaalsContact C-N 3.32Å; L244-I246 PolarHBondContact O-N 2.97Å; I246-G249 PolarHBondContact O-N 3.45Å; I246-R250 HydrophobicContact CG2-CG 4.47Å; I246-R250 WeakPolarHBondContact O-CG 3.47Å; I246-R250 PolarHBondContact O-N 3.26Å
247A88.2Confident88.1Confident56 Ų56100.3 Ų100.346%0.46350%0.502SS..Hα-helixtrans-61.9-45.7177.600000111.8S243 L244 G249 R250 Q251S243-A247 WeakPolarHBondContact O-CB 3.49Å; S243-A247 PolarHBondContact O-N 3.06Å; L244-A247 PolarHBondContact O-N 3.36Å; A247-G249 VanDerWaalsContact C-N 3.34Å; A247-G249 PolarHBondContact O-N 2.99Å; A247-R250 PolarHBondContact O-N 3.16Å; A247-Q251 WeakPolarHBondContact O-CB 3.28Å; A247-Q251 PolarHBondContact O-N 3.34Å
248Q89.2Confident87.6Confident102 Ų102101.9 Ų101.948%0.47751%0.51SS..Hα-helixtrans-59.5-43173.2-72.6176.7-5.300111.8L244 K245 Q251 K252L244-Q248 WeakPolarHBondContact O-CB 3.43Å; L244-Q248 WeakPolarHBondContact O-CG 3.49Å; L244-Q248 PolarHBondContact O-N 3Å; K245-Q248 PolarHBondContact O-N 3.36Å; Q248-Q251 PolarHBondContact O-N 3.43Å; Q248-K252 WeakPolarHBondContact O-CG 3.41Å; Q248-K252 PolarHBondContact O-N 3.49Å
249G87.3Confident87.4Confident32 Ų32102.1 Ų102.133%0.3352%0.516SS..Hα-helixtrans-62.2-43.5175.300000112.7K245 I246 A247 Q251 K252 T253K245-G249 PolarHBondContact O-N 2.95Å; I246-G249 PolarHBondContact O-N 3.45Å; A247-G249 VanDerWaalsContact C-N 3.34Å; A247-G249 PolarHBondContact O-N 2.99Å; G249-Q251 VanDerWaalsContact C-N 3.35Å; G249-Q251 PolarHBondContact O-N 3.22Å; G249-K252 PolarHBondContact O-N 2.66Å; G249-T253 WeakPolarHBondContact O-CB 3.47Å; G249-T253 PolarHBondContact O-N 2.66Å; G249-T253 PolarHBondContact O-OG1 3.3Å
250R88.2Confident87Confident170 Ų170100 Ų10064%0.64251%0.509SS*.Hα-helixtrans-62.2-41.3174.2-74.4178.8177.5-173.70.4111.5I246 A247 T253 R254I246-R250 HydrophobicContact CG2-CG 4.47Å; I246-R250 WeakPolarHBondContact O-CG 3.47Å; I246-R250 PolarHBondContact O-N 3.26Å; A247-R250 PolarHBondContact O-N 3.16Å; R250-T253 WeakPolarHBondContact O-CB 3.33Å; R250-T253 PolarHBondContact O-N 2.79Å; R250-R254 WeakPolarHBondContact O-CG 3.43Å; R250-R254 PolarHBondContact O-N 2.93Å
251Q87.4Confident86.5Confident88 Ų8896.6 Ų96.641%0.41150%0.503SS..Hα-helixtrans-63.5-49177-178.859.519.900111.8A247 Q248 G249 T253 R254 E255A247-Q251 WeakPolarHBondContact O-CB 3.28Å; A247-Q251 PolarHBondContact O-N 3.34Å; Q248-Q251 PolarHBondContact O-N 3.43Å; G249-Q251 VanDerWaalsContact C-N 3.35Å; G249-Q251 PolarHBondContact O-N 3.22Å; Q251-T253 PolarHBondContact O-N 3.12Å; Q251-R254 WeakPolarHBondContact O-CA 3.25Å; Q251-R254 WeakPolarHBondContact O-CB 3.48Å; Q251-R254 PolarHBondContact O-N 3.39Å; Q251-E255 WeakPolarHBondContact CG-OE1 3.27Å; Q251-E255 PolarHBondContact NE2-OE1 3.35Å; Q251-E255 WeakPolarHBondContact O-CG 3.4Å; Q251-E255 PolarHBondContact O-N 3.21Å
252K87.6Confident86.2Confident135 Ų13597.1 Ų97.159%0.58751%0.506SS*.Hα-helixtrans-57.8-36.9173.4-73.2-180-179.5179.30112.4Q248 G249 E255 K256Q248-K252 WeakPolarHBondContact O-CG 3.41Å; Q248-K252 PolarHBondContact O-N 3.49Å; G249-K252 PolarHBondContact O-N 2.66Å; K252-E255 PolarHBondContact O-N 2.87Å; K252-K256 WeakPolarHBondContact O-CB 3.45Å; K252-K256 WeakPolarHBondContact O-CG 3.46Å; K252-K256 PolarHBondContact O-N 3.4Å
253T85.9Confident85.7Confident79 Ų7999.3 Ų99.349%0.48551%0.511SS..Hα-helixtrans-66.8-41.4175.9-54.90000111.2G249 R250 Q251 K256 N257G249-T253 WeakPolarHBondContact O-CB 3.47Å; G249-T253 PolarHBondContact O-N 2.66Å; G249-T253 PolarHBondContact O-OG1 3.3Å; R250-T253 WeakPolarHBondContact O-CB 3.33Å; R250-T253 PolarHBondContact O-N 2.79Å; Q251-T253 PolarHBondContact O-N 3.12Å; T253-K256 PolarHBondContact O-N 2.92Å; T253-N257 WeakPolarHBondContact O-CB 3.38Å; T253-N257 PolarHBondContact O-N 2.89Å; T253-N257 PolarHBondContact O-ND2 2.81Å
254R86Confident85.2Confident162 Ų162102.6 Ų102.661%0.61152%0.517SS*.Hα-helixtrans-60.8-47.8173.8-72.3171.7179.9172.4-2.8111.3R250 Q251 K256 N257 T258R250-R254 WeakPolarHBondContact O-CG 3.43Å; R250-R254 PolarHBondContact O-N 2.93Å; Q251-R254 WeakPolarHBondContact O-CA 3.25Å; Q251-R254 WeakPolarHBondContact O-CB 3.48Å; Q251-R254 PolarHBondContact O-N 3.39Å; R254-K256 PolarHBondContact O-N 2.87Å; R254-N257 WeakPolarHBondContact O-CB 3.23Å; R254-N257 PolarHBondContact O-N 3.29Å; R254-N257 VanDerWaalsContact O-N 3.12Å; R254-T258 PolarHBondContact O-N 3.42Å; R254-T258 PolarHBondContact O-OG1 3.15Å
255E85.2Confident84.8Confident100 Ų100103.8 Ų103.847%0.46752%0.519SS..Hα-helixtrans-61.1-41.3177.3-71163.8-17000112.6Q251 K252 T258 C259Q251-E255 WeakPolarHBondContact CG-OE1 3.27Å; Q251-E255 PolarHBondContact NE2-OE1 3.35Å; Q251-E255 WeakPolarHBondContact O-CG 3.4Å; Q251-E255 PolarHBondContact O-N 3.21Å; K252-E255 PolarHBondContact O-N 2.87Å; E255-T258 WeakPolarHBondContact CA-OG1 3.34Å; E255-T258 PolarHBondContact O-N 3.48Å; E255-T258 PolarHBondContact O-OG1 2.84Å; E255-C259 WeakPolarHBondContact O-CB 3.44Å; E255-C259 PolarHBondContact O-N 2.69Å
256K84.4Confident84.4Confident155 Ų155103.1 Ų103.167%0.67452%0.516SS*.Hα-helixtrans-65.8-38.9172.9-75.9-164.3177.3-1730111.9K252 T253 R254 C259 V260K252-K256 WeakPolarHBondContact O-CB 3.45Å; K252-K256 WeakPolarHBondContact O-CG 3.46Å; K252-K256 PolarHBondContact O-N 3.4Å; T253-K256 PolarHBondContact O-N 2.92Å; R254-K256 PolarHBondContact O-N 2.87Å; K256-C259 PolarHBondContact O-N 3.34Å; K256-V260 WeakPolarHBondContact O-CB 3.25Å; K256-V260 VanDerWaalsContact O-CG2 3.24Å; K256-V260 WeakPolarHBondContact O-CG2 3.34Å; K256-V260 PolarHBondContact O-N 3.02Å
257N84.4Confident84.1Confident100 Ų100102.7 Ų102.754%0.53551%0.514SS..Hα-helixtrans-66.8-37.6177.2-74.5-17.9000112.3T253 R254 V260 A261T253-N257 WeakPolarHBondContact O-CB 3.38Å; T253-N257 PolarHBondContact O-N 2.89Å; T253-N257 PolarHBondContact O-ND2 2.81Å; R254-N257 WeakPolarHBondContact O-CB 3.23Å; R254-N257 PolarHBondContact O-N 3.29Å; R254-N257 VanDerWaalsContact O-N 3.12Å; N257-V260 PolarHBondContact O-N 2.98Å; N257-A261 WeakPolarHBondContact O-CB 3.24Å; N257-A261 PolarHBondContact O-N 2.9Å
258T81.1Confident83.8Confident79 Ų79103.9 Ų103.949%0.48551%0.513SS..Hα-helixtrans-66.2-44.2173.153.70000110.9R254 E255 V260 A261 E262R254-T258 PolarHBondContact O-N 3.42Å; R254-T258 PolarHBondContact O-OG1 3.15Å; E255-T258 WeakPolarHBondContact CA-OG1 3.34Å; E255-T258 PolarHBondContact O-N 3.48Å; E255-T258 PolarHBondContact O-OG1 2.84Å; T258-V260 VanDerWaalsContact C-N 3.33Å; T258-V260 PolarHBondContact O-N 3.33Å; T258-A261 WeakPolarHBondContact O-CB 3.36Å; T258-A261 PolarHBondContact O-N 2.95Å; T258-A261 VanDerWaalsContact O-N 3.12Å; T258-E262 WeakPolarHBondContact O-CG 3.3Å; T258-E262 PolarHBondContact O-N 2.75Å
259C85.1Confident83.4Confident67 Ų67101.5 Ų101.545%0.45351%0.506SS..Hα-helixtrans-58.5-43.2173.5-174.70000112.1E255 K256 E262 M263E255-C259 WeakPolarHBondContact O-CB 3.44Å; E255-C259 PolarHBondContact O-N 2.69Å; K256-C259 PolarHBondContact O-N 3.34Å; C259-E262 PolarHBondContact O-N 2.93Å; C259-M263 WeakPolarHBondContact O-CB 3.47Å; C259-M263 VanDerWaalsContact O-CG 3.29Å; C259-M263 WeakPolarHBondContact O-CG 3.29Å; C259-M263 PolarHBondContact O-N 2.73Å
260V81.9Confident82.8Confident73 Ų73105.4 Ų105.444%0.44252%0.515SS..Hα-helixtrans-64.8-39.5175168.80000111.5K256 N257 T258 M263 K264K256-V260 WeakPolarHBondContact O-CB 3.25Å; K256-V260 VanDerWaalsContact O-CG2 3.24Å; K256-V260 WeakPolarHBondContact O-CG2 3.34Å; K256-V260 PolarHBondContact O-N 3.02Å; N257-V260 PolarHBondContact O-N 2.98Å; T258-V260 VanDerWaalsContact C-N 3.33Å; T258-V260 PolarHBondContact O-N 3.33Å; V260-M263 PolarHBondContact O-N 3.14Å; V260-K264 HydrophobicContact CG1-CD 4.46Å; V260-K264 WeakPolarHBondContact O-CB 3.48Å; V260-K264 WeakPolarHBondContact O-CG 3.36Å; V260-K264 PolarHBondContact O-N 3.07Å
261A81.1Confident82.4Confident57 Ų57104 Ų10447%0.47151%0.51SS..Hα-helixtrans-64-42.4175.600000111.6N257 T258 K264 H265N257-A261 WeakPolarHBondContact O-CB 3.24Å; N257-A261 PolarHBondContact O-N 2.9Å; T258-A261 WeakPolarHBondContact O-CB 3.36Å; T258-A261 PolarHBondContact O-N 2.95Å; T258-A261 VanDerWaalsContact O-N 3.12Å; A261-K264 PolarHBondContact O-N 3.45Å; A261-H265 WeakPolarHBondContact O-CB 3.36Å; A261-H265 PolarHBondContact O-N 2.95Å
262E82.4Confident82.1Confident111 Ų111103.6 Ų103.652%0.51951%0.511SS..Hα-helixtrans-61.9-43.6173.2-72.2172.2-165.300111.9T258 C259 H265 K266T258-E262 WeakPolarHBondContact O-CG 3.3Å; T258-E262 PolarHBondContact O-N 2.75Å; C259-E262 PolarHBondContact O-N 2.93Å; E262-H265 PolarHBondContact O-N 3.05Å; E262-K266 WeakPolarHBondContact O-CG 3.23Å; E262-K266 PolarHBondContact O-N 3.32Å
263M79.1Confident81.9Confident116 Ų116100.7 Ų100.757%0.57150%0.501SS*.Hα-helixtrans-65.9-37.6176.6-71.5-62-73.300112.1C259 V260 K266 L267C259-M263 WeakPolarHBondContact O-CB 3.47Å; C259-M263 VanDerWaalsContact O-CG 3.29Å; C259-M263 WeakPolarHBondContact O-CG 3.29Å; C259-M263 PolarHBondContact O-N 2.73Å; V260-M263 PolarHBondContact O-N 3.14Å; M263-K266 PolarHBondContact O-N 3.24Å; M263-K266 HydrophobicContact SD-CD 4.38Å; M263-L267 WeakPolarHBondContact O-CB 3.41Å; M263-L267 PolarHBondContact O-N 2.85Å
264K76.8Confident81.6Confident136 Ų136101.6 Ų101.659%0.59150%0.503SS*.Hα-helixtrans-63.4-45.6171.8-79.8-178.5177-178.90111.5V260 A261 K266 L267 D268V260-K264 HydrophobicContact CG1-CD 4.46Å; V260-K264 WeakPolarHBondContact O-CB 3.48Å; V260-K264 WeakPolarHBondContact O-CG 3.36Å; V260-K264 PolarHBondContact O-N 3.07Å; A261-K264 PolarHBondContact O-N 3.45Å; K264-K266 PolarHBondContact O-N 2.93Å; K264-L267 WeakPolarHBondContact O-CB 3.47Å; K264-L267 PolarHBondContact O-N 3.35Å; K264-D268 PolarHBondContact O-N 3.44Å
265H82.6Confident81.3Confident126 Ų126100.8 Ų100.858%0.58350%0.5SS*.Hα-helixtrans-59.6-46.3176.4-177.2-77.4000111.4A261 E262 L267 D268 T269A261-H265 WeakPolarHBondContact O-CB 3.36Å; A261-H265 PolarHBondContact O-N 2.95Å; E262-H265 PolarHBondContact O-N 3.05Å; H265-L267 VanDerWaalsContact C-N 3.34Å; H265-L267 PolarHBondContact O-N 2.81Å; H265-D268 PolarHBondContact O-N 3.45Å; H265-T269 PolarHBondContact O-N 3.02Å; H265-T269 PolarHBondContact O-OG1 2.94Å
266K80.1Confident80.9Confident122 Ų122101.2 Ų101.253%0.5350%0.502SS..Hα-helixtrans-59.1-42.8174.9-74.9175.4-179.1173.40112.1E262 M263 K264 D268 T269 E270E262-K266 WeakPolarHBondContact O-CG 3.23Å; E262-K266 PolarHBondContact O-N 3.32Å; M263-K266 PolarHBondContact O-N 3.24Å; M263-K266 HydrophobicContact SD-CD 4.38Å; K264-K266 PolarHBondContact O-N 2.93Å; K266-D268 VanDerWaalsContact C-N 3.35Å; K266-D268 PolarHBondContact O-N 3.23Å; K266-T269 VanDerWaalsContact CA-OG1 3.29Å; K266-T269 WeakPolarHBondContact CA-OG1 3.31Å; K266-T269 PolarHBondContact O-N 2.84Å; K266-T269 PolarHBondContact O-OG1 3.08Å; K266-E270 WeakPolarHBondContact O-CG 3.4Å; K266-E270 PolarHBondContact O-N 3.36Å
267L82.1Confident80.5Confident90 Ų9098.5 Ų98.547%0.47150%0.495SS..Hα-helixtrans-63.1-41.7176.4-173.276.9000111.8M263 K264 H265 E270 R271M263-L267 WeakPolarHBondContact O-CB 3.41Å; M263-L267 PolarHBondContact O-N 2.85Å; K264-L267 WeakPolarHBondContact O-CB 3.47Å; K264-L267 PolarHBondContact O-N 3.35Å; H265-L267 VanDerWaalsContact C-N 3.34Å; H265-L267 PolarHBondContact O-N 2.81Å; L267-E270 PolarHBondContact O-N 3.21Å; L267-R271 WeakPolarHBondContact O-CB 3.29Å; L267-R271 WeakPolarHBondContact O-CG 3.49Å; L267-R271 PolarHBondContact O-N 3.09Å
268D82.1Confident80Confident82 Ų82100.2 Ų100.244%0.43950%0.499SS..Hα-helixtrans-70.2-35.9179.5-72.6-25.5000112K264 H265 K266 R271 N272K264-D268 PolarHBondContact O-N 3.44Å; H265-D268 PolarHBondContact O-N 3.45Å; K266-D268 VanDerWaalsContact C-N 3.35Å; K266-D268 PolarHBondContact O-N 3.23Å; D268-R271 PolarHBondContact O-N 3.49Å; D268-R271 IonicContact OD1-NH1 3.57Å; D268-N272 PolarHBondContact O-N 2.98Å; D268-N272 PolarHBondContact O-ND2 3.49Å
269T79.9Confident79.9Confident52 Ų52104 Ų10432%0.31951%0.505SS..Hα-helixtrans-63-44.2169.948.50000111.7H265 K266 R271 N272 N273H265-T269 PolarHBondContact O-N 3.02Å; H265-T269 PolarHBondContact O-OG1 2.94Å; K266-T269 VanDerWaalsContact CA-OG1 3.29Å; K266-T269 WeakPolarHBondContact CA-OG1 3.31Å; K266-T269 PolarHBondContact O-N 2.84Å; K266-T269 PolarHBondContact O-OG1 3.08Å; T269-R271 PolarHBondContact O-N 2.72Å; T269-N272 PolarHBondContact O-N 3.36Å; T269-N273 VanDerWaalsContact O-CG 3.32Å; T269-N273 PolarHBondContact O-N 2.83Å
270E76.3Confident79.5Confident113 Ų113105.5 Ų105.553%0.52851%0.508SS..Hα-helixtrans-65.8-36.2176.7-71.4-52.7139.900112.6K266 L267 N272 N273 N274K266-E270 WeakPolarHBondContact O-CG 3.4Å; K266-E270 PolarHBondContact O-N 3.36Å; L267-E270 PolarHBondContact O-N 3.21Å; E270-N272 VanDerWaalsContact C-N 3.34Å; E270-N273 PolarHBondContact O-N 3.14Å; E270-N274 PolarHBondContact O-N 3.37Å
271R80.1Confident79Confident141 Ų141106 Ų10653%0.53251%0.508SS..Hα-helixtrans-63.7-38.7172.6-80.8175.2170.6164.3-3.2112.2L267 D268 T269 N274 R275L267-R271 WeakPolarHBondContact O-CB 3.29Å; L267-R271 WeakPolarHBondContact O-CG 3.49Å; L267-R271 PolarHBondContact O-N 3.09Å; D268-R271 PolarHBondContact O-N 3.49Å; D268-R271 IonicContact OD1-NH1 3.57Å; T269-R271 PolarHBondContact O-N 2.72Å; R271-N274 PolarHBondContact O-N 3.39Å; R271-R275 WeakPolarHBondContact O-CG 3.44Å; R271-R275 PolarHBondContact O-N 3.15Å
272N80.8Confident78.6Confident80 Ų80106 Ų10643%0.42851%0.508SS..Hα-helixtrans-69.7-41.8176.5-74.2-23000111.7D268 T269 E270 N274 R275 E276D268-N272 PolarHBondContact O-N 2.98Å; D268-N272 PolarHBondContact O-ND2 3.49Å; T269-N272 PolarHBondContact O-N 3.36Å; E270-N272 VanDerWaalsContact C-N 3.34Å; N272-N274 VanDerWaalsContact C-N 3.3Å; N272-N274 PolarHBondContact O-N 2.86Å; N272-R275 WeakPolarHBondContact O-CB 3.48Å; N272-R275 PolarHBondContact O-N 3.42Å; N272-R275 VanDerWaalsContact O-N 3.12Å; N272-R275 PolarHBondContact OD1-NH1 3.06Å; N272-E276 PolarHBondContact O-N 2.96Å
273N83.4Confident78.3Confident73 Ų73104.6 Ų104.639%0.3951%0.507SS..Hα-helixtrans-56.8-44.5172.1-70.2-12.6000111.4T269 E270 R275 E276 L277T269-N273 VanDerWaalsContact O-CG 3.32Å; T269-N273 PolarHBondContact O-N 2.83Å; E270-N273 PolarHBondContact O-N 3.14Å; N273-R275 PolarHBondContact O-N 3.24Å; N273-E276 PolarHBondContact O-N 3.03Å; N273-L277 WeakPolarHBondContact O-CG 3.46Å; N273-L277 PolarHBondContact O-N 3.43Å
274N77.9Confident78.2Confident99 Ų99101.7 Ų101.753%0.52950%0.501SS..Hα-helixtrans-63.4-38.7176.2-107.6-39000113E270 R271 N272 E276 L277 Q278E270-N274 PolarHBondContact O-N 3.37Å; R271-N274 PolarHBondContact O-N 3.39Å; N272-N274 VanDerWaalsContact C-N 3.3Å; N272-N274 PolarHBondContact O-N 2.86Å; N274-E276 VanDerWaalsContact C-N 3.34Å; N274-L277 PolarHBondContact O-N 2.9Å; N274-Q278 WeakPolarHBondContact O-CG 3.35Å; N274-Q278 PolarHBondContact O-N 3.34Å
275R81.2Confident78.1Confident144 Ų144104 Ų10454%0.54351%0.506SS..Hα-helixtrans-63.6-38.8173.9-76174.7179.3163.8-3.4111.9R271 N272 N273 Q278 R279R271-R275 WeakPolarHBondContact O-CG 3.44Å; R271-R275 PolarHBondContact O-N 3.15Å; N272-R275 WeakPolarHBondContact O-CB 3.48Å; N272-R275 PolarHBondContact O-N 3.42Å; N272-R275 VanDerWaalsContact O-N 3.12Å; N272-R275 PolarHBondContact OD1-NH1 3.06Å; N273-R275 PolarHBondContact O-N 3.24Å; R275-Q278 PolarHBondContact O-N 3.21Å; R275-R279 WeakPolarHBondContact O-CG 3.38Å; R275-R279 PolarHBondContact O-N 2.95Å; R275-R279 VanDerWaalsContact O-N 3.11Å
276E77.1Confident77.6Confident110 Ų110104.4 Ų104.451%0.51451%0.51SS..Hα-helixtrans-68.3-42.5175.8-74.3-174.8172.400112.5N272 N273 N274 Q278 R279 N280N272-E276 PolarHBondContact O-N 2.96Å; N273-E276 PolarHBondContact O-N 3.03Å; N274-E276 VanDerWaalsContact C-N 3.34Å; E276-Q278 VanDerWaalsContact C-N 3.29Å; E276-Q278 PolarHBondContact O-N 2.84Å; E276-R279 WeakPolarHBondContact O-CB 3.44Å; E276-R279 PolarHBondContact O-N 3.27Å; E276-R279 VanDerWaalsContact O-N 3.09Å; E276-N280 PolarHBondContact O-N 2.89Å
277L75.9Confident77.3Confident98 Ų98104.9 Ų104.951%0.51351%0.514SS..Hα-helixtrans-59-41.1172.7-74.2168.7000111.7N273 N274 R279 N280 I281N273-L277 WeakPolarHBondContact O-CG 3.46Å; N273-L277 PolarHBondContact O-N 3.43Å; N274-L277 PolarHBondContact O-N 2.9Å; L277-R279 PolarHBondContact O-N 2.98Å; L277-N280 PolarHBondContact O-N 2.93Å; L277-I281 VanDerWaalsContact O-CG1 3.31Å; L277-I281 WeakPolarHBondContact O-CG1 3.48Å; L277-I281 PolarHBondContact O-N 3.1Å
278Q73.1Confident77.1Confident136 Ų136106.5 Ų106.564%0.63652%0.517SS*.Hα-helixtrans-62.5-38.4173.9-76.9-175.7-6.200112.9N274 R275 E276 I281 A282N274-Q278 WeakPolarHBondContact O-CG 3.35Å; N274-Q278 PolarHBondContact O-N 3.34Å; R275-Q278 PolarHBondContact O-N 3.21Å; E276-Q278 VanDerWaalsContact C-N 3.29Å; E276-Q278 PolarHBondContact O-N 2.84Å; Q278-I281 PolarHBondContact O-N 2.99Å; Q278-A282 PolarHBondContact O-N 3.05Å; Q278-A282 VanDerWaalsContact O-N 3.13Å
279R78.3Confident76.7Confident157 Ų157105.4 Ų105.459%0.59252%0.52SS*.Hα-helixtrans-64.3-42.5173.3-71.3-178.5-171.8113.9-2.7111.8R275 E276 L277 I281 A282 T283R275-R279 WeakPolarHBondContact O-CG 3.38Å; R275-R279 PolarHBondContact O-N 2.95Å; R275-R279 VanDerWaalsContact O-N 3.11Å; E276-R279 WeakPolarHBondContact O-CB 3.44Å; E276-R279 PolarHBondContact O-N 3.27Å; E276-R279 VanDerWaalsContact O-N 3.09Å; L277-R279 PolarHBondContact O-N 2.98Å; R279-I281 VanDerWaalsContact C-N 3.34Å; R279-I281 PolarHBondContact O-N 2.99Å; R279-A282 WeakPolarHBondContact O-CB 3.37Å; R279-A282 PolarHBondContact O-N 3.26Å; R279-A282 VanDerWaalsContact O-N 3.15Å; R279-T283 PolarHBondContact O-N 3.4Å; R279-T283 PolarHBondContact O-OG1 2.95Å
280N76.9Confident76.4Confident99 Ų99106.9 Ų106.953%0.52953%0.525SS..Hα-helixtrans-66.2-34.9178.5-69-17.2000112.6E276 L277 A282 T283 A284E276-N280 PolarHBondContact O-N 2.89Å; L277-N280 PolarHBondContact O-N 2.93Å; N280-A282 VanDerWaalsContact C-N 3.34Å; N280-T283 WeakPolarHBondContact CA-OG1 3.43Å; N280-T283 PolarHBondContact O-OG1 2.89Å; N280-A284 WeakPolarHBondContact O-CB 3.32Å; N280-A284 PolarHBondContact O-N 3.29Å; N280-A284 VanDerWaalsContact O-N 3.11Å
281I71Confident76.2Confident85 Ų85107 Ų10744%0.43653%0.529SS..Hα-helixtrans-67-37.5172.7-68.5165.9000111L277 Q278 R279 R285L277-I281 VanDerWaalsContact O-CG1 3.31Å; L277-I281 WeakPolarHBondContact O-CG1 3.48Å; L277-I281 PolarHBondContact O-N 3.1Å; Q278-I281 PolarHBondContact O-N 2.99Å; R279-I281 VanDerWaalsContact C-N 3.34Å; R279-I281 PolarHBondContact O-N 2.99Å; I281-R285 WeakPolarHBondContact O-CG 3.33Å; I281-R285 PolarHBondContact O-N 2.93Å; I281-R285 VanDerWaalsContact O-N 3.08Å
282A73.2Confident75.9Confident57 Ų57108.7 Ų108.747%0.47154%0.535SS..Hα-helixtrans-66.3-42.5177.700000112.2Q278 R279 N280 R285 M286Q278-A282 PolarHBondContact O-N 3.05Å; Q278-A282 VanDerWaalsContact O-N 3.13Å; R279-A282 WeakPolarHBondContact O-CB 3.37Å; R279-A282 PolarHBondContact O-N 3.26Å; R279-A282 VanDerWaalsContact O-N 3.15Å; N280-A282 VanDerWaalsContact C-N 3.34Å; A282-R285 PolarHBondContact O-N 3.45Å; A282-M286 PolarHBondContact O-N 3.24Å; A282-M286 VanDerWaalsContact O-N 3.17Å
283T76.9Confident75.5Confident80 Ų80112 Ų11249%0.49155%0.548SS..Hα-helixtrans-66.3-41.1176.652.10000112.2R279 N280 R285 M286 Q287R279-T283 PolarHBondContact O-N 3.4Å; R279-T283 PolarHBondContact O-OG1 2.95Å; N280-T283 WeakPolarHBondContact CA-OG1 3.43Å; N280-T283 PolarHBondContact O-OG1 2.89Å; T283-R285 VanDerWaalsContact C-N 3.33Å; T283-R285 PolarHBondContact O-N 3.38Å; T283-M286 WeakPolarHBondContact O-CB 3.49Å; T283-M286 PolarHBondContact O-N 2.93Å; T283-Q287 PolarHBondContact O-N 3.25Å; T283-Q287 VanDerWaalsContact O-N 3.1Å
284A75.7Confident74.9Confident55 Ų55113.5 Ų113.546%0.45555%0.552SS.*Hα-helixtrans-62.8-36.6174.700000112.9N280 Q287 K288N280-A284 WeakPolarHBondContact O-CB 3.32Å; N280-A284 PolarHBondContact O-N 3.29Å; N280-A284 VanDerWaalsContact O-N 3.11Å; A284-Q287 PolarHBondContact O-N 2.97Å; A284-K288 PolarHBondContact O-N 3.25Å
285R75.1Confident74.5Confident184 Ų184114.1 Ų114.169%0.69456%0.555SS**Hα-helixtrans-65.3-37174.2-77.8176.5179.6145.81112.5I281 A282 T283 K288 A289I281-R285 WeakPolarHBondContact O-CG 3.33Å; I281-R285 PolarHBondContact O-N 2.93Å; I281-R285 VanDerWaalsContact O-N 3.08Å; A282-R285 PolarHBondContact O-N 3.45Å; T283-R285 VanDerWaalsContact C-N 3.33Å; T283-R285 PolarHBondContact O-N 3.38Å; R285-K288 PolarHBondContact O-N 3.07Å; R285-A289 PolarHBondContact O-N 3.48Å
286M72.8Confident74Confident136 Ų136114 Ų11467%0.6756%0.559SS**Hα-helixtrans-67-43.2176.8-170.8174.1169.400111.8A282 T283 K288 A289 I290A282-M286 PolarHBondContact O-N 3.24Å; A282-M286 VanDerWaalsContact O-N 3.17Å; T283-M286 WeakPolarHBondContact O-CB 3.49Å; T283-M286 PolarHBondContact O-N 2.93Å; M286-K288 VanDerWaalsContact C-N 3.32Å; M286-K288 PolarHBondContact O-N 3.42Å; M286-A289 WeakPolarHBondContact O-CB 3.23Å; M286-A289 PolarHBondContact O-N 3Å; M286-A289 VanDerWaalsContact O-N 3.13Å; M286-I290 PolarHBondContact O-N 3.26Å
287Q73.6Confident73.7Confident132 Ų132116 Ų11662%0.61757%0.566SS**Hα-helixtrans-61.8-37.6175.8-73.3-178.5-18.200112.9T283 A284 A289 I290 L291T283-Q287 PolarHBondContact O-N 3.25Å; T283-Q287 VanDerWaalsContact O-N 3.1Å; A284-Q287 PolarHBondContact O-N 2.97Å; Q287-A289 VanDerWaalsContact C-N 3.27Å; Q287-A289 PolarHBondContact O-N 3.36Å; Q287-I290 PolarHBondContact O-N 3.46Å; Q287-L291 PolarHBondContact O-N 2.92Å
288K77Confident73Confident123 Ų123117.6 Ų117.654%0.53557%0.57SS.*Hα-helixtrans-62.9-31175-174.5176.6-179.8174.40113.2A284 R285 M286 R292A284-K288 PolarHBondContact O-N 3.25Å; R285-K288 PolarHBondContact O-N 3.07Å; M286-K288 VanDerWaalsContact C-N 3.32Å; M286-K288 PolarHBondContact O-N 3.42Å; K288-R292 PolarHBondContact O-N 3.07Å
289A73.9Confident72.6Confident60 Ų60117.2 Ų117.250%0.49657%0.568SS.*Hα-helixtrans-72.8-38.3178.600000112.1R285 M286 Q287 R292 Q293R285-A289 PolarHBondContact O-N 3.48Å; M286-A289 WeakPolarHBondContact O-CB 3.23Å; M286-A289 PolarHBondContact O-N 3Å; M286-A289 VanDerWaalsContact O-N 3.13Å; Q287-A289 VanDerWaalsContact C-N 3.27Å; Q287-A289 PolarHBondContact O-N 3.36Å; A289-R292 PolarHBondContact O-N 3.22Å; A289-Q293 PolarHBondContact O-N 2.96Å
290I74.2Confident72Confident83 Ų83115.5 Ų115.543%0.42657%0.567SS.*Hα-helixtrans-64.8-48178.5-63.4169.5000110.7M286 Q287 R292 Q293 E294M286-I290 PolarHBondContact O-N 3.26Å; Q287-I290 PolarHBondContact O-N 3.46Å; I290-R292 PolarHBondContact O-N 3.42Å; I290-Q293 WeakPolarHBondContact O-CB 3.39Å; I290-Q293 PolarHBondContact O-N 3.32Å; I290-E294 PolarHBondContact O-N 2.95Å
291L72.4Confident71.3Confident116 Ų116115 Ų11561%0.60757%0.565SS**Hα-helixtrans-62.6-27.4178.6-70.6167.5000113.2Q287 L295Q287-L291 PolarHBondContact O-N 2.92Å; L291-L295 PolarHBondContact O-N 3.33Å
292R73.8Confident70.7Confident175 Ų175117.1 Ų117.166%0.6658%0.576SS**Hα-helixtrans-73.2-28.6173.8-82.6179.6170.5171.7-6.1113.3K288 A289 I290K288-R292 PolarHBondContact O-N 3.07Å; A289-R292 PolarHBondContact O-N 3.22Å; I290-R292 PolarHBondContact O-N 3.42Å
293Q72.6Confident70Confident151 Ų151117.9 Ų117.971%0.70658%0.582SS**Hα-helixtrans-79-33.8179.5-164.9170.911.600111.7A289 I290 K296 K297A289-Q293 PolarHBondContact O-N 2.96Å; I290-Q293 WeakPolarHBondContact O-CB 3.39Å; I290-Q293 PolarHBondContact O-N 3.32Å; Q293-K296 PolarHBondContact O-N 3.44Å; Q293-K297 PolarHBondContact O-N 2.88Å
294E70.8Confident69.1Low103 Ų103122.1 Ų122.148%0.48159%0.589SS.*Hα-helixtrans-68.4-38.4175.6-68.7179.7162.700112.5I290 K296 K297 H298I290-E294 PolarHBondContact O-N 2.95Å; E294-K296 VanDerWaalsContact C-N 3.29Å; E294-K296 PolarHBondContact O-N 3.21Å; E294-K297 PolarHBondContact O-N 3.48Å; E294-H298 PolarHBondContact O-CD2 3.01Å; E294-H298 VanDerWaalsContact O-CD2 3.24Å; E294-H298 PolarHBondContact O-N 2.93Å
295L68.4Low68.2Low113 Ų113126.7 Ų126.759%0.59260%0.603SS**Hα-helixtrans-60.4-37.5176.8-160.692.8000112.5L291 H298 Q299L291-L295 PolarHBondContact O-N 3.33Å; L295-H298 PolarHBondContact O-N 3.32Å; L295-Q299 WeakPolarHBondContact O-CG 3.37Å; L295-Q299 PolarHBondContact O-N 3.37Å
296K71.1Confident67.3Low141 Ų141124.4 Ų124.461%0.61360%0.6SS**Hα-helixtrans-68.9-34.3179.1-162.8177-178.7-175.80112.1Q293 E294 Q299Q293-K296 PolarHBondContact O-N 3.44Å; E294-K296 VanDerWaalsContact C-N 3.29Å; E294-K296 PolarHBondContact O-N 3.21Å; K296-Q299 PolarHBondContact O-N 2.97Å
297K70.5Confident66.7Low152 Ų152123.5 Ų123.566%0.66160%0.602SS**Hα-helixtrans-70.7-33.5178.3-131.6177.9-176.3-178.40112.7Q293 E294Q293-K297 PolarHBondContact O-N 2.88Å; E294-K297 PolarHBondContact O-N 3.48Å
298H62.7Low65.8Low132 Ų132124.9 Ų124.961%0.61161%0.609SS**Hα-helixtrans-74.1-26.1176.8-75.4-62000113.5E294 L295E294-H298 PolarHBondContact O-CD2 3.01Å; E294-H298 VanDerWaalsContact O-CD2 3.24Å; E294-H298 PolarHBondContact O-N 2.93Å; L295-H298 PolarHBondContact O-N 3.32Å
299Q64.7Low64.5Low127 Ų127125.6 Ų125.659%0.59362%0.618SS**Hα-helixtrans-74-32.6178.5-73.2174.2-22.800113.3L295 K296L295-Q299 WeakPolarHBondContact O-CG 3.37Å; L295-Q299 PolarHBondContact O-N 3.37Å; K296-Q299 PolarHBondContact O-N 2.97Å
300E64.6Low63.2Low122 Ų122129 Ų12957%0.5763%0.627SS**Hα-helixtrans-76.4-22.4179-71.4170.9176.600113.4
301N61.7Low61.7Low88 Ų88128.8 Ų128.847%0.47163%0.633SS.*Hα-helixtrans-83.3-25.2179.1-76.4-19.3000113.6R304N301-R304 PolarHBondContact OD1-NH2 3.42Å
302L59.4Low59.8Low129 Ų129133.3 Ų133.368%0.67564%0.644SS**Hα-helixtrans-74.1-26.3177.2-92.1158.9000113.6
303A58.2Low58.5Low73 Ų73133.7 Ų133.760%0.60365%0.65SS**THydrogen-bonded Turntrans-76.5-21.1-179.400000114.3
304R57.7Low56.6Low169 Ų169132.3 Ų132.364%0.63865%0.652SS**THydrogen-bonded Turntrans-85.9-30.9-178.4-83-176.6-69.8-154.9-1.3114.3N301N301-R304 PolarHBondContact OD1-NH2 3.42Å
305M56.5Low54.9Low152 Ų152133.6 Ų133.675%0.74967%0.667SS**THydrogen-bonded Turntrans-88.9-4.2-176.8-65.1-153.717100114.1
306Q57.3Low53.5Low135 Ų135135.5 Ų135.563%0.63168%0.677SS**THydrogen-bonded Turntrans-79.9-14.4177.2-161.472.52800113.4
307V59.9Low51.7Low117 Ų117134.8 Ų134.871%0.70968%0.68SS**SBendtrans-94.5-18.8-177.2176.30000113.2
308E55Low49.6Very low162 Ų162135.6 Ų135.676%0.75769%0.686SS**SBendtrans-92.6-6.1-179.9-68.4-17816900113.7
309L49.3Very low48.1Very low138 Ų138135.8 Ų135.872%0.72369%0.692SS**SBendtrans-85.2-11.3-177.4-148.894.5000114.3
310D46.7Very low46.6Very low130 Ų130140.9 Ų140.970%0.69571%0.706SS**SBendtrans-103-1.2-172-83.2-26.1000115.4
311S43.1Very low45.3Very low79 Ų79138 Ų13855%0.55271%0.709SS**SBendtrans-103-4.6-175.577.90000117.7
312Y32.7Very low44.1Very low211 Ų211141.1 Ų141.183%0.82773%0.725SS**  trans-139.650.6176.4-72.5-70000114.8T314Y312-T314 VanDerWaalsContact C-N 3.29Å; Y312-T314 PolarHBondContact O-N 2.99Å
313K45.7Very low42.6Very low184 Ų184142 Ų14280%0.873%0.728SS**  trans-84.418.8170.2-141.8174.2-171.7171.60114.3
314T32.6Very low42.1Very low121 Ų121147.3 Ų147.374%0.74274%0.737SS**  trans-144.473.9179.535.60000113.9Y312Y312-T314 VanDerWaalsContact C-N 3.29Å; Y312-T314 PolarHBondContact O-N 2.99Å
315T35.7Very low41.1Very low130 Ų130144.4 Ų144.480%0.79874%0.743SS**  trans-16670.6142.246.20000106.5
316L39.1Very low40.2Very low153 Ų153143 Ų14380%0.80174%0.742SS**  3570.980.7-156.2100.7000114
317N32.1Very low39.6Very low126 Ų126142.2 Ų142.267%0.67475%0.747SS**  159.1151.9113-84.7-37.1000113.3
318Q27.8Very low39.1Very low170 Ų170141.8 Ų141.879%0.79475%0.749SS**  trans82.584.9163.2-75.5146.6-2200118.9
319N29.5Very low37.9Very low136 Ų136143 Ų14373%0.72776%0.755SS**  143.6122.7111.6-76.3-27.9000110
320R34.1Very low37.1Very low234 Ų234144.8 Ų144.888%0.88376%0.763SS**  81.7112.353.1-179.5-174.9160.9-178.8-4.5111.8
321G36.7Very low36.6Very low61 Ų61143.1 Ų143.163%0.62977%0.768SS**  trans74.1137.5161.200000114
322D37.2Very low36.3Very low154 Ų154151 Ų15182%0.82479%0.785SS**  cis-175.4159.220.7-109-30.8000110.7
323M27.8Very low36.4Very low147 Ų147149.8 Ų149.872%0.72479%0.79SS**  trans78.2101.2147.9-69.6-73.7-72.800119.3
324K46.8Very low35.9Very low184 Ų184150.5 Ų150.580%0.879%0.792SS**  47.4109.973.7-67-176.2176.3176.10114.7
325S37.3Very low36Very low108 Ų108153.4 Ų153.476%0.75580%0.8SS**  165.3150.2112.467.80000113.3
326V38.8Very low36.1Very low123 Ų123153.5 Ų153.575%0.74580%0.796SS**  trans80.2107.2162.8-165.10000116.3
327T43.2Very low36.4Very low119 Ų119153.8 Ų153.873%0.7380%0.795SS**  cis97.7117.827-47.10000114.7
328S49.8Very low36.8Very low108 Ų108154.3 Ų154.376%0.75580%0.798SS**  trans88.9144.9140.143.70000124.2
329Q29.2Very low37.3Very low187 Ų187153.1 Ų153.187%0.87480%0.795SS**  trans100.981165.5-70.7-170.4-1.600118.8
330I33.8Very low38.5Very low175 Ų175153.9 Ų153.990%0.89780%0.799SS**  trans-152.1105.5141.4-61.9-171.1000108.7
331A36.3Very low38.7Very low95 Ų95149.6 Ų149.679%0.78579%0.794SS**  trans-163.145.2170.700000115
332R36.1Very low38.9Very low244 Ų244154.5 Ų154.592%0.92180%0.8SS**  trans-150.415.2-177.9-120-168.3-66.1-172.72.9125.5
333M35Very low38.9Very low187 Ų187156.8 Ų156.892%0.92180%0.803SS**  trans-145.1107169.7-69.5-179.383.100113.1
334K35.1Very low39.3Very low198 Ų198158.2 Ų158.286%0.86181%0.812SS**  trans-177.297.1155.2-107.5178.4-178.4-171.10112.9
335M34.6Very low39.1Very low183 Ų183156.5 Ų156.590%0.90181%0.811SS**  trans17886.8157-110.6179159.200106.4
336D38.6Very low39.2Very low132 Ų132160.2 Ų160.271%0.70682%0.817SS**  68.2106.478.1-64.7-22.7000113
337M45.3Very low39.4Very low159 Ų159159.4 Ų159.478%0.78382%0.817SS**  79.4108.7103.5-80.3-176.954.700115
338D39Very low39.4Very low137 Ų137161.6 Ų161.673%0.73382%0.818SS**  165.8131.7129.6-92.4-14.5000117.2
339I39.8Very low39.4Very low144 Ų144160.9 Ų160.974%0.73882%0.819SS**  trans71.3118137.1-54.9162.5000118.8
340N53.8Low40.2Very low152 Ų152161.6 Ų161.681%0.81382%0.816SS**  cis86.611130.8-130.919.1000116.9
341N38.6Very low41Very low145 Ų145159.2 Ų159.278%0.77581%0.805SS**  trans95.8141.1145.6-132.117000123.4
342E40.2Very low42.4Very low163 Ų163158.2 Ų158.276%0.76280%0.796SS**  trans95.6105.4157.7-74.2176.5164.300122.9
343K37.4Very low43.1Very low203 Ų203150.4 Ų150.488%0.88378%0.784SS**  -173.999.3125.3-98.5173.7-173.9-167.20112.9
344L36.8Very low44Very low176 Ų176148.2 Ų148.292%0.92178%0.775SS**  trans-125.88.7173.1-166.872.3000112.6
345L42.3Very low44.6Very low149 Ų149146.2 Ų146.278%0.7877%0.769SS**  trans-103.114.7-160-97.2163.8000117.7
346E40Very low45.7Very low186 Ų186142.6 Ų142.687%0.86975%0.75SS**SBendtrans-103.61.1-174.6-84.1177.2171.500116.3
347S42.3Very low46.4Very low106 Ų106144.5 Ų144.574%0.74175%0.752SS**SBendtrans-91.3-6-173.2-169.20000116.4
348E44.1Very low46.6Very low164 Ų164143.5 Ų143.577%0.76675%0.749SS**SBendtrans-91-12-167.9-70.6-177.8156.600115.5
349A48.5Very low47.3Very low94 Ų94143 Ų14378%0.77774%0.737SS**SBendtrans-87.8-14.6-169.300000116.6
350Y46.8Very low48Very low202 Ų202140.7 Ų140.779%0.79273%0.729SS**SBendtrans-90.3-18.1-173.6-170.9-105000114.5
351N51.3Low47.7Very low125 Ų125138.4 Ų138.467%0.66872%0.721SS**SBendtrans-84.8-18.7-175.7-81.2-28.3000115.1A353N351-A353 PolarHBondContact O-N 3.47Å
352A64.4Low48.1Very low74 Ų74136.6 Ų136.661%0.61272%0.715SS**Hα-helixtrans-74.6-22.9-176.400000113.8
353A51.8Low48.5Very low79 Ų79135.7 Ų135.765%0.65371%0.711SS**Hα-helixtrans-82.1-12.4-174.800000114.7N351N351-A353 PolarHBondContact O-N 3.47Å
354L52.4Low49.2Very low142 Ų142130.7 Ų130.774%0.74370%0.702SS**Hα-helixtrans-93.7-21.1-179.3-125.587.1000113.9
355Q49.5Very low49.5Very low156 Ų156126.3 Ų126.373%0.72969%0.69SS**Hα-helixtrans-75.5-27.1-179.6-84.3179.2-24.600113.6K357 L358Q355-K357 VanDerWaalsContact C-N 3.33Å; Q355-K357 PolarHBondContact O-N 3.4Å; Q355-L358 PolarHBondContact O-N 3.18Å
356E56.3Low50Low106 Ų106126.5 Ų126.550%0.49569%0.692SS.*Hα-helixtrans-73.5-22.8-178.7-167.159.9-164.800113.1L358 R359E356-L358 VanDerWaalsContact C-N 3.31Å; E356-L358 PolarHBondContact O-N 2.93Å; E356-R359 IonicContact OE1-CZ 3.36Å; E356-R359 IonicContact OE1-NE 3.67Å; E356-R359 PolarHBondContact OE1-NE 2.96Å; E356-R359 VanDerWaalsContact OE1-NE 3.11Å; E356-R359 IonicContact OE1-NH2 2.74Å; E356-R359 PolarHBondContact OE1-NH2 3.31Å; E356-R359 IonicContact OE2-NE 3.87Å
357K53Low51Low172 Ų172120.6 Ų120.675%0.74867%0.671SS**Hα-helixtrans-76.7-12174.9-83.9-176.6176.2178.30114.3Q355Q355-K357 VanDerWaalsContact C-N 3.33Å; Q355-K357 PolarHBondContact O-N 3.4Å
358L49.3Very low51.6Low139 Ų139122.9 Ų122.973%0.72867%0.67SS**Hα-helixtrans-86.5-22.6177.7-156.677.3000112.3Q355 E356 T362Q355-L358 PolarHBondContact O-N 3.18Å; E356-L358 VanDerWaalsContact C-N 3.31Å; E356-L358 PolarHBondContact O-N 2.93Å; L358-T362 PolarHBondContact O-OG1 3.45Å; L358-T362 VanDerWaalsContact O-OG1 3.07Å
359R55.1Low52.2Low126 Ų126123.1 Ų123.148%0.47567%0.671SS.*Hα-helixtrans-76.1-34.4-178.3-167172.770.692.9-2.7113.2E356 V361 T362 E363E356-R359 IonicContact OE1-CZ 3.36Å; E356-R359 IonicContact OE1-NE 3.67Å; E356-R359 PolarHBondContact OE1-NE 2.96Å; E356-R359 VanDerWaalsContact OE1-NE 3.11Å; E356-R359 IonicContact OE1-NH2 2.74Å; E356-R359 PolarHBondContact OE1-NH2 3.31Å; E356-R359 IonicContact OE2-NE 3.87Å; R359-V361 VanDerWaalsContact C-N 3.29Å; R359-V361 PolarHBondContact O-N 2.9Å; R359-T362 PolarHBondContact O-N 3.15Å; R359-T362 PolarHBondContact O-OG1 3.36Å; R359-E363 IonicContact NH1-OE1 2.68Å
360T53.5Low52.8Low95 Ų95125.9 Ų125.958%0.58367%0.668SS**Hα-helixtrans-74.9-15.1-177.954.20000114.2
361V47.9Very low53.5Low105 Ų105123.6 Ų123.664%0.63666%0.657SS**Hα-helixtrans-90.2-22.2178.51780000111.7R359R359-V361 VanDerWaalsContact C-N 3.29Å; R359-V361 PolarHBondContact O-N 2.9Å
362T48Very low54.3Low107 Ų107120.3 Ų120.366%0.65665%0.648SS**Hα-helixtrans-85.9-14.3-178.310.90000114.4L358 R359L358-T362 PolarHBondContact O-OG1 3.45Å; L358-T362 VanDerWaalsContact O-OG1 3.07Å; R359-T362 PolarHBondContact O-N 3.15Å; R359-T362 PolarHBondContact O-OG1 3.36Å
363E48.3Very low54.7Low144 Ų144119.4 Ų119.467%0.67364%0.641SS**THydrogen-bonded Turntrans-90.50.7178.8-71.6173.8179.500114R359R359-E363 IonicContact NH1-OE1 2.68Å
364S51.1Low55.7Low98 Ų98121.4 Ų121.469%0.68564%0.636SS**THydrogen-bonded Turntrans-106.511.4179.967.80000115.6
365A44.5Very low56.7Low83 Ų83120.2 Ų120.269%0.68663%0.628SS**SBendtrans-103.916-177.300000115
366L51.2Low58.2Low154 Ų154118.9 Ų118.981%0.80662%0.622SS**  trans-121.884.5175.7-71.4164.3000109.6
367S61Low59.4Low62 Ų62119.1 Ų119.143%0.43462%0.623SS.*SBendtrans-166.4-5.4167.1121.20000117.2R371S367-R371 PolarHBondContact O-NH2 2.98Å; S367-R371 VanDerWaalsContact O-NH2 3.08Å; S367-R371 PolarHBondContact OG-NH2 2.89Å
368E55Low60.9Low153 Ų153114.6 Ų114.672%0.71561%0.606SS**SBendtrans-94.4-32.5177.5-72.4-89.3130.300112.6A372E368-A372 PolarHBondContact O-N 3.42Å; E368-A372 VanDerWaalsContact O-N 3.16Å
369E58.4Low62.4Low169 Ų169112.8 Ų112.879%0.7960%0.597SS**Hα-helixtrans-79.6-37.7-171.6-148.7154.2-164.900113R371 A372 A373E369-R371 VanDerWaalsContact C-N 3.32Å; E369-R371 PolarHBondContact O-N 3.42Å; E369-A372 PolarHBondContact O-N 3.23Å; E369-A373 WeakPolarHBondContact O-CB 3.43Å; E369-A373 PolarHBondContact O-N 3.03Å
370E59.9Low64.1Low152 Ų152111.2 Ų111.271%0.7160%0.597SS**Hα-helixtrans-70.4-28.2174.3-67.4179.9163.700112.5H374E370-H374 WeakPolarHBondContact O-CB 3.35Å; E370-H374 PolarHBondContact O-N 3.43Å
371R62.7Low65.7Low154 Ų154111.2 Ų111.258%0.58159%0.591SS**Hα-helixtrans-78-34.6177.7-149.5-177.7-57.9148.77.7111.7S367 E369 M375S367-R371 PolarHBondContact O-NH2 2.98Å; S367-R371 VanDerWaalsContact O-NH2 3.08Å; S367-R371 PolarHBondContact OG-NH2 2.89Å; E369-R371 VanDerWaalsContact C-N 3.32Å; E369-R371 PolarHBondContact O-N 3.42Å; R371-M375 WeakPolarHBondContact O-CB 3.45Å; R371-M375 PolarHBondContact O-N 3.28Å
372A67.1Low67.3Low57 Ų57108.8 Ų108.847%0.47158%0.581SS.*Hα-helixtrans-68.8-45.2172.500000111.8E368 E369 H374 M375 E376E368-A372 PolarHBondContact O-N 3.42Å; E368-A372 VanDerWaalsContact O-N 3.16Å; E369-A372 PolarHBondContact O-N 3.23Å; A372-H374 PolarHBondContact O-N 2.9Å; A372-M375 PolarHBondContact O-N 3.01Å; A372-E376 WeakPolarHBondContact O-CB 3.35Å; A372-E376 PolarHBondContact O-N 3.06Å
373A72.8Confident68.9Low55 Ų55108.4 Ų108.446%0.45557%0.572SS.*Hα-helixtrans-63.3-39.117800000113.1E369 E376 Q377E369-A373 WeakPolarHBondContact O-CB 3.43Å; E369-A373 PolarHBondContact O-N 3.03Å; A373-E376 PolarHBondContact O-N 2.74Å; A373-Q377 WeakPolarHBondContact O-CB 3.45Å; A373-Q377 PolarHBondContact O-N 2.9Å
374H72.6Confident70.9Confident121 Ų121107.4 Ų107.456%0.5657%0.567SS**Hα-helixtrans-68.4-38.3175.6-175.7-82.6000112.6E370 A372 I378E370-H374 WeakPolarHBondContact O-CB 3.35Å; E370-H374 PolarHBondContact O-N 3.43Å; A372-H374 PolarHBondContact O-N 2.9Å; H374-I378 WeakPolarHBondContact CE1-CD1 3.4Å; H374-I378 WeakPolarHBondContact ND1-CD1 3.44Å; H374-I378 WeakPolarHBondContact O-CG1 3.37Å; H374-I378 PolarHBondContact O-N 3.11Å; H374-I378 VanDerWaalsContact O-N 3.08Å
375M74.6Confident72.5Confident117 Ų117107.7 Ų107.758%0.57656%0.562SS**Hα-helixtrans-69.2-38.5175.1-17069.289.400111.5R371 A372 I378 L379R371-M375 WeakPolarHBondContact O-CB 3.45Å; R371-M375 PolarHBondContact O-N 3.28Å; A372-M375 PolarHBondContact O-N 3.01Å; M375-I378 PolarHBondContact O-N 2.72Å; M375-L379 HydrophobicContact CG-CD1 4.41Å; M375-L379 WeakPolarHBondContact O-CB 3.41Å; M375-L379 WeakPolarHBondContact O-CG 3.29Å; M375-L379 PolarHBondContact O-N 3.12Å
376E79.2Confident74.4Confident127 Ų127108.6 Ų108.659%0.59355%0.553SS**Hα-helixtrans-66.3-36.9176.2-166.2166.5-160.600111.8A372 A373 L379 L380A372-E376 WeakPolarHBondContact O-CB 3.35Å; A372-E376 PolarHBondContact O-N 3.06Å; A373-E376 PolarHBondContact O-N 2.74Å; E376-L379 PolarHBondContact O-N 3.28Å; E376-L380 HydrophobicContact CG-CD1 4.46Å; E376-L380 WeakPolarHBondContact O-CB 3.44Å; E376-L380 PolarHBondContact O-N 3.46Å
377Q83.3Confident76.2Confident111 Ų111107.1 Ų107.152%0.51954%0.54SS..Hα-helixtrans-64.8-44.5172.1-173.9176.3-12.600112.3A373 L379 L380 E381A373-Q377 WeakPolarHBondContact O-CB 3.45Å; A373-Q377 PolarHBondContact O-N 2.9Å; Q377-L379 VanDerWaalsContact C-N 3.32Å; Q377-L379 PolarHBondContact O-N 2.96Å; Q377-L380 PolarHBondContact O-N 3.42Å; Q377-E381 WeakPolarHBondContact CG-OE1 3.46Å; Q377-E381 PolarHBondContact NE2-OE1 2.87Å; Q377-E381 WeakPolarHBondContact O-CB 3.38Å; Q377-E381 WeakPolarHBondContact O-CG 3.38Å; Q377-E381 PolarHBondContact O-N 3.43Å
378I82.6Confident77.6Confident78 Ų78109.6 Ų109.640%0.455%0.546SS..Hα-helixtrans-63-39.1175.5-71.3173.2000111.3H374 M375 E381 A382H374-I378 WeakPolarHBondContact CE1-CD1 3.4Å; H374-I378 WeakPolarHBondContact ND1-CD1 3.44Å; H374-I378 WeakPolarHBondContact O-CG1 3.37Å; H374-I378 PolarHBondContact O-N 3.11Å; H374-I378 VanDerWaalsContact O-N 3.08Å; M375-I378 PolarHBondContact O-N 2.72Å; I378-E381 PolarHBondContact O-N 3.08Å; I378-A382 VanDerWaalsContact O-CB 3.29Å; I378-A382 WeakPolarHBondContact O-CB 3.3Å; I378-A382 PolarHBondContact O-N 3.44Å
379L82.5Confident79.3Confident101 Ų101107.6 Ų107.653%0.52954%0.54SS..Hα-helixtrans-66.3-40.9176-74.1172.3000111.6M375 E376 Q377 A382 E383M375-L379 HydrophobicContact CG-CD1 4.41Å; M375-L379 WeakPolarHBondContact O-CB 3.41Å; M375-L379 WeakPolarHBondContact O-CG 3.29Å; M375-L379 PolarHBondContact O-N 3.12Å; E376-L379 PolarHBondContact O-N 3.28Å; Q377-L379 VanDerWaalsContact C-N 3.32Å; Q377-L379 PolarHBondContact O-N 2.96Å; L379-A382 PolarHBondContact O-N 3.39Å; L379-E383 WeakPolarHBondContact O-CB 3.37Å; L379-E383 WeakPolarHBondContact O-CG 3.45Å; L379-E383 PolarHBondContact O-N 2.97Å
380L89.5Confident80.6Confident93 Ų93104.5 Ų104.549%0.48753%0.525SS..Hα-helixtrans-63.5-42174.6-90.4157.6000112.6E376 Q377 E383 Q384E376-L380 HydrophobicContact CG-CD1 4.46Å; E376-L380 WeakPolarHBondContact O-CB 3.44Å; E376-L380 PolarHBondContact O-N 3.46Å; Q377-L380 PolarHBondContact O-N 3.42Å; L380-E383 PolarHBondContact O-N 3.05Å; L380-Q384 WeakPolarHBondContact O-CB 3.42Å; L380-Q384 WeakPolarHBondContact O-CG 3.37Å; L380-Q384 PolarHBondContact O-N 2.87Å
381E87.1Confident82.1Confident95 Ų9599.6 Ų99.644%0.44451%0.51SS..Hα-helixtrans-64.8-45.4175.3-73.1172.4-16800110.8Q377 I378 E383 Q384 D385Q377-E381 WeakPolarHBondContact CG-OE1 3.46Å; Q377-E381 PolarHBondContact NE2-OE1 2.87Å; Q377-E381 WeakPolarHBondContact O-CB 3.38Å; Q377-E381 WeakPolarHBondContact O-CG 3.38Å; Q377-E381 PolarHBondContact O-N 3.43Å; I378-E381 PolarHBondContact O-N 3.08Å; E381-E383 PolarHBondContact O-N 3.35Å; E381-Q384 PolarHBondContact O-N 2.67Å; E381-D385 PolarHBondContact O-N 3.49Å
382A81.4Confident83.4Confident53 Ų5397.1 Ų97.144%0.43851%0.505SS..Hα-helixtrans-64.7-37.2175.800000113I378 L379 D385 M386I378-A382 VanDerWaalsContact O-CB 3.29Å; I378-A382 WeakPolarHBondContact O-CB 3.3Å; I378-A382 PolarHBondContact O-N 3.44Å; L379-A382 PolarHBondContact O-N 3.39Å; A382-D385 PolarHBondContact O-N 2.86Å; A382-M386 WeakPolarHBondContact O-CB 3.44Å; A382-M386 PolarHBondContact O-N 2.89Å
383E82.6Confident84.3Confident99 Ų99100.1 Ų100.146%0.46351%0.51SS..Hα-helixtrans-67.5-35.8173.6-80.4-175.4-174.300112.4L379 L380 E381 K387L379-E383 WeakPolarHBondContact O-CB 3.37Å; L379-E383 WeakPolarHBondContact O-CG 3.45Å; L379-E383 PolarHBondContact O-N 2.97Å; L380-E383 PolarHBondContact O-N 3.05Å; E381-E383 PolarHBondContact O-N 3.35Å; E383-K387 WeakPolarHBondContact O-CB 3.32Å; E383-K387 VanDerWaalsContact O-CG 3.31Å; E383-K387 WeakPolarHBondContact O-CG 3.33Å; E383-K387 PolarHBondContact O-N 3.45Å
384Q88.9Confident85.2Confident123 Ų123102.4 Ų102.458%0.57551%0.511SS*.Hα-helixtrans-67.5-44.7173.2-82.2179-12.600111.4L380 E381 M386 K387 M388L380-Q384 WeakPolarHBondContact O-CB 3.42Å; L380-Q384 WeakPolarHBondContact O-CG 3.37Å; L380-Q384 PolarHBondContact O-N 2.87Å; E381-Q384 PolarHBondContact O-N 2.67Å; Q384-M386 VanDerWaalsContact C-N 3.33Å; Q384-M386 PolarHBondContact O-N 3.46Å; Q384-K387 PolarHBondContact O-N 2.77Å; Q384-M388 WeakPolarHBondContact O-CG 3.5Å; Q384-M388 PolarHBondContact O-N 3.36Å
385D86.2Confident86.2Confident105 Ų105101.3 Ų101.356%0.56151%0.509SS*.Hα-helixtrans-62.3-40.2176-76.8-14.9000111.8E381 A382 M388 L389E381-D385 PolarHBondContact O-N 3.49Å; A382-D385 PolarHBondContact O-N 2.86Å; D385-M388 PolarHBondContact O-N 3.36Å; D385-L389 WeakPolarHBondContact O-CB 3.3Å; D385-L389 PolarHBondContact O-N 3.08Å
386M83.8Confident86.9Confident102 Ų102101.8 Ų101.850%0.50251%0.513SS..Hα-helixtrans-63.8-44.2175.2-166.6179.176.100111.5A382 Q384 M388 L389 E390A382-M386 WeakPolarHBondContact O-CB 3.44Å; A382-M386 PolarHBondContact O-N 2.89Å; Q384-M386 VanDerWaalsContact C-N 3.33Å; Q384-M386 PolarHBondContact O-N 3.46Å; M386-M388 VanDerWaalsContact C-N 3.32Å; M386-M388 PolarHBondContact O-N 3.27Å; M386-L389 PolarHBondContact O-N 3.31Å; M386-E390 WeakPolarHBondContact O-CB 3.47Å; M386-E390 WeakPolarHBondContact O-CG 3.4Å; M386-E390 PolarHBondContact O-N 3.47Å
387K89.8Confident87.6Confident123 Ų123100.8 Ų100.854%0.53551%0.51SS..Hα-helixtrans-62.5-37.5174.8-76.5169.2-176.6159.90112.5E383 Q384 A391E383-K387 WeakPolarHBondContact O-CB 3.32Å; E383-K387 VanDerWaalsContact O-CG 3.31Å; E383-K387 WeakPolarHBondContact O-CG 3.33Å; E383-K387 PolarHBondContact O-N 3.45Å; Q384-K387 PolarHBondContact O-N 2.77Å; K387-A391 WeakPolarHBondContact O-CB 3.45Å; K387-A391 PolarHBondContact O-N 2.91Å
388M90.4Very high88.1Confident114 Ų11499.1 Ų99.156%0.56250%0.502SS*.Hα-helixtrans-66.3-42.4175.4-73.2-64.8-63.400111.7Q384 D385 M386 A391 Q392Q384-M388 WeakPolarHBondContact O-CG 3.5Å; Q384-M388 PolarHBondContact O-N 3.36Å; D385-M388 PolarHBondContact O-N 3.36Å; M386-M388 VanDerWaalsContact C-N 3.32Å; M386-M388 PolarHBondContact O-N 3.27Å; M388-A391 PolarHBondContact O-N 3.13Å; M388-Q392 VanDerWaalsContact O-CG 3.31Å; M388-Q392 WeakPolarHBondContact O-CG 3.26Å; M388-Q392 PolarHBondContact O-N 3.46Å
389L89.3Confident88.5Confident111 Ų11199.3 Ų99.358%0.58150%0.501SS*.Hα-helixtrans-66.5-39.8175.1-80163.2000112.3D385 M386 Q392 Q393D385-L389 WeakPolarHBondContact O-CB 3.3Å; D385-L389 PolarHBondContact O-N 3.08Å; M386-L389 PolarHBondContact O-N 3.31Å; L389-Q392 PolarHBondContact O-N 2.96Å; L389-Q393 WeakPolarHBondContact O-CB 3.34Å; L389-Q393 PolarHBondContact O-N 3.49Å
390E85.5Confident89Confident104 Ų104100.2 Ų100.249%0.48651%0.506SS..Hα-helixtrans-63.6-41.8174.4-76176.9173.600111.6M386 Q393 H394M386-E390 WeakPolarHBondContact O-CB 3.47Å; M386-E390 WeakPolarHBondContact O-CG 3.4Å; M386-E390 PolarHBondContact O-N 3.47Å; E390-Q393 PolarHBondContact O-N 2.87Å; E390-H394 WeakPolarHBondContact O-CB 3.5Å; E390-H394 PolarHBondContact O-N 3.05Å
391A91.3Very high89.2Confident48 Ų48102.3 Ų102.340%0.39751%0.511SS..Hα-helixtrans-62.4-4617400000111.6K387 M388 Q393 H394 D395K387-A391 WeakPolarHBondContact O-CB 3.45Å; K387-A391 PolarHBondContact O-N 2.91Å; M388-A391 PolarHBondContact O-N 3.13Å; A391-Q393 VanDerWaalsContact C-N 3.33Å; A391-Q393 PolarHBondContact O-N 3.28Å; A391-H394 WeakPolarHBondContact O-CB 3.45Å; A391-H394 PolarHBondContact O-N 3.46Å; A391-D395 PolarHBondContact O-N 2.92Å
392Q90.9Very high89.6Confident103 Ų103103.3 Ų103.348%0.48151%0.511SS..Hα-helixtrans-61.4-39.9175.1-73.7176.1-100112.4M388 L389 H394 D395 L396M388-Q392 VanDerWaalsContact O-CG 3.31Å; M388-Q392 WeakPolarHBondContact O-CG 3.26Å; M388-Q392 PolarHBondContact O-N 3.46Å; L389-Q392 PolarHBondContact O-N 2.96Å; Q392-H394 VanDerWaalsContact C-N 3.32Å; Q392-D395 PolarHBondContact O-N 3.37Å; Q392-L396 WeakPolarHBondContact O-CB 3.46Å; Q392-L396 VanDerWaalsContact O-CG 3.29Å; Q392-L396 WeakPolarHBondContact O-CG 3.43Å; Q392-L396 PolarHBondContact O-N 3.41Å
393Q86.3Confident90.1Very high120 Ų120105.8 Ų105.856%0.56151%0.514SS*.Hα-helixtrans-65.4-38.4176.2-170.8-177.65.700111.3L389 E390 A391 M397L389-Q393 WeakPolarHBondContact O-CB 3.34Å; L389-Q393 PolarHBondContact O-N 3.49Å; E390-Q393 PolarHBondContact O-N 2.87Å; A391-Q393 VanDerWaalsContact C-N 3.33Å; A391-Q393 PolarHBondContact O-N 3.28Å; Q393-M397 HydrophobicContact CG-CE 4.41Å; Q393-M397 WeakPolarHBondContact O-CB 3.43Å; Q393-M397 WeakPolarHBondContact O-CG 3.36Å; Q393-M397 PolarHBondContact O-N 3.48Å
394H92.3Very high90.6Very high103 Ų103107.1 Ų107.148%0.47752%0.518SS..Hα-helixtrans-65.1-47.5176-16835.7000111.7E390 A391 Q392 L396 M397 E398E390-H394 WeakPolarHBondContact O-CB 3.5Å; E390-H394 PolarHBondContact O-N 3.05Å; A391-H394 WeakPolarHBondContact O-CB 3.45Å; A391-H394 PolarHBondContact O-N 3.46Å; Q392-H394 VanDerWaalsContact C-N 3.32Å; H394-L396 VanDerWaalsContact C-N 3.33Å; H394-L396 PolarHBondContact O-N 3.1Å; H394-M397 PolarHBondContact O-N 3Å; H394-M397 VanDerWaalsContact O-N 3.14Å; H394-E398 PolarHBondContact O-N 3.44Å
395D91.8Very high90.9Very high98 Ų98106.9 Ų106.952%0.52452%0.517SS..Hα-helixtrans-59.2-43.4176.8-70.4-18.6000111.8A391 Q392 E398 E399A391-D395 PolarHBondContact O-N 2.92Å; Q392-D395 PolarHBondContact O-N 3.37Å; D395-E398 PolarHBondContact O-N 2.97Å; D395-E399 PolarHBondContact O-N 2.96Å
396L91.1Very high91.2Very high126 Ų126106 Ų10666%0.6651%0.512SS*.Hα-helixtrans-64.9-38.1176.1-76.1168.8000112.4Q392 H394 E399 L400Q392-L396 WeakPolarHBondContact O-CB 3.46Å; Q392-L396 VanDerWaalsContact O-CG 3.29Å; Q392-L396 WeakPolarHBondContact O-CG 3.43Å; Q392-L396 PolarHBondContact O-N 3.41Å; H394-L396 VanDerWaalsContact C-N 3.33Å; H394-L396 PolarHBondContact O-N 3.1Å; L396-E399 PolarHBondContact O-N 2.98Å; L396-L400 VanDerWaalsContact O-CB 3.32Å; L396-L400 WeakPolarHBondContact O-CB 3.49Å; L396-L400 PolarHBondContact O-N 3.44Å
397M92.8Very high91.7Very high106 Ų106107.6 Ų107.652%0.52252%0.516SS..Hα-helixtrans-67.3-40.8174.8-81.6-169.1-62.400112.2Q393 H394 L400 F401Q393-M397 HydrophobicContact CG-CE 4.41Å; Q393-M397 WeakPolarHBondContact O-CB 3.43Å; Q393-M397 WeakPolarHBondContact O-CG 3.36Å; Q393-M397 PolarHBondContact O-N 3.48Å; H394-M397 PolarHBondContact O-N 3Å; H394-M397 VanDerWaalsContact O-N 3.14Å; M397-L400 PolarHBondContact O-N 3.08Å; M397-F401 WeakPolarHBondContact O-CB 3.34Å; M397-F401 PolarHBondContact O-N 3.46Å
398E93.3Very high91.9Very high77 Ų77107.6 Ų107.636%0.3652%0.518SS..Hα-helixtrans-62.5-43.7174.6-75.6-158.4168.500111.8H394 D395 F401 R402H394-E398 PolarHBondContact O-N 3.44Å; D395-E398 PolarHBondContact O-N 2.97Å; E398-F401 PolarHBondContact O-N 3.36Å; E398-R402 PolarHBondContact O-N 3.04Å; E398-R402 IonicContact OE2-CZ 3.11Å; E398-R402 IonicContact OE2-NH1 2.66Å; E398-R402 PolarHBondContact OE2-NH1 3.42Å; E398-R402 IonicContact OE2-NH2 3.61Å; E398-R402 PolarHBondContact OE2-NH2 2.9Å
399E92.5Very high92.1Very high82 Ų82104.4 Ų104.438%0.38351%0.507SS..Hα-helixtrans-65.2-41.9178-173.654.2-151.100111.1D395 L396 F401 R402 Q403D395-E399 PolarHBondContact O-N 2.96Å; L396-E399 PolarHBondContact O-N 2.98Å; E399-F401 VanDerWaalsContact C-N 3.28Å; E399-F401 PolarHBondContact O-N 2.84Å; E399-R402 PolarHBondContact O-N 2.9Å; E399-R402 IonicContact OE2-NE 2.74Å; E399-R402 PolarHBondContact OE2-NE 3.26Å; E399-Q403 HydrophobicContact CG-CG 4.43Å; E399-Q403 WeakPolarHBondContact O-CB 3.25Å; E399-Q403 VanDerWaalsContact O-CG 3.23Å; E399-Q403 WeakPolarHBondContact O-CG 3.36Å; E399-Q403 PolarHBondContact O-N 3.32Å; E399-Q403 PolarHBondContact OE1-NE2 3.48Å
400L91.4Very high92.2Very high119 Ų119101.6 Ų101.662%0.62350%0.5SS*.Hα-helixtrans-61-38.7174.2-171.1146000111.7L396 M397 K404L396-L400 VanDerWaalsContact O-CB 3.32Å; L396-L400 WeakPolarHBondContact O-CB 3.49Å; L396-L400 PolarHBondContact O-N 3.44Å; M397-L400 PolarHBondContact O-N 3.08Å; L400-K404 VanDerWaalsContact O-CB 3.3Å; L400-K404 WeakPolarHBondContact O-CB 3.43Å; L400-K404 PolarHBondContact O-N 3.42Å
401F94.2Very high92.6Very high137 Ų137101.4 Ų101.460%0.60150%0.498SS*.Hα-helixtrans-65.9-46.5174.9-176.1-96.5000111.9M397 E398 E399 Q403 K404 Q405M397-F401 WeakPolarHBondContact O-CB 3.34Å; M397-F401 PolarHBondContact O-N 3.46Å; E398-F401 PolarHBondContact O-N 3.36Å; E399-F401 VanDerWaalsContact C-N 3.28Å; E399-F401 PolarHBondContact O-N 2.84Å; F401-Q403 PolarHBondContact O-N 2.86Å; F401-K404 PolarHBondContact O-N 2.97Å; F401-Q405 PolarHBondContact O-N 2.91Å
402R95.1Very high92.8Very high116 Ų116102.8 Ų102.844%0.43850%0.502SS..Hα-helixtrans-56.8-48173.9-83-170.3-91.4-90.4-3.3111.3E398 E399 K404 Q405 N406E398-R402 PolarHBondContact O-N 3.04Å; E398-R402 IonicContact OE2-CZ 3.11Å; E398-R402 IonicContact OE2-NH1 2.66Å; E398-R402 PolarHBondContact OE2-NH1 3.42Å; E398-R402 IonicContact OE2-NH2 3.61Å; E398-R402 PolarHBondContact OE2-NH2 2.9Å; E399-R402 PolarHBondContact O-N 2.9Å; E399-R402 IonicContact OE2-NE 2.74Å; E399-R402 PolarHBondContact OE2-NE 3.26Å; R402-K404 PolarHBondContact O-N 3.12Å; R402-Q405 PolarHBondContact O-N 2.68Å; R402-N406 WeakPolarHBondContact O-CB 3.38Å; R402-N406 PolarHBondContact O-N 3.48Å; R402-N406 PolarHBondContact O-ND2 3.32Å
403Q93.3Very high93Very high106 Ų106104.4 Ų104.450%0.49551%0.507SS..Hα-helixtrans-60.9-41.8176.9-70.2-67.3-17.900112E399 F401 N406 F407E399-Q403 HydrophobicContact CG-CG 4.43Å; E399-Q403 WeakPolarHBondContact O-CB 3.25Å; E399-Q403 VanDerWaalsContact O-CG 3.23Å; E399-Q403 WeakPolarHBondContact O-CG 3.36Å; E399-Q403 PolarHBondContact O-N 3.32Å; E399-Q403 PolarHBondContact OE1-NE2 3.48Å; F401-Q403 PolarHBondContact O-N 2.86Å; Q403-N406 PolarHBondContact O-N 2.93Å; Q403-F407 WeakPolarHBondContact O-CB 3.38Å; Q403-F407 PolarHBondContact O-N 2.84Å
404K93.3Very high93.3Very high126 Ų126104 Ų10455%0.54851%0.505SS..Hα-helixtrans-65.4-40177.1-169.8173.5-177.1176.90112.1L400 F401 R402 F407 Q408L400-K404 VanDerWaalsContact O-CB 3.3Å; L400-K404 WeakPolarHBondContact O-CB 3.43Å; L400-K404 PolarHBondContact O-N 3.42Å; F401-K404 PolarHBondContact O-N 2.97Å; R402-K404 PolarHBondContact O-N 3.12Å; K404-F407 PolarHBondContact O-N 3.4Å; K404-Q408 WeakPolarHBondContact O-CG 3.45Å; K404-Q408 PolarHBondContact O-N 3.31Å
405Q93.8Very high93.5Very high118 Ų118105.5 Ų105.555%0.55151%0.51SS*.Hα-helixtrans-66.5-44.2175-169.217817.700111.3F401 R402 F407 Q408 S409F401-Q405 PolarHBondContact O-N 2.91Å; R402-Q405 PolarHBondContact O-N 2.68Å; Q405-F407 PolarHBondContact O-N 2.94Å; Q405-Q408 PolarHBondContact O-N 3.3Å; Q405-S409 PolarHBondContact O-N 2.98Å
406N93.3Very high93.6Very high87 Ų87106.2 Ų106.247%0.46551%0.514SS..Hα-helixtrans-59.2-46.3174.8-72.8-18.6000111.1R402 Q403 Q408 S409 A410R402-N406 WeakPolarHBondContact O-CB 3.38Å; R402-N406 PolarHBondContact O-N 3.48Å; R402-N406 PolarHBondContact O-ND2 3.32Å; Q403-N406 PolarHBondContact O-N 2.93Å; N406-Q408 PolarHBondContact O-N 2.99Å; N406-S409 PolarHBondContact O-N 3.25Å; N406-S409 PolarHBondContact O-OG 3.41Å; N406-A410 PolarHBondContact O-N 3.42Å
407F94.4Very high93.8Very high135 Ų135105.4 Ų105.459%0.59251%0.51SS*.Hα-helixtrans-59.8-43.9175.6176.4-102.7000112.3Q403 K404 Q405 S409 A410 K411Q403-F407 WeakPolarHBondContact O-CB 3.38Å; Q403-F407 PolarHBondContact O-N 2.84Å; K404-F407 PolarHBondContact O-N 3.4Å; Q405-F407 PolarHBondContact O-N 2.94Å; F407-S409 VanDerWaalsContact C-N 3.35Å; F407-S409 PolarHBondContact O-N 3.18Å; F407-A410 PolarHBondContact O-N 3Å; F407-K411 HydrophobicContact CE1-CD 4.24Å; F407-K411 HydrophobicContact CZ-CD 4.46Å; F407-K411 WeakPolarHBondContact O-CB 3.41Å; F407-K411 PolarHBondContact O-N 2.96Å
408Q94.1Very high94Very high123 Ų123105.2 Ų105.258%0.57551%0.51SS*.Hα-helixtrans-63.1-41.1175.2-74.3-160.19.700112.2K404 Q405 N406 A410 K411 T412K404-Q408 WeakPolarHBondContact O-CG 3.45Å; K404-Q408 PolarHBondContact O-N 3.31Å; Q405-Q408 PolarHBondContact O-N 3.3Å; N406-Q408 PolarHBondContact O-N 2.99Å; Q408-A410 VanDerWaalsContact C-N 3.32Å; Q408-A410 PolarHBondContact O-N 3.15Å; Q408-K411 PolarHBondContact O-N 2.96Å; Q408-T412 WeakPolarHBondContact O-CG2 3.22Å; Q408-T412 PolarHBondContact O-N 3.24Å; Q408-T412 PolarHBondContact O-OG1 3.25Å
409S93.6Very high94Very high47 Ų47104.3 Ų104.333%0.32952%0.515SS..Hα-helixtrans-63.9-37175.884.30000112.4Q405 N406 F407 T412 K413Q405-S409 PolarHBondContact O-N 2.98Å; N406-S409 PolarHBondContact O-N 3.25Å; N406-S409 PolarHBondContact O-OG 3.41Å; F407-S409 VanDerWaalsContact C-N 3.35Å; F407-S409 PolarHBondContact O-N 3.18Å; S409-T412 PolarHBondContact O-OG1 3.42Å; S409-K413 VanDerWaalsContact O-CG 3.27Å; S409-K413 WeakPolarHBondContact O-CG 3.49Å; S409-K413 PolarHBondContact O-N 3.08Å; S409-K413 VanDerWaalsContact O-N 3.12Å
410A91.9Very high94.1Very high53 Ų53104.5 Ų104.544%0.43852%0.518SS..Hα-helixtrans-68-41.5174.600000110.8N406 F407 Q408 T412 K413 E414N406-A410 PolarHBondContact O-N 3.42Å; F407-A410 PolarHBondContact O-N 3Å; Q408-A410 VanDerWaalsContact C-N 3.32Å; Q408-A410 PolarHBondContact O-N 3.15Å; A410-T412 PolarHBondContact O-N 2.97Å; A410-K413 WeakPolarHBondContact O-CB 3.44Å; A410-K413 PolarHBondContact O-N 3.43Å; A410-E414 WeakPolarHBondContact O-CB 3.5Å; A410-E414 PolarHBondContact O-N 2.68Å
411K95.1Very high94.2Very high99 Ų99103.1 Ų103.143%0.4352%0.515SS..Hα-helixtrans-65.2-35.6177.6-170.2169.9-172.3169.60113F407 Q408 K415F407-K411 HydrophobicContact CE1-CD 4.24Å; F407-K411 HydrophobicContact CZ-CD 4.46Å; F407-K411 WeakPolarHBondContact O-CB 3.41Å; F407-K411 PolarHBondContact O-N 2.96Å; Q408-K411 PolarHBondContact O-N 2.96Å; K411-K415 WeakPolarHBondContact O-CG 3.42Å; K411-K415 PolarHBondContact O-N 2.92Å; K411-K415 VanDerWaalsContact O-N 3.12Å
412T94.4Very high94.2Very high78 Ų78100 Ų10048%0.47951%0.511SS..Hα-helixtrans-71.1-40.7173.655.30000111.4Q408 S409 A410 E414 K415 N416Q408-T412 WeakPolarHBondContact O-CG2 3.22Å; Q408-T412 PolarHBondContact O-N 3.24Å; Q408-T412 PolarHBondContact O-OG1 3.25Å; S409-T412 PolarHBondContact O-OG1 3.42Å; A410-T412 PolarHBondContact O-N 2.97Å; T412-E414 VanDerWaalsContact C-N 3.34Å; T412-E414 PolarHBondContact O-N 3.01Å; T412-K415 PolarHBondContact O-N 3.15Å; T412-N416 VanDerWaalsContact O-CG 3.23Å; T412-N416 PolarHBondContact O-N 3.42Å; T412-N416 PolarHBondContact O-ND2 3.02Å
413K94.9Very high94.2Very high136 Ų136101.1 Ų101.159%0.59152%0.519SS*.Hα-helixtrans-58.9-44.5172.2-73.1171.4-177.3175.70111.7S409 A410 N416 L417S409-K413 VanDerWaalsContact O-CG 3.27Å; S409-K413 WeakPolarHBondContact O-CG 3.49Å; S409-K413 PolarHBondContact O-N 3.08Å; S409-K413 VanDerWaalsContact O-N 3.12Å; A410-K413 WeakPolarHBondContact O-CB 3.44Å; A410-K413 PolarHBondContact O-N 3.43Å; K413-N416 PolarHBondContact O-N 3.42Å; K413-L417 WeakPolarHBondContact O-CG 3.27Å; K413-L417 PolarHBondContact O-N 3.47Å
414E94.1Very high94.2Very high113 Ų11399.6 Ų99.653%0.52851%0.514SS..Hα-helixtrans-58.1-50176-175.1-169.9179.600111.6A410 T412 N416 L417 I418A410-E414 WeakPolarHBondContact O-CB 3.5Å; A410-E414 PolarHBondContact O-N 2.68Å; T412-E414 VanDerWaalsContact C-N 3.34Å; T412-E414 PolarHBondContact O-N 3.01Å; E414-N416 VanDerWaalsContact C-N 3.29Å; E414-N416 PolarHBondContact O-N 2.94Å; E414-L417 PolarHBondContact O-N 2.91Å; E414-L417 VanDerWaalsContact O-N 3.13Å; E414-I418 HydrophobicContact CG-CD1 4.03Å; E414-I418 WeakPolarHBondContact O-CG1 3.48Å; E414-I418 PolarHBondContact O-N 3.47Å
415K95.4Very high94.4Very high133 Ų133100.8 Ų100.858%0.57852%0.519SS*.Hα-helixtrans-57.8-42176.3-74179.2178.7-173.30112.5K411 T412 I418 A419K411-K415 WeakPolarHBondContact O-CG 3.42Å; K411-K415 PolarHBondContact O-N 2.92Å; K411-K415 VanDerWaalsContact O-N 3.12Å; T412-K415 PolarHBondContact O-N 3.15Å; K415-I418 PolarHBondContact O-N 2.92Å; K415-A419 WeakPolarHBondContact O-CB 3.35Å; K415-A419 PolarHBondContact O-N 2.84Å
416N94.6Very high94.5Very high113 Ų113102.1 Ų102.160%0.60452%0.523SS*.Hα-helixtrans-64.5-41177.1-68.3-16000111.6T412 K413 E414 A419 L420T412-N416 VanDerWaalsContact O-CG 3.23Å; T412-N416 PolarHBondContact O-N 3.42Å; T412-N416 PolarHBondContact O-ND2 3.02Å; K413-N416 PolarHBondContact O-N 3.42Å; E414-N416 VanDerWaalsContact C-N 3.29Å; E414-N416 PolarHBondContact O-N 2.94Å; N416-A419 PolarHBondContact O-N 3.15Å; N416-L420 WeakPolarHBondContact O-CB 3.42Å; N416-L420 PolarHBondContact O-N 3.25Å
417L94.9Very high94.6Very high110 Ų110100.8 Ų100.858%0.57652%0.518SS*.Hα-helixtrans-66.1-38.6175.5-71.6173.1000112.1K413 E414 L420 T421K413-L417 WeakPolarHBondContact O-CG 3.27Å; K413-L417 PolarHBondContact O-N 3.47Å; E414-L417 PolarHBondContact O-N 2.91Å; E414-L417 VanDerWaalsContact O-N 3.13Å; L417-L420 PolarHBondContact O-N 3.39Å; L417-T421 WeakPolarHBondContact O-CB 3.33Å; L417-T421 PolarHBondContact O-N 3.16Å; L417-T421 PolarHBondContact O-OG1 3.05Å
418I95.6Very high94.6Very high102 Ų10298.9 Ų98.952%0.52351%0.513SS..Hα-helixtrans-62.6-45.6174.3-68.7166.9000110.4E414 K415 L420 T421 S422E414-I418 HydrophobicContact CG-CD1 4.03Å; E414-I418 WeakPolarHBondContact O-CG1 3.48Å; E414-I418 PolarHBondContact O-N 3.47Å; K415-I418 PolarHBondContact O-N 2.92Å; I418-L420 VanDerWaalsContact C-N 3.34Å; I418-L420 PolarHBondContact O-N 3.48Å; I418-T421 PolarHBondContact O-N 3.27Å; I418-S422 PolarHBondContact O-N 2.81Å; I418-S422 PolarHBondContact O-OG 2.85Å
419A93.8Very high94.8Very high57 Ų5797.1 Ų97.147%0.47151%0.511SS..Hα-helixtrans-64-38176.500000112.4K415 N416 S422 K423K415-A419 WeakPolarHBondContact O-CB 3.35Å; K415-A419 PolarHBondContact O-N 2.84Å; N416-A419 PolarHBondContact O-N 3.15Å; A419-S422 PolarHBondContact O-OG 3.16Å; A419-K423 WeakPolarHBondContact O-CB 3.49Å; A419-K423 PolarHBondContact O-N 3.46Å
420L94.7Very high94.9Very high86 Ų8698.2 Ų98.245%0.4551%0.513SS..Hα-helixtrans-66.8-41.2173.9-175.164.5000111.3N416 L417 I418 K423 N424N416-L420 WeakPolarHBondContact O-CB 3.42Å; N416-L420 PolarHBondContact O-N 3.25Å; L417-L420 PolarHBondContact O-N 3.39Å; I418-L420 VanDerWaalsContact C-N 3.34Å; I418-L420 PolarHBondContact O-N 3.48Å; L420-K423 PolarHBondContact O-N 3.26Å; L420-N424 WeakPolarHBondContact O-CB 3.49Å; L420-N424 PolarHBondContact O-N 3.09Å; L420-N424 PolarHBondContact O-OD1 3.34Å
421T93.4Very high95Very high90 Ų90100.8 Ų100.855%0.55252%0.519SS*.Hα-helixtrans-64.2-41.4178.1-570000111.1L417 I418 N424 K425L417-T421 WeakPolarHBondContact O-CB 3.33Å; L417-T421 PolarHBondContact O-N 3.16Å; L417-T421 PolarHBondContact O-OG1 3.05Å; I418-T421 PolarHBondContact O-N 3.27Å; T421-N424 PolarHBondContact O-N 3.17Å; T421-K425 WeakPolarHBondContact O-CB 3.43Å; T421-K425 PolarHBondContact O-N 3.37Å
422S94.4Very high95.1Very high73 Ų73100.7 Ų100.751%0.5152%0.522SS..Hα-helixtrans-66.9-41.4176.366.30000111.9I418 A419 K425 F426I418-S422 PolarHBondContact O-N 2.81Å; I418-S422 PolarHBondContact O-OG 2.85Å; A419-S422 PolarHBondContact O-OG 3.16Å; S422-K425 PolarHBondContact O-N 3.5Å; S422-F426 PolarHBondContact O-N 3.06Å
423K95.4Very high95.1Very high139 Ų13999.2 Ų99.260%0.60452%0.516SS*.Hα-helixtrans-59.1-47.7171.8-176.3-177.8178-177.60111.4A419 L420 K425 F426 T427A419-K423 WeakPolarHBondContact O-CB 3.49Å; A419-K423 PolarHBondContact O-N 3.46Å; L420-K423 PolarHBondContact O-N 3.26Å; K423-K425 VanDerWaalsContact C-N 3.34Å; K423-K425 PolarHBondContact O-N 2.95Å; K423-F426 WeakPolarHBondContact O-CB 3.32Å; K423-F426 PolarHBondContact O-N 2.98Å; K423-T427 PolarHBondContact O-N 3.04Å; K423-T427 PolarHBondContact O-OG1 3.26Å
424N94.2Very high95.2Very high74 Ų7497.2 Ų97.240%0.39651%0.508SS..Hα-helixtrans-62.3-42.1178.7-72.3-4.7000111.2L420 T421 F426 T427 I428L420-N424 WeakPolarHBondContact O-CB 3.49Å; L420-N424 PolarHBondContact O-N 3.09Å; L420-N424 PolarHBondContact O-OD1 3.34Å; T421-N424 PolarHBondContact O-N 3.17Å; N424-F426 VanDerWaalsContact C-N 3.32Å; N424-F426 PolarHBondContact O-N 3.26Å; N424-T427 VanDerWaalsContact CA-OG1 3.28Å; N424-T427 WeakPolarHBondContact CA-OG1 3.46Å; N424-T427 PolarHBondContact O-N 3.21Å; N424-T427 VanDerWaalsContact O-N 3.16Å; N424-T427 PolarHBondContact O-OG1 3.2Å; N424-I428 VanDerWaalsContact O-CG1 3.31Å; N424-I428 WeakPolarHBondContact O-CG1 3.38Å; N424-I428 PolarHBondContact O-N 2.87Å
425K96.8Very high95.2Very high151 Ų15196 Ų9666%0.65751%0.505SS*.Hα-helixtrans-59.4-42.4175.3-171.3176.1-178.5178.20111.8T421 S422 K423 I428 T429T421-K425 WeakPolarHBondContact O-CB 3.43Å; T421-K425 PolarHBondContact O-N 3.37Å; S422-K425 PolarHBondContact O-N 3.5Å; K423-K425 VanDerWaalsContact C-N 3.34Å; K423-K425 PolarHBondContact O-N 2.95Å; K425-I428 PolarHBondContact O-N 2.82Å; K425-T429 WeakPolarHBondContact O-CB 3.49Å; K425-T429 PolarHBondContact O-N 2.88Å; K425-T429 PolarHBondContact O-OG1 3.42Å
426F95.5Very high95.2Very high146 Ų14692.7 Ų92.764%0.6450%0.496SS*.Hα-helixtrans-62.5-45.6174.1-177.7-97.4000111.7S422 K423 N424 I428 T429 N430S422-F426 PolarHBondContact O-N 3.06Å; K423-F426 WeakPolarHBondContact O-CB 3.32Å; K423-F426 PolarHBondContact O-N 2.98Å; N424-F426 VanDerWaalsContact C-N 3.32Å; N424-F426 PolarHBondContact O-N 3.26Å; F426-I428 PolarHBondContact O-N 3.13Å; F426-T429 PolarHBondContact O-N 2.97Å; F426-N430 PolarHBondContact O-N 2.99Å
427T95.5Very high95.3Very high58 Ų5894 Ų9436%0.35650%0.496SS..Hα-helixtrans-62.4-41.3177.355.30000112.7K423 N424 N430 L431K423-T427 PolarHBondContact O-N 3.04Å; K423-T427 PolarHBondContact O-OG1 3.26Å; N424-T427 VanDerWaalsContact CA-OG1 3.28Å; N424-T427 WeakPolarHBondContact CA-OG1 3.46Å; N424-T427 PolarHBondContact O-N 3.21Å; N424-T427 VanDerWaalsContact O-N 3.16Å; N424-T427 PolarHBondContact O-OG1 3.2Å; T427-N430 PolarHBondContact O-N 3.28Å; T427-L431 WeakPolarHBondContact O-CB 3.37Å; T427-L431 VanDerWaalsContact O-CG 3.3Å; T427-L431 WeakPolarHBondContact O-CG 3.49Å; T427-L431 PolarHBondContact O-N 3.38Å
428I95.4Very high95.3Very high96 Ų9694.8 Ų94.849%0.49250%0.499SS..Hα-helixtrans-62.4-45.7176-70.2166.1000110.2N424 K425 F426 N430 L431 L432N424-I428 VanDerWaalsContact O-CG1 3.31Å; N424-I428 WeakPolarHBondContact O-CG1 3.38Å; N424-I428 PolarHBondContact O-N 2.87Å; K425-I428 PolarHBondContact O-N 2.82Å; F426-I428 PolarHBondContact O-N 3.13Å; I428-N430 VanDerWaalsContact C-N 3.31Å; I428-N430 PolarHBondContact O-N 2.88Å; I428-L431 PolarHBondContact O-N 3.03Å; I428-L432 HydrophobicContact CG2-CD1 3.87Å; I428-L432 HydrophobicContact CG2-CG 4.31Å; I428-L432 WeakPolarHBondContact O-CB 3.42Å; I428-L432 WeakPolarHBondContact O-CG 3.5Å; I428-L432 PolarHBondContact O-N 3.22Å
429T96.8Very high95.3Very high85 Ų8594.7 Ų94.752%0.52150%0.496SS..Hα-helixtrans-62.4-40.3179.5-480000111.2K425 F426 L432 S433K425-T429 WeakPolarHBondContact O-CB 3.49Å; K425-T429 PolarHBondContact O-N 2.88Å; K425-T429 PolarHBondContact O-OG1 3.42Å; F426-T429 PolarHBondContact O-N 2.97Å; T429-L432 PolarHBondContact O-N 2.95Å; T429-S433 PolarHBondContact O-N 3.22Å
430N95.7Very high95.4Very high71 Ų7197 Ų9738%0.3850%0.501SS..Hα-helixtrans-64.2-47.8174.5-173.912.3000111.5F426 T427 I428 L432 S433 Q434F426-N430 PolarHBondContact O-N 2.99Å; T427-N430 PolarHBondContact O-N 3.28Å; I428-N430 VanDerWaalsContact C-N 3.31Å; I428-N430 PolarHBondContact O-N 2.88Å; N430-L432 VanDerWaalsContact C-N 3.32Å; N430-L432 PolarHBondContact O-N 2.75Å; N430-S433 WeakPolarHBondContact O-CB 3.49Å; N430-S433 PolarHBondContact O-N 3.19Å; N430-S433 VanDerWaalsContact O-N 3.1Å; N430-S433 PolarHBondContact O-OG 2.83Å; N430-Q434 WeakPolarHBondContact O-CG 3.2Å; N430-Q434 PolarHBondContact O-N 3.01Å; N430-Q434 PolarHBondContact OD1-NE2 3.47Å
431L95.5Very high95.5Very high106 Ų10696 Ų9656%0.55550%0.498SS*.Hα-helixtrans-60.1-40.8176.8-71.1172.8000112T427 I428 S433 Q434 L435T427-L431 WeakPolarHBondContact O-CB 3.37Å; T427-L431 VanDerWaalsContact O-CG 3.3Å; T427-L431 WeakPolarHBondContact O-CG 3.49Å; T427-L431 PolarHBondContact O-N 3.38Å; I428-L431 PolarHBondContact O-N 3.03Å; L431-S433 VanDerWaalsContact C-N 3.34Å; L431-S433 PolarHBondContact O-N 2.9Å; L431-Q434 PolarHBondContact O-N 2.96Å; L431-L435 WeakPolarHBondContact O-CB 3.47Å; L431-L435 PolarHBondContact O-N 3.11Å
432L96.3Very high95.6Very high97 Ų9796.9 Ų96.951%0.50850%0.499SS..Hα-helixtrans-63-39.5173.7-73.6171000112I428 T429 N430 Q434 L435 T436I428-L432 HydrophobicContact CG2-CD1 3.87Å; I428-L432 HydrophobicContact CG2-CG 4.31Å; I428-L432 WeakPolarHBondContact O-CB 3.42Å; I428-L432 WeakPolarHBondContact O-CG 3.5Å; I428-L432 PolarHBondContact O-N 3.22Å; T429-L432 PolarHBondContact O-N 2.95Å; N430-L432 VanDerWaalsContact C-N 3.32Å; N430-L432 PolarHBondContact O-N 2.75Å; L432-Q434 VanDerWaalsContact C-N 3.28Å; L432-Q434 PolarHBondContact O-N 3.48Å; L432-L435 PolarHBondContact O-N 3.06Å; L432-T436 WeakPolarHBondContact O-CG2 3.49Å; L432-T436 PolarHBondContact O-N 3.3Å; L432-T436 PolarHBondContact O-OG1 3.43Å
433S95.3Very high95.6Very high48 Ų4897.7 Ų97.734%0.33650%0.497SS..Hα-helixtrans-65.7-31.3174.782.70000112.8T429 N430 L431 T436 K437T429-S433 PolarHBondContact O-N 3.22Å; N430-S433 WeakPolarHBondContact O-CB 3.49Å; N430-S433 PolarHBondContact O-N 3.19Å; N430-S433 VanDerWaalsContact O-N 3.1Å; N430-S433 PolarHBondContact O-OG 2.83Å; L431-S433 VanDerWaalsContact C-N 3.34Å; L431-S433 PolarHBondContact O-N 2.9Å; S433-T436 WeakPolarHBondContact CA-OG1 3.37Å; S433-T436 PolarHBondContact O-OG1 3.08Å; S433-K437 VanDerWaalsContact O-CG 3.27Å; S433-K437 WeakPolarHBondContact O-CG 3.39Å; S433-K437 PolarHBondContact O-N 3.41Å
434Q96.3Very high95.6Very high93 Ų9399.7 Ų99.744%0.43550%0.5SS..Hα-helixtrans-75.2-42.8174.3-68.9176.723.500110.9N430 L431 L432 T436 K437 M438N430-Q434 WeakPolarHBondContact O-CG 3.2Å; N430-Q434 PolarHBondContact O-N 3.01Å; N430-Q434 PolarHBondContact OD1-NE2 3.47Å; L431-Q434 PolarHBondContact O-N 2.96Å; L432-Q434 VanDerWaalsContact C-N 3.28Å; L432-Q434 PolarHBondContact O-N 3.48Å; Q434-T436 PolarHBondContact O-N 3.01Å; Q434-K437 WeakPolarHBondContact O-CB 3.35Å; Q434-K437 PolarHBondContact O-N 3.27Å; Q434-M438 WeakPolarHBondContact O-CG 3.45Å; Q434-M438 PolarHBondContact O-N 2.96Å
435L94.3Very high95.6Very high87 Ų87102.1 Ų102.146%0.45551%0.509SS..Hα-helixtrans-59.7-47.9177.5-174145.4000111L431 L432 K437 M438 E439L431-L435 WeakPolarHBondContact O-CB 3.47Å; L431-L435 PolarHBondContact O-N 3.11Å; L432-L435 PolarHBondContact O-N 3.06Å; L435-K437 VanDerWaalsContact C-N 3.32Å; L435-K437 PolarHBondContact O-N 2.93Å; L435-M438 CarbonylContact O-C 3.6Å; L435-M438 WeakPolarHBondContact O-CB 3.48Å; L435-M438 PolarHBondContact O-N 2.72Å; L435-E439 HydrophobicContact CD2-CG 4.09Å; L435-E439 WeakPolarHBondContact CD2-OE1 3.42Å; L435-E439 WeakPolarHBondContact O-CG 3.38Å; L435-E439 PolarHBondContact O-N 2.93Å
436T95.6Very high95.5Very high65 Ų6599.7 Ų99.740%0.39950%0.5SS..Hα-helixtrans-61.5-35.9175.348.50000113L432 S433 Q434 N440L432-T436 WeakPolarHBondContact O-CG2 3.49Å; L432-T436 PolarHBondContact O-N 3.3Å; L432-T436 PolarHBondContact O-OG1 3.43Å; S433-T436 WeakPolarHBondContact CA-OG1 3.37Å; S433-T436 PolarHBondContact O-OG1 3.08Å; Q434-T436 PolarHBondContact O-N 3.01Å; T436-N440 WeakPolarHBondContact O-CB 3.47Å; T436-N440 VanDerWaalsContact O-CG 3.25Å; T436-N440 PolarHBondContact O-N 3.42Å; T436-N440 PolarHBondContact O-ND2 3.04Å
437K96.1Very high95.3Very high139 Ų13998.3 Ų98.360%0.60450%0.497SS*.Hα-helixtrans-63.3-45.5171.3-75.5172.1-177.3178.70111.5S433 Q434 L435 N440 T441S433-K437 VanDerWaalsContact O-CG 3.27Å; S433-K437 WeakPolarHBondContact O-CG 3.39Å; S433-K437 PolarHBondContact O-N 3.41Å; Q434-K437 WeakPolarHBondContact O-CB 3.35Å; Q434-K437 PolarHBondContact O-N 3.27Å; L435-K437 VanDerWaalsContact C-N 3.32Å; L435-K437 PolarHBondContact O-N 2.93Å; K437-N440 PolarHBondContact O-N 3.45Å; K437-T441 WeakPolarHBondContact O-CG2 3.44Å; K437-T441 PolarHBondContact O-N 3.03Å; K437-T441 PolarHBondContact O-OG1 3.32Å
438M95.2Very high95.3Very high128 Ų12899.4 Ų99.463%0.63150%0.5SS*.Hα-helixtrans-63.8-42.5178.1-67.2-59.5-65.600111.9Q434 L435 N440 T441 L442Q434-M438 WeakPolarHBondContact O-CG 3.45Å; Q434-M438 PolarHBondContact O-N 2.96Å; L435-M438 CarbonylContact O-C 3.6Å; L435-M438 WeakPolarHBondContact O-CB 3.48Å; L435-M438 PolarHBondContact O-N 2.72Å; M438-N440 PolarHBondContact O-N 3.37Å; M438-T441 WeakPolarHBondContact CA-OG1 3.38Å; M438-T441 PolarHBondContact O-N 2.86Å; M438-T441 PolarHBondContact O-OG1 3.2Å; M438-L442 WeakPolarHBondContact O-CB 3.39Å; M438-L442 PolarHBondContact O-N 3.24Å
439E96.1Very high95.2Very high99 Ų9996.9 Ų96.946%0.46349%0.491SS..Hα-helixtrans-59.2-44.8174.3-73.417515500111.7L435 T441 L442 I443L435-E439 HydrophobicContact CD2-CG 4.09Å; L435-E439 WeakPolarHBondContact CD2-OE1 3.42Å; L435-E439 WeakPolarHBondContact O-CG 3.38Å; L435-E439 PolarHBondContact O-N 2.93Å; E439-T441 VanDerWaalsContact C-N 3.33Å; E439-T441 PolarHBondContact O-N 2.88Å; E439-L442 WeakPolarHBondContact O-CB 3.45Å; E439-L442 PolarHBondContact O-N 3.25Å; E439-I443 WeakPolarHBondContact O-CG1 3.28Å; E439-I443 PolarHBondContact O-N 3.38Å
440N95.6Very high95.2Very high106 Ų10696.6 Ų96.657%0.56749%0.486SS*.Hα-helixtrans-63-39176-74.6-36000112.2T436 K437 M438 R444T436-N440 WeakPolarHBondContact O-CB 3.47Å; T436-N440 VanDerWaalsContact O-CG 3.25Å; T436-N440 PolarHBondContact O-N 3.42Å; T436-N440 PolarHBondContact O-ND2 3.04Å; K437-N440 PolarHBondContact O-N 3.45Å; M438-N440 PolarHBondContact O-N 3.37Å; N440-R444 WeakPolarHBondContact O-CB 3.48Å; N440-R444 PolarHBondContact O-N 3.14Å
441T95.6Very high95.1Very high66 Ų6698.5 Ų98.541%0.40550%0.496SS..Hα-helixtrans-66.3-38.1174.256.50000112.2K437 M438 E439 R444 Q445K437-T441 WeakPolarHBondContact O-CG2 3.44Å; K437-T441 PolarHBondContact O-N 3.03Å; K437-T441 PolarHBondContact O-OG1 3.32Å; M438-T441 WeakPolarHBondContact CA-OG1 3.38Å; M438-T441 PolarHBondContact O-N 2.86Å; M438-T441 PolarHBondContact O-OG1 3.2Å; E439-T441 VanDerWaalsContact C-N 3.33Å; E439-T441 PolarHBondContact O-N 2.88Å; T441-R444 PolarHBondContact O-N 3.3Å; T441-Q445 WeakPolarHBondContact O-CB 3.49Å; T441-Q445 WeakPolarHBondContact O-CG 3.45Å; T441-Q445 PolarHBondContact O-N 2.97Å
442L95.8Very high95.1Very high107 Ų10798.8 Ų98.856%0.5650%0.495SS*.Hα-helixtrans-65.1-46177.2-178.466.5000111.1M438 E439 R444 Q445 Q446M438-L442 WeakPolarHBondContact O-CB 3.39Å; M438-L442 PolarHBondContact O-N 3.24Å; E439-L442 WeakPolarHBondContact O-CB 3.45Å; E439-L442 PolarHBondContact O-N 3.25Å; L442-R444 VanDerWaalsContact C-N 3.3Å; L442-R444 PolarHBondContact O-N 2.94Å; L442-Q445 PolarHBondContact O-N 3.32Å; L442-Q446 PolarHBondContact O-N 3.11Å
443I94.7Very high94.9Very high91 Ų9198.8 Ų98.847%0.46749%0.492SS..Hα-helixtrans-58.5-44.3175.6-69.2166.9000110.4E439 Q446 M447E439-I443 WeakPolarHBondContact O-CG1 3.28Å; E439-I443 PolarHBondContact O-N 3.38Å; I443-Q446 PolarHBondContact O-N 3.27Å; I443-M447 HydrophobicContact CG2-CE 3.75Å; I443-M447 WeakPolarHBondContact O-CG 3.35Å; I443-M447 PolarHBondContact O-N 3.1Å
444R95.6Very high94.9Very high181 Ų18198.5 Ų98.568%0.68349%0.493SS*.Hα-helixtrans-63-42.8176.7-176.1175.9177.9153.8-0.2112N440 T441 L442 M447 I448N440-R444 WeakPolarHBondContact O-CB 3.48Å; N440-R444 PolarHBondContact O-N 3.14Å; T441-R444 PolarHBondContact O-N 3.3Å; L442-R444 VanDerWaalsContact C-N 3.3Å; L442-R444 PolarHBondContact O-N 2.94Å; R444-M447 PolarHBondContact O-N 3.43Å; R444-I448 HydrophobicContact CG-CD1 4.23Å; R444-I448 WeakPolarHBondContact O-CG1 3.3Å; R444-I448 PolarHBondContact O-N 3.3Å
445Q94.2Very high94.8Very high125 Ų125100.8 Ų100.858%0.58450%0.502SS*.Hα-helixtrans-62.6-42.2175.5-76176.5-9.600111.4T441 L442 M447 I448 S449T441-Q445 WeakPolarHBondContact O-CB 3.49Å; T441-Q445 WeakPolarHBondContact O-CG 3.45Å; T441-Q445 PolarHBondContact O-N 2.97Å; L442-Q445 PolarHBondContact O-N 3.32Å; Q445-M447 VanDerWaalsContact C-N 3.35Å; Q445-M447 PolarHBondContact O-N 3.15Å; Q445-I448 PolarHBondContact O-N 3.44Å; Q445-I448 VanDerWaalsContact O-N 3.15Å; Q445-S449 PolarHBondContact O-N 3.24Å
446Q93.6Very high94.8Very high100 Ų100100.8 Ų100.847%0.46750%0.501SS..Hα-helixtrans-60.8-42.8175.7-169.965.342.700111.7L442 I443 I448 S449 N450L442-Q446 PolarHBondContact O-N 3.11Å; I443-Q446 PolarHBondContact O-N 3.27Å; Q446-I448 VanDerWaalsContact C-N 3.32Å; Q446-I448 PolarHBondContact O-N 2.9Å; Q446-S449 PolarHBondContact O-N 3.4Å; Q446-N450 PolarHBondContact NE2-OD1 2.99Å; Q446-N450 WeakPolarHBondContact O-CB 3.38Å; Q446-N450 PolarHBondContact O-N 2.65Å; Q446-N450 PolarHBondContact O-OD1 3.17Å
447M93.2Very high94.7Very high117 Ų117102.3 Ų102.358%0.57651%0.506SS*.Hα-helixtrans-61.7-39.7175-70.7178.5-176.800112.2I443 R444 Q445 N451I443-M447 HydrophobicContact CG2-CE 3.75Å; I443-M447 WeakPolarHBondContact O-CG 3.35Å; I443-M447 PolarHBondContact O-N 3.1Å; R444-M447 PolarHBondContact O-N 3.43Å; Q445-M447 VanDerWaalsContact C-N 3.35Å; Q445-M447 PolarHBondContact O-N 3.15Å; M447-N451 WeakPolarHBondContact O-CB 3.42Å; M447-N451 PolarHBondContact O-N 3.38Å; M447-N451 PolarHBondContact O-ND2 3.02Å
448I94.8Very high94.5Very high81 Ų81102.1 Ų102.142%0.41551%0.509SS..Hα-helixtrans-65.7-44.8175.9-66.3165.1000110.3R444 Q445 Q446 N451 Q452R444-I448 HydrophobicContact CG-CD1 4.23Å; R444-I448 WeakPolarHBondContact O-CG1 3.3Å; R444-I448 PolarHBondContact O-N 3.3Å; Q445-I448 PolarHBondContact O-N 3.44Å; Q445-I448 VanDerWaalsContact O-N 3.15Å; Q446-I448 VanDerWaalsContact C-N 3.32Å; Q446-I448 PolarHBondContact O-N 2.9Å; I448-N451 PolarHBondContact O-N 3.4Å; I448-Q452 HydrophobicContact CG2-CG 4.39Å; I448-Q452 WeakPolarHBondContact O-CG 3.41Å; I448-Q452 PolarHBondContact O-N 2.84Å
449S93.8Very high94.2Very high43 Ų43101.2 Ų101.230%0.30151%0.506SS..Hα-helixtrans-57.7-51.8176.3-165.70000111.1Q445 Q446 N451 Q452 E453Q445-S449 PolarHBondContact O-N 3.24Å; Q446-S449 PolarHBondContact O-N 3.4Å; S449-N451 VanDerWaalsContact C-N 3.28Å; S449-N451 PolarHBondContact O-N 3.37Å; S449-Q452 CarbonylContact O-C 3.59Å; S449-Q452 WeakPolarHBondContact O-CA 3.45Å; S449-Q452 WeakPolarHBondContact O-CB 3.36Å; S449-Q452 PolarHBondContact O-N 2.99Å; S449-E453 WeakPolarHBondContact O-CB 3.33Å; S449-E453 WeakPolarHBondContact O-CG 3.44Å; S449-E453 PolarHBondContact O-N 2.88Å; S449-E453 PolarHBondContact OG-OE1 3.38Å
450N95.2Very high93.9Very high78 Ų78101.9 Ų101.942%0.41751%0.509SS..Hα-helixtrans-59.1-39.5179.4-66.82.9000111.8Q446 E453 A454Q446-N450 PolarHBondContact NE2-OD1 2.99Å; Q446-N450 WeakPolarHBondContact O-CB 3.38Å; Q446-N450 PolarHBondContact O-N 2.65Å; Q446-N450 PolarHBondContact O-OD1 3.17Å; N450-E453 PolarHBondContact O-N 3.34Å; N450-A454 WeakPolarHBondContact O-CB 3.26Å; N450-A454 PolarHBondContact O-N 2.94Å
451N95.3Very high93.3Very high111 Ų111105.1 Ų105.159%0.59451%0.514SS*.Hα-helixtrans-67-38.2175.2-80-19.1000112.5M447 I448 S449 K455M447-N451 WeakPolarHBondContact O-CB 3.42Å; M447-N451 PolarHBondContact O-N 3.38Å; M447-N451 PolarHBondContact O-ND2 3.02Å; I448-N451 PolarHBondContact O-N 3.4Å; S449-N451 VanDerWaalsContact C-N 3.28Å; S449-N451 PolarHBondContact O-N 3.37Å; N451-K455 WeakPolarHBondContact O-CG 3.35Å; N451-K455 PolarHBondContact O-N 2.88Å
452Q93.9Very high92.9Very high113 Ų113108 Ų10853%0.52852%0.521SS..Hα-helixtrans-68.6-42.7175-74177.6-21.300111.2I448 S449 A454 K455 I456I448-Q452 HydrophobicContact CG2-CG 4.39Å; I448-Q452 WeakPolarHBondContact O-CG 3.41Å; I448-Q452 PolarHBondContact O-N 2.84Å; S449-Q452 CarbonylContact O-C 3.59Å; S449-Q452 WeakPolarHBondContact O-CA 3.45Å; S449-Q452 WeakPolarHBondContact O-CB 3.36Å; S449-Q452 PolarHBondContact O-N 2.99Å; Q452-A454 VanDerWaalsContact C-N 3.33Å; Q452-A454 PolarHBondContact O-N 3.3Å; Q452-K455 CarbonylContact O-C 3.57Å; Q452-K455 WeakPolarHBondContact O-CB 3.49Å; Q452-K455 PolarHBondContact O-N 3.41Å; Q452-K455 VanDerWaalsContact O-N 3.11Å; Q452-I456 VanDerWaalsContact O-CG1 3.31Å; Q452-I456 WeakPolarHBondContact O-CG1 3.33Å; Q452-I456 PolarHBondContact O-N 2.82Å
453E93.6Very high92.4Very high96 Ų96107.4 Ų107.445%0.44952%0.521SS..Hα-helixtrans-58.9-42.9174.1-74.9166.9-148.200111.6S449 N450 K455 I456 L457S449-E453 WeakPolarHBondContact O-CB 3.33Å; S449-E453 WeakPolarHBondContact O-CG 3.44Å; S449-E453 PolarHBondContact O-N 2.88Å; S449-E453 PolarHBondContact OG-OE1 3.38Å; N450-E453 PolarHBondContact O-N 3.34Å; E453-K455 VanDerWaalsContact C-N 3.33Å; E453-K455 PolarHBondContact O-N 2.99Å; E453-I456 PolarHBondContact O-N 2.89Å; E453-L457 WeakPolarHBondContact O-CB 3.41Å; E453-L457 WeakPolarHBondContact O-CG 3.4Å; E453-L457 PolarHBondContact O-N 2.98Å
454A93.8Very high91.7Very high43 Ų43104.5 Ų104.536%0.35551%0.511SS..Hα-helixtrans-60.3-42174.100000112N450 Q452 L457 M458N450-A454 WeakPolarHBondContact O-CB 3.26Å; N450-A454 PolarHBondContact O-N 2.94Å; Q452-A454 VanDerWaalsContact C-N 3.33Å; Q452-A454 PolarHBondContact O-N 3.3Å; A454-L457 PolarHBondContact O-N 3.23Å; A454-M458 WeakPolarHBondContact O-CG 3.48Å; A454-M458 PolarHBondContact O-N 3.46Å
455K95.3Very high90.9Very high141 Ų141101.5 Ų101.561%0.61351%0.505SS*.Hα-helixtrans-65.8-43.1174.5-73.8177.8-178.8-179.30111.9N451 Q452 E453 L457 M458 L459N451-K455 WeakPolarHBondContact O-CG 3.35Å; N451-K455 PolarHBondContact O-N 2.88Å; Q452-K455 CarbonylContact O-C 3.57Å; Q452-K455 WeakPolarHBondContact O-CB 3.49Å; Q452-K455 PolarHBondContact O-N 3.41Å; Q452-K455 VanDerWaalsContact O-N 3.11Å; E453-K455 VanDerWaalsContact C-N 3.33Å; E453-K455 PolarHBondContact O-N 2.99Å; K455-L457 VanDerWaalsContact C-N 3.32Å; K455-L457 PolarHBondContact O-N 2.91Å; K455-M458 PolarHBondContact O-N 2.92Å; K455-L459 WeakPolarHBondContact O-CB 3.45Å; K455-L459 WeakPolarHBondContact O-CG 3.38Å; K455-L459 PolarHBondContact O-N 3.49Å
456I93.3Very high90.1Very high86 Ų86102.3 Ų102.344%0.44151%0.512SS..Hα-helixtrans-59.4-45.4176.4-71166.5000109.5Q452 E453 M458 L459 Q460Q452-I456 VanDerWaalsContact O-CG1 3.31Å; Q452-I456 WeakPolarHBondContact O-CG1 3.33Å; Q452-I456 PolarHBondContact O-N 2.82Å; E453-I456 PolarHBondContact O-N 2.89Å; I456-M458 VanDerWaalsContact C-N 3.35Å; I456-M458 PolarHBondContact O-N 3.38Å; I456-L459 CarbonylContact O-C 3.57Å; I456-L459 PolarHBondContact O-N 3.21Å; I456-Q460 HydrophobicContact CG2-CG 4.09Å; I456-Q460 VanDerWaalsContact O-CB 3.3Å; I456-Q460 WeakPolarHBondContact O-CB 3.48Å; I456-Q460 VanDerWaalsContact O-CG 3.25Å; I456-Q460 WeakPolarHBondContact O-CG 3.35Å; I456-Q460 PolarHBondContact O-N 3.26Å
457L93.6Very high88.9Confident97 Ų97101.5 Ų101.551%0.50852%0.518SS..Hα-helixtrans-60.9-41.2176.3-75.9168.7000112.4E453 A454 K455 R461E453-L457 WeakPolarHBondContact O-CB 3.41Å; E453-L457 WeakPolarHBondContact O-CG 3.4Å; E453-L457 PolarHBondContact O-N 2.98Å; A454-L457 PolarHBondContact O-N 3.23Å; K455-L457 VanDerWaalsContact C-N 3.32Å; K455-L457 PolarHBondContact O-N 2.91Å; L457-R461 WeakPolarHBondContact O-CB 3.46Å; L457-R461 WeakPolarHBondContact O-CG 3.28Å; L457-R461 PolarHBondContact O-N 2.94Å
458M91.6Very high87.7Confident136 Ų13697.8 Ų97.867%0.6751%0.509SS*.Hα-helixtrans-64-44.3174.6-71.6-176.5-175.300111.9A454 K455 I456 R461 K462A454-M458 WeakPolarHBondContact O-CG 3.48Å; A454-M458 PolarHBondContact O-N 3.46Å; K455-M458 PolarHBondContact O-N 2.92Å; I456-M458 VanDerWaalsContact C-N 3.35Å; I456-M458 PolarHBondContact O-N 3.38Å; M458-R461 PolarHBondContact O-N 3.22Å; M458-K462 WeakPolarHBondContact O-CB 3.41Å; M458-K462 PolarHBondContact O-N 3.32Å
459L90.3Very high86.1Confident108 Ų10897.1 Ų97.157%0.56552%0.516SS*.Hα-helixtrans-65.9-42.1177.3-71.2173.9000111.3K455 I456 R461 K462 V463K455-L459 WeakPolarHBondContact O-CB 3.45Å; K455-L459 WeakPolarHBondContact O-CG 3.38Å; K455-L459 PolarHBondContact O-N 3.49Å; I456-L459 CarbonylContact O-C 3.57Å; I456-L459 PolarHBondContact O-N 3.21Å; L459-R461 VanDerWaalsContact C-N 3.34Å; L459-R461 PolarHBondContact O-N 3.38Å; L459-K462 CarbonylContact O-C 3.59Å; L459-K462 PolarHBondContact O-N 3.03Å; L459-K462 VanDerWaalsContact O-N 3.15Å; L459-V463 WeakPolarHBondContact O-CB 3.46Å; L459-V463 VanDerWaalsContact O-CG2 3.28Å; L459-V463 WeakPolarHBondContact O-CG2 3.5Å; L459-V463 PolarHBondContact O-N 3.19Å
460Q88.3Confident84.2Confident114 Ų114100.2 Ų100.253%0.53353%0.528SS..Hα-helixtrans-60.6-42.2174.2-77.4175.1-15.900111.3I456 V463 A464I456-Q460 HydrophobicContact CG2-CG 4.09Å; I456-Q460 VanDerWaalsContact O-CB 3.3Å; I456-Q460 WeakPolarHBondContact O-CB 3.48Å; I456-Q460 VanDerWaalsContact O-CG 3.25Å; I456-Q460 WeakPolarHBondContact O-CG 3.35Å; I456-Q460 PolarHBondContact O-N 3.26Å; Q460-V463 PolarHBondContact O-N 3.04Å; Q460-A464 VanDerWaalsContact O-CB 3.29Å; Q460-A464 WeakPolarHBondContact O-CB 3.46Å; Q460-A464 PolarHBondContact O-N 2.99Å
461R85Confident82.4Confident174 Ų174102.5 Ų102.566%0.65753%0.531SS*.Hα-helixtrans-61.8-44.1172.3-77.8179.9-175.2172.72.2111.7L457 M458 L459 A464 Q465L457-R461 WeakPolarHBondContact O-CB 3.46Å; L457-R461 WeakPolarHBondContact O-CG 3.28Å; L457-R461 PolarHBondContact O-N 2.94Å; M458-R461 PolarHBondContact O-N 3.22Å; L459-R461 VanDerWaalsContact C-N 3.34Å; L459-R461 PolarHBondContact O-N 3.38Å; R461-A464 PolarHBondContact O-N 3.41Å; R461-Q465 VanDerWaalsContact O-CG 3.29Å; R461-Q465 WeakPolarHBondContact O-CG 3.47Å; R461-Q465 PolarHBondContact O-N 2.87Å
462K87.1Confident80.8Confident127 Ų127100.8 Ų100.855%0.55253%0.525SS*.Hα-helixtrans-65.6-39.8178.5-169171.4-177.3178.90111.8M458 L459 Q465 L466M458-K462 WeakPolarHBondContact O-CB 3.41Å; M458-K462 PolarHBondContact O-N 3.32Å; L459-K462 CarbonylContact O-C 3.59Å; L459-K462 PolarHBondContact O-N 3.03Å; L459-K462 VanDerWaalsContact O-N 3.15Å; K462-Q465 WeakPolarHBondContact O-CB 2.94Å; K462-Q465 PolarHBondContact O-N 3.46Å; K462-L466 HydrophobicContact CG-CD1 4.24Å; K462-L466 WeakPolarHBondContact O-CB 3.4Å; K462-L466 VanDerWaalsContact O-CG 3.27Å; K462-L466 WeakPolarHBondContact O-CG 3.47Å; K462-L466 PolarHBondContact O-N 3.27Å
463V84.3Confident79.2Confident93 Ų93100.9 Ų100.956%0.56453%0.529SS*.Hα-helixtrans-63.3-46.2172.7169.90000109.9L459 Q460 Q465 L466 S467L459-V463 WeakPolarHBondContact O-CB 3.46Å; L459-V463 VanDerWaalsContact O-CG2 3.28Å; L459-V463 WeakPolarHBondContact O-CG2 3.5Å; L459-V463 PolarHBondContact O-N 3.19Å; Q460-V463 PolarHBondContact O-N 3.04Å; V463-Q465 VanDerWaalsContact C-N 3.28Å; V463-Q465 PolarHBondContact O-N 2.83Å; V463-L466 CarbonylContact O-C 3.58Å; V463-L466 PolarHBondContact O-N 3.15Å; V463-L466 VanDerWaalsContact O-N 3.15Å; V463-S467 VanDerWaalsContact O-CB 3.23Å; V463-S467 WeakPolarHBondContact O-CB 3.28Å; V463-S467 PolarHBondContact O-N 2.96Å; V463-S467 PolarHBondContact O-OG 3.33Å; V463-S467 VanDerWaalsContact O-OG 3.09Å
464A80.3Confident77.6Confident31 Ų31101.5 Ų101.526%0.25653%0.532SS..Hα-helixtrans-60.7-36.3176.200000112.6Q460 R461 S467 G468 A469Q460-A464 VanDerWaalsContact O-CB 3.29Å; Q460-A464 WeakPolarHBondContact O-CB 3.46Å; Q460-A464 PolarHBondContact O-N 2.99Å; R461-A464 PolarHBondContact O-N 3.41Å; A464-S467 WeakPolarHBondContact CA-OG 3.37Å; A464-S467 PolarHBondContact O-OG 3.38Å; A464-G468 PolarHBondContact O-N 3.45Å; A464-A469 HydrophobicContact CB-CB 4.42Å; A464-A469 WeakPolarHBondContact O-CB 3.38Å; A464-A469 PolarHBondContact O-N 2.89Å
465Q77.8Confident76.3Confident118 Ų118102.6 Ų102.655%0.55154%0.537SS*.Hα-helixtrans-65.7-48.5172.2-73.6173.9-1400111.6R461 K462 V463 S467 G468 L470R461-Q465 VanDerWaalsContact O-CG 3.29Å; R461-Q465 WeakPolarHBondContact O-CG 3.47Å; R461-Q465 PolarHBondContact O-N 2.87Å; K462-Q465 WeakPolarHBondContact O-CB 2.94Å; K462-Q465 PolarHBondContact O-N 3.46Å; V463-Q465 VanDerWaalsContact C-N 3.28Å; V463-Q465 PolarHBondContact O-N 2.83Å; Q465-S467 VanDerWaalsContact C-N 3.33Å; Q465-S467 PolarHBondContact O-N 3.41Å; Q465-G468 PolarHBondContact O-N 3.05Å; Q465-L470 HydrophobicContact CB-CD1 4.47Å; Q465-L470 HydrophobicContact CG-CB 4.31Å; Q465-L470 HydrophobicContact CG-CD1 3.37Å; Q465-L470 HydrophobicContact CG-CG 4.47Å
466L77.3Confident75.2Confident141 Ų141101.5 Ų101.574%0.73853%0.534SS*.Hα-helixtrans-68.6-31179.7-70.3171.7000112.7K462 V463 G468K462-L466 HydrophobicContact CG-CD1 4.24Å; K462-L466 WeakPolarHBondContact O-CB 3.4Å; K462-L466 VanDerWaalsContact O-CG 3.27Å; K462-L466 WeakPolarHBondContact O-CG 3.47Å; K462-L466 PolarHBondContact O-N 3.27Å; V463-L466 CarbonylContact O-C 3.58Å; V463-L466 PolarHBondContact O-N 3.15Å; V463-L466 VanDerWaalsContact O-N 3.15Å; L466-G468 PolarHBondContact O-N 3.45Å
467S70Confident74.3Confident84 Ų84104 Ų10459%0.58755%0.545SS*.THydrogen-bonded Turntrans-81.86.6175.875.20000112.8V463 A464 Q465 A469V463-S467 VanDerWaalsContact O-CB 3.23Å; V463-S467 WeakPolarHBondContact O-CB 3.28Å; V463-S467 PolarHBondContact O-N 2.96Å; V463-S467 PolarHBondContact O-OG 3.33Å; V463-S467 VanDerWaalsContact O-OG 3.09Å; A464-S467 WeakPolarHBondContact CA-OG 3.37Å; A464-S467 PolarHBondContact O-OG 3.38Å; Q465-S467 VanDerWaalsContact C-N 3.33Å; Q465-S467 PolarHBondContact O-N 3.41Å; S467-A469 VanDerWaalsContact C-N 3.32Å; S467-A469 PolarHBondContact O-N 3.06Å
468G67.9Low73.5Confident39 Ų39104 Ų10440%0.40255%0.546SS..THydrogen-bonded Turntrans78.82.9173.200000116A464 Q465 L466 L470 R471A464-G468 PolarHBondContact O-N 3.45Å; Q465-G468 PolarHBondContact O-N 3.05Å; L466-G468 PolarHBondContact O-N 3.45Å; G468-L470 PolarHBondContact O-N 3.37Å; G468-L470 VanDerWaalsContact O-N 3.16Å; G468-R471 PolarHBondContact O-N 2.99Å
469A61Low72.9Confident67 Ų67103.3 Ų103.355%0.55454%0.541SS*.THydrogen-bonded Turntrans-70.6-10.7-17600000114.1A464 S467A464-A469 HydrophobicContact CB-CB 4.42Å; A464-A469 WeakPolarHBondContact O-CB 3.38Å; A464-A469 PolarHBondContact O-N 2.89Å; S467-A469 VanDerWaalsContact C-N 3.32Å; S467-A469 PolarHBondContact O-N 3.06Å
470L54.3Low72.5Confident107 Ų107102.5 Ų102.556%0.5654%0.54SS*.THydrogen-bonded Turntrans-109.45177.7-84.1156.9000114.1Q465 G468 T472Q465-L470 HydrophobicContact CB-CD1 4.47Å; Q465-L470 HydrophobicContact CG-CB 4.31Å; Q465-L470 HydrophobicContact CG-CD1 3.37Å; Q465-L470 HydrophobicContact CG-CG 4.47Å; G468-L470 PolarHBondContact O-N 3.37Å; G468-L470 VanDerWaalsContact O-N 3.16Å; L470-T472 VanDerWaalsContact C-N 3.28Å; L470-T472 PolarHBondContact O-N 3.46Å
471R56.8Low72.4Confident126 Ų126101.8 Ų101.848%0.47554%0.535SS..  trans-93.150.6171.2-66.5-174.676.2-144.24.3110.5G468 E474 S475G468-R471 PolarHBondContact O-N 2.99Å; R471-E474 IonicContact CZ-OE2 3.88Å; R471-E474 IonicContact NE-OE2 3.74Å; R471-E474 PolarHBondContact NE-OE2 2.95Å; R471-E474 IonicContact NH2-OE2 3.57Å; R471-E474 PolarHBondContact NH2-OE2 3.39Å; R471-S475 WeakPolarHBondContact O-CB 3.46Å; R471-S475 PolarHBondContact O-N 2.85Å
472T61.2Low72.3Confident75 Ų7597.4 Ų97.446%0.4653%0.528SS..Hα-helixtrans-63.1-46.9175.545.90000110.3L470 E474 S475 E476L470-T472 VanDerWaalsContact C-N 3.28Å; L470-T472 PolarHBondContact O-N 3.46Å; T472-E474 PolarHBondContact O-N 3.43Å; T472-S475 PolarHBondContact O-N 3.47Å; T472-E476 VanDerWaalsContact O-CB 3.27Å; T472-E476 WeakPolarHBondContact O-CB 3.35Å; T472-E476 VanDerWaalsContact O-CG 3.23Å; T472-E476 WeakPolarHBondContact O-CG 3.47Å; T472-E476 PolarHBondContact O-N 3.3Å
473D61.1Low72.3Confident115 Ų11595.9 Ų95.962%0.61553%0.526SS*.Hα-helixtrans-70.8-40.9-173.5-57.56.7000112.1M477D473-M477 VanDerWaalsContact O-CB 3.3Å; D473-M477 WeakPolarHBondContact O-CB 3.4Å; D473-M477 WeakPolarHBondContact O-CG 2.99Å; D473-M477 PolarHBondContact O-N 3.08Å
474E60.6Low72.4Confident109 Ų10995.9 Ų95.951%0.50952%0.519SS..Hα-helixtrans-75.9-31177.6-67.3-176143.700112.2R471 T472 L478R471-E474 IonicContact CZ-OE2 3.88Å; R471-E474 IonicContact NE-OE2 3.74Å; R471-E474 PolarHBondContact NE-OE2 2.95Å; R471-E474 IonicContact NH2-OE2 3.57Å; R471-E474 PolarHBondContact NH2-OE2 3.39Å; T472-E474 PolarHBondContact O-N 3.43Å; E474-L478 WeakPolarHBondContact O-CB 3.44Å; E474-L478 WeakPolarHBondContact O-CD1 3.48Å; E474-L478 WeakPolarHBondContact O-CG 3.4Å; E474-L478 PolarHBondContact O-N 2.89Å
475S65.1Low72.8Confident67 Ų6799.3 Ų99.347%0.46953%0.533SS..Hα-helixtrans-69.5-44.9173.2-172.20000111.1R471 T472 L478 E479R471-S475 WeakPolarHBondContact O-CB 3.46Å; R471-S475 PolarHBondContact O-N 2.85Å; T472-S475 PolarHBondContact O-N 3.47Å; S475-L478 PolarHBondContact O-N 3.25Å; S475-E479 VanDerWaalsContact O-CB 3.3Å; S475-E479 WeakPolarHBondContact O-CB 3.42Å; S475-E479 PolarHBondContact O-N 2.77Å
476E72.3Confident73.1Confident118 Ų11897.2 Ų97.255%0.55153%0.528SS*.Hα-helixtrans-63-42.2176.4-75.7174.3-170.300111.3T472 L478 E479 V480T472-E476 VanDerWaalsContact O-CB 3.27Å; T472-E476 WeakPolarHBondContact O-CB 3.35Å; T472-E476 VanDerWaalsContact O-CG 3.23Å; T472-E476 WeakPolarHBondContact O-CG 3.47Å; T472-E476 PolarHBondContact O-N 3.3Å; E476-L478 PolarHBondContact O-N 3.28Å; E476-E479 PolarHBondContact O-N 3.34Å; E476-V480 VanDerWaalsContact O-CG2 3.3Å; E476-V480 WeakPolarHBondContact O-CG2 3.44Å; E476-V480 PolarHBondContact O-N 2.87Å
477M74.9Confident73.7Confident137 Ų13793 Ų9368%0.67551%0.513SS*.Hα-helixtrans-63.8-39.7175.7-75.4-71.4-70.200112.7D473 K481D473-M477 VanDerWaalsContact O-CB 3.3Å; D473-M477 WeakPolarHBondContact O-CB 3.4Å; D473-M477 WeakPolarHBondContact O-CG 2.99Å; D473-M477 PolarHBondContact O-N 3.08Å; M477-K481 WeakPolarHBondContact O-CB 3.45Å; M477-K481 PolarHBondContact O-N 3.47Å
478L76.2Confident74.6Confident99 Ų9992.6 Ų92.652%0.51851%0.505SS..Hα-helixtrans-69.6-37175.3-73.6170.1000111.5E474 S475 E476 K481 V482E474-L478 WeakPolarHBondContact O-CB 3.44Å; E474-L478 WeakPolarHBondContact O-CD1 3.48Å; E474-L478 WeakPolarHBondContact O-CG 3.4Å; E474-L478 PolarHBondContact O-N 2.89Å; S475-L478 PolarHBondContact O-N 3.25Å; E476-L478 PolarHBondContact O-N 3.28Å; L478-K481 PolarHBondContact O-N 2.87Å; L478-V482 WeakPolarHBondContact O-CB 3.45Å; L478-V482 VanDerWaalsContact O-CG2 3.25Å; L478-V482 WeakPolarHBondContact O-CG2 3.29Å; L478-V482 PolarHBondContact O-N 3.05Å
479E78.6Confident75.5Confident120 Ų12095.3 Ų95.356%0.56151%0.51SS*.Hα-helixtrans-66.8-41.9177-168.3165.2-166.200111.6S475 E476 K481 V482 N483S475-E479 VanDerWaalsContact O-CB 3.3Å; S475-E479 WeakPolarHBondContact O-CB 3.42Å; S475-E479 PolarHBondContact O-N 2.77Å; E476-E479 PolarHBondContact O-N 3.34Å; E479-K481 VanDerWaalsContact C-N 3.33Å; E479-K481 PolarHBondContact O-N 3.02Å; E479-V482 PolarHBondContact O-N 3.06Å; E479-N483 WeakPolarHBondContact O-CB 3.43Å; E479-N483 PolarHBondContact O-N 2.84Å; E479-N483 PolarHBondContact O-ND2 3.23Å
480V83.4Confident76.8Confident92 Ų9296.9 Ų96.956%0.55851%0.506SS*.Hα-helixtrans-59.8-43.7170.2171.70000110.8E476 N483 E484E476-V480 VanDerWaalsContact O-CG2 3.3Å; E476-V480 WeakPolarHBondContact O-CG2 3.44Å; E476-V480 PolarHBondContact O-N 2.87Å; V480-N483 PolarHBondContact O-N 2.92Å; V480-E484 WeakPolarHBondContact O-CB 3.38Å; V480-E484 PolarHBondContact O-N 3.48Å
481K85.9Confident78.4Confident99 Ų9996.6 Ų96.643%0.4351%0.505SS..Hα-helixtrans-67.6-37.4179.4-159.474-162.41610112.7M477 L478 E479 E484 L485M477-K481 WeakPolarHBondContact O-CB 3.45Å; M477-K481 PolarHBondContact O-N 3.47Å; L478-K481 PolarHBondContact O-N 2.87Å; E479-K481 VanDerWaalsContact C-N 3.33Å; E479-K481 PolarHBondContact O-N 3.02Å; K481-E484 IonicContact NZ-OE1 3.04Å; K481-E484 IonicContact NZ-OE2 3.03Å; K481-E484 PolarHBondContact NZ-OE2 3.29Å; K481-E484 PolarHBondContact O-N 3.03Å; K481-L485 HydrophobicContact CG-CD1 4.36Å; K481-L485 WeakPolarHBondContact O-CB 3.49Å; K481-L485 VanDerWaalsContact O-CG 3.27Å; K481-L485 WeakPolarHBondContact O-CG 3.27Å; K481-L485 PolarHBondContact O-N 3.47Å
482V82.1Confident79.9Confident82 Ų8297.5 Ų97.550%0.49751%0.512SS..Hα-helixtrans-63.1-46174167.30000109.9L478 E479 E484 L485 T486L478-V482 WeakPolarHBondContact O-CB 3.45Å; L478-V482 VanDerWaalsContact O-CG2 3.25Å; L478-V482 WeakPolarHBondContact O-CG2 3.29Å; L478-V482 PolarHBondContact O-N 3.05Å; E479-V482 PolarHBondContact O-N 3.06Å; V482-E484 VanDerWaalsContact C-N 3.34Å; V482-E484 PolarHBondContact O-N 3.5Å; V482-L485 PolarHBondContact O-N 3.17Å; V482-T486 HydrophobicContact CG1-CG2 4.32Å; V482-T486 WeakPolarHBondContact O-CG2 3.37Å; V482-T486 PolarHBondContact O-N 3.23Å; V482-T486 PolarHBondContact O-OG1 3.22Å; V482-T486 VanDerWaalsContact O-OG1 3.05Å
483N86.2Confident81.1Confident95 Ų9599 Ų9951%0.50851%0.512SS..Hα-helixtrans-63.5-38178.2-69.8-25.2000112.7E479 V480 T486 A487E479-N483 WeakPolarHBondContact O-CB 3.43Å; E479-N483 PolarHBondContact O-N 2.84Å; E479-N483 PolarHBondContact O-ND2 3.23Å; V480-N483 PolarHBondContact O-N 2.92Å; N483-T486 WeakPolarHBondContact CA-OG1 3.42Å; N483-T486 PolarHBondContact O-OG1 3.3Å; N483-A487 WeakPolarHBondContact O-CB 3.41Å; N483-A487 PolarHBondContact O-N 3.44Å
484E88.3Confident82.4Confident92 Ų9298.1 Ų98.143%0.4351%0.505SS..Hα-helixtrans-67.1-41.5174.8-166.8-169.4171.900111.7V480 K481 V482 N488V480-E484 WeakPolarHBondContact O-CB 3.38Å; V480-E484 PolarHBondContact O-N 3.48Å; K481-E484 IonicContact NZ-OE1 3.04Å; K481-E484 IonicContact NZ-OE2 3.03Å; K481-E484 PolarHBondContact NZ-OE2 3.29Å; K481-E484 PolarHBondContact O-N 3.03Å; V482-E484 VanDerWaalsContact C-N 3.34Å; V482-E484 PolarHBondContact O-N 3.5Å; E484-N488 WeakPolarHBondContact O-CB 3.5Å; E484-N488 PolarHBondContact O-N 3.26Å; E484-N488 PolarHBondContact O-ND2 2.94Å
485L87.4Confident83.6Confident103 Ų10396.1 Ų96.154%0.53950%0.5SS..Hα-helixtrans-71-35.2178.4-73173000112.4K481 V482 L489K481-L485 HydrophobicContact CG-CD1 4.36Å; K481-L485 WeakPolarHBondContact O-CB 3.49Å; K481-L485 VanDerWaalsContact O-CG 3.27Å; K481-L485 WeakPolarHBondContact O-CG 3.27Å; K481-L485 PolarHBondContact O-N 3.47Å; V482-L485 PolarHBondContact O-N 3.17Å; L485-L489 VanDerWaalsContact O-CB 3.31Å; L485-L489 WeakPolarHBondContact O-CB 3.47Å; L485-L489 PolarHBondContact O-N 2.71Å
486T84.9Confident84.6Confident74 Ų7495.6 Ų95.645%0.45450%0.5SS..Hα-helixtrans-69.3-40.7175.551.50000111.6V482 N483 L489 E490V482-T486 HydrophobicContact CG1-CG2 4.32Å; V482-T486 WeakPolarHBondContact O-CG2 3.37Å; V482-T486 PolarHBondContact O-N 3.23Å; V482-T486 PolarHBondContact O-OG1 3.22Å; V482-T486 VanDerWaalsContact O-OG1 3.05Å; N483-T486 WeakPolarHBondContact CA-OG1 3.42Å; N483-T486 PolarHBondContact O-OG1 3.3Å; T486-L489 PolarHBondContact O-N 3.29Å; T486-E490 PolarHBondContact O-N 3.32Å
487A90Very high85.4Confident52 Ų5295.7 Ų95.743%0.4350%0.498SS..Hα-helixtrans-60.6-48.9172.600000111.5N483 L489 E490 D491N483-A487 WeakPolarHBondContact O-CB 3.41Å; N483-A487 PolarHBondContact O-N 3.44Å; A487-L489 VanDerWaalsContact C-N 3.29Å; A487-L489 PolarHBondContact O-N 2.87Å; A487-E490 PolarHBondContact O-N 3.4Å; A487-E490 VanDerWaalsContact O-N 3.14Å; A487-D491 PolarHBondContact O-N 2.94Å
488N87.8Confident86.1Confident76 Ų7694.1 Ų94.141%0.40649%0.491SS..Hα-helixtrans-59.7-38.9175.8-81-52.6000112.5E484 E490 K492E484-N488 WeakPolarHBondContact O-CB 3.5Å; E484-N488 PolarHBondContact O-N 3.26Å; E484-N488 PolarHBondContact O-ND2 2.94Å; N488-E490 VanDerWaalsContact C-N 3.35Å; N488-K492 WeakPolarHBondContact O-CB 3.4Å; N488-K492 VanDerWaalsContact O-CG 3.23Å; N488-K492 WeakPolarHBondContact O-CG 3.4Å; N488-K492 PolarHBondContact O-N 3.16Å
489L87.9Confident86.6Confident97 Ų9795.2 Ų95.251%0.50850%0.497SS..Hα-helixtrans-64.5-41.4177.2-17966.4000111.3L485 T486 A487 K492 K493L485-L489 VanDerWaalsContact O-CB 3.31Å; L485-L489 WeakPolarHBondContact O-CB 3.47Å; L485-L489 PolarHBondContact O-N 2.71Å; T486-L489 PolarHBondContact O-N 3.29Å; A487-L489 VanDerWaalsContact C-N 3.29Å; A487-L489 PolarHBondContact O-N 2.87Å; L489-K492 PolarHBondContact O-N 3.35Å; L489-K493 WeakPolarHBondContact O-CG 3.35Å; L489-K493 PolarHBondContact O-N 2.97Å
490E88.6Confident87.1Confident99 Ų9996.9 Ų96.946%0.46350%0.503SS..Hα-helixtrans-67.8-41.9179.5-155.158.5-150.500111.3T486 A487 N488 K492 K493 E494T486-E490 PolarHBondContact O-N 3.32Å; A487-E490 PolarHBondContact O-N 3.4Å; A487-E490 VanDerWaalsContact O-N 3.14Å; N488-E490 VanDerWaalsContact C-N 3.35Å; E490-K492 VanDerWaalsContact C-N 3.28Å; E490-K492 PolarHBondContact O-N 2.92Å; E490-K493 WeakPolarHBondContact O-CB 3.41Å; E490-K493 PolarHBondContact O-N 3.32Å; E490-K493 VanDerWaalsContact O-N 3.1Å; E490-K493 IonicContact OE2-NZ 3.77Å; E490-K493 PolarHBondContact OE2-NZ 3.15Å; E490-E494 PolarHBondContact O-N 2.91Å
491D87.9Confident87.3Confident102 Ų10296.6 Ų96.655%0.54550%0.498SS..Hα-helixtrans-58.7-40.1171.3-72.1-13.3000111.8A487 E494 T495A487-D491 PolarHBondContact O-N 2.94Å; D491-E494 PolarHBondContact O-N 3.01Å; D491-T495 WeakPolarHBondContact O-CG2 3.3Å; D491-T495 PolarHBondContact O-N 3.47Å; D491-T495 PolarHBondContact O-OG1 2.91Å
492K87.6Confident87.3Confident145 Ų14594.2 Ų94.263%0.6350%0.497SS*.Hα-helixtrans-68.7-34.3175.6-69-60178.4-168.50113N488 L489 E490 T495 A496N488-K492 WeakPolarHBondContact O-CB 3.4Å; N488-K492 VanDerWaalsContact O-CG 3.23Å; N488-K492 WeakPolarHBondContact O-CG 3.4Å; N488-K492 PolarHBondContact O-N 3.16Å; L489-K492 PolarHBondContact O-N 3.35Å; E490-K492 VanDerWaalsContact C-N 3.28Å; E490-K492 PolarHBondContact O-N 2.92Å; K492-T495 VanDerWaalsContact CA-OG1 3.29Å; K492-T495 WeakPolarHBondContact CA-OG1 3.32Å; K492-T495 PolarHBondContact O-OG1 2.95Å; K492-A496 VanDerWaalsContact O-CB 3.23Å; K492-A496 WeakPolarHBondContact O-CB 3.49Å; K492-A496 PolarHBondContact O-N 3.48Å
493K86.4Confident87.4Confident106 Ų10695.1 Ų95.146%0.46150%0.498SS..Hα-helixtrans-67.7-42.4172.8-73.3178.7-164.5155.90111.6L489 E490 A496 K497L489-K493 WeakPolarHBondContact O-CG 3.35Å; L489-K493 PolarHBondContact O-N 2.97Å; E490-K493 WeakPolarHBondContact O-CB 3.41Å; E490-K493 PolarHBondContact O-N 3.32Å; E490-K493 VanDerWaalsContact O-N 3.1Å; E490-K493 IonicContact OE2-NZ 3.77Å; E490-K493 PolarHBondContact OE2-NZ 3.15Å; K493-A496 PolarHBondContact O-N 3.27Å; K493-K497 WeakPolarHBondContact O-CB 3.39Å; K493-K497 PolarHBondContact O-N 2.84Å
494E88.4Confident87.5Confident97 Ų9793 Ų9345%0.45349%0.491SS..Hα-helixtrans-63.7-45.8178.9-158.567.3-149.500110.2E490 D491 A496 K497 I498E490-E494 PolarHBondContact O-N 2.91Å; D491-E494 PolarHBondContact O-N 3.01Å; E494-A496 PolarHBondContact O-N 3.4Å; E494-K497 WeakPolarHBondContact O-CB 3.49Å; E494-K497 PolarHBondContact O-N 3.4Å; E494-I498 WeakPolarHBondContact O-CG1 3.36Å; E494-I498 PolarHBondContact O-N 2.9Å
495T86.4Confident87.5Confident67 Ų6794.5 Ų94.541%0.41150%0.498SS..Hα-helixtrans-63.8-40.2174.851.50000112.7D491 K492 K497 I498 L499D491-T495 WeakPolarHBondContact O-CG2 3.3Å; D491-T495 PolarHBondContact O-N 3.47Å; D491-T495 PolarHBondContact O-OG1 2.91Å; K492-T495 VanDerWaalsContact CA-OG1 3.29Å; K492-T495 WeakPolarHBondContact CA-OG1 3.32Å; K492-T495 PolarHBondContact O-OG1 2.95Å; T495-K497 VanDerWaalsContact C-N 3.31Å; T495-K497 PolarHBondContact O-N 3.17Å; T495-I498 PolarHBondContact O-N 3.39Å; T495-L499 WeakPolarHBondContact O-CB 3.37Å; T495-L499 WeakPolarHBondContact O-CG 3.32Å; T495-L499 PolarHBondContact O-N 3.31Å
496A85.4Confident87.5Confident56 Ų5692.5 Ų92.546%0.46349%0.492SS..Hα-helixtrans-63.3-36.9174.300000112.3K492 K493 E494 L499 K500K492-A496 VanDerWaalsContact O-CB 3.23Å; K492-A496 WeakPolarHBondContact O-CB 3.49Å; K492-A496 PolarHBondContact O-N 3.48Å; K493-A496 PolarHBondContact O-N 3.27Å; E494-A496 PolarHBondContact O-N 3.4Å; A496-L499 PolarHBondContact O-N 3.36Å; A496-K500 VanDerWaalsContact O-CB 3.29Å; A496-K500 WeakPolarHBondContact O-CB 3.41Å; A496-K500 PolarHBondContact O-N 2.94Å
497K89.4Confident87.6Confident120 Ų12093.9 Ų93.952%0.52249%0.493SS..Hα-helixtrans-66-43.8175.2-175.4-177.2175.5-166.80111.4K493 E494 T495 K500 N501K493-K497 WeakPolarHBondContact O-CB 3.39Å; K493-K497 PolarHBondContact O-N 2.84Å; E494-K497 WeakPolarHBondContact O-CB 3.49Å; E494-K497 PolarHBondContact O-N 3.4Å; T495-K497 VanDerWaalsContact C-N 3.31Å; T495-K497 PolarHBondContact O-N 3.17Å; K497-K500 PolarHBondContact O-N 2.98Å; K497-N501 PolarHBondContact O-N 3.3Å; K497-N501 PolarHBondContact O-OD1 3.5Å
498I89.3Confident87.6Confident103 Ų10395.5 Ų95.553%0.52849%0.493SS..Hα-helixtrans-59.5-48.5173.8-66.9165.9000110.4E494 T495 K500 N501 A502E494-I498 WeakPolarHBondContact O-CG1 3.36Å; E494-I498 PolarHBondContact O-N 2.9Å; T495-I498 PolarHBondContact O-N 3.39Å; I498-K500 VanDerWaalsContact C-N 3.33Å; I498-K500 PolarHBondContact O-N 2.95Å; I498-N501 PolarHBondContact O-N 2.88Å; I498-A502 PolarHBondContact O-N 2.96Å
499L86.8Confident87.6Confident122 Ų12296.9 Ų96.964%0.63950%0.501SS*.Hα-helixtrans-63-38.1178.8-72172.9000112.4T495 A496 N501 A502 L503T495-L499 WeakPolarHBondContact O-CB 3.37Å; T495-L499 WeakPolarHBondContact O-CG 3.32Å; T495-L499 PolarHBondContact O-N 3.31Å; A496-L499 PolarHBondContact O-N 3.36Å; L499-N501 VanDerWaalsContact C-N 3.35Å; L499-A502 PolarHBondContact O-N 2.88Å; L499-L503 WeakPolarHBondContact O-CB 3.4Å; L499-L503 PolarHBondContact O-N 2.95Å
500K88.4Confident87.4Confident156 Ų15696.4 Ų96.468%0.67850%0.498SS*.Hα-helixtrans-64-40.6175.7-174177.9-179.6179.30111.8A496 K497 I498 L503 S504A496-K500 VanDerWaalsContact O-CB 3.29Å; A496-K500 WeakPolarHBondContact O-CB 3.41Å; A496-K500 PolarHBondContact O-N 2.94Å; K497-K500 PolarHBondContact O-N 2.98Å; I498-K500 VanDerWaalsContact C-N 3.33Å; I498-K500 PolarHBondContact O-N 2.95Å; K500-L503 PolarHBondContact O-N 3.5Å; K500-S504 PolarHBondContact O-N 2.85Å
501N88.5Confident87.4Confident86 Ų8698.9 Ų98.946%0.4650%0.503SS..Hα-helixtrans-64.8-47.1175.4-69.5-7.7000110.8K497 I498 L499 L503 S504 E505K497-N501 PolarHBondContact O-N 3.3Å; K497-N501 PolarHBondContact O-OD1 3.5Å; I498-N501 PolarHBondContact O-N 2.88Å; L499-N501 VanDerWaalsContact C-N 3.35Å; N501-L503 VanDerWaalsContact C-N 3.3Å; N501-L503 PolarHBondContact O-N 3.42Å; N501-S504 PolarHBondContact O-N 3.23Å; N501-S504 VanDerWaalsContact O-N 3.08Å; N501-S504 PolarHBondContact O-OG 2.86Å; N501-E505 PolarHBondContact O-N 2.98Å
502A84.9Confident87.4Confident49 Ų4997.2 Ų97.241%0.40550%0.499SS..Hα-helixtrans-60.5-37.7176.500000112.6I498 L499 E505 C506I498-A502 PolarHBondContact O-N 2.96Å; L499-A502 PolarHBondContact O-N 2.88Å; A502-E505 PolarHBondContact O-N 2.89Å; A502-C506 WeakPolarHBondContact O-CB 3.47Å; A502-C506 PolarHBondContact O-N 3.27Å
503L85.8Confident87.2Confident101 Ų10192.1 Ų92.153%0.52948%0.484SS..Hα-helixtrans-62.9-44.2173.6-17668.8000111.1L499 K500 N501 E505 C506 E507L499-L503 WeakPolarHBondContact O-CB 3.4Å; L499-L503 PolarHBondContact O-N 2.95Å; K500-L503 PolarHBondContact O-N 3.5Å; N501-L503 VanDerWaalsContact C-N 3.3Å; N501-L503 PolarHBondContact O-N 3.42Å; L503-E505 VanDerWaalsContact C-N 3.33Å; L503-E505 PolarHBondContact O-N 3.07Å; L503-C506 PolarHBondContact O-N 3.2Å; L503-E507 WeakPolarHBondContact O-CG 3.5Å; L503-E507 PolarHBondContact O-N 3.44Å
504S87.8Confident87.1Confident51 Ų5193.1 Ų93.136%0.35749%0.488SS..Hα-helixtrans-65.3-35.3178.6710000113.1K500 N501 E507 I508K500-S504 PolarHBondContact O-N 2.85Å; N501-S504 PolarHBondContact O-N 3.23Å; N501-S504 VanDerWaalsContact O-N 3.08Å; N501-S504 PolarHBondContact O-OG 2.86Å; S504-E507 PolarHBondContact O-N 3.47Å; S504-I508 VanDerWaalsContact O-CG1 3.3Å; S504-I508 WeakPolarHBondContact O-CG1 3.39Å; S504-I508 PolarHBondContact O-N 3.27Å; S504-I508 VanDerWaalsContact O-N 3.12Å
505E88.8Confident87.1Confident123 Ų12395.3 Ų95.358%0.57550%0.496SS*.Hα-helixtrans-65.4-47.8172.1-74.5175.8176.300110.8N501 A502 L503 E507 I508 D509N501-E505 PolarHBondContact O-N 2.98Å; A502-E505 PolarHBondContact O-N 2.89Å; L503-E505 VanDerWaalsContact C-N 3.33Å; L503-E505 PolarHBondContact O-N 3.07Å; E505-E507 VanDerWaalsContact C-N 3.3Å; E505-E507 PolarHBondContact O-N 3.29Å; E505-I508 WeakPolarHBondContact O-CA 3.45Å; E505-I508 WeakPolarHBondContact O-CB 3.38Å; E505-I508 PolarHBondContact O-N 3.34Å; E505-D509 PolarHBondContact O-N 2.94Å
506C86.1Confident87.1Confident61 Ų6198.2 Ų98.241%0.41251%0.505SS..Hα-helixtrans-60.1-38175.9-171.10000112.4A502 L503 I508 D509 I510A502-C506 WeakPolarHBondContact O-CB 3.47Å; A502-C506 PolarHBondContact O-N 3.27Å; L503-C506 PolarHBondContact O-N 3.2Å; C506-I508 VanDerWaalsContact C-N 3.29Å; C506-I508 PolarHBondContact O-N 3.31Å; C506-D509 PolarHBondContact O-N 3.46Å; C506-I510 WeakPolarHBondContact O-CB 3.48Å; C506-I510 VanDerWaalsContact O-CG1 3.26Å; C506-I510 WeakPolarHBondContact O-CG1 3.5Å; C506-I510 PolarHBondContact O-N 3.27Å
507E87.9Confident87Confident102 Ų102100.6 Ų100.648%0.47751%0.508SS..Hα-helixtrans-65.3-30.2173.3-76.3178174.400113.3L503 S504 E505 R511L503-E507 WeakPolarHBondContact O-CG 3.5Å; L503-E507 PolarHBondContact O-N 3.44Å; S504-E507 PolarHBondContact O-N 3.47Å; E505-E507 VanDerWaalsContact C-N 3.3Å; E505-E507 PolarHBondContact O-N 3.29Å; E507-R511 WeakPolarHBondContact O-CB 3.43Å; E507-R511 WeakPolarHBondContact O-CG 3.3Å; E507-R511 PolarHBondContact O-N 3.19Å; E507-R511 PolarHBondContact O-NE 2.95Å; E507-R511 VanDerWaalsContact O-NE 3.17Å
508I89.2Confident86.9Confident86 Ų86100.6 Ų100.644%0.44151%0.51SS..Hα-helixtrans-71.3-46.7171.9-68.3163.5000109.2S504 E505 C506 I510 R511 C512S504-I508 VanDerWaalsContact O-CG1 3.3Å; S504-I508 WeakPolarHBondContact O-CG1 3.39Å; S504-I508 PolarHBondContact O-N 3.27Å; S504-I508 VanDerWaalsContact O-N 3.12Å; E505-I508 WeakPolarHBondContact O-CA 3.45Å; E505-I508 WeakPolarHBondContact O-CB 3.38Å; E505-I508 PolarHBondContact O-N 3.34Å; C506-I508 VanDerWaalsContact C-N 3.29Å; C506-I508 PolarHBondContact O-N 3.31Å; I508-I510 PolarHBondContact O-N 2.95Å; I508-R511 WeakPolarHBondContact O-CA 3.37Å; I508-R511 WeakPolarHBondContact O-CB 3.32Å; I508-R511 PolarHBondContact O-N 2.99Å; I508-R511 VanDerWaalsContact O-N 3.08Å; I508-C512 PolarHBondContact O-N 3.21Å; I508-C512 PolarHBondContact O-SG 3.47Å; I508-C512 VanDerWaalsContact O-SG 3.42Å
509D87.4Confident86.8Confident106 Ų106102.2 Ų102.257%0.56751%0.513SS*.Hα-helixtrans-60.9-44.6179.2-68.1-19.8000111.9E505 C506 R511 C512 A513E505-D509 PolarHBondContact O-N 2.94Å; C506-D509 PolarHBondContact O-N 3.46Å; D509-R511 VanDerWaalsContact C-N 3.29Å; D509-R511 PolarHBondContact O-N 3.3Å; D509-C512 WeakPolarHBondContact O-CB 3.38Å; D509-C512 PolarHBondContact O-N 3.5Å; D509-C512 VanDerWaalsContact O-N 3.16Å; D509-A513 WeakPolarHBondContact O-CB 3.45Å; D509-A513 PolarHBondContact O-N 3.25Å
510I84.7Confident86.7Confident86 Ų86101.4 Ų101.444%0.44151%0.509SS..Hα-helixtrans-59.6-40.4174.1-70.1167.2000110.9C506 I508 K514C506-I510 WeakPolarHBondContact O-CB 3.48Å; C506-I510 VanDerWaalsContact O-CG1 3.26Å; C506-I510 WeakPolarHBondContact O-CG1 3.5Å; C506-I510 PolarHBondContact O-N 3.27Å; I508-I510 PolarHBondContact O-N 2.95Å; I510-K514 HydrophobicContact CG2-CD 4.29Å; I510-K514 WeakPolarHBondContact O-CB 3.31Å; I510-K514 WeakPolarHBondContact O-CG 3.46Å; I510-K514 PolarHBondContact O-N 3.18Å
511R88.7Confident86.5Confident151 Ų15198.5 Ų98.557%0.5750%0.498SS*.Hα-helixtrans-66.2-39.9176.4-85.4-176.2-75.3179.1-5.6112E507 I508 D509 K515E507-R511 WeakPolarHBondContact O-CB 3.43Å; E507-R511 WeakPolarHBondContact O-CG 3.3Å; E507-R511 PolarHBondContact O-N 3.19Å; E507-R511 PolarHBondContact O-NE 2.95Å; E507-R511 VanDerWaalsContact O-NE 3.17Å; I508-R511 WeakPolarHBondContact O-CA 3.37Å; I508-R511 WeakPolarHBondContact O-CB 3.32Å; I508-R511 PolarHBondContact O-N 2.99Å; I508-R511 VanDerWaalsContact O-N 3.08Å; D509-R511 VanDerWaalsContact C-N 3.29Å; D509-R511 PolarHBondContact O-N 3.3Å; R511-K515 PolarHBondContact O-N 2.9Å; R511-K515 VanDerWaalsContact O-N 3.16Å
512C87.1Confident86.3Confident67 Ų6798.1 Ų98.145%0.45350%0.499SS..Hα-helixtrans-62.9-49.5174.5-70.20000111I508 D509 K514 K515 E516I508-C512 PolarHBondContact O-N 3.21Å; I508-C512 PolarHBondContact O-SG 3.47Å; I508-C512 VanDerWaalsContact O-SG 3.42Å; D509-C512 WeakPolarHBondContact O-CB 3.38Å; D509-C512 PolarHBondContact O-N 3.5Å; D509-C512 VanDerWaalsContact O-N 3.16Å; C512-K514 VanDerWaalsContact C-N 3.35Å; C512-K514 PolarHBondContact O-N 3.35Å; C512-K515 WeakPolarHBondContact O-CB 3.31Å; C512-K515 PolarHBondContact O-N 3.37Å; C512-K515 VanDerWaalsContact O-N 3.15Å; C512-E516 PolarHBondContact O-N 3.19Å
513A84.1Confident86.3Confident39 Ų39101.1 Ų101.132%0.32250%0.504SS..Hα-helixtrans-60.1-41177.900000112.5D509 K515 E516 M517D509-A513 WeakPolarHBondContact O-CB 3.45Å; D509-A513 PolarHBondContact O-N 3.25Å; A513-K515 PolarHBondContact O-N 2.85Å; A513-E516 PolarHBondContact O-N 2.85Å; A513-M517 WeakPolarHBondContact O-CB 3.31Å; A513-M517 PolarHBondContact O-N 3.4Å
514K84.9Confident86.3Confident127 Ų127103.2 Ų103.255%0.55251%0.509SS*.Hα-helixtrans-60.7-43.2174.5-80-179.1177.1-178.40112.5I510 C512 E516 M517 E518I510-K514 HydrophobicContact CG2-CD 4.29Å; I510-K514 WeakPolarHBondContact O-CB 3.31Å; I510-K514 WeakPolarHBondContact O-CG 3.46Å; I510-K514 PolarHBondContact O-N 3.18Å; C512-K514 VanDerWaalsContact C-N 3.35Å; C512-K514 PolarHBondContact O-N 3.35Å; K514-E516 VanDerWaalsContact C-N 3.32Å; K514-E516 PolarHBondContact O-N 2.8Å; K514-M517 PolarHBondContact O-N 3.46Å; K514-E518 WeakPolarHBondContact O-CG 3.38Å; K514-E518 PolarHBondContact O-N 3.19Å
515K88Confident86.1Confident143 Ų143106.6 Ų106.662%0.62252%0.517SS*.Hα-helixtrans-63.7-37.7175.8-77.5-177.9177.5-179.90112.2R511 C512 A513 K519R511-K515 PolarHBondContact O-N 2.9Å; R511-K515 VanDerWaalsContact O-N 3.16Å; C512-K515 WeakPolarHBondContact O-CB 3.31Å; C512-K515 PolarHBondContact O-N 3.37Å; C512-K515 VanDerWaalsContact O-N 3.15Å; A513-K515 PolarHBondContact O-N 2.85Å; K515-K519 WeakPolarHBondContact O-CG 3.41Å; K515-K519 PolarHBondContact O-N 3.48Å
516E85.3Confident85.9Confident128 Ų128105 Ų10560%0.59851%0.512SS*.Hα-helixtrans-67.7-42.1174.7-71-173.2161.400111.8C512 A513 K514 E518 K519 L520C512-E516 PolarHBondContact O-N 3.19Å; A513-E516 PolarHBondContact O-N 2.85Å; K514-E516 VanDerWaalsContact C-N 3.32Å; K514-E516 PolarHBondContact O-N 2.8Å; E516-E518 PolarHBondContact O-N 2.98Å; E516-K519 WeakPolarHBondContact O-CB 3.26Å; E516-K519 PolarHBondContact O-N 3Å; E516-L520 WeakPolarHBondContact O-CG 3.29Å; E516-L520 PolarHBondContact O-N 3.48Å
517M84.1Confident85.8Confident105 Ų105107 Ų10752%0.51752%0.518SS..Hα-helixtrans-59.7-45175.2-168-163.678.300111.6A513 K514 K519 L520 E521A513-M517 WeakPolarHBondContact O-CB 3.31Å; A513-M517 PolarHBondContact O-N 3.4Å; K514-M517 PolarHBondContact O-N 3.46Å; M517-K519 VanDerWaalsContact C-N 3.34Å; M517-K519 PolarHBondContact O-N 3.42Å; M517-L520 PolarHBondContact O-N 2.84Å; M517-E521 WeakPolarHBondContact O-CB 3.46Å; M517-E521 PolarHBondContact O-N 3.08Å
518E87.4Confident85.5Confident120 Ų120105.2 Ų105.256%0.56152%0.515SS*.Hα-helixtrans-59.3-43175.5-77.2174.5-176.500111.9K514 E516 E521 T522K514-E518 WeakPolarHBondContact O-CG 3.38Å; K514-E518 PolarHBondContact O-N 3.19Å; E516-E518 PolarHBondContact O-N 2.98Å; E518-E521 PolarHBondContact O-N 3.31Å; E518-T522 WeakPolarHBondContact O-CG2 3.3Å; E518-T522 PolarHBondContact O-N 2.88Å; E518-T522 PolarHBondContact O-OG1 2.99Å
519K87.3Confident85.3Confident138 Ų138107.2 Ų107.260%0.652%0.522SS*.Hα-helixtrans-62.2-42.3175.3-72.1173.6-178.2178.40112.4K515 E516 M517 E521 T522 Q523K515-K519 WeakPolarHBondContact O-CG 3.41Å; K515-K519 PolarHBondContact O-N 3.48Å; E516-K519 WeakPolarHBondContact O-CB 3.26Å; E516-K519 PolarHBondContact O-N 3Å; M517-K519 VanDerWaalsContact C-N 3.34Å; M517-K519 PolarHBondContact O-N 3.42Å; K519-E521 VanDerWaalsContact C-N 3.32Å; K519-T522 WeakPolarHBondContact CA-OG1 3.4Å; K519-T522 PolarHBondContact O-N 2.87Å; K519-T522 PolarHBondContact O-OG1 3.21Å; K519-Q523 WeakPolarHBondContact O-CG 3.41Å; K519-Q523 PolarHBondContact O-N 2.99Å
520L84.2Confident85.1Confident105 Ų105107.8 Ų107.855%0.5552%0.522SS..Hα-helixtrans-67.6-35.8176.8-71.2172.9000111.2E516 M517 Q523 K524E516-L520 WeakPolarHBondContact O-CG 3.29Å; E516-L520 PolarHBondContact O-N 3.48Å; M517-L520 PolarHBondContact O-N 2.84Å; L520-Q523 PolarHBondContact O-N 3.27Å; L520-K524 WeakPolarHBondContact O-CB 3.34Å; L520-K524 PolarHBondContact O-N 3.42Å
521E83.4Confident84.9Confident95 Ų95107.1 Ų107.144%0.44452%0.521SS..Hα-helixtrans-69.2-37.4177.3-165169.8-170.900111.9M517 E518 K519 K524 K525M517-E521 WeakPolarHBondContact O-CB 3.46Å; M517-E521 PolarHBondContact O-N 3.08Å; E518-E521 PolarHBondContact O-N 3.31Å; K519-E521 VanDerWaalsContact C-N 3.32Å; E521-K524 PolarHBondContact O-N 3.48Å; E521-K525 WeakPolarHBondContact O-CG 3.4Å; E521-K525 PolarHBondContact O-N 3.25Å
522T85.1Confident84.6Confident78 Ų78104.1 Ų104.148%0.47952%0.517SS..Hα-helixtrans-63.4-45170.252.90000111.5E518 K519 K524 K525 D526E518-T522 WeakPolarHBondContact O-CG2 3.3Å; E518-T522 PolarHBondContact O-N 2.88Å; E518-T522 PolarHBondContact O-OG1 2.99Å; K519-T522 WeakPolarHBondContact CA-OG1 3.4Å; K519-T522 PolarHBondContact O-N 2.87Å; K519-T522 PolarHBondContact O-OG1 3.21Å; T522-K524 VanDerWaalsContact C-N 3.31Å; T522-K524 PolarHBondContact O-N 2.96Å; T522-K525 PolarHBondContact O-N 3.25Å; T522-D526 PolarHBondContact O-N 2.88Å
523Q85.8Confident84.3Confident111 Ų111104.8 Ų104.852%0.51952%0.521SS..Hα-helixtrans-61.2-40.1176-73.5176.1-1.600112.2K519 L520 D526 L527K519-Q523 WeakPolarHBondContact O-CG 3.41Å; K519-Q523 PolarHBondContact O-N 2.99Å; L520-Q523 PolarHBondContact O-N 3.27Å; Q523-D526 PolarHBondContact O-N 2.93Å; Q523-L527 WeakPolarHBondContact O-CG 3.29Å; Q523-L527 PolarHBondContact O-N 2.86Å
524K84.5Confident84.1Confident145 Ų145108 Ų10863%0.6353%0.533SS*.Hα-helixtrans-62.2-43.5175.5-177.6-174.9173.8-174.70111.3L520 E521 T522 L527 T528L520-K524 WeakPolarHBondContact O-CB 3.34Å; L520-K524 PolarHBondContact O-N 3.42Å; E521-K524 PolarHBondContact O-N 3.48Å; T522-K524 VanDerWaalsContact C-N 3.31Å; T522-K524 PolarHBondContact O-N 2.96Å; K524-L527 PolarHBondContact O-N 3.46Å; K524-T528 WeakPolarHBondContact O-CB 3.42Å; K524-T528 PolarHBondContact O-N 3.44Å; K524-T528 PolarHBondContact O-OG1 2.9Å
525K84.5Confident83.9Confident123 Ų123106.5 Ų106.554%0.53553%0.53SS..Hα-helixtrans-61.1-47.5176.5-75174.9-176.9172.80111.2E521 T522 L527 T528 E529E521-K525 WeakPolarHBondContact O-CG 3.4Å; E521-K525 PolarHBondContact O-N 3.25Å; T522-K525 PolarHBondContact O-N 3.25Å; K525-L527 VanDerWaalsContact C-N 3.33Å; K525-L527 PolarHBondContact O-N 3.26Å; K525-T528 WeakPolarHBondContact O-CB 3.42Å; K525-T528 PolarHBondContact O-N 2.88Å; K525-E529 PolarHBondContact O-N 2.9Å
526D84.4Confident83.6Confident88 Ų88103.8 Ų103.847%0.47153%0.525SS..Hα-helixtrans-58-44.4177.2-64.9-14.9000111.8T522 Q523 T528 E529 Q530T522-D526 PolarHBondContact O-N 2.88Å; Q523-D526 PolarHBondContact O-N 2.93Å; D526-T528 VanDerWaalsContact C-N 3.34Å; D526-E529 PolarHBondContact O-N 3.27Å; D526-Q530 WeakPolarHBondContact O-CG 3.48Å; D526-Q530 PolarHBondContact O-N 3.49Å
527L83.8Confident83.3Confident103 Ų103102.4 Ų102.454%0.53952%0.521SS..Hα-helixtrans-65.4-37175.6-73.9171.1000112.3Q523 K524 K525 Q530 V531Q523-L527 WeakPolarHBondContact O-CG 3.29Å; Q523-L527 PolarHBondContact O-N 2.86Å; K524-L527 PolarHBondContact O-N 3.46Å; K525-L527 VanDerWaalsContact C-N 3.33Å; K525-L527 PolarHBondContact O-N 3.26Å; L527-Q530 WeakPolarHBondContact O-CB 3.45Å; L527-Q530 PolarHBondContact O-N 2.98Å; L527-V531 WeakPolarHBondContact O-CG2 3.31Å; L527-V531 PolarHBondContact O-N 3.28Å
528T82.4Confident82.9Confident66 Ų66100.9 Ų100.941%0.40552%0.52SS..Hα-helixtrans-66.8-42.9177.9-50.40000110.5K524 K525 D526 Q530 V531 D532K524-T528 WeakPolarHBondContact O-CB 3.42Å; K524-T528 PolarHBondContact O-N 3.44Å; K524-T528 PolarHBondContact O-OG1 2.9Å; K525-T528 WeakPolarHBondContact O-CB 3.42Å; K525-T528 PolarHBondContact O-N 2.88Å; D526-T528 VanDerWaalsContact C-N 3.34Å; T528-Q530 VanDerWaalsContact C-N 3.31Å; T528-Q530 PolarHBondContact O-N 2.76Å; T528-V531 PolarHBondContact O-N 3.28Å; T528-V531 VanDerWaalsContact O-N 3.15Å; T528-D532 PolarHBondContact O-N 2.81Å
529E83.7Confident82.6Confident127 Ų12798.2 Ų98.259%0.59351%0.512SS*.Hα-helixtrans-61.7-38.1173.9-73.6-179.4-178.200112.2K525 D526 D532 C533K525-E529 PolarHBondContact O-N 2.9Å; D526-E529 PolarHBondContact O-N 3.27Å; E529-D532 PolarHBondContact O-N 3.39Å; E529-C533 WeakPolarHBondContact O-CB 3.41Å; E529-C533 PolarHBondContact O-N 2.87Å; E529-C533 PolarHBondContact O-SG 3.47Å
530Q84.3Confident82.3Confident119 Ų11995.6 Ų95.656%0.55650%0.504SS*.Hα-helixtrans-63.5-42.9172.8-72.9176.129.600112D526 L527 T528 C533 L534D526-Q530 WeakPolarHBondContact O-CG 3.48Å; D526-Q530 PolarHBondContact O-N 3.49Å; L527-Q530 WeakPolarHBondContact O-CB 3.45Å; L527-Q530 PolarHBondContact O-N 2.98Å; T528-Q530 VanDerWaalsContact C-N 3.31Å; T528-Q530 PolarHBondContact O-N 2.76Å; Q530-C533 WeakPolarHBondContact O-CB 3.35Å; Q530-C533 PolarHBondContact O-N 2.79Å; Q530-L534 WeakPolarHBondContact O-CG 3.43Å; Q530-L534 PolarHBondContact O-N 2.96Å
531V80.4Confident82Confident71 Ų7197.8 Ų97.843%0.4351%0.51SS..Hα-helixtrans-63.5-43.7176169.30000111.2L527 T528 C533 L534 L535L527-V531 WeakPolarHBondContact O-CG2 3.31Å; L527-V531 PolarHBondContact O-N 3.28Å; T528-V531 PolarHBondContact O-N 3.28Å; T528-V531 VanDerWaalsContact O-N 3.15Å; V531-C533 VanDerWaalsContact C-N 3.33Å; V531-C533 PolarHBondContact O-N 2.88Å; V531-L534 WeakPolarHBondContact O-CB 3.24Å; V531-L534 PolarHBondContact O-N 3.38Å; V531-L535 HydrophobicContact CG1-CD1 4.04Å; V531-L535 PolarHBondContact O-N 3.48Å
532D81.4Confident81.7Confident89 Ų8999 Ų9948%0.47652%0.515SS..Hα-helixtrans-63.3-40.3177.1-75.5-20.2000111.5T528 E529 L534 L535 V536T528-D532 PolarHBondContact O-N 2.81Å; E529-D532 PolarHBondContact O-N 3.39Å; D532-L534 VanDerWaalsContact C-N 3.35Å; D532-L534 PolarHBondContact O-N 3.45Å; D532-L535 WeakPolarHBondContact O-CB 3.26Å; D532-L535 PolarHBondContact O-N 3.34Å; D532-V536 WeakPolarHBondContact O-CG2 3.48Å; D532-V536 PolarHBondContact O-N 3.18Å
533C80.7Confident81.3Confident81 Ų81101.3 Ų101.355%0.54752%0.518SS..Hα-helixtrans-60.6-42.8172.9-75.60000111.9E529 Q530 V531 V536 L537E529-C533 WeakPolarHBondContact O-CB 3.41Å; E529-C533 PolarHBondContact O-N 2.87Å; E529-C533 PolarHBondContact O-SG 3.47Å; Q530-C533 WeakPolarHBondContact O-CB 3.35Å; Q530-C533 PolarHBondContact O-N 2.79Å; V531-C533 VanDerWaalsContact C-N 3.33Å; V531-C533 PolarHBondContact O-N 2.88Å; C533-V536 PolarHBondContact O-N 3.44Å; C533-L537 WeakPolarHBondContact O-CG 3.47Å; C533-L537 PolarHBondContact O-N 2.79Å
534L79.9Confident80.7Confident107 Ų107101 Ų10156%0.5652%0.517SS*.Hα-helixtrans-65.4-40.2174.8-72.3171.4000112.1Q530 V531 D532 V536 L537 C538Q530-L534 WeakPolarHBondContact O-CG 3.43Å; Q530-L534 PolarHBondContact O-N 2.96Å; V531-L534 WeakPolarHBondContact O-CB 3.24Å; V531-L534 PolarHBondContact O-N 3.38Å; D532-L534 VanDerWaalsContact C-N 3.35Å; D532-L534 PolarHBondContact O-N 3.45Å; L534-V536 PolarHBondContact O-N 2.81Å; L534-L537 HydrophobicContact CD2-CD1 4.39Å; L534-L537 WeakPolarHBondContact O-CB 3.28Å; L534-L537 PolarHBondContact O-N 2.78Å; L534-C538 PolarHBondContact O-N 2.9Å; L534-C538 PolarHBondContact O-SG 2.99Å
535L81.1Confident80.1Confident94 Ų9497.5 Ų97.549%0.49251%0.505SS..Hα-helixtrans-60.4-44.7174.9-89.8159.7000111.7V531 D532 L537 C538 V539V531-L535 HydrophobicContact CG1-CD1 4.04Å; V531-L535 PolarHBondContact O-N 3.48Å; D532-L535 WeakPolarHBondContact O-CB 3.26Å; D532-L535 PolarHBondContact O-N 3.34Å; L535-L537 VanDerWaalsContact C-N 3.33Å; L535-L537 PolarHBondContact O-N 3.14Å; L535-C538 WeakPolarHBondContact O-CB 3.17Å; L535-C538 PolarHBondContact O-N 3.3Å; L535-V539 WeakPolarHBondContact O-CG2 3.41Å; L535-V539 PolarHBondContact O-N 3Å
536V82.1Confident79.6Confident86 Ų8698.3 Ų98.352%0.52151%0.509SS..Hα-helixtrans-62.4-41.7175.4171.50000111.1D532 C533 L534 V539 N540D532-V536 WeakPolarHBondContact O-CG2 3.48Å; D532-V536 PolarHBondContact O-N 3.18Å; C533-V536 PolarHBondContact O-N 3.44Å; L534-V536 PolarHBondContact O-N 2.81Å; V536-V539 PolarHBondContact O-N 2.89Å; V536-N540 WeakPolarHBondContact O-CB 3.48Å; V536-N540 PolarHBondContact O-N 3.21Å
537L78.8Confident79Confident99 Ų99100.5 Ų100.552%0.51851%0.514SS..Hα-helixtrans-60.4-45.5173.8-74.5169.2000111.4C533 L534 L535 N540 K541C533-L537 WeakPolarHBondContact O-CG 3.47Å; C533-L537 PolarHBondContact O-N 2.79Å; L534-L537 HydrophobicContact CD2-CD1 4.39Å; L534-L537 WeakPolarHBondContact O-CB 3.28Å; L534-L537 PolarHBondContact O-N 2.78Å; L535-L537 VanDerWaalsContact C-N 3.33Å; L535-L537 PolarHBondContact O-N 3.14Å; L537-N540 PolarHBondContact O-N 3.41Å; L537-K541 VanDerWaalsContact O-CG 3.28Å; L537-K541 WeakPolarHBondContact O-CG 3.41Å; L537-K541 PolarHBondContact O-N 3.38Å
538C76.8Confident78.1Confident73 Ų73101.1 Ų101.149%0.49352%0.517SS..Hα-helixtrans-59.2-48.3175.6-71.80000111.7L534 L535 N540 K541 E542L534-C538 PolarHBondContact O-N 2.9Å; L534-C538 PolarHBondContact O-SG 2.99Å; L535-C538 WeakPolarHBondContact O-CB 3.17Å; L535-C538 PolarHBondContact O-N 3.3Å; C538-N540 VanDerWaalsContact C-N 3.33Å; C538-N540 PolarHBondContact O-N 2.91Å; C538-K541 PolarHBondContact O-N 2.88Å; C538-K541 VanDerWaalsContact O-N 3.17Å; C538-E542 WeakPolarHBondContact O-CG 3.41Å; C538-E542 PolarHBondContact O-N 3.15Å
539V80.9Confident77.2Confident64 Ų64104.6 Ų104.639%0.38853%0.526SS..Hα-helixtrans-61.9-40177.8170.80000111.6L535 V536 E542 K543L535-V539 WeakPolarHBondContact O-CG2 3.41Å; L535-V539 PolarHBondContact O-N 3Å; V536-V539 PolarHBondContact O-N 2.89Å; V539-E542 PolarHBondContact O-N 2.9Å; V539-K543 HydrophobicContact CG1-CD 4.43Å; V539-K543 WeakPolarHBondContact O-CG 3.37Å; V539-K543 PolarHBondContact O-N 3.32Å
540N79.4Confident76.2Confident83 Ų83103.9 Ų103.944%0.44453%0.526SS..Hα-helixtrans-64.4-42.8175.2-81.8-16.4000111.5V536 L537 C538 K543 E544V536-N540 WeakPolarHBondContact O-CB 3.48Å; V536-N540 PolarHBondContact O-N 3.21Å; L537-N540 PolarHBondContact O-N 3.41Å; C538-N540 VanDerWaalsContact C-N 3.33Å; C538-N540 PolarHBondContact O-N 2.91Å; N540-K543 PolarHBondContact O-N 3.31Å; N540-E544 WeakPolarHBondContact O-CG 3.41Å; N540-E544 PolarHBondContact O-N 2.81Å
541K78.8Confident75Confident152 Ų152106 Ų10666%0.66153%0.534SS*.Hα-helixtrans-64.1-39.3175.1-68.4-68.9-178.3176.10112L537 C538 E544 L545L537-K541 VanDerWaalsContact O-CG 3.28Å; L537-K541 WeakPolarHBondContact O-CG 3.41Å; L537-K541 PolarHBondContact O-N 3.38Å; C538-K541 PolarHBondContact O-N 2.88Å; C538-K541 VanDerWaalsContact O-N 3.17Å; K541-E544 WeakPolarHBondContact O-CB 3.23Å; K541-E544 PolarHBondContact O-N 3.5Å; K541-L545 WeakPolarHBondContact O-CB 3.44Å; K541-L545 PolarHBondContact O-N 3.4Å
542E76.3Confident73.8Confident121 Ų121109.5 Ų109.557%0.56554%0.543SS*.Hα-helixtrans-64.4-39.8173.5-75.9-173.1167.400113C538 V539 L545 K546C538-E542 WeakPolarHBondContact O-CG 3.41Å; C538-E542 PolarHBondContact O-N 3.15Å; V539-E542 PolarHBondContact O-N 2.9Å; E542-L545 WeakPolarHBondContact O-CB 3.45Å; E542-L545 PolarHBondContact O-N 2.91Å; E542-K546 PolarHBondContact O-N 2.95Å
543K76.9Confident72.5Confident125 Ų125113.2 Ų113.254%0.54356%0.558SS.*Hα-helixtrans-64.3-43175-77.3177.3-178.2173.90111.8V539 N540 L545 K546 K547V539-K543 HydrophobicContact CG1-CD 4.43Å; V539-K543 WeakPolarHBondContact O-CG 3.37Å; V539-K543 PolarHBondContact O-N 3.32Å; N540-K543 PolarHBondContact O-N 3.31Å; K543-L545 VanDerWaalsContact C-N 3.3Å; K543-L545 PolarHBondContact O-N 3.17Å; K543-K546 PolarHBondContact O-N 3.31Å; K543-K547 PolarHBondContact O-N 3.48Å
544E73.9Confident71.1Confident105 Ų105115.7 Ų115.749%0.49157%0.57SS.*Hα-helixtrans-57.8-44171.8-75.3-77116.300111N540 K541 K546 K547 L548N540-E544 WeakPolarHBondContact O-CG 3.41Å; N540-E544 PolarHBondContact O-N 2.81Å; K541-E544 WeakPolarHBondContact O-CB 3.23Å; K541-E544 PolarHBondContact O-N 3.5Å; E544-K546 PolarHBondContact O-N 3.47Å; E544-K547 WeakPolarHBondContact O-CB 3.43Å; E544-K547 PolarHBondContact O-N 3.36Å; E544-K547 IonicContact OE1-NZ 3.73Å; E544-L548 PolarHBondContact O-N 3.48Å
545L71.8Confident69.3Low72 Ų72114.4 Ų114.438%0.37757%0.57SS.*Hα-helixtrans-65.3-37.8178.5-151.7147.8000112.1K541 E542 K543 L548 K549K541-L545 WeakPolarHBondContact O-CB 3.44Å; K541-L545 PolarHBondContact O-N 3.4Å; E542-L545 WeakPolarHBondContact O-CB 3.45Å; E542-L545 PolarHBondContact O-N 2.91Å; K543-L545 VanDerWaalsContact C-N 3.3Å; K543-L545 PolarHBondContact O-N 3.17Å; L545-L548 PolarHBondContact O-N 3.45Å; L545-K549 HydrophobicContact CD2-CD 4.12Å; L545-K549 WeakPolarHBondContact O-CG 3.34Å; L545-K549 PolarHBondContact O-N 2.86Å
546K73.9Confident67.6Low140 Ų140113.8 Ų113.861%0.60959%0.586SS**Hα-helixtrans-66.5-40.2171.8-78.8179.9179.71720112.6E542 K543 E544 K549 L550E542-K546 PolarHBondContact O-N 2.95Å; K543-K546 PolarHBondContact O-N 3.31Å; E544-K546 PolarHBondContact O-N 3.47Å; K546-K549 PolarHBondContact O-N 3.13Å; K546-L550 PolarHBondContact O-N 3.43Å
547K72.2Confident65.7Low134 Ų134115 Ų11558%0.58359%0.593SS**Hα-helixtrans-61.7-42.7173.8-75.2179.1-175.6170.80111.8K543 E544 K549 L550 K551K543-K547 PolarHBondContact O-N 3.48Å; E544-K547 WeakPolarHBondContact O-CB 3.43Å; E544-K547 PolarHBondContact O-N 3.36Å; E544-K547 IonicContact OE1-NZ 3.73Å; K547-K549 VanDerWaalsContact C-N 3.34Å; K547-L550 PolarHBondContact O-N 2.86Å; K547-K551 PolarHBondContact O-N 2.84Å
548L64.4Low64Low115 Ų115116.4 Ų116.460%0.60261%0.608SS**Hα-helixtrans-62.4-40.5175-76.3166.7000111.8E544 L545 K551 K552E544-L548 PolarHBondContact O-N 3.48Å; L545-L548 PolarHBondContact O-N 3.45Å; L548-K551 PolarHBondContact O-N 3.15Å; L548-K552 PolarHBondContact O-N 3.32Å
549K64.1Low62.2Low139 Ų139121 Ų12160%0.60462%0.62SS**Hα-helixtrans-64.3-38.6174.2-76.5179.5175.8177.60113L545 K546 K547 K552 Q553L545-K549 HydrophobicContact CD2-CD 4.12Å; L545-K549 WeakPolarHBondContact O-CG 3.34Å; L545-K549 PolarHBondContact O-N 2.86Å; K546-K549 PolarHBondContact O-N 3.13Å; K547-K549 VanDerWaalsContact C-N 3.34Å; K549-K552 WeakPolarHBondContact O-CB 3.4Å; K549-K552 PolarHBondContact O-N 2.87Å; K549-Q553 PolarHBondContact O-N 3.45Å
550L62.4Low60.7Low112 Ų112125.7 Ų125.759%0.58664%0.638SS**Hα-helixtrans-70-38.1176.6-89.7152.8000112.8K546 K547 K552 Q553K546-L550 PolarHBondContact O-N 3.43Å; K547-L550 PolarHBondContact O-N 2.86Å; L550-K552 PolarHBondContact O-N 3.42Å; L550-Q553 PolarHBondContact O-N 3.25Å
551K59.5Low59.1Low164 Ų164127.7 Ų127.771%0.71365%0.647SS**Hα-helixtrans-58.8-34.3170-98.9-177.81751800112.1K547 L548 Q553K547-K551 PolarHBondContact O-N 2.84Å; L548-K551 PolarHBondContact O-N 3.15Å; K551-Q553 VanDerWaalsContact C-N 3.34Å; K551-Q553 PolarHBondContact O-N 2.89Å
552K54.8Low58.1Low145 Ų145124 Ų12463%0.6364%0.638SS**Hα-helixtrans-67.6-27.8177.8-163.1178.1-179.3177.50113.8L548 K549 L550L548-K552 PolarHBondContact O-N 3.32Å; K549-K552 WeakPolarHBondContact O-CB 3.4Å; K549-K552 PolarHBondContact O-N 2.87Å; L550-K552 PolarHBondContact O-N 3.42Å
553Q53.4Low57.2Low167 Ų167126.6 Ų126.678%0.7865%0.653SS**Hα-helixtrans-83.8-17.3-179.9-96.8178.9-6.400114.3K549 L550 K551K549-Q553 PolarHBondContact O-N 3.45Å; L550-Q553 PolarHBondContact O-N 3.25Å; K551-Q553 VanDerWaalsContact C-N 3.34Å; K551-Q553 PolarHBondContact O-N 2.89Å
554V51Low56.4Low132 Ų132127.7 Ų127.780%0.866%0.66SS**Hα-helixtrans-96.8-15.8-174.7179.60000113.5
555S43.3Very low55.7Low81 Ų81126.8 Ų126.857%0.56666%0.658SS**SBendtrans-1139.9-171.288.50000117.4V557S555-V557 WeakPolarHBondContact O-CG2 3.5Å; S555-V557 PolarHBondContact O-N 2.87Å
556G45.2Very low55.5Low80 Ų80129.4 Ų129.483%0.82567%0.672SS**  trans46.228.216000000119.1
557V41.5Very low55.3Low112 Ų112128.6 Ų128.668%0.67967%0.671SS**SBendtrans-133.8135.5179.2178.60000108.5S555 F559S555-V557 WeakPolarHBondContact O-CG2 3.5Å; S555-V557 PolarHBondContact O-N 2.87Å; V557-F559 PolarHBondContact O-N 2.79Å
558P43.4Very low55.1Low128 Ų128127.2 Ų127.283%0.83167%0.666SS**  trans-73.11201798.15.8000109.6
559F38Very low55.3Low170 Ų170126.7 Ų126.775%0.74666%0.664SS**  trans-124.6134169.3-158.6-98.2000110.2V557V557-F559 PolarHBondContact O-N 2.79Å
560Q50.6Low55.8Low162 Ų162123.4 Ų123.476%0.75766%0.658SS**PPolyproline II helixtrans-48.4140.7177.6-100.6112.6-17.100112.3P562Q560-P562 VanDerWaalsContact O-CD 3.29Å; Q560-P562 WeakPolarHBondContact O-CD 3.37Å
561I46.3Very low56.4Low126 Ų126122.8 Ų122.865%0.64665%0.651SS**PPolyproline II helixtrans-65.9119164.3-60.9171.5000106.9L565I561-L565 HydrophobicContact CG2-CB 4.49Å; I561-L565 HydrophobicContact CG2-CD2 4.42Å
562P57.2Low57.2Low73 Ų73119.5 Ų119.547%0.47464%0.644SS.*PPolyproline II helixtrans-69.7142-179.6-17.531.6000111.7Q560 E564 L565Q560-P562 VanDerWaalsContact O-CD 3.29Å; Q560-P562 WeakPolarHBondContact O-CD 3.37Å; P562-E564 PolarHBondContact O-N 2.86Å; P562-L565 PolarHBondContact O-N 3.33Å
563M57.9Low58.2Low177 Ų177117.3 Ų117.387%0.87264%0.636SS**THydrogen-bonded Turntrans-53.1-23.8179.6-154164.5175.700113.6L565 N566 E567M563-L565 VanDerWaalsContact C-N 3.32Å; M563-L565 PolarHBondContact O-N 3.41Å; M563-N566 PolarHBondContact O-N 3.07Å; M563-E567 PolarHBondContact O-N 2.95Å
564E59.8Low59.2Low148 Ų148115 Ų11569%0.69263%0.627SS**Hα-helixtrans-63.5-29.4175.8-70.5172.2154.500113.7P562 E568P562-E564 PolarHBondContact O-N 2.86Å; E564-E568 WeakPolarHBondContact O-CG 3.27Å; E564-E568 PolarHBondContact O-N 3.39Å
565L59.6Low60.4Low86 Ų86113.2 Ų113.245%0.4562%0.616SS.*Hα-helixtrans-74.6-28.3179.8-153.481.6000112.2I561 P562 M563 L569I561-L565 HydrophobicContact CG2-CB 4.49Å; I561-L565 HydrophobicContact CG2-CD2 4.42Å; P562-L565 PolarHBondContact O-N 3.33Å; M563-L565 VanDerWaalsContact C-N 3.32Å; M563-L565 PolarHBondContact O-N 3.41Å; L565-L569 PolarHBondContact O-N 3.28Å
566N67.3Low61.9Low126 Ų126114.7 Ų114.767%0.67461%0.612SS**Hα-helixtrans-77.8-32.4177.5-162.951.9000111.6M563 S570M563-N566 PolarHBondContact O-N 3.07Å; N566-S570 PolarHBondContact O-N 2.84Å; N566-S570 VanDerWaalsContact O-N 3.14Å
567E68.7Low63.3Low123 Ų123114.9 Ų114.958%0.57560%0.595SS**Hα-helixtrans-72.1-39176.8-157.8175-172.100111.8M563 S570 K571M563-E567 PolarHBondContact O-N 2.95Å; E567-S570 PolarHBondContact O-N 2.88Å; E567-K571 WeakPolarHBondContact O-CG 3.29Å; E567-K571 PolarHBondContact O-N 3.33Å; E567-K571 VanDerWaalsContact O-N 3.1Å
568E68.8Low64.8Low105 Ų105118.7 Ų118.749%0.49160%0.597SS.*Hα-helixtrans-67.7-37.5174.5-73.5-70.8121.600112.5E564 K571 V572E564-E568 WeakPolarHBondContact O-CG 3.27Å; E564-E568 PolarHBondContact O-N 3.39Å; E568-K571 PolarHBondContact O-N 2.95Å; E568-K571 IonicContact OE1-NZ 2.66Å; E568-K571 PolarHBondContact OE1-NZ 2.85Å; E568-V572 WeakPolarHBondContact O-CG2 3.45Å; E568-V572 PolarHBondContact O-N 2.83Å
569L69.6Low66Low104 Ų104118.6 Ų118.655%0.54558%0.583SS.*Hα-helixtrans-63.8-40.5173.3-106.4140.9000112.1L565 K571 V572 E573L565-L569 PolarHBondContact O-N 3.28Å; L569-K571 VanDerWaalsContact C-N 3.31Å; L569-K571 PolarHBondContact O-N 3.35Å; L569-V572 PolarHBondContact O-N 3.45Å; L569-E573 PolarHBondContact O-N 3.39Å
570S73.9Confident67.6Low70 Ų70115.3 Ų115.349%0.4957%0.57SS.*Hα-helixtrans-66.3-31.4175.6-169.50000112.9N566 E567 M574N566-S570 PolarHBondContact O-N 2.84Å; N566-S570 VanDerWaalsContact O-N 3.14Å; E567-S570 PolarHBondContact O-N 2.88Å; S570-M574 PolarHBondContact O-N 3.41Å; S570-M574 VanDerWaalsContact O-N 3.15Å
571K74.8Confident68.5Low99 Ų99113.1 Ų113.143%0.4356%0.563SS.*Hα-helixtrans-70.5-40.7173.6-71.7174.6-165.9163.90111.8E567 E568 L569 M574 V575E567-K571 WeakPolarHBondContact O-CG 3.29Å; E567-K571 PolarHBondContact O-N 3.33Å; E567-K571 VanDerWaalsContact O-N 3.1Å; E568-K571 PolarHBondContact O-N 2.95Å; E568-K571 IonicContact OE1-NZ 2.66Å; E568-K571 PolarHBondContact OE1-NZ 2.85Å; L569-K571 VanDerWaalsContact C-N 3.31Å; L569-K571 PolarHBondContact O-N 3.35Å; K571-M574 PolarHBondContact O-N 2.85Å; K571-V575 WeakPolarHBondContact O-CG2 3.49Å; K571-V575 PolarHBondContact O-N 3.23Å
572V76.5Confident69.3Low96 Ų96112 Ų11258%0.58256%0.556SS**Hα-helixtrans-63.4-42.6176172.80000111.1E568 L569 M574 V575 K576E568-V572 WeakPolarHBondContact O-CG2 3.45Å; E568-V572 PolarHBondContact O-N 2.83Å; L569-V572 PolarHBondContact O-N 3.45Å; V572-M574 VanDerWaalsContact C-N 3.33Å; V572-M574 PolarHBondContact O-N 3.43Å; V572-V575 PolarHBondContact O-N 2.9Å; V572-K576 WeakPolarHBondContact O-CB 3.39Å; V572-K576 PolarHBondContact O-N 3.46Å
573E75.2Confident69.4Low99 Ų99114.7 Ų114.746%0.46356%0.562SS.*Hα-helixtrans-62.7-38.9175.8-153.777-14300111.7L569 K576 N577L569-E573 PolarHBondContact O-N 3.39Å; E573-K576 PolarHBondContact O-N 2.79Å; E573-N577 PolarHBondContact O-N 3.25Å
574M74.7Confident69.4Low119 Ų119110.2 Ų110.259%0.58655%0.549SS*.Hα-helixtrans-65.7-39.6174.7-109.7-169-73.400113S570 K571 V572 R578S570-M574 PolarHBondContact O-N 3.41Å; S570-M574 VanDerWaalsContact O-N 3.15Å; K571-M574 PolarHBondContact O-N 2.85Å; V572-M574 VanDerWaalsContact C-N 3.33Å; V572-M574 PolarHBondContact O-N 3.43Å; M574-R578 WeakPolarHBondContact O-CB 3.49Å; M574-R578 PolarHBondContact O-N 2.96Å
575V76.3Confident69.1Low94 Ų94107.1 Ų107.157%0.5754%0.543SS*.Hα-helixtrans-68.8-39.4176.9172.60000110.5K571 V572 R578 F579K571-V575 WeakPolarHBondContact O-CG2 3.49Å; K571-V575 PolarHBondContact O-N 3.23Å; V572-V575 PolarHBondContact O-N 2.9Å; V575-R578 PolarHBondContact O-N 3.45Å; V575-F579 WeakPolarHBondContact O-CB 3.45Å; V575-F579 PolarHBondContact O-N 3.36Å
576K75.4Confident68.7Low112 Ų112110 Ų11049%0.48756%0.558SS.*Hα-helixtrans-61.8-48174.8-171.7-174.8171.7-163.80111.8V572 E573 R578 F579 E580V572-K576 WeakPolarHBondContact O-CB 3.39Å; V572-K576 PolarHBondContact O-N 3.46Å; E573-K576 PolarHBondContact O-N 2.79Å; K576-R578 VanDerWaalsContact C-N 3.3Å; K576-R578 PolarHBondContact O-N 3.45Å; K576-F579 PolarHBondContact O-N 3.33Å; K576-F579 VanDerWaalsContact O-N 3.11Å; K576-E580 PolarHBondContact O-N 3.45Å
577N74.3Confident67.8Low84 Ų84107.7 Ų107.745%0.44956%0.556SS.*Hα-helixtrans-62.3-36.2175.6-80.9-11.7000112.4E573 I581E573-N577 PolarHBondContact O-N 3.25Å; N577-I581 WeakPolarHBondContact O-CD1 3.48Å; N577-I581 WeakPolarHBondContact O-CG1 3.42Å; N577-I581 PolarHBondContact O-N 3.22Å; N577-I581 VanDerWaalsContact O-N 3.08Å
578R72.1Confident66.5Low192 Ų192104.3 Ų104.373%0.72555%0.554SS**Hα-helixtrans-67.4-36.1173.4-87.8-178.5162.6-180-4.2112.8M574 V575 K576 M582M574-R578 WeakPolarHBondContact O-CB 3.49Å; M574-R578 PolarHBondContact O-N 2.96Å; V575-R578 PolarHBondContact O-N 3.45Å; K576-R578 VanDerWaalsContact C-N 3.3Å; K576-R578 PolarHBondContact O-N 3.45Å; R578-M582 WeakPolarHBondContact O-CB 3.29Å; R578-M582 PolarHBondContact O-N 2.88Å
579F70.2Confident65.2Low125 Ų125104.5 Ų104.555%0.54857%0.568SS.*Hα-helixtrans-68.7-43.5177.5-145.3-88.9000111.1V575 K576 I581 M582 E583V575-F579 WeakPolarHBondContact O-CB 3.45Å; V575-F579 PolarHBondContact O-N 3.36Å; K576-F579 PolarHBondContact O-N 3.33Å; K576-F579 VanDerWaalsContact O-N 3.11Å; F579-I581 VanDerWaalsContact C-N 3.34Å; F579-I581 PolarHBondContact O-N 2.76Å; F579-M582 PolarHBondContact O-N 3Å; F579-M582 VanDerWaalsContact O-N 3.15Å; F579-E583 WeakPolarHBondContact O-CB 3.38Å; F579-E583 PolarHBondContact O-N 3.07Å
580E70.6Confident64Low101 Ų101109 Ų10947%0.47259%0.586SS.*Hα-helixtrans-61.7-38.9174.4-81.9177.5-178.400112.2K576 S584K576-E580 PolarHBondContact O-N 3.45Å; E580-S584 WeakPolarHBondContact O-CB 3.44Å; E580-S584 PolarHBondContact O-N 2.93Å; E580-S584 PolarHBondContact O-OG 3.48Å
581I68.6Low62.8Low117 Ų117108.6 Ų108.660%0.659%0.593SS**Hα-helixtrans-66.9-38.8174.3-68.4165.7000111.4N577 F579 S584 S585N577-I581 WeakPolarHBondContact O-CD1 3.48Å; N577-I581 WeakPolarHBondContact O-CG1 3.42Å; N577-I581 PolarHBondContact O-N 3.22Å; N577-I581 VanDerWaalsContact O-N 3.08Å; F579-I581 VanDerWaalsContact C-N 3.34Å; F579-I581 PolarHBondContact O-N 2.76Å; I581-S584 PolarHBondContact O-N 3.49Å; I581-S585 PolarHBondContact O-N 3.35Å
582M63.7Low61.1Low101 Ų101112.8 Ų112.850%0.49861%0.614SS.*Hα-helixtrans-67.7-43179.1-154.2-174.4-49.600111.3R578 F579 S584 S585 L586R578-M582 WeakPolarHBondContact O-CB 3.29Å; R578-M582 PolarHBondContact O-N 2.88Å; F579-M582 PolarHBondContact O-N 3Å; F579-M582 VanDerWaalsContact O-N 3.15Å; M582-S584 VanDerWaalsContact C-N 3.32Å; M582-S584 PolarHBondContact O-N 3.16Å; M582-S585 PolarHBondContact O-N 2.77Å; M582-S585 VanDerWaalsContact O-N 3.1Å; M582-S585 PolarHBondContact O-OG 2.77Å; M582-L586 HydrophobicContact CG-CD1 4.2Å; M582-L586 WeakPolarHBondContact O-CD1 3.39Å; M582-L586 PolarHBondContact O-N 3.36Å
583E60Low59.5Low130 Ų130117.2 Ų117.261%0.60763%0.626SS**Hα-helixtrans-62.6-39.8175.5-148.6179-165.300111.4F579 S585 L586 A587F579-E583 WeakPolarHBondContact O-CB 3.38Å; F579-E583 PolarHBondContact O-N 3.07Å; E583-S585 VanDerWaalsContact C-N 3.32Å; E583-S585 PolarHBondContact O-N 2.84Å; E583-L586 PolarHBondContact O-N 3.46Å; E583-A587 PolarHBondContact O-N 3.44Å
584S57.1Low58.3Low84 Ų84117 Ų11759%0.58764%0.635SS**Hα-helixtrans-66-30.4173.1-53.60000113.1E580 I581 M582 A587E580-S584 WeakPolarHBondContact O-CB 3.44Å; E580-S584 PolarHBondContact O-N 2.93Å; E580-S584 PolarHBondContact O-OG 3.48Å; I581-S584 PolarHBondContact O-N 3.49Å; M582-S584 VanDerWaalsContact C-N 3.32Å; M582-S584 PolarHBondContact O-N 3.16Å; S584-A587 CarbonylContact O-C 3.58Å
585S54.3Low56.9Low82 Ų82119.1 Ų119.157%0.57364%0.644SS**Hα-helixtrans-82.8-27.9177.284.30000113.8I581 M582 E583 A587 G588I581-S585 PolarHBondContact O-N 3.35Å; M582-S585 PolarHBondContact O-N 2.77Å; M582-S585 VanDerWaalsContact O-N 3.1Å; M582-S585 PolarHBondContact O-OG 2.77Å; E583-S585 VanDerWaalsContact C-N 3.32Å; E583-S585 PolarHBondContact O-N 2.84Å; S585-A587 VanDerWaalsContact C-N 3.32Å; S585-G588 PolarHBondContact O-N 3.07Å
586L50.4Low55.3Low147 Ų147122.1 Ų122.177%0.7766%0.655SS**Hα-helixtrans-73.1-26.9169.4-94.6118.5000111.6M582 E583 G588M582-L586 HydrophobicContact CG-CD1 4.2Å; M582-L586 WeakPolarHBondContact O-CD1 3.39Å; M582-L586 PolarHBondContact O-N 3.36Å; E583-L586 PolarHBondContact O-N 3.46Å; L586-G588 PolarHBondContact O-N 3.05Å
587A49.2Very low53.7Low77 Ų77126.9 Ų126.964%0.63667%0.671SS**SBendtrans-77.255.6162.100000110.9E583 S584 S585E583-A587 PolarHBondContact O-N 3.44Å; S584-A587 CarbonylContact O-C 3.58Å; S585-A587 VanDerWaalsContact C-N 3.32Å
588G40.8Very low52.2Low52 Ų52132.6 Ų132.654%0.53669%0.688SS.*  trans-59.9144.6176.200000112.7S585 L586S585-G588 PolarHBondContact O-N 3.07Å; L586-G588 PolarHBondContact O-N 3.05Å
589S41.4Very low51Low110 Ų110129.4 Ų129.477%0.76968%0.684SS**  trans-34.6146.2-179.853.20000116.5G591S589-G591 PolarHBondContact O-N 3.28Å
590E45.4Very low49.8Very low197 Ų197130.2 Ų130.292%0.92170%0.7SS**THydrogen-bonded Turntrans-53.323.7-179.7-69.617813000118.2
591G47.3Very low48.1Very low63 Ų63137.9 Ų137.965%0.64973%0.731SS**THydrogen-bonded Turntrans-101.3-25.7-173.400000117.4S589S589-G591 PolarHBondContact O-N 3.28Å
592E39.1Very low47.1Very low186 Ų186138.9 Ų138.987%0.86974%0.738SS**  trans-137.544.8-168.8-70.3-175.9164.900113.4S594E592-S594 PolarHBondContact O-N 2.9Å; E592-S594 VanDerWaalsContact O-N 3.12Å
593K42.8Very low46.2Very low189 Ų189140.9 Ų140.982%0.82275%0.75SS**  trans-82.855.8167.1-73.9-176.1178.2173.30111.8
594S50.3Low45.4Very low95 Ų95141.5 Ų141.566%0.66476%0.758SS**SBendtrans-121.96.5-175.5-76.90000117.6E592E592-S594 PolarHBondContact O-N 2.9Å; E592-S594 VanDerWaalsContact O-N 3.12Å
595Q45Very low44.8Very low163 Ų163144.9 Ų144.976%0.76277%0.768SS**SBendtrans-132.9-8.3175.6-116.9103.420.300118.4
596I43.8Very low44.2Very low157 Ų157148.8 Ų148.881%0.80578%0.78SS**SBendtrans-110.1-12.7-175.2-61.3179000113.7
597Y41Very low43.7Very low212 Ų212148.9 Ų148.983%0.83178%0.781SS**THydrogen-bonded Turntrans-94.22.2-179.2-147.2-96.5000115.2
598Y42.9Very low43.3Very low205 Ų205154.1 Ų154.180%0.80479%0.791SS**THydrogen-bonded Turntrans-120.623.7-178.9-80.4-75.6000114.6
599I48Very low43.5Very low124 Ų124161.9 Ų161.964%0.63681%0.811SS**SBendtrans-98.51.6175.7-64.8178.7000113
600T43.4Very low43.7Very low143 Ų143166.3 Ų166.388%0.87782%0.815SS**  trans-136.364.4170.6320000112.4
601K35.7Very low43.6Very low261 Ų261163.5 Ų163.5100%1.13581%0.805SS**  trans-141.30146.1-161.3177.3-176.1-179.60110.9

Retrieved 601 of 601 residues in 103 ms (Link to these results)