A0A077ZC58_TRITR Loading...

SNARE domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZC58, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 107 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
1M43.7Very low62.5Low241 Ų24195.4 Ų95.4100%1.18767%0.673SS**  01360-76.1171.5157.500107.2
2V52.9Low63.6Low158 Ų15899.5 Ų99.596%0.95868%0.676SS**  trans81.1108.7-176.1-166.10000114.4
3G54.3Low64.9Low72 Ų7298.2 Ų98.274%0.74267%0.669SS**  trans172.7-3.6177.200000117
4G59.7Low66.2Low57 Ų57101.6 Ų101.659%0.58867%0.666SS**  trans-111.17.4-169.500000117.6
5S60.2Low67.2Low100 Ų100103.6 Ų103.670%0.69966%0.663SS**SBendtrans-98.7-14-168.8-510000115.2S8S5-S8 PolarHBondContact O-OG 3.16Å; S5-S8 VanDerWaalsContact O-OG 3.14Å
6S61.7Low68.1Low95 Ų95105.5 Ų105.566%0.66466%0.66SS**Hα-helixtrans-85.4-27-176.837.10000113.5A10S6-A10 PolarHBondContact O-N 3.43Å
7S65.8Low69Low89 Ų89108.9 Ų108.962%0.62266%0.659SS**Hα-helixtrans-72.4-33178.953.20000113.1G11S7-G11 PolarHBondContact O-N 3.24Å; S7-G11 VanDerWaalsContact O-N 3.16Å
8S69Low69.9Low77 Ų77108.2 Ų108.254%0.53865%0.65SS.*Hα-helixtrans-71.1-39.6178.752.90000112.6S5 G11 M12S5-S8 PolarHBondContact O-OG 3.16Å; S5-S8 VanDerWaalsContact O-OG 3.14Å; S8-G11 PolarHBondContact O-N 3.14Å; S8-M12 PolarHBondContact O-N 3.44Å
9A71.2Confident70.7Confident57 Ų57108.5 Ų108.547%0.47164%0.644SS.*Hα-helixtrans-65.8-44.8177.900000112.1G11 M12 S13A9-G11 VanDerWaalsContact C-N 3.33Å; A9-G11 PolarHBondContact O-N 3.01Å; A9-M12 PolarHBondContact O-N 3.42Å; A9-S13 PolarHBondContact O-N 3.08Å; A9-S13 PolarHBondContact O-OG 3.36Å
10A73.2Confident71.4Confident63 Ų63105.5 Ų105.552%0.52163%0.629SS.*Hα-helixtrans-64.2-37.2176.700000112.4S6 K14S6-A10 PolarHBondContact O-N 3.43Å; A10-K14 WeakPolarHBondContact O-CB 3.43Å; A10-K14 PolarHBondContact O-N 3.05Å; A10-K14 VanDerWaalsContact O-N 3.08Å
11G75.8Confident72.1Confident40 Ų40103.3 Ų103.341%0.41261%0.614SS.*Hα-helixtrans-63.2-41.8173.400000112.8S7 S8 A9 K14 Q15S7-G11 PolarHBondContact O-N 3.24Å; S7-G11 VanDerWaalsContact O-N 3.16Å; S8-G11 PolarHBondContact O-N 3.14Å; A9-G11 VanDerWaalsContact C-N 3.33Å; A9-G11 PolarHBondContact O-N 3.01Å; G11-K14 PolarHBondContact O-N 2.96Å; G11-Q15 WeakPolarHBondContact O-CB 3.48Å; G11-Q15 PolarHBondContact O-N 3.49Å
12M76.2Confident74.3Confident145 Ų14596.4 Ų96.471%0.71458%0.582SS**Hα-helixtrans-66.4-42.7178.6-168.4169.6-169.800112.3S8 A9 Q15 H16S8-M12 PolarHBondContact O-N 3.44Å; A9-M12 PolarHBondContact O-N 3.42Å; M12-Q15 PolarHBondContact O-N 2.93Å; M12-H16 WeakPolarHBondContact O-CB 3.35Å; M12-H16 PolarHBondContact O-N 3.16Å
13S80.4Confident76.1Confident82 Ų8293.7 Ų93.757%0.57356%0.562SS**Hα-helixtrans-64.4-40.3175.4-52.30000112.3A9 H16 Y17A9-S13 PolarHBondContact O-N 3.08Å; A9-S13 PolarHBondContact O-OG 3.36Å; S13-H16 PolarHBondContact O-N 3.38Å; S13-Y17 WeakPolarHBondContact O-CB 3.41Å; S13-Y17 PolarHBondContact O-N 2.9Å
14K82.4Confident77.8Confident146 Ų14695.8 Ų95.864%0.63555%0.553SS**Hα-helixtrans-65.9-42.4176.2-173177-179.6-177.90111.5A10 G11 Y17 L18A10-K14 WeakPolarHBondContact O-CB 3.43Å; A10-K14 PolarHBondContact O-N 3.05Å; A10-K14 VanDerWaalsContact O-N 3.08Å; G11-K14 PolarHBondContact O-N 2.96Å; K14-Y17 PolarHBondContact O-N 3.4Å; K14-L18 HydrophobicContact CG-CD1 4.09Å; K14-L18 WeakPolarHBondContact O-CB 3.48Å; K14-L18 VanDerWaalsContact O-CG 3.27Å; K14-L18 WeakPolarHBondContact O-CG 3.27Å; K14-L18 PolarHBondContact O-N 2.97Å
15Q81.9Confident79.1Confident132 Ų13297.9 Ų97.962%0.61755%0.549SS*.Hα-helixtrans-63.6-44.3177-168.1171.3-85.300111.2G11 M12 Y17 L18 E19G11-Q15 WeakPolarHBondContact O-CB 3.48Å; G11-Q15 PolarHBondContact O-N 3.49Å; M12-Q15 PolarHBondContact O-N 2.93Å; Q15-Y17 VanDerWaalsContact C-N 3.35Å; Q15-Y17 PolarHBondContact O-N 2.94Å; Q15-L18 PolarHBondContact O-N 3.28Å; Q15-E19 VanDerWaalsContact O-CB 3.28Å; Q15-E19 WeakPolarHBondContact O-CB 3.39Å; Q15-E19 PolarHBondContact O-N 3.5Å
16H81.7Confident80.6Confident134 Ų13495.7 Ų95.762%0.6253%0.531SS*.Hα-helixtrans-62.7-38.8175.8-174.9-80.4000112.7M12 S13 E19 S20M12-H16 WeakPolarHBondContact O-CB 3.35Å; M12-H16 PolarHBondContact O-N 3.16Å; S13-H16 PolarHBondContact O-N 3.38Å; H16-E19 PolarHBondContact O-N 2.92Å; H16-S20 WeakPolarHBondContact O-CB 3.38Å; H16-S20 PolarHBondContact O-N 3.49Å
17Y82.6Confident82Confident163 Ų16396.2 Ų96.264%0.63953%0.526SS*.Hα-helixtrans-65.4-44.6175.1-173.8-88000111.8S13 K14 Q15 E19 S20 D21S13-Y17 WeakPolarHBondContact O-CB 3.41Å; S13-Y17 PolarHBondContact O-N 2.9Å; K14-Y17 PolarHBondContact O-N 3.4Å; Q15-Y17 VanDerWaalsContact C-N 3.35Å; Q15-Y17 PolarHBondContact O-N 2.94Å; Y17-E19 VanDerWaalsContact C-N 3.33Å; Y17-E19 PolarHBondContact O-N 3.4Å; Y17-S20 PolarHBondContact O-N 2.99Å; Y17-D21 WeakPolarHBondContact O-CB 3.34Å; Y17-D21 PolarHBondContact O-N 2.83Å
18L85.2Confident83.2Confident96 Ų9696.4 Ų96.450%0.50352%0.52SS..Hα-helixtrans-65.7-36.1177-69.6170.6000112.3K14 Q15 N22K14-L18 HydrophobicContact CG-CD1 4.09Å; K14-L18 WeakPolarHBondContact O-CB 3.48Å; K14-L18 VanDerWaalsContact O-CG 3.27Å; K14-L18 WeakPolarHBondContact O-CG 3.27Å; K14-L18 PolarHBondContact O-N 2.97Å; Q15-L18 PolarHBondContact O-N 3.28Å; L18-N22 WeakPolarHBondContact O-CB 3.31Å; L18-N22 PolarHBondContact O-N 3.42Å
19E84.6Confident84.3Confident114 Ų11497.8 Ų97.853%0.53352%0.521SS..Hα-helixtrans-67.2-46.3175.5-168.9172.5131.800110.9Q15 H16 Y17 D21 N22 D23Q15-E19 VanDerWaalsContact O-CB 3.28Å; Q15-E19 WeakPolarHBondContact O-CB 3.39Å; Q15-E19 PolarHBondContact O-N 3.5Å; H16-E19 PolarHBondContact O-N 2.92Å; Y17-E19 VanDerWaalsContact C-N 3.33Å; Y17-E19 PolarHBondContact O-N 3.4Å; E19-D21 VanDerWaalsContact C-N 3.32Å; E19-D21 PolarHBondContact O-N 3.44Å; E19-N22 PolarHBondContact O-N 3.13Å; E19-D23 WeakPolarHBondContact O-CB 3.38Å; E19-D23 PolarHBondContact O-N 3.31Å
20S86.4Confident85.3Confident49 Ų49101.3 Ų101.334%0.34353%0.526SS..Hα-helixtrans-62.3-36.9175179.90000113H16 Y17 Q24H16-S20 WeakPolarHBondContact O-CB 3.38Å; H16-S20 PolarHBondContact O-N 3.49Å; Y17-S20 PolarHBondContact O-N 2.99Å; S20-Q24 WeakPolarHBondContact O-CG 3.5Å; S20-Q24 PolarHBondContact O-N 2.97Å; S20-Q24 VanDerWaalsContact O-N 3.13Å
21D85.8Confident86.3Confident60 Ų60104.4 Ų104.432%0.32153%0.529SS..Hα-helixtrans-69.4-42.2177.4-168.542.6000110.7Y17 E19 Q24 M25Y17-D21 WeakPolarHBondContact O-CB 3.34Å; Y17-D21 PolarHBondContact O-N 2.83Å; E19-D21 VanDerWaalsContact C-N 3.32Å; E19-D21 PolarHBondContact O-N 3.44Å; D21-Q24 PolarHBondContact O-N 3.14Å; D21-M25 WeakPolarHBondContact O-CG 3.46Å; D21-M25 PolarHBondContact O-N 3.28Å; D21-M25 VanDerWaalsContact OD2-CE 3.31Å; D21-M25 WeakPolarHBondContact OD2-CE 3.45Å
22N89.1Confident87.1Confident95 Ų95108.7 Ų108.751%0.50854%0.536SS..Hα-helixtrans-63.1-43.4174.7-165.43.9000111.9L18 E19 Q24 M25 V26L18-N22 WeakPolarHBondContact O-CB 3.31Å; L18-N22 PolarHBondContact O-N 3.42Å; E19-N22 PolarHBondContact O-N 3.13Å; N22-Q24 VanDerWaalsContact C-N 3.31Å; N22-Q24 PolarHBondContact O-N 2.87Å; N22-M25 PolarHBondContact O-N 2.81Å; N22-M25 VanDerWaalsContact O-N 3.14Å; N22-V26 WeakPolarHBondContact O-CB 3.28Å; N22-V26 VanDerWaalsContact O-CG2 3.29Å; N22-V26 WeakPolarHBondContact O-CG2 3.38Å; N22-V26 PolarHBondContact O-N 3.39Å
23D90.6Very high88Confident102 Ų102106.1 Ų106.155%0.54553%0.529SS..Hα-helixtrans-60.3-40.3176.1-83.4-8.7000112.1E19 V26 D27E19-D23 WeakPolarHBondContact O-CB 3.38Å; E19-D23 PolarHBondContact O-N 3.31Å; D23-V26 PolarHBondContact O-N 2.99Å; D23-D27 WeakPolarHBondContact O-CB 3.31Å; D23-D27 PolarHBondContact O-N 3.43Å
24Q90.1Very high88.5Confident115 Ų115106.7 Ų106.754%0.53753%0.529SS..Hα-helixtrans-65.2-41.7173.8-74.1-17820.100112.1S20 D21 N22 V26 D27 N28S20-Q24 WeakPolarHBondContact O-CG 3.5Å; S20-Q24 PolarHBondContact O-N 2.97Å; S20-Q24 VanDerWaalsContact O-N 3.13Å; D21-Q24 PolarHBondContact O-N 3.14Å; N22-Q24 VanDerWaalsContact C-N 3.31Å; N22-Q24 PolarHBondContact O-N 2.87Å; Q24-V26 VanDerWaalsContact C-N 3.35Å; Q24-D27 PolarHBondContact O-N 2.83Å; Q24-N28 WeakPolarHBondContact O-CB 3.49Å; Q24-N28 PolarHBondContact O-N 3.44Å; Q24-N28 PolarHBondContact O-ND2 2.91Å
25M86.9Confident89Confident102 Ų102103.3 Ų103.350%0.50252%0.521SS..Hα-helixtrans-63.8-41.7175.8-69.5-174.3-164.600111.5D21 N22 N28 L29D21-M25 WeakPolarHBondContact O-CG 3.46Å; D21-M25 PolarHBondContact O-N 3.28Å; D21-M25 VanDerWaalsContact OD2-CE 3.31Å; D21-M25 WeakPolarHBondContact OD2-CE 3.45Å; N22-M25 PolarHBondContact O-N 2.81Å; N22-M25 VanDerWaalsContact O-N 3.14Å; M25-N28 PolarHBondContact O-N 2.89Å; M25-L29 WeakPolarHBondContact O-CB 3.5Å; M25-L29 VanDerWaalsContact O-CG 3.31Å; M25-L29 WeakPolarHBondContact O-CG 3.29Å; M25-L29 PolarHBondContact O-N 3.14Å
26V91.1Very high89.6Confident54 Ų54102 Ų10233%0.32752%0.517SS..Hα-helixtrans-64.5-42.2177.1169.50000111.2N22 D23 Q24 L29 K30N22-V26 WeakPolarHBondContact O-CB 3.28Å; N22-V26 VanDerWaalsContact O-CG2 3.29Å; N22-V26 WeakPolarHBondContact O-CG2 3.38Å; N22-V26 PolarHBondContact O-N 3.39Å; D23-V26 PolarHBondContact O-N 2.99Å; Q24-V26 VanDerWaalsContact C-N 3.35Å; V26-L29 PolarHBondContact O-N 3.4Å; V26-K30 HydrophobicContact CG1-CD 4.26Å; V26-K30 WeakPolarHBondContact O-CG 3.42Å; V26-K30 PolarHBondContact O-N 3.4Å
27D92.2Very high90.2Very high105 Ų105102.3 Ų102.356%0.56152%0.517SS*.Hα-helixtrans-63.8-43.7176.3-169.364.9000111.8D23 Q24 L29 K30 H31D23-D27 WeakPolarHBondContact O-CB 3.31Å; D23-D27 PolarHBondContact O-N 3.43Å; Q24-D27 PolarHBondContact O-N 2.83Å; D27-L29 VanDerWaalsContact C-N 3.34Å; D27-L29 PolarHBondContact O-N 3.31Å; D27-K30 WeakPolarHBondContact O-CB 3.49Å; D27-K30 PolarHBondContact O-N 2.91Å; D27-H31 PolarHBondContact O-N 2.97Å
28N91.6Very high90.6Very high93 Ų9397.5 Ų97.550%0.49751%0.507SS..Hα-helixtrans-60.2-41.7173.6-84.9-77.2000112.4Q24 M25 H31 K32Q24-N28 WeakPolarHBondContact O-CB 3.49Å; Q24-N28 PolarHBondContact O-N 3.44Å; Q24-N28 PolarHBondContact O-ND2 2.91Å; M25-N28 PolarHBondContact O-N 2.89Å; N28-H31 PolarHBondContact O-N 2.87Å; N28-K32 WeakPolarHBondContact O-CB 3.34Å; N28-K32 VanDerWaalsContact O-CG 3.31Å; N28-K32 WeakPolarHBondContact O-CG 3.31Å; N28-K32 PolarHBondContact O-N 3.4Å
29L91.9Very high90.9Very high107 Ų10797.5 Ų97.556%0.5651%0.507SS*.Hα-helixtrans-64.4-43.9175.1-74.3170.1000111.3M25 V26 D27 H31 K32 V33M25-L29 WeakPolarHBondContact O-CB 3.5Å; M25-L29 VanDerWaalsContact O-CG 3.31Å; M25-L29 WeakPolarHBondContact O-CG 3.29Å; M25-L29 PolarHBondContact O-N 3.14Å; V26-L29 PolarHBondContact O-N 3.4Å; D27-L29 VanDerWaalsContact C-N 3.34Å; D27-L29 PolarHBondContact O-N 3.31Å; L29-H31 VanDerWaalsContact C-N 3.34Å; L29-H31 PolarHBondContact O-N 3.09Å; L29-K32 PolarHBondContact O-N 2.93Å; L29-V33 WeakPolarHBondContact O-CB 3.46Å; L29-V33 VanDerWaalsContact O-CG2 3.26Å; L29-V33 WeakPolarHBondContact O-CG2 3.36Å; L29-V33 PolarHBondContact O-N 2.79Å
30K92.4Very high91.2Very high131 Ų13196.5 Ų96.557%0.5751%0.509SS*.Hα-helixtrans-59.1-44.2175.2-76.3173.9180172.80111.7V26 D27 V33 T34V26-K30 HydrophobicContact CG1-CD 4.26Å; V26-K30 WeakPolarHBondContact O-CG 3.42Å; V26-K30 PolarHBondContact O-N 3.4Å; D27-K30 WeakPolarHBondContact O-CB 3.49Å; D27-K30 PolarHBondContact O-N 2.91Å; K30-V33 PolarHBondContact O-N 3.45Å; K30-T34 WeakPolarHBondContact O-CB 3.48Å; K30-T34 PolarHBondContact O-N 2.87Å; K30-T34 PolarHBondContact O-OG1 3.19Å
31H93Very high91.5Very high127 Ų12798.3 Ų98.359%0.58851%0.513SS*.Hα-helixtrans-61.7-49.5176.6-173.6-72.3000111D27 N28 L29 V33 T34 T35D27-H31 PolarHBondContact O-N 2.97Å; N28-H31 PolarHBondContact O-N 2.87Å; L29-H31 VanDerWaalsContact C-N 3.34Å; L29-H31 PolarHBondContact O-N 3.09Å; H31-V33 VanDerWaalsContact C-N 3.35Å; H31-V33 PolarHBondContact O-N 3.4Å; H31-T34 WeakPolarHBondContact O-CB 3.45Å; H31-T34 PolarHBondContact O-N 3.42Å; H31-T34 VanDerWaalsContact O-N 3.14Å; H31-T35 PolarHBondContact O-N 2.87Å; H31-T35 PolarHBondContact O-OG1 3.47Å; H31-T35 VanDerWaalsContact O-OG1 3.09Å
32K93.5Very high91.7Very high130 Ų13099.7 Ų99.757%0.56552%0.521SS*.Hα-helixtrans-58.4-43.9177.3-73.7173.4-174.6-720112.3N28 L29 T34 T35 L36N28-K32 WeakPolarHBondContact O-CB 3.34Å; N28-K32 VanDerWaalsContact O-CG 3.31Å; N28-K32 WeakPolarHBondContact O-CG 3.31Å; N28-K32 PolarHBondContact O-N 3.4Å; L29-K32 PolarHBondContact O-N 2.93Å; K32-T34 VanDerWaalsContact C-N 3.31Å; K32-T34 PolarHBondContact O-N 3.3Å; K32-T35 PolarHBondContact O-N 3.42Å; K32-L36 WeakPolarHBondContact O-CG 3.26Å; K32-L36 PolarHBondContact O-N 2.93Å
33V94Very high91.9Very high92 Ų9299.7 Ų99.756%0.55852%0.52SS*.Hα-helixtrans-63.7-39.1177170.30000111L29 K30 H31 L36 K37L29-V33 WeakPolarHBondContact O-CB 3.46Å; L29-V33 VanDerWaalsContact O-CG2 3.26Å; L29-V33 WeakPolarHBondContact O-CG2 3.36Å; L29-V33 PolarHBondContact O-N 2.79Å; K30-V33 PolarHBondContact O-N 3.45Å; H31-V33 VanDerWaalsContact C-N 3.35Å; H31-V33 PolarHBondContact O-N 3.4Å; V33-L36 PolarHBondContact O-N 3.41Å; V33-K37 VanDerWaalsContact O-CB 3.28Å; V33-K37 WeakPolarHBondContact O-CB 3.41Å; V33-K37 PolarHBondContact O-N 3.22Å
34T92.3Very high91.9Very high93 Ų9396.3 Ų96.357%0.57151%0.509SS*.Hα-helixtrans-66.4-41.8177.1-56.70000111.4K30 H31 K32 K37 S38K30-T34 WeakPolarHBondContact O-CB 3.48Å; K30-T34 PolarHBondContact O-N 2.87Å; K30-T34 PolarHBondContact O-OG1 3.19Å; H31-T34 WeakPolarHBondContact O-CB 3.45Å; H31-T34 PolarHBondContact O-N 3.42Å; H31-T34 VanDerWaalsContact O-N 3.14Å; K32-T34 VanDerWaalsContact C-N 3.31Å; K32-T34 PolarHBondContact O-N 3.3Å; T34-K37 WeakPolarHBondContact O-CB 3.28Å; T34-K37 PolarHBondContact O-N 2.97Å; T34-S38 PolarHBondContact O-N 3.34Å
35T91.7Very high92Very high76 Ų7695.4 Ų95.447%0.46651%0.508SS..Hα-helixtrans-61.6-47.2173.5-53.10000111.7H31 K32 K37 S38 L39H31-T35 PolarHBondContact O-N 2.87Å; H31-T35 PolarHBondContact O-OG1 3.47Å; H31-T35 VanDerWaalsContact O-OG1 3.09Å; K32-T35 PolarHBondContact O-N 3.42Å; T35-K37 VanDerWaalsContact C-N 3.3Å; T35-K37 PolarHBondContact O-N 2.94Å; T35-S38 PolarHBondContact O-N 3.34Å; T35-L39 PolarHBondContact O-N 2.85Å
36L94.3Very high92Very high105 Ų10593.3 Ų93.355%0.5550%0.497SS..Hα-helixtrans-62.2-38.8177.1-73.4172.4000112K32 V33 L39 T40K32-L36 WeakPolarHBondContact O-CG 3.26Å; K32-L36 PolarHBondContact O-N 2.93Å; V33-L36 PolarHBondContact O-N 3.41Å; L36-L39 PolarHBondContact O-N 3.06Å; L36-T40 WeakPolarHBondContact O-CB 3.46Å; L36-T40 PolarHBondContact O-N 3.35Å; L36-T40 PolarHBondContact O-OG1 2.93Å
37K94Very high91.9Very high140 Ų14094.1 Ų94.161%0.60950%0.502SS*.Hα-helixtrans-60.5-46.8174.4-176.6-179.7179.4-176.70110.9V33 T34 T35 T40 I41V33-K37 VanDerWaalsContact O-CB 3.28Å; V33-K37 WeakPolarHBondContact O-CB 3.41Å; V33-K37 PolarHBondContact O-N 3.22Å; T34-K37 WeakPolarHBondContact O-CB 3.28Å; T34-K37 PolarHBondContact O-N 2.97Å; T35-K37 VanDerWaalsContact C-N 3.3Å; T35-K37 PolarHBondContact O-N 2.94Å; K37-T40 PolarHBondContact O-N 2.9Å; K37-I41 HydrophobicContact CG-CD1 4.12Å; K37-I41 VanDerWaalsContact O-CG1 3.3Å; K37-I41 WeakPolarHBondContact O-CG1 3.2Å; K37-I41 PolarHBondContact O-N 2.88Å
38S91.8Very high91.7Very high61 Ų6198.1 Ų98.143%0.42751%0.509SS..Hα-helixtrans-59.6-51175.6-164.40000111.2T34 T35 T40 I41 D42T34-S38 PolarHBondContact O-N 3.34Å; T35-S38 PolarHBondContact O-N 3.34Å; S38-T40 PolarHBondContact O-N 3.41Å; S38-I41 WeakPolarHBondContact O-CB 3.48Å; S38-I41 PolarHBondContact O-N 2.73Å; S38-D42 PolarHBondContact O-N 3.45Å
39L92.3Very high91.4Very high96 Ų96100 Ų10050%0.50351%0.509SS..Hα-helixtrans-58.4-37.9179.8-176.963.6000112.1T35 L36 D42 I43T35-L39 PolarHBondContact O-N 2.85Å; L36-L39 PolarHBondContact O-N 3.06Å; L39-D42 PolarHBondContact O-N 3.04Å; L39-I43 HydrophobicContact CD1-CD1 4.43Å; L39-I43 HydrophobicContact CG-CD1 4.06Å; L39-I43 WeakPolarHBondContact O-CB 3.48Å; L39-I43 WeakPolarHBondContact O-CD1 3.42Å; L39-I43 WeakPolarHBondContact O-CG1 3.29Å; L39-I43 PolarHBondContact O-N 3.22Å
40T90.7Very high90.9Very high94 Ų9499.3 Ų99.358%0.57750%0.503SS*.Hα-helixtrans-69.1-38.3178.2-55.20000111.9L36 K37 S38 G44L36-T40 WeakPolarHBondContact O-CB 3.46Å; L36-T40 PolarHBondContact O-N 3.35Å; L36-T40 PolarHBondContact O-OG1 2.93Å; K37-T40 PolarHBondContact O-N 2.9Å; S38-T40 PolarHBondContact O-N 3.41Å; T40-G44 PolarHBondContact O-N 3.49Å
41I91.3Very high90.6Very high86 Ų8697.8 Ų97.844%0.44150%0.501SS..Hα-helixtrans-64.3-48.1173.7-67.7164.8000109.6K37 S38 I43 G44 D45K37-I41 HydrophobicContact CG-CD1 4.12Å; K37-I41 VanDerWaalsContact O-CG1 3.3Å; K37-I41 WeakPolarHBondContact O-CG1 3.2Å; K37-I41 PolarHBondContact O-N 2.88Å; S38-I41 WeakPolarHBondContact O-CB 3.48Å; S38-I41 PolarHBondContact O-N 2.73Å; I41-I43 VanDerWaalsContact C-N 3.32Å; I41-I43 PolarHBondContact O-N 2.73Å; I41-G44 CarbonylContact O-C 3.6Å; I41-G44 WeakPolarHBondContact O-CA 3.45Å; I41-G44 PolarHBondContact O-N 3.41Å; I41-D45 PolarHBondContact O-N 2.87Å
42D91.7Very high90Very high90 Ų90100 Ų10048%0.48151%0.509SS..Hα-helixtrans-58.9-42.6179.5-61.7-28.1000111.4S38 L39 D45 E46S38-D42 PolarHBondContact O-N 3.45Å; L39-D42 PolarHBondContact O-N 3.04Å; D42-D45 PolarHBondContact O-N 2.99Å; D42-E46 VanDerWaalsContact O-CB 3.29Å; D42-E46 WeakPolarHBondContact O-CB 3.27Å; D42-E46 PolarHBondContact O-N 2.66Å
43I92.1Very high89.1Confident95 Ų9599.7 Ų99.749%0.48751%0.51SS..Hα-helixtrans-62.5-42.4173.3-69.7164.8000111L39 I41 D45 E46 V47L39-I43 HydrophobicContact CD1-CD1 4.43Å; L39-I43 HydrophobicContact CG-CD1 4.06Å; L39-I43 WeakPolarHBondContact O-CB 3.48Å; L39-I43 WeakPolarHBondContact O-CD1 3.42Å; L39-I43 WeakPolarHBondContact O-CG1 3.29Å; L39-I43 PolarHBondContact O-N 3.22Å; I41-I43 VanDerWaalsContact C-N 3.32Å; I41-I43 PolarHBondContact O-N 2.73Å; I43-D45 VanDerWaalsContact C-N 3.35Å; I43-D45 PolarHBondContact O-N 3Å; I43-E46 PolarHBondContact O-N 2.8Å; I43-V47 HydrophobicContact CG2-CG2 4.37Å; I43-V47 WeakPolarHBondContact O-CB 3.3Å; I43-V47 VanDerWaalsContact O-CG2 3.27Å; I43-V47 WeakPolarHBondContact O-CG2 3.37Å; I43-V47 PolarHBondContact O-N 2.86Å
44G90.8Very high88.5Confident31 Ų31100.2 Ų100.232%0.3251%0.509SS..Hα-helixtrans-62.4-41.1178.200000113T40 I41 R48T40-G44 PolarHBondContact O-N 3.49Å; I41-G44 CarbonylContact O-C 3.6Å; I41-G44 WeakPolarHBondContact O-CA 3.45Å; I41-G44 PolarHBondContact O-N 3.41Å; G44-R48 PolarHBondContact O-N 2.9Å; G44-R48 VanDerWaalsContact O-N 3.09Å
45D92Very high87.8Confident95 Ų9598 Ų9851%0.50851%0.505SS..Hα-helixtrans-71.5-39.7177.2-73.1-16.3000111.6I41 D42 I43 R48 R49I41-D45 PolarHBondContact O-N 2.87Å; D42-D45 PolarHBondContact O-N 2.99Å; I43-D45 VanDerWaalsContact C-N 3.35Å; I43-D45 PolarHBondContact O-N 3Å; D45-R48 PolarHBondContact O-N 3.16Å; D45-R49 WeakPolarHBondContact O-CB 3.33Å; D45-R49 PolarHBondContact O-N 3.41Å
46E87.9Confident87.2Confident59 Ų5995.8 Ų95.828%0.27650%0.497SS..Hα-helixtrans-60.7-47.3173.9-175.162.5-146.200111.4D42 I43 R48 R49 Q50D42-E46 VanDerWaalsContact O-CB 3.29Å; D42-E46 WeakPolarHBondContact O-CB 3.27Å; D42-E46 PolarHBondContact O-N 2.66Å; I43-E46 PolarHBondContact O-N 2.8Å; E46-R48 VanDerWaalsContact C-N 3.32Å; E46-R48 PolarHBondContact O-N 3.41Å; E46-R49 PolarHBondContact O-N 3.29Å; E46-R49 VanDerWaalsContact O-N 3.15Å; E46-R49 IonicContact OE1-CZ 3.94Å; E46-R49 IonicContact OE1-NH2 2.8Å; E46-R49 PolarHBondContact OE1-NH2 2.92Å; E46-R49 IonicContact OE2-CZ 2.73Å; E46-R49 IonicContact OE2-NH1 2.8Å; E46-R49 PolarHBondContact OE2-NH1 2.88Å; E46-R49 IonicContact OE2-NH2 3.5Å; E46-R49 PolarHBondContact OE2-NH2 2.83Å; E46-Q50 HydrophobicContact CG-CG 4.48Å; E46-Q50 WeakPolarHBondContact O-CB 3.44Å; E46-Q50 WeakPolarHBondContact O-CG 3.33Å; E46-Q50 PolarHBondContact O-N 3.09Å; E46-Q50 PolarHBondContact OE1-NE2 3.36Å
47V89.2Confident86.5Confident70 Ų7094.7 Ų94.742%0.42449%0.491SS..Hα-helixtrans-62.7-38.5177.1169.90000111I43 N51I43-V47 HydrophobicContact CG2-CG2 4.37Å; I43-V47 WeakPolarHBondContact O-CB 3.3Å; I43-V47 VanDerWaalsContact O-CG2 3.27Å; I43-V47 WeakPolarHBondContact O-CG2 3.37Å; I43-V47 PolarHBondContact O-N 2.86Å; V47-N51 VanDerWaalsContact O-CB 3.25Å; V47-N51 WeakPolarHBondContact O-CB 3.44Å; V47-N51 PolarHBondContact O-N 3.15Å; V47-N51 PolarHBondContact O-ND2 2.84Å; V47-N51 VanDerWaalsContact O-ND2 3.16Å
48R86.9Confident86Confident190 Ų19095 Ų9572%0.71750%0.495SS*.Hα-helixtrans-66.1-40.5173.1-82.3177-155.5-88.1-6.6112.3G44 D45 E46 N51 K52G44-R48 PolarHBondContact O-N 2.9Å; G44-R48 VanDerWaalsContact O-N 3.09Å; D45-R48 PolarHBondContact O-N 3.16Å; E46-R48 VanDerWaalsContact C-N 3.32Å; E46-R48 PolarHBondContact O-N 3.41Å; R48-N51 PolarHBondContact O-N 2.9Å; R48-K52 WeakPolarHBondContact O-CB 3.43Å; R48-K52 PolarHBondContact O-N 3.08Å
49R85.4Confident85.7Confident132 Ų13297.3 Ų97.350%0.49850%0.502SS..Hα-helixtrans-63.9-47.8177.5-166.6175.478.8-124.11110.8D45 E46 N51 K52 E53D45-R49 WeakPolarHBondContact O-CB 3.33Å; D45-R49 PolarHBondContact O-N 3.41Å; E46-R49 PolarHBondContact O-N 3.29Å; E46-R49 VanDerWaalsContact O-N 3.15Å; E46-R49 IonicContact OE1-CZ 3.94Å; E46-R49 IonicContact OE1-NH2 2.8Å; E46-R49 PolarHBondContact OE1-NH2 2.92Å; E46-R49 IonicContact OE2-CZ 2.73Å; E46-R49 IonicContact OE2-NH1 2.8Å; E46-R49 PolarHBondContact OE2-NH1 2.88Å; E46-R49 IonicContact OE2-NH2 3.5Å; E46-R49 PolarHBondContact OE2-NH2 2.83Å; R49-N51 PolarHBondContact O-N 3.34Å; R49-K52 WeakPolarHBondContact O-CB 3.37Å; R49-K52 PolarHBondContact O-N 3.21Å; R49-K52 VanDerWaalsContact O-N 3.1Å; R49-E53 IonicContact NE-OE1 2.96Å; R49-E53 PolarHBondContact O-N 2.94Å
50Q82.5Confident85.4Confident93 Ų9399.3 Ų99.344%0.43551%0.509SS..Hα-helixtrans-63.1-40.6176.4-69.7178.94.200112.1E46 K52 E53 L54E46-Q50 HydrophobicContact CG-CG 4.48Å; E46-Q50 WeakPolarHBondContact O-CB 3.44Å; E46-Q50 WeakPolarHBondContact O-CG 3.33Å; E46-Q50 PolarHBondContact O-N 3.09Å; E46-Q50 PolarHBondContact OE1-NE2 3.36Å; Q50-K52 VanDerWaalsContact C-N 3.28Å; Q50-K52 PolarHBondContact O-N 2.85Å; Q50-E53 PolarHBondContact O-N 3.4Å; Q50-L54 WeakPolarHBondContact O-CG 3.25Å; Q50-L54 PolarHBondContact O-N 3.46Å
51N84.4Confident85.2Confident98 Ų98101.8 Ų101.852%0.52451%0.512SS..Hα-helixtrans-63.9-32.9173.3-78.7-29000112.7V47 R48 R49 L54 G55V47-N51 VanDerWaalsContact O-CB 3.25Å; V47-N51 WeakPolarHBondContact O-CB 3.44Å; V47-N51 PolarHBondContact O-N 3.15Å; V47-N51 PolarHBondContact O-ND2 2.84Å; V47-N51 VanDerWaalsContact O-ND2 3.16Å; R48-N51 PolarHBondContact O-N 2.9Å; R49-N51 PolarHBondContact O-N 3.34Å; N51-L54 WeakPolarHBondContact O-CB 3.5Å; N51-G55 PolarHBondContact O-N 3.18Å
52K81.6Confident85.1Confident175 Ų175102.7 Ų102.776%0.76151%0.514SS*.Hα-helixtrans-70-39.8173.2-172.5-180178.7-1770111.7R48 R49 Q50 L54 G55 G56R48-K52 WeakPolarHBondContact O-CB 3.43Å; R48-K52 PolarHBondContact O-N 3.08Å; R49-K52 WeakPolarHBondContact O-CB 3.37Å; R49-K52 PolarHBondContact O-N 3.21Å; R49-K52 VanDerWaalsContact O-N 3.1Å; Q50-K52 VanDerWaalsContact C-N 3.28Å; Q50-K52 PolarHBondContact O-N 2.85Å; K52-L54 VanDerWaalsContact C-N 3.34Å; K52-G55 WeakPolarHBondContact O-CA 3.49Å; K52-G55 PolarHBondContact O-N 3.29Å; K52-G55 VanDerWaalsContact O-N 3.1Å; K52-G56 PolarHBondContact O-N 2.83Å
53E75.1Confident84.9Confident122 Ų122101.8 Ų101.857%0.5752%0.515SS*.Hα-helixtrans-66.4-35.3174.6-71174-164.700112.1R49 Q50 G55 G56 L57R49-E53 IonicContact NE-OE1 2.96Å; R49-E53 PolarHBondContact O-N 2.94Å; Q50-E53 PolarHBondContact O-N 3.4Å; E53-G55 PolarHBondContact O-N 3.1Å; E53-G56 CarbonylContact O-C 3.56Å; E53-G56 WeakPolarHBondContact O-CA 3.46Å; E53-G56 PolarHBondContact O-N 2.96Å; E53-L57 PolarHBondContact O-N 3.48Å; E53-L57 VanDerWaalsContact O-N 3.08Å
54L79.6Confident84.8Confident103 Ų10398.9 Ų98.954%0.53951%0.508SS..Hα-helixtrans-59.5-32.7169-79.9156.8000112.1Q50 N51 K52 G56 L57Q50-L54 WeakPolarHBondContact O-CG 3.25Å; Q50-L54 PolarHBondContact O-N 3.46Å; N51-L54 WeakPolarHBondContact O-CB 3.5Å; K52-L54 VanDerWaalsContact C-N 3.34Å; L54-G56 VanDerWaalsContact C-N 3.31Å; L54-L57 VanDerWaalsContact O-CB 3.31Å; L54-L57 WeakPolarHBondContact O-CB 3.38Å; L54-L57 PolarHBondContact O-N 3.27Å
55G79.2Confident84.8Confident47 Ų47105.5 Ų105.549%0.48552%0.523SS..Hα-helixtrans-67.1-30169.200000113.5N51 K52 E53 L57N51-G55 PolarHBondContact O-N 3.18Å; K52-G55 WeakPolarHBondContact O-CA 3.49Å; K52-G55 PolarHBondContact O-N 3.29Å; K52-G55 VanDerWaalsContact O-N 3.1Å; E53-G55 PolarHBondContact O-N 3.1Å; G55-L57 VanDerWaalsContact C-N 3.32Å
56G78.7Confident84.7Confident29 Ų29104.8 Ų104.830%0.29952%0.52SS..Hα-helixtrans-74-21.6172.500000113.7K52 E53 L54 E58 D59 H60K52-G56 PolarHBondContact O-N 2.83Å; E53-G56 CarbonylContact O-C 3.56Å; E53-G56 WeakPolarHBondContact O-CA 3.46Å; E53-G56 PolarHBondContact O-N 2.96Å; L54-G56 VanDerWaalsContact C-N 3.31Å; G56-E58 VanDerWaalsContact C-N 3.27Å; G56-E58 PolarHBondContact O-N 3.35Å; G56-D59 PolarHBondContact O-N 3.41Å; G56-H60 PolarHBondContact O-CD2 3.28Å; G56-H60 PolarHBondContact O-N 3.38Å
57L80.3Confident84.9Confident82 Ų82106.3 Ų106.343%0.42953%0.532SS..Hα-helixtrans-64.7-32.5175.7-174.560.9000111.9E53 L54 G55 H60 F61E53-L57 PolarHBondContact O-N 3.48Å; E53-L57 VanDerWaalsContact O-N 3.08Å; L54-L57 VanDerWaalsContact O-CB 3.31Å; L54-L57 WeakPolarHBondContact O-CB 3.38Å; L54-L57 PolarHBondContact O-N 3.27Å; G55-L57 VanDerWaalsContact C-N 3.32Å; L57-H60 PolarHBondContact O-N 3.2Å; L57-F61 HydrophobicContact CD1-CD2 3.64Å; L57-F61 HydrophobicContact CD1-CE2 3.75Å; L57-F61 HydrophobicContact CD2-CD2 4.4Å; L57-F61 HydrophobicContact CD2-CE2 4.18Å; L57-F61 HydrophobicContact CG-CD2 3.69Å; L57-F61 HydrophobicContact CG-CE2 3.91Å; L57-F61 WeakPolarHBondContact O-CB 3.31Å; L57-F61 WeakPolarHBondContact O-CD2 3.38Å; L57-F61 PolarHBondContact O-N 3.25Å
58E83.3Confident85.1Confident148 Ų148107.8 Ų107.869%0.69254%0.537SS*.Hα-helixtrans-60.4-45.9175.8-173.7170.7-179.400111.5G56 F61 E62G56-E58 VanDerWaalsContact C-N 3.27Å; G56-E58 PolarHBondContact O-N 3.35Å; E58-F61 PolarHBondContact O-N 3.1Å; E58-E62 WeakPolarHBondContact O-CB 3.36Å; E58-E62 PolarHBondContact O-N 3.23Å
59D85.1Confident85.2Confident109 Ų109102 Ų10258%0.58352%0.519SS*.Hα-helixtrans-64.7-41.6177.5-172.649000111.8G56 E62 S63G56-D59 PolarHBondContact O-N 3.41Å; D59-E62 PolarHBondContact O-N 3.45Å; D59-S63 WeakPolarHBondContact O-CB 3.4Å; D59-S63 PolarHBondContact O-N 2.78Å
60H85.1Confident85.4Confident137 Ų13797.8 Ų97.863%0.63451%0.512SS*.Hα-helixtrans-65.2-40.8174.3-70-49000112.8G56 L57 G64G56-H60 PolarHBondContact O-CD2 3.28Å; G56-H60 PolarHBondContact O-N 3.38Å; L57-H60 PolarHBondContact O-N 3.2Å; H60-G64 PolarHBondContact O-N 3.47Å
61F87.9Confident85.7Confident146 Ų14696.6 Ų96.664%0.6451%0.511SS*.Hα-helixtrans-66.7-39.4174.8-102.7-90.6000111.7L57 E58 G64 R65L57-F61 HydrophobicContact CD1-CD2 3.64Å; L57-F61 HydrophobicContact CD1-CE2 3.75Å; L57-F61 HydrophobicContact CD2-CD2 4.4Å; L57-F61 HydrophobicContact CD2-CE2 4.18Å; L57-F61 HydrophobicContact CG-CD2 3.69Å; L57-F61 HydrophobicContact CG-CE2 3.91Å; L57-F61 WeakPolarHBondContact O-CB 3.31Å; L57-F61 WeakPolarHBondContact O-CD2 3.38Å; L57-F61 PolarHBondContact O-N 3.25Å; E58-F61 PolarHBondContact O-N 3.1Å; F61-G64 PolarHBondContact O-N 2.95Å; F61-R65 WeakPolarHBondContact O-CB 3.46Å; F61-R65 PolarHBondContact O-N 2.91Å
62E88.5Confident85.8Confident106 Ų10698 Ų9850%0.49552%0.516SS..Hα-helixtrans-64.1-46.6176.4-169-176.3157.300110.8E58 D59 G64 R65 N66E58-E62 WeakPolarHBondContact O-CB 3.36Å; E58-E62 PolarHBondContact O-N 3.23Å; D59-E62 PolarHBondContact O-N 3.45Å; E62-G64 PolarHBondContact O-N 3.49Å; E62-R65 WeakPolarHBondContact O-CB 3.1Å; E62-R65 PolarHBondContact O-N 3.37Å; E62-N66 WeakPolarHBondContact O-CB 3.28Å; E62-N66 PolarHBondContact O-N 2.85Å; E62-N66 PolarHBondContact O-ND2 3.18Å
63S87.2Confident86Confident71 Ų7197.4 Ų97.450%0.49751%0.509SS..Hα-helixtrans-59.1-48.1175.2-1760000112D59 R65 N66 V67D59-S63 WeakPolarHBondContact O-CB 3.4Å; D59-S63 PolarHBondContact O-N 2.78Å; S63-R65 VanDerWaalsContact C-N 3.35Å; S63-R65 PolarHBondContact O-N 2.81Å; S63-N66 PolarHBondContact O-N 2.92Å; S63-V67 WeakPolarHBondContact O-CG2 3.39Å; S63-V67 PolarHBondContact O-N 3.36Å; S63-V67 VanDerWaalsContact O-N 3.14Å
64G89.1Confident86.4Confident33 Ų3399.9 Ų99.934%0.3451%0.513SS..Hα-helixtrans-61.3-41.517500000112.7H60 F61 E62 V67 L68H60-G64 PolarHBondContact O-N 3.47Å; F61-G64 PolarHBondContact O-N 2.95Å; E62-G64 PolarHBondContact O-N 3.49Å; G64-V67 PolarHBondContact O-N 3.14Å; G64-L68 WeakPolarHBondContact O-CD1 3.2Å; G64-L68 PolarHBondContact O-N 3.27Å
65R90.8Very high86.6Confident171 Ų171100.2 Ų100.265%0.64552%0.515SS*.Hα-helixtrans-62.8-41.9175.6176.8-176159.7964.8111.5F61 E62 S63 V67 L68 E69F61-R65 WeakPolarHBondContact O-CB 3.46Å; F61-R65 PolarHBondContact O-N 2.91Å; E62-R65 WeakPolarHBondContact O-CB 3.1Å; E62-R65 PolarHBondContact O-N 3.37Å; S63-R65 VanDerWaalsContact C-N 3.35Å; S63-R65 PolarHBondContact O-N 2.81Å; R65-V67 VanDerWaalsContact C-N 3.35Å; R65-V67 PolarHBondContact O-N 3.47Å; R65-L68 CarbonylContact O-C 3.48Å; R65-L68 PolarHBondContact O-N 3.27Å; R65-E69 VanDerWaalsContact O-CB 3.28Å; R65-E69 WeakPolarHBondContact O-CB 3.48Å; R65-E69 PolarHBondContact O-N 2.74Å
66N91.4Very high86.7Confident80 Ų8099.6 Ų99.643%0.42851%0.509SS..Hα-helixtrans-63.2-41.1177.8-72.5-25.8000111.6E62 S63 E69 A70E62-N66 WeakPolarHBondContact O-CB 3.28Å; E62-N66 PolarHBondContact O-N 2.85Å; E62-N66 PolarHBondContact O-ND2 3.18Å; S63-N66 PolarHBondContact O-N 2.92Å; N66-E69 PolarHBondContact O-N 2.89Å; N66-A70 WeakPolarHBondContact O-CB 3.42Å; N66-A70 PolarHBondContact O-N 3.17Å
67V91.4Very high86.3Confident90 Ų90103.8 Ų103.855%0.54552%0.524SS..Hα-helixtrans-65.6-43.7174.3174.90000111.4S63 G64 R65 A70 T71S63-V67 WeakPolarHBondContact O-CG2 3.39Å; S63-V67 PolarHBondContact O-N 3.36Å; S63-V67 VanDerWaalsContact O-N 3.14Å; G64-V67 PolarHBondContact O-N 3.14Å; R65-V67 VanDerWaalsContact C-N 3.35Å; R65-V67 PolarHBondContact O-N 3.47Å; V67-A70 PolarHBondContact O-N 2.99Å; V67-T71 PolarHBondContact O-N 2.91Å; V67-T71 PolarHBondContact O-OG1 2.82Å
68L92.8Very high85.8Confident101 Ų101105.4 Ų105.453%0.52953%0.532SS..Hα-helixtrans-64.1-40.9174.6-99.874.1000111.5G64 R65 T71 M72G64-L68 WeakPolarHBondContact O-CD1 3.2Å; G64-L68 PolarHBondContact O-N 3.27Å; R65-L68 CarbonylContact O-C 3.48Å; R65-L68 PolarHBondContact O-N 3.27Å; L68-T71 CarbonylContact O-C 3.55Å; L68-T71 WeakPolarHBondContact O-CA 3.44Å; L68-T71 WeakPolarHBondContact O-CB 3.28Å; L68-T71 PolarHBondContact O-N 2.77Å; L68-M72 HydrophobicContact CB-CE 4.43Å; L68-M72 HydrophobicContact CD2-CE 4.42Å; L68-M72 WeakPolarHBondContact O-CB 3.5Å; L68-M72 WeakPolarHBondContact O-CG 3.34Å; L68-M72 PolarHBondContact O-N 3.29Å
69E90.5Very high85.1Confident69 Ų69103.1 Ų103.132%0.32253%0.532SS..Hα-helixtrans-63.2-43.6177.4-167-166.8129.400110.4R65 N66 T71 M72 R73R65-E69 VanDerWaalsContact O-CB 3.28Å; R65-E69 WeakPolarHBondContact O-CB 3.48Å; R65-E69 PolarHBondContact O-N 2.74Å; N66-E69 PolarHBondContact O-N 2.89Å; E69-T71 VanDerWaalsContact C-N 3.29Å; E69-T71 PolarHBondContact O-N 3.39Å; E69-M72 PolarHBondContact O-N 2.72Å; E69-R73 HydrophobicContact CG-CG 4.42Å; E69-R73 WeakPolarHBondContact O-CB 3.36Å; E69-R73 WeakPolarHBondContact O-CG 3.48Å; E69-R73 PolarHBondContact O-N 3.41Å; E69-R73 IonicContact OE1-CZ 3.72Å; E69-R73 IonicContact OE1-NH1 2.66Å; E69-R73 PolarHBondContact OE1-NH1 3.4Å
70A89.2Confident84Confident44 Ų44108.8 Ų108.836%0.36455%0.545SS..Hα-helixtrans-59.4-43173.600000111.3N66 V67 R73 R74N66-A70 WeakPolarHBondContact O-CB 3.42Å; N66-A70 PolarHBondContact O-N 3.17Å; V67-A70 PolarHBondContact O-N 2.99Å; A70-R73 PolarHBondContact O-N 3.43Å; A70-R74 VanDerWaalsContact O-CG 3.29Å; A70-R74 WeakPolarHBondContact O-CG 3.13Å; A70-R74 PolarHBondContact O-N 3.5Å
71T88.5Confident82.7Confident68 Ų68106.2 Ų106.242%0.41754%0.542SS..Hα-helixtrans-62.9-47.1174.9-560000111.8V67 L68 E69 R73 R74 L75V67-T71 PolarHBondContact O-N 2.91Å; V67-T71 PolarHBondContact O-OG1 2.82Å; L68-T71 CarbonylContact O-C 3.55Å; L68-T71 WeakPolarHBondContact O-CA 3.44Å; L68-T71 WeakPolarHBondContact O-CB 3.28Å; L68-T71 PolarHBondContact O-N 2.77Å; E69-T71 VanDerWaalsContact C-N 3.29Å; E69-T71 PolarHBondContact O-N 3.39Å; T71-R73 PolarHBondContact O-N 2.71Å; T71-R74 WeakPolarHBondContact O-CB 3.46Å; T71-R74 PolarHBondContact O-N 3.28Å; T71-L75 HydrophobicContact CG2-CD1 3.94Å; T71-L75 VanDerWaalsContact O-CD1 3.28Å; T71-L75 WeakPolarHBondContact O-CD1 3.37Å; T71-L75 PolarHBondContact O-N 3.49Å
72M87.2Confident81.3Confident127 Ų127101.5 Ų101.563%0.62654%0.535SS*.Hα-helixtrans-65-36.9177.3-72.4-166.1-144.900112.2L68 E69 R74 L75 G76L68-M72 HydrophobicContact CB-CE 4.43Å; L68-M72 HydrophobicContact CD2-CE 4.42Å; L68-M72 WeakPolarHBondContact O-CB 3.5Å; L68-M72 WeakPolarHBondContact O-CG 3.34Å; L68-M72 PolarHBondContact O-N 3.29Å; E69-M72 PolarHBondContact O-N 2.72Å; M72-R74 VanDerWaalsContact C-N 3.34Å; M72-L75 PolarHBondContact O-N 3.48Å; M72-G76 WeakPolarHBondContact O-CA 3.47Å; M72-G76 PolarHBondContact O-N 3.33Å
73R85.4Confident80.1Confident162 Ų16297.8 Ų97.861%0.61152%0.52SS*.Hα-helixtrans-64.1-41.4173.2-72.8169.496.5154.8-0.7110.3E69 A70 T71 G76 L77E69-R73 HydrophobicContact CG-CG 4.42Å; E69-R73 WeakPolarHBondContact O-CB 3.36Å; E69-R73 WeakPolarHBondContact O-CG 3.48Å; E69-R73 PolarHBondContact O-N 3.41Å; E69-R73 IonicContact OE1-CZ 3.72Å; E69-R73 IonicContact OE1-NH1 2.66Å; E69-R73 PolarHBondContact OE1-NH1 3.4Å; A70-R73 PolarHBondContact O-N 3.43Å; T71-R73 PolarHBondContact O-N 2.71Å; R73-G76 PolarHBondContact O-N 2.8Å; R73-L77 VanDerWaalsContact O-CB 3.23Å; R73-L77 WeakPolarHBondContact O-CB 3.49Å; R73-L77 WeakPolarHBondContact O-CG 3.33Å; R73-L77 PolarHBondContact O-N 3.35Å
74R83Confident79.1Confident175 Ų17598.1 Ų98.166%0.6653%0.527SS*.Hα-helixtrans-63.1-46.9172.8-70.1172.2-174.2-164.62.2111.5A70 T71 M72 G76 L77 I78A70-R74 VanDerWaalsContact O-CG 3.29Å; A70-R74 WeakPolarHBondContact O-CG 3.13Å; A70-R74 PolarHBondContact O-N 3.5Å; T71-R74 WeakPolarHBondContact O-CB 3.46Å; T71-R74 PolarHBondContact O-N 3.28Å; M72-R74 VanDerWaalsContact C-N 3.34Å; R74-G76 PolarHBondContact O-N 2.98Å; R74-L77 PolarHBondContact O-N 2.82Å; R74-I78 WeakPolarHBondContact O-CB 3.14Å; R74-I78 WeakPolarHBondContact O-CD1 3.15Å; R74-I78 WeakPolarHBondContact O-CG1 3.23Å; R74-I78 PolarHBondContact O-N 3.45Å
75L83.6Confident78.1Confident109 Ų109105.8 Ų105.857%0.57155%0.546SS*.Hα-helixtrans-64.5-39.7177.2-94.370.1000112.4T71 M72 I78 S79T71-L75 HydrophobicContact CG2-CD1 3.94Å; T71-L75 VanDerWaalsContact O-CD1 3.28Å; T71-L75 WeakPolarHBondContact O-CD1 3.37Å; T71-L75 PolarHBondContact O-N 3.49Å; M72-L75 PolarHBondContact O-N 3.48Å; L75-I78 PolarHBondContact O-N 2.87Å; L75-S79 WeakPolarHBondContact O-CB 3.41Å; L75-S79 PolarHBondContact O-N 2.75Å
76G80.9Confident77.3Confident34 Ų34104.8 Ų104.835%0.35155%0.547SS..Hα-helixtrans-69.3-39.1177.600000112M72 R73 R74 S79 R80M72-G76 WeakPolarHBondContact O-CA 3.47Å; M72-G76 PolarHBondContact O-N 3.33Å; R73-G76 PolarHBondContact O-N 2.8Å; R74-G76 PolarHBondContact O-N 2.98Å; G76-S79 PolarHBondContact O-N 3.49Å; G76-R80 WeakPolarHBondContact O-CB 3.29Å; G76-R80 PolarHBondContact O-N 2.8Å
77L71.9Confident76.6Confident118 Ų118104.7 Ų104.762%0.61855%0.549SS*.Hα-helixtrans-65.3-42.5169.8-72.7170.8000110.7R73 R74 S79 S81R73-L77 VanDerWaalsContact O-CB 3.23Å; R73-L77 WeakPolarHBondContact O-CB 3.49Å; R73-L77 WeakPolarHBondContact O-CG 3.33Å; R73-L77 PolarHBondContact O-N 3.35Å; R74-L77 PolarHBondContact O-N 2.82Å; L77-S79 VanDerWaalsContact C-N 3.34Å; L77-S79 PolarHBondContact O-N 2.88Å; L77-S81 WeakPolarHBondContact O-CA 3.45Å; L77-S81 WeakPolarHBondContact O-CB 2.92Å; L77-S81 PolarHBondContact O-N 2.7Å; L77-S81 PolarHBondContact O-OG 2.95Å; L77-S81 VanDerWaalsContact O-OG 3.06Å
78I68.4Low76.2Confident116 Ų116105.6 Ų105.660%0.59555%0.551SS**Hα-helixtrans-66.8-37.3176.7-68.7160.9000111.1R74 L75 S81 G82R74-I78 WeakPolarHBondContact O-CB 3.14Å; R74-I78 WeakPolarHBondContact O-CD1 3.15Å; R74-I78 WeakPolarHBondContact O-CG1 3.23Å; R74-I78 PolarHBondContact O-N 3.45Å; L75-I78 PolarHBondContact O-N 2.87Å; I78-S81 CarbonylContact O-C 3.54Å; I78-G82 PolarHBondContact O-N 3.47Å
79S68.7Low75.9Confident99 Ų99108 Ų10869%0.69255%0.553SS**Hα-helixtrans-69.3-44.2178.2-1800000111.8L75 G76 L77L75-S79 WeakPolarHBondContact O-CB 3.41Å; L75-S79 PolarHBondContact O-N 2.75Å; G76-S79 PolarHBondContact O-N 3.49Å; L77-S79 VanDerWaalsContact C-N 3.34Å; L77-S79 PolarHBondContact O-N 2.88Å
80R62.6Low75.7Confident229 Ų229110.6 Ų110.686%0.86457%0.569SS**Hα-helixtrans-81.8-26.6175.3-85.2173.776.4177.53.8114.2G76 G82G76-R80 WeakPolarHBondContact O-CB 3.29Å; G76-R80 PolarHBondContact O-N 2.8Å; R80-G82 VanDerWaalsContact C-N 3.33Å
81S58.5Low75.7Confident82 Ų82113.7 Ų113.757%0.57358%0.578SS**  trans-95.212.6175.4104.50000112.4L77 I78 S83L77-S81 WeakPolarHBondContact O-CA 3.45Å; L77-S81 WeakPolarHBondContact O-CB 2.92Å; L77-S81 PolarHBondContact O-N 2.7Å; L77-S81 PolarHBondContact O-OG 2.95Å; L77-S81 VanDerWaalsContact O-OG 3.06Å; I78-S81 CarbonylContact O-C 3.54Å; S81-S83 WeakPolarHBondContact O-CA 3.44Å; S81-S83 PolarHBondContact O-N 3.06Å
82G58Low75.9Confident47 Ų47115.4 Ų115.449%0.48559%0.585SS.*SBendtrans-54.882.9144.400000106.7I78 R80 A84I78-G82 PolarHBondContact O-N 3.47Å; R80-G82 VanDerWaalsContact C-N 3.33Å; G82-A84 PolarHBondContact O-N 2.95Å
83S63.8Low76.2Confident28 Ų28116 Ų11620%0.19658%0.584CS.*  trans-43.2112.7-158177.70000110.4S81 R85 F86 T87S81-S83 WeakPolarHBondContact O-CA 3.44Å; S81-S83 PolarHBondContact O-N 3.06Å; S83-R85 CarbonylContact O-C 3.56Å; S83-R85 PolarHBondContact O-N 3.47Å; S83-R85 VanDerWaalsContact OG-CB 3.28Å; S83-R85 WeakPolarHBondContact OG-CB 3.45Å; S83-R85 PolarHBondContact OG-N 3.25Å; S83-F86 WeakPolarHBondContact O-CA 3.35Å; S83-F86 PolarHBondContact O-N 3.32Å; S83-F86 PolarHBondContact OG-N 3.42Å; S83-T87 PolarHBondContact O-N 2.92Å; S83-T87 PolarHBondContact O-OG1 3.06Å
84A64.5Low76.5Confident78 Ų78110.9 Ų110.965%0.64557%0.573SS**Hα-helixtrans-49-27.4167.800000110.7G82 L88G82-A84 PolarHBondContact O-N 2.95Å; A84-L88 WeakPolarHBondContact O-CB 3.48Å; A84-L88 PolarHBondContact O-N 2.64Å
85R68.4Low77Confident194 Ų194109.5 Ų109.573%0.73257%0.572SS**Hα-helixtrans-68.8-48.5170.6-46.8177.5-179.5148.7-0.6112.5S83 L88 Y89S83-R85 CarbonylContact O-C 3.56Å; S83-R85 PolarHBondContact O-N 3.47Å; S83-R85 VanDerWaalsContact OG-CB 3.28Å; S83-R85 WeakPolarHBondContact OG-CB 3.45Å; S83-R85 PolarHBondContact OG-N 3.25Å; R85-L88 PolarHBondContact O-N 2.96Å; R85-Y89 HydrophobicContact CB-CD2 4.38Å; R85-Y89 HydrophobicContact CB-CE2 4.16Å; R85-Y89 WeakPolarHBondContact O-CB 3.2Å; R85-Y89 WeakPolarHBondContact O-CD2 3.23Å; R85-Y89 PolarHBondContact O-N 3.25Å
86F74.6Confident77.5Confident151 Ų151108.9 Ų108.966%0.66257%0.567SS**Hα-helixtrans-61.6-44.8175.3-74.1-60.4000111.6S83 L88 Y89 L90S83-F86 WeakPolarHBondContact O-CA 3.35Å; S83-F86 PolarHBondContact O-N 3.32Å; S83-F86 PolarHBondContact OG-N 3.42Å; F86-L88 VanDerWaalsContact C-N 3.32Å; F86-L88 PolarHBondContact O-N 3.34Å; F86-Y89 PolarHBondContact O-N 2.88Å; F86-L90 WeakPolarHBondContact O-CG 3.34Å; F86-L90 PolarHBondContact O-N 2.79Å
87T76.8Confident78.1Confident78 Ų78110.7 Ų110.748%0.47957%0.572SS.*Hα-helixtrans-60.7-41.8175.3-51.10000111.2S83 L90 I91S83-T87 PolarHBondContact O-N 2.92Å; S83-T87 PolarHBondContact O-OG1 3.06Å; T87-L90 PolarHBondContact O-N 3.02Å; T87-I91 HydrophobicContact CG2-CD1 4.23Å; T87-I91 WeakPolarHBondContact O-CG1 3.5Å; T87-I91 PolarHBondContact O-N 3.32Å
88L82.7Confident79.1Confident109 Ų109112.2 Ų112.257%0.57157%0.573SS**Hα-helixtrans-67.2-39175.9-175.2126.6000112.7A84 R85 F86 L90 I91 L92A84-L88 WeakPolarHBondContact O-CB 3.48Å; A84-L88 PolarHBondContact O-N 2.64Å; R85-L88 PolarHBondContact O-N 2.96Å; F86-L88 VanDerWaalsContact C-N 3.32Å; F86-L88 PolarHBondContact O-N 3.34Å; L88-L90 VanDerWaalsContact C-N 3.35Å; L88-I91 PolarHBondContact O-N 3.07Å; L88-L92 WeakPolarHBondContact O-CB 3.32Å; L88-L92 PolarHBondContact O-N 3.28Å
89Y87Confident80.2Confident150 Ų150109.4 Ų109.459%0.58856%0.562SS**Hα-helixtrans-62-41.4172.9-77.8-62.7000111.5R85 F86 L92 F93R85-Y89 HydrophobicContact CB-CD2 4.38Å; R85-Y89 HydrophobicContact CB-CE2 4.16Å; R85-Y89 WeakPolarHBondContact O-CB 3.2Å; R85-Y89 WeakPolarHBondContact O-CD2 3.23Å; R85-Y89 PolarHBondContact O-N 3.25Å; F86-Y89 PolarHBondContact O-N 2.88Å; Y89-L92 PolarHBondContact O-N 3.4Å; Y89-F93 WeakPolarHBondContact O-CB 3.46Å; Y89-F93 PolarHBondContact O-N 3.46Å
90L86.8Confident81.3Confident124 Ų124110 Ų11065%0.64956%0.555SS**Hα-helixtrans-64.9-40175.5-69.8-169.4000112.3F86 T87 L88 S94F86-L90 WeakPolarHBondContact O-CG 3.34Å; F86-L90 PolarHBondContact O-N 2.79Å; T87-L90 PolarHBondContact O-N 3.02Å; L88-L90 VanDerWaalsContact C-N 3.35Å; L90-S94 WeakPolarHBondContact O-CB 3.43Å; L90-S94 PolarHBondContact O-N 2.79Å
91I89.3Confident82.7Confident110 Ų110104.9 Ų104.956%0.56454%0.542SS*.Hα-helixtrans-64.6-46.5175.5-69165.4000110.9T87 L88 S94 F95T87-I91 HydrophobicContact CG2-CD1 4.23Å; T87-I91 WeakPolarHBondContact O-CG1 3.5Å; T87-I91 PolarHBondContact O-N 3.32Å; L88-I91 PolarHBondContact O-N 3.07Å; I91-S94 WeakPolarHBondContact O-CB 3.21Å; I91-S94 PolarHBondContact O-N 3.27Å; I91-F95 PolarHBondContact O-N 3.44Å
92L91.7Very high84.3Confident104 Ų104107.3 Ų107.355%0.54554%0.54SS..Hα-helixtrans-63.1-45.1179.1-163169.7000110.7L88 Y89 S94 F95 M96L88-L92 WeakPolarHBondContact O-CB 3.32Å; L88-L92 PolarHBondContact O-N 3.28Å; Y89-L92 PolarHBondContact O-N 3.4Å; L92-S94 PolarHBondContact O-N 2.89Å; L92-F95 PolarHBondContact O-N 3.24Å; L92-M96 WeakPolarHBondContact O-CB 2.94Å; L92-M96 PolarHBondContact O-N 2.94Å
93F93.4Very high86Confident139 Ų139112.6 Ų112.661%0.6155%0.546SS*.Hα-helixtrans-57.9-47.1175.3179.5-100.5000111.7Y89 F95 M96 V97Y89-F93 WeakPolarHBondContact O-CB 3.46Å; Y89-F93 PolarHBondContact O-N 3.46Å; F93-F95 PolarHBondContact O-N 2.86Å; F93-M96 PolarHBondContact O-N 3.35Å; F93-V97 HydrophobicContact CE1-CG2 4.21Å; F93-V97 HydrophobicContact CZ-CG2 4.19Å; F93-V97 WeakPolarHBondContact O-CG2 3.28Å; F93-V97 PolarHBondContact O-N 3.44Å; F93-V97 VanDerWaalsContact O-N 3.07Å
94S91.8Very high87.3Confident55 Ų55118.4 Ų118.439%0.38557%0.572SS.*Hα-helixtrans-58.2-47.2175.3-176.60000111.7L90 I91 L92 M96 V97 F98L90-S94 WeakPolarHBondContact O-CB 3.43Å; L90-S94 PolarHBondContact O-N 2.79Å; I91-S94 WeakPolarHBondContact O-CB 3.21Å; I91-S94 PolarHBondContact O-N 3.27Å; L92-S94 PolarHBondContact O-N 2.89Å; S94-M96 VanDerWaalsContact C-N 3.33Å; S94-M96 PolarHBondContact O-N 3.03Å; S94-V97 PolarHBondContact O-N 3.27Å; S94-F98 WeakPolarHBondContact O-CD2 3.41Å; S94-F98 PolarHBondContact O-N 2.93Å
95F94Very high88.5Confident145 Ų145120.8 Ų120.864%0.63657%0.573SS**Hα-helixtrans-61.8-40.8178.6-160-97.7000112.3I91 L92 F93 V97 F98 V99I91-F95 PolarHBondContact O-N 3.44Å; L92-F95 PolarHBondContact O-N 3.24Å; F93-F95 PolarHBondContact O-N 2.86Å; F95-V97 PolarHBondContact O-N 3.5Å; F95-F98 PolarHBondContact O-N 3.41Å; F95-V99 HydrophobicContact CD1-CG2 3.93Å; F95-V99 HydrophobicContact CE1-CG2 3.79Å; F95-V99 VanDerWaalsContact O-CG2 3.3Å; F95-V99 WeakPolarHBondContact O-CG2 3.49Å; F95-V99 PolarHBondContact O-N 2.9Å
96M93.4Very high89.5Confident97 Ų97120.5 Ų120.548%0.47857%0.572SS.*Hα-helixtrans-62-43.1177.4-163.2-79.2177.700111.5L92 F93 S94 V99 M100L92-M96 WeakPolarHBondContact O-CB 2.94Å; L92-M96 PolarHBondContact O-N 2.94Å; F93-M96 PolarHBondContact O-N 3.35Å; S94-M96 VanDerWaalsContact C-N 3.33Å; S94-M96 PolarHBondContact O-N 3.03Å; M96-V99 PolarHBondContact O-N 3.21Å; M96-M100 HydrophobicContact CE-CE 3.51Å; M96-M100 HydrophobicContact CE-CG 3.93Å; M96-M100 PolarHBondContact O-N 2.9Å; M96-M100 HydrophobicContact SD-CG 3.8Å
97V93.2Very high89.5Confident72 Ų72126.2 Ų126.244%0.43659%0.589SS.*Hα-helixtrans-63.6-44.1174.8173.40000111.6F93 S94 F95 V99 M100 M101F93-V97 HydrophobicContact CE1-CG2 4.21Å; F93-V97 HydrophobicContact CZ-CG2 4.19Å; F93-V97 WeakPolarHBondContact O-CG2 3.28Å; F93-V97 PolarHBondContact O-N 3.44Å; F93-V97 VanDerWaalsContact O-N 3.07Å; S94-V97 PolarHBondContact O-N 3.27Å; F95-V97 PolarHBondContact O-N 3.5Å; V97-V99 VanDerWaalsContact C-N 3.34Å; V97-V99 PolarHBondContact O-N 3.49Å; V97-M100 PolarHBondContact O-N 3.4Å; V97-M101 WeakPolarHBondContact O-CB 3.45Å; V97-M101 PolarHBondContact O-N 3.43Å
98F93.7Very high90.2Very high150 Ų150128.7 Ų128.766%0.65860%0.595SS**Hα-helixtrans-60-42.9175.5-93.5-76.9000112.4S94 F95 M101 Y102S94-F98 WeakPolarHBondContact O-CD2 3.41Å; S94-F98 PolarHBondContact O-N 2.93Å; F95-F98 PolarHBondContact O-N 3.41Å; F98-M101 PolarHBondContact O-N 2.9Å; F98-Y102 WeakPolarHBondContact O-CB 3.03Å; F98-Y102 PolarHBondContact O-N 2.93Å
99V91.9Very high90.5Very high57 Ų57129.7 Ų129.735%0.34560%0.596SS.*Hα-helixtrans-64.5-47.2176.8170.60000110.7F95 M96 V97 M101 Y102 Y103F95-V99 HydrophobicContact CD1-CG2 3.93Å; F95-V99 HydrophobicContact CE1-CG2 3.79Å; F95-V99 VanDerWaalsContact O-CG2 3.3Å; F95-V99 WeakPolarHBondContact O-CG2 3.49Å; F95-V99 PolarHBondContact O-N 2.9Å; M96-V99 PolarHBondContact O-N 3.21Å; V97-V99 VanDerWaalsContact C-N 3.34Å; V97-V99 PolarHBondContact O-N 3.49Å; V99-M101 VanDerWaalsContact C-N 3.31Å; V99-M101 PolarHBondContact O-N 3.33Å; V99-Y102 PolarHBondContact O-N 3.45Å; V99-Y103 HydrophobicContact CG1-CD2 3.59Å; V99-Y103 HydrophobicContact CG1-CE2 3.63Å; V99-Y103 VanDerWaalsContact O-CD2 3.31Å; V99-Y103 WeakPolarHBondContact O-CD2 3.31Å; V99-Y103 PolarHBondContact O-N 2.92Å
100M91.1Very high90.7Very high112 Ų112128.6 Ų128.655%0.55260%0.596SS**Hα-helixtrans-57.6-44.3176.1-83.8-67.7172.700111.9M96 V97 Y103 M104M96-M100 HydrophobicContact CE-CE 3.51Å; M96-M100 HydrophobicContact CE-CG 3.93Å; M96-M100 PolarHBondContact O-N 2.9Å; M96-M100 HydrophobicContact SD-CG 3.8Å; V97-M100 PolarHBondContact O-N 3.4Å; M100-Y103 PolarHBondContact O-N 3.3Å; M100-M104 WeakPolarHBondContact O-CB 3.3Å; M100-M104 PolarHBondContact O-N 3.24Å
101M91.4Very high91Very high121 Ų121128.8 Ų128.860%0.59659%0.593SS**Hα-helixtrans-64.6-42.8176.5-170.4154.9-177.800112V97 F98 V99 Y103 M104 L105V97-M101 WeakPolarHBondContact O-CB 3.45Å; V97-M101 PolarHBondContact O-N 3.43Å; F98-M101 PolarHBondContact O-N 2.9Å; V99-M101 VanDerWaalsContact C-N 3.31Å; V99-M101 PolarHBondContact O-N 3.33Å; M101-Y103 PolarHBondContact O-N 3.49Å; M101-M104 PolarHBondContact O-N 2.92Å; M101-L105 HydrophobicContact CE-CD1 3.91Å; M101-L105 HydrophobicContact CG-CD1 3.53Å; M101-L105 VanDerWaalsContact O-CD1 3.23Å; M101-L105 WeakPolarHBondContact O-CD1 3.37Å; M101-L105 PolarHBondContact O-N 2.94Å
102Y93.5Very high91.1Very high133 Ų133130 Ų13052%0.52260%0.595SS.*Hα-helixtrans-61.5-43.6175.6179.8-96.5000112.4F98 V99 M104 L105 R106F98-Y102 WeakPolarHBondContact O-CB 3.03Å; F98-Y102 PolarHBondContact O-N 2.93Å; V99-Y102 PolarHBondContact O-N 3.45Å; Y102-M104 VanDerWaalsContact C-N 3.34Å; Y102-M104 PolarHBondContact O-N 2.88Å; Y102-L105 PolarHBondContact O-N 2.97Å; Y102-R106 VanDerWaalsContact O-CB 3.24Å; Y102-R106 WeakPolarHBondContact O-CB 3.24Å; Y102-R106 PolarHBondContact O-N 2.98Å; Y102-R106 PolarHBondContact OH-NH1 3.37Å
103Y93.1Very high91Very high158 Ų158131.7 Ų131.762%0.6260%0.599SS**Hα-helixtrans-64.2-38.3175.4-88.8-78.1000112V99 M100 M101 R107V99-Y103 HydrophobicContact CG1-CD2 3.59Å; V99-Y103 HydrophobicContact CG1-CE2 3.63Å; V99-Y103 VanDerWaalsContact O-CD2 3.31Å; V99-Y103 WeakPolarHBondContact O-CD2 3.31Å; V99-Y103 PolarHBondContact O-N 2.92Å; M100-Y103 PolarHBondContact O-N 3.3Å; M101-Y103 PolarHBondContact O-N 3.49Å; Y103-R107 WeakPolarHBondContact O-CB 3.16Å; Y103-R107 PolarHBondContact O-N 2.9Å
104M91.4Very high90.9Very high150 Ų150131.2 Ų131.274%0.73960%0.598SS**Hα-helixtrans-72.4-31179-153.7-163.1104.900113.1M100 M101 Y102M100-M104 WeakPolarHBondContact O-CB 3.3Å; M100-M104 PolarHBondContact O-N 3.24Å; M101-M104 PolarHBondContact O-N 2.92Å; Y102-M104 VanDerWaalsContact C-N 3.34Å; Y102-M104 PolarHBondContact O-N 2.88Å
105L90.1Very high90.8Very high128 Ų128137.1 Ų137.167%0.6761%0.614SS**Hα-helixtrans-80.1-28.4173.7-91.2109.6000113.3M101 Y102M101-L105 HydrophobicContact CE-CD1 3.91Å; M101-L105 HydrophobicContact CG-CD1 3.53Å; M101-L105 VanDerWaalsContact O-CD1 3.23Å; M101-L105 WeakPolarHBondContact O-CD1 3.37Å; M101-L105 PolarHBondContact O-N 2.94Å; Y102-L105 PolarHBondContact O-N 2.97Å
106R89.7Confident90.5Very high188 Ų188136.4 Ų136.471%0.70961%0.612SS**Hα-helixtrans-86.1-20.5178.8-174.4169.3176177.1-3.4112.9Y102Y102-R106 VanDerWaalsContact O-CB 3.24Å; Y102-R106 WeakPolarHBondContact O-CB 3.24Å; Y102-R106 PolarHBondContact O-N 2.98Å; Y102-R106 PolarHBondContact OH-NH1 3.37Å
107R74Confident90.3Very high271 Ų271140 Ų140100%1.02363%0.625SS**  trans-82.40171.9-178.273.5169.9136.20.3110.4Y103Y103-R107 WeakPolarHBondContact O-CB 3.16Å; Y103-R107 PolarHBondContact O-N 2.9Å

Retrieved 107 of 107 residues in 195.4 ms (Link to these results)