A0A077ZMN2_TRITR Loading...

DUF7041 domain-containing protein

AlphaFold DB , UniProt , Accession A0A077ZMN2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 143 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
1M55Low77.5Confident189 Ų189102.5 Ų102.593%0.93152%0.519SS*.  01180-66-61.5-108.500106.9
2P69.6Low78.4Confident67 Ų6795.9 Ų95.944%0.43548%0.484SS..  trans-59143.6174.8-0.16.3000110.3E4 T5P2-E4 PolarHBondContact O-N 3.34Å; P2-T5 WeakPolarHBondContact CD-OG1 3.15Å; P2-T5 WeakPolarHBondContact CG-OG1 3.5Å; P2-T5 VanDerWaalsContact O-CB 3.3Å; P2-T5 WeakPolarHBondContact O-CB 3.5Å; P2-T5 PolarHBondContact O-N 3.27Å; P2-T5 PolarHBondContact O-OG1 3.1Å
3E73.5Confident79.1Confident171 Ų17197.1 Ų97.180%0.79949%0.491SS*.Hα-helixtrans-59.8-32.4-178.4-172.3158.6-170.800112.2T5 L6 G7E3-T5 VanDerWaalsContact C-N 3.26Å; E3-T5 PolarHBondContact O-N 3.27Å; E3-L6 PolarHBondContact O-N 3.28Å; E3-L6 VanDerWaalsContact O-N 3.16Å; E3-G7 PolarHBondContact O-N 3.18Å; E3-G7 VanDerWaalsContact O-N 3.07Å
4E75.5Confident79.7Confident154 Ų15498.9 Ų98.972%0.7250%0.502SS*.Hα-helixtrans-60.5-33.2174.2-58.7179.8172.300113.1P2 G7 T8P2-E4 PolarHBondContact O-N 3.34Å; E4-G7 PolarHBondContact O-N 3.38Å; E4-T8 PolarHBondContact O-N 3.34Å; E4-T8 PolarHBondContact O-OG1 2.9Å
5T73.8Confident80.3Confident39 Ų3996.3 Ų96.324%0.23949%0.493CS..Hα-helixtrans-68.4-40.5177.1-48.50000111P2 E3 L9P2-T5 WeakPolarHBondContact CD-OG1 3.15Å; P2-T5 WeakPolarHBondContact CG-OG1 3.5Å; P2-T5 VanDerWaalsContact O-CB 3.3Å; P2-T5 WeakPolarHBondContact O-CB 3.5Å; P2-T5 PolarHBondContact O-N 3.27Å; P2-T5 PolarHBondContact O-OG1 3.1Å; E3-T5 VanDerWaalsContact C-N 3.26Å; E3-T5 PolarHBondContact O-N 3.27Å; T5-L9 WeakPolarHBondContact O-CB 3.38Å; T5-L9 PolarHBondContact O-N 3.05Å; T5-L9 VanDerWaalsContact O-N 3.09Å
6L78.8Confident80.5Confident102 Ų10291.8 Ų91.853%0.53447%0.474SS..Hα-helixtrans-67.3-39.9177.2-66.4176.9000111.2E3 L9 R10E3-L6 PolarHBondContact O-N 3.28Å; E3-L6 VanDerWaalsContact O-N 3.16Å; L6-L9 PolarHBondContact O-N 3.09Å; L6-R10 VanDerWaalsContact O-CB 3.31Å; L6-R10 WeakPolarHBondContact O-CB 3.35Å; L6-R10 PolarHBondContact O-N 3.48Å
7G84.6Confident80.7Confident29 Ų2994.3 Ų94.330%0.29949%0.489SS..Hα-helixtrans-58.1-52.2174.100000112.2E3 E4 L9 R10 D11E3-G7 PolarHBondContact O-N 3.18Å; E3-G7 VanDerWaalsContact O-N 3.07Å; E4-G7 PolarHBondContact O-N 3.38Å; G7-L9 VanDerWaalsContact C-N 3.32Å; G7-L9 PolarHBondContact O-N 3.26Å; G7-R10 WeakPolarHBondContact O-CB 3.39Å; G7-R10 PolarHBondContact O-N 3.15Å; G7-R10 VanDerWaalsContact O-N 3.13Å; G7-D11 VanDerWaalsContact O-CG 3.27Å; G7-D11 PolarHBondContact O-N 3Å
8T83Confident81Confident33 Ų3397.4 Ų97.420%0.20250%0.5CS..Hα-helixtrans-60-42.3179.5-51.50000112.2E4 R10 D11 F12 V29 R33E4-T8 PolarHBondContact O-N 3.34Å; E4-T8 PolarHBondContact O-OG1 2.9Å; T8-R10 VanDerWaalsContact C-N 3.35Å; T8-D11 PolarHBondContact O-N 3.37Å; T8-F12 WeakPolarHBondContact O-CB 3Å; T8-F12 PolarHBondContact O-N 3Å; T8-V29 HydrophobicContact CG2-CG1 3.91Å; T8-R33 VanDerWaalsContact OG1-CZ 3.31Å; T8-R33 PolarHBondContact OG1-NE 2.85Å; T8-R33 PolarHBondContact OG1-NH2 2.97Å
9L84.1Confident81.2Confident64 Ų6496.6 Ų96.634%0.33549%0.494SS..Hα-helixtrans-66-39.6178.4-177.763.6000111.4T5 L6 G7 F12 I13 L26T5-L9 WeakPolarHBondContact O-CB 3.38Å; T5-L9 PolarHBondContact O-N 3.05Å; T5-L9 VanDerWaalsContact O-N 3.09Å; L6-L9 PolarHBondContact O-N 3.09Å; G7-L9 VanDerWaalsContact C-N 3.32Å; G7-L9 PolarHBondContact O-N 3.26Å; L9-F12 PolarHBondContact O-N 3.44Å; L9-I13 HydrophobicContact CD1-CD1 4.44Å; L9-I13 HydrophobicContact CG-CD1 4.06Å; L9-I13 VanDerWaalsContact O-CG1 3.25Å; L9-I13 WeakPolarHBondContact O-CG1 3.4Å; L9-I13 PolarHBondContact O-N 3.05Å; L9-L26 HydrophobicContact CD1-CD1 3.37Å
10R87.2Confident81.5Confident180 Ų18099.5 Ų99.568%0.67952%0.517SS*.Hα-helixtrans-61.8-47.7175.8-173.3-172.4-158.3176.24.2111.2L6 G7 T8 F12 I13 L14L6-R10 VanDerWaalsContact O-CB 3.31Å; L6-R10 WeakPolarHBondContact O-CB 3.35Å; L6-R10 PolarHBondContact O-N 3.48Å; G7-R10 WeakPolarHBondContact O-CB 3.39Å; G7-R10 PolarHBondContact O-N 3.15Å; G7-R10 VanDerWaalsContact O-N 3.13Å; T8-R10 VanDerWaalsContact C-N 3.35Å; R10-F12 VanDerWaalsContact C-N 3.28Å; R10-F12 PolarHBondContact O-N 3.41Å; R10-I13 PolarHBondContact O-N 3.16Å; R10-I13 VanDerWaalsContact O-N 3.17Å; R10-L14 HydrophobicContact CG-CD1 4.48Å; R10-L14 WeakPolarHBondContact O-CG 3.49Å; R10-L14 PolarHBondContact O-N 3.27Å
11D87.1Confident81.8Confident100 Ų10097 Ų9754%0.53551%0.511SS..Hα-helixtrans-63.1-37.5179.3-64.4-20.6000111.3G7 T8 L14 T15G7-D11 VanDerWaalsContact O-CG 3.27Å; G7-D11 PolarHBondContact O-N 3Å; T8-D11 PolarHBondContact O-N 3.37Å; D11-L14 PolarHBondContact O-N 3.06Å; D11-T15 PolarHBondContact O-N 2.58Å; D11-T15 PolarHBondContact O-OG1 3.41Å
12F88.7Confident83.3Confident23 Ų2391 Ų9110%0.10149%0.486CS..Hα-helixtrans-64-45.8172.7-179.2-90.8000112.1T8 L9 R10 L14 T15 A16 Q19 P22 A25 L26 V29T8-F12 WeakPolarHBondContact O-CB 3Å; T8-F12 PolarHBondContact O-N 3Å; L9-F12 PolarHBondContact O-N 3.44Å; R10-F12 VanDerWaalsContact C-N 3.28Å; R10-F12 PolarHBondContact O-N 3.41Å; F12-L14 VanDerWaalsContact C-N 3.25Å; F12-L14 PolarHBondContact O-N 3.42Å; F12-T15 CarbonylContact O-C 3.53Å; F12-T15 PolarHBondContact O-N 3.47Å; F12-T15 VanDerWaalsContact O-N 3.09Å; F12-T15 PolarHBondContact O-OG1 3.2Å; F12-A16 HydrophobicContact CE1-CB 4.22Å; F12-A16 WeakPolarHBondContact O-CB 3.26Å; F12-A16 PolarHBondContact O-N 2.94Å; F12-Q19 HydrophobicContact CE2-CG 4.44Å; F12-Q19 HydrophobicContact CZ-CG 4.48Å; F12-P22 WeakPolarHBondContact CZ-O 3.38Å; F12-A25 HydrophobicContact CE2-CB 3.65Å; F12-A25 HydrophobicContact CZ-CB 3.65Å; F12-L26 HydrophobicContact CD1-CB 4.21Å; F12-L26 HydrophobicContact CD1-CD1 3.64Å; F12-L26 HydrophobicContact CE1-CB 3.49Å; F12-L26 VanDerWaalsContact CE1-CB 3.49Å; F12-L26 HydrophobicContact CE1-CD1 3.82Å; F12-L26 HydrophobicContact CE1-CG 4.2Å; F12-L26 HydrophobicContact CG-CD1 4.49Å; F12-L26 HydrophobicContact CZ-CB 3.89Å; F12-V29 HydrophobicContact CD2-CG2 3.74Å; F12-V29 HydrophobicContact CE2-CG2 4.16Å; F12-V29 HydrophobicContact CG-CG2 4.38Å
13I87.4Confident84.1Confident111 Ų11195.3 Ų95.357%0.56950%0.498SS*.Hα-helixtrans-60.2-37.3178.2-70.2165.3000111.3L9 R10 T15 A16L9-I13 HydrophobicContact CD1-CD1 4.44Å; L9-I13 HydrophobicContact CG-CD1 4.06Å; L9-I13 VanDerWaalsContact O-CG1 3.25Å; L9-I13 WeakPolarHBondContact O-CG1 3.4Å; L9-I13 PolarHBondContact O-N 3.05Å; R10-I13 PolarHBondContact O-N 3.16Å; R10-I13 VanDerWaalsContact O-N 3.17Å; I13-T15 PolarHBondContact O-N 3.41Å; I13-A16 PolarHBondContact O-N 3.26Å
14L88Confident85Confident123 Ų12391.6 Ų91.664%0.64449%0.487SS*.Hα-helixtrans-68.1-19.7177.7-69.1173.5000114R10 D11 F12R10-L14 HydrophobicContact CG-CD1 4.48Å; R10-L14 WeakPolarHBondContact O-CG 3.49Å; R10-L14 PolarHBondContact O-N 3.27Å; D11-L14 PolarHBondContact O-N 3.06Å; F12-L14 VanDerWaalsContact C-N 3.25Å; F12-L14 PolarHBondContact O-N 3.42Å
15T87.9Confident85.6Confident60 Ų6085.2 Ų85.237%0.36846%0.461SS..Hα-helixtrans-114.85.2-178.754.10000113D11 F12 I13 D17 Q18D11-T15 PolarHBondContact O-N 2.58Å; D11-T15 PolarHBondContact O-OG1 3.41Å; F12-T15 CarbonylContact O-C 3.53Å; F12-T15 PolarHBondContact O-N 3.47Å; F12-T15 VanDerWaalsContact O-N 3.09Å; F12-T15 PolarHBondContact O-OG1 3.2Å; I13-T15 PolarHBondContact O-N 3.41Å; T15-D17 VanDerWaalsContact C-N 3.28Å; T15-D17 PolarHBondContact O-N 3.42Å; T15-Q18 PolarHBondContact O-N 3.24Å
16A84.5Confident86.4Confident24 Ų2485.9 Ų85.920%0.19846%0.463CS..G310 helixtrans-68.1-26.3-173.400000113.2F12 I13 Q18 Q19 P22F12-A16 HydrophobicContact CE1-CB 4.22Å; F12-A16 WeakPolarHBondContact O-CB 3.26Å; F12-A16 PolarHBondContact O-N 2.94Å; I13-A16 PolarHBondContact O-N 3.26Å; A16-Q18 PolarHBondContact O-N 2.98Å; A16-Q19 WeakPolarHBondContact O-CB 3.49Å; A16-Q19 PolarHBondContact O-N 2.83Å; A16-P22 HydrophobicContact CB-CB 4.47Å
17D82.6Confident86.9Confident134 Ų13487 Ų8772%0.71746%0.464SS*.G310 helixtrans-66.5-23.4177.565.2-31.9000113.3T15T15-D17 VanDerWaalsContact C-N 3.28Å; T15-D17 PolarHBondContact O-N 3.42Å
18Q86.6Confident87.1Confident150 Ų15087.8 Ų87.870%0.70147%0.467SS*.G310 helixtrans-86.1-8.1177-61.8176.8900113T15 A16T15-Q18 PolarHBondContact O-N 3.24Å; A16-Q18 PolarHBondContact O-N 2.98Å
19Q85Confident87.3Confident83 Ų8387.9 Ų87.939%0.38847%0.468SS..  trans-86.2131.9-177.8-61.5-62.1-43.200111.1F12 A16 A21 P22 A25F12-Q19 HydrophobicContact CE2-CG 4.44Å; F12-Q19 HydrophobicContact CZ-CG 4.48Å; A16-Q19 WeakPolarHBondContact O-CB 3.49Å; A16-Q19 PolarHBondContact O-N 2.83Å; Q19-A21 PolarHBondContact O-N 3.06Å; Q19-P22 HydrophobicContact CB-CB 4.34Å; Q19-A25 HydrophobicContact CG-CB 4.22Å
20T86.5Confident87.4Confident153 Ų15388 Ų8894%0.93947%0.473SS*.SBendtrans-63.4-29.8174.9-46.90000112.5
21A88.9Confident87.4Confident47 Ų4783.5 Ų83.539%0.38846%0.462SS..SBendtrans-139.378.7179.100000110.2Q19 F23 T24 A25Q19-A21 PolarHBondContact O-N 3.06Å; A21-F23 VanDerWaalsContact C-N 3.31Å; A21-F23 PolarHBondContact O-N 3.13Å; A21-T24 PolarHBondContact O-N 3.38Å; A21-T24 VanDerWaalsContact O-N 3.08Å; A21-A25 PolarHBondContact O-N 2.95Å
22P86.5Confident87.3Confident64 Ų6483.8 Ų83.842%0.41646%0.463SS..Hα-helixtrans-60.8-37.5-168.422.1-33.4000113F12 A16 Q19 A25 L26F12-P22 WeakPolarHBondContact CZ-O 3.38Å; A16-P22 HydrophobicContact CB-CB 4.47Å; Q19-P22 HydrophobicContact CB-CB 4.34Å; P22-A25 PolarHBondContact O-N 3.1Å; P22-L26 VanDerWaalsContact O-CB 3.29Å; P22-L26 WeakPolarHBondContact O-CB 3.42Å; P22-L26 PolarHBondContact O-N 2.88Å
23F86.7Confident87.1Confident157 Ų15787.1 Ų87.169%0.68948%0.475SS*.Hα-helixtrans-66.6-39.1177.3-176.8-99.8000112.7A21 L26 K27A21-F23 VanDerWaalsContact C-N 3.31Å; A21-F23 PolarHBondContact O-N 3.13Å; F23-L26 PolarHBondContact O-N 2.95Å; F23-K27 WeakPolarHBondContact O-CB 3.01Å; F23-K27 PolarHBondContact O-N 3.43Å
24T90.6Very high86.8Confident93 Ų9387.3 Ų87.357%0.57148%0.477SS*.Hα-helixtrans-67-44.3177.7-56.20000110.8A21 K27 A28A21-T24 PolarHBondContact O-N 3.38Å; A21-T24 VanDerWaalsContact O-N 3.08Å; T24-K27 PolarHBondContact O-N 2.98Å; T24-A28 PolarHBondContact O-N 3.11Å
25A89.8Confident86.4Confident21 Ų2187.6 Ų87.617%0.17448%0.477CS..Hα-helixtrans-64.3-41176.500000111.3F12 Q19 A21 P22 K27 A28 V29F12-A25 HydrophobicContact CE2-CB 3.65Å; F12-A25 HydrophobicContact CZ-CB 3.65Å; Q19-A25 HydrophobicContact CG-CB 4.22Å; A21-A25 PolarHBondContact O-N 2.95Å; P22-A25 PolarHBondContact O-N 3.1Å; A25-K27 VanDerWaalsContact C-N 3.35Å; A25-K27 PolarHBondContact O-N 3.22Å; A25-A28 WeakPolarHBondContact O-CB 3.37Å; A25-A28 PolarHBondContact O-N 3.03Å; A25-V29 WeakPolarHBondContact O-CG2 3.37Å; A25-V29 PolarHBondContact O-N 3.33Å
26L89Confident86Confident52 Ų5288.2 Ų88.227%0.27248%0.478SS..Hα-helixtrans-59.1-46.8173.7179.161.1000111.4L9 F12 P22 F23 A28 V29 C30L9-L26 HydrophobicContact CD1-CD1 3.37Å; F12-L26 HydrophobicContact CD1-CB 4.21Å; F12-L26 HydrophobicContact CD1-CD1 3.64Å; F12-L26 HydrophobicContact CE1-CB 3.49Å; F12-L26 VanDerWaalsContact CE1-CB 3.49Å; F12-L26 HydrophobicContact CE1-CD1 3.82Å; F12-L26 HydrophobicContact CE1-CG 4.2Å; F12-L26 HydrophobicContact CG-CD1 4.49Å; F12-L26 HydrophobicContact CZ-CB 3.89Å; P22-L26 VanDerWaalsContact O-CB 3.29Å; P22-L26 WeakPolarHBondContact O-CB 3.42Å; P22-L26 PolarHBondContact O-N 2.88Å; F23-L26 PolarHBondContact O-N 2.95Å; L26-A28 VanDerWaalsContact C-N 3.29Å; L26-A28 PolarHBondContact O-N 3.3Å; L26-V29 PolarHBondContact O-N 3.49Å; L26-C30 WeakPolarHBondContact O-CB 3.36Å; L26-C30 PolarHBondContact O-N 3.1Å; L26-C30 PolarHBondContact O-SG 3.37Å; L26-C30 VanDerWaalsContact O-SG 3.4Å
27K89.6Confident85.7Confident127 Ų12790.3 Ų90.355%0.55249%0.485SS*.Hα-helixtrans-59.2-42.1177.8-176.3179.8177.71790111.2F23 T24 A25 C30 L31F23-K27 WeakPolarHBondContact O-CB 3.01Å; F23-K27 PolarHBondContact O-N 3.43Å; T24-K27 PolarHBondContact O-N 2.98Å; A25-K27 VanDerWaalsContact C-N 3.35Å; A25-K27 PolarHBondContact O-N 3.22Å; K27-C30 PolarHBondContact O-N 2.83Å; K27-L31 HydrophobicContact CG-CD1 4.05Å; K27-L31 HydrophobicContact CG-CG 4.46Å; K27-L31 WeakPolarHBondContact O-CB 3.42Å; K27-L31 VanDerWaalsContact O-CG 3.24Å; K27-L31 WeakPolarHBondContact O-CG 3.36Å; K27-L31 PolarHBondContact O-N 2.83Å
28A89.8Confident85.3Confident45 Ų4591 Ų9137%0.37248%0.478SS..Hα-helixtrans-60.8-49.2175.800000111.3T24 A25 L26 C30 L31 D32T24-A28 PolarHBondContact O-N 3.11Å; A25-A28 WeakPolarHBondContact O-CB 3.37Å; A25-A28 PolarHBondContact O-N 3.03Å; L26-A28 VanDerWaalsContact C-N 3.29Å; L26-A28 PolarHBondContact O-N 3.3Å; A28-C30 VanDerWaalsContact C-N 3.34Å; A28-C30 PolarHBondContact O-N 3.05Å; A28-L31 PolarHBondContact O-N 2.86Å; A28-L31 VanDerWaalsContact O-N 3.11Å; A28-D32 PolarHBondContact O-N 2.91Å
29V87.4Confident84.7Confident35 Ų3585.3 Ų85.321%0.21246%0.457CS..Hα-helixtrans-58.4-44.7176.9173.30000111.8T8 F12 A25 L26 L31 D32 R33T8-V29 HydrophobicContact CG2-CG1 3.91Å; F12-V29 HydrophobicContact CD2-CG2 3.74Å; F12-V29 HydrophobicContact CE2-CG2 4.16Å; F12-V29 HydrophobicContact CG-CG2 4.38Å; A25-V29 WeakPolarHBondContact O-CG2 3.37Å; A25-V29 PolarHBondContact O-N 3.33Å; L26-V29 PolarHBondContact O-N 3.49Å; V29-L31 VanDerWaalsContact C-N 3.34Å; V29-L31 PolarHBondContact O-N 3.25Å; V29-D32 PolarHBondContact O-N 3.47Å; V29-R33 WeakPolarHBondContact O-CB 3.28Å; V29-R33 WeakPolarHBondContact O-CG 3.47Å; V29-R33 PolarHBondContact O-N 3.33Å
30C86.8Confident84.3Confident67 Ų6786 Ų8645%0.45346%0.46SS..Hα-helixtrans-61.6-41.8176.1-73.60000112.4L26 K27 A28 L34L26-C30 WeakPolarHBondContact O-CB 3.36Å; L26-C30 PolarHBondContact O-N 3.1Å; L26-C30 PolarHBondContact O-SG 3.37Å; L26-C30 VanDerWaalsContact O-SG 3.4Å; K27-C30 PolarHBondContact O-N 2.83Å; A28-C30 VanDerWaalsContact C-N 3.34Å; A28-C30 PolarHBondContact O-N 3.05Å; C30-L34 WeakPolarHBondContact O-CB 3.35Å; C30-L34 PolarHBondContact O-N 3.13Å
31L87.2Confident83.7Confident85 Ų8583.6 Ų83.645%0.44544%0.438SS..Hα-helixtrans-67.4-46.9178.2-75.1171.4000111.6K27 A28 V29 R33 L34 M35K27-L31 HydrophobicContact CG-CD1 4.05Å; K27-L31 HydrophobicContact CG-CG 4.46Å; K27-L31 WeakPolarHBondContact O-CB 3.42Å; K27-L31 VanDerWaalsContact O-CG 3.24Å; K27-L31 WeakPolarHBondContact O-CG 3.36Å; K27-L31 PolarHBondContact O-N 2.83Å; A28-L31 PolarHBondContact O-N 2.86Å; A28-L31 VanDerWaalsContact O-N 3.11Å; V29-L31 VanDerWaalsContact C-N 3.34Å; V29-L31 PolarHBondContact O-N 3.25Å; L31-R33 VanDerWaalsContact C-N 3.27Å; L31-R33 PolarHBondContact O-N 2.96Å; L31-L34 PolarHBondContact O-N 2.97Å; L31-M35 WeakPolarHBondContact O-CB 3.39Å; L31-M35 VanDerWaalsContact O-CG 3.29Å; L31-M35 WeakPolarHBondContact O-CG 3.5Å; L31-M35 PolarHBondContact O-N 3.04Å
32D85Confident83Confident105 Ų10582.6 Ų82.656%0.56143%0.426SS*.Hα-helixtrans-59-42.1177.8-72.8-21.2000110.8A28 V29 M35 D36A28-D32 PolarHBondContact O-N 2.91Å; V29-D32 PolarHBondContact O-N 3.47Å; D32-M35 PolarHBondContact O-N 3.4Å; D32-D36 PolarHBondContact O-N 3.43Å
33R83.2Confident82.4Confident94 Ų9485.7 Ų85.736%0.35543%0.429SS..Hα-helixtrans-66.5-41.6175.7-74.3-65-179.7-162.2-0.8113.2T8 V29 L31 M35 D36 D37T8-R33 VanDerWaalsContact OG1-CZ 3.31Å; T8-R33 PolarHBondContact OG1-NE 2.85Å; T8-R33 PolarHBondContact OG1-NH2 2.97Å; V29-R33 WeakPolarHBondContact O-CB 3.28Å; V29-R33 WeakPolarHBondContact O-CG 3.47Å; V29-R33 PolarHBondContact O-N 3.33Å; L31-R33 VanDerWaalsContact C-N 3.27Å; L31-R33 PolarHBondContact O-N 2.96Å; R33-M35 VanDerWaalsContact C-N 3.26Å; R33-M35 PolarHBondContact O-N 3.2Å; R33-D36 IonicContact NH1-OD2 3.8Å; R33-D36 PolarHBondContact O-N 3.42Å; R33-D37 WeakPolarHBondContact O-CB 3.43Å; R33-D37 PolarHBondContact O-N 2.85Å
34L81.8Confident81.9Confident114 Ų11482.9 Ų82.960%0.59742%0.418SS*.Hα-helixtrans-62.7-37.6174.5-176.666.1000111.2C30 L31 R38C30-L34 WeakPolarHBondContact O-CB 3.35Å; C30-L34 PolarHBondContact O-N 3.13Å; L31-L34 PolarHBondContact O-N 2.97Å; L34-R38 VanDerWaalsContact O-CB 3.27Å; L34-R38 WeakPolarHBondContact O-CB 3.46Å; L34-R38 PolarHBondContact O-N 3.32Å
35M79.8Confident81.2Confident130 Ų13080 Ų8064%0.6440%0.404SS*.Hα-helixtrans-67.3-43176.1-72.7-179.565.300111.9L31 D32 R33 R38 A39L31-M35 WeakPolarHBondContact O-CB 3.39Å; L31-M35 VanDerWaalsContact O-CG 3.29Å; L31-M35 WeakPolarHBondContact O-CG 3.5Å; L31-M35 PolarHBondContact O-N 3.04Å; D32-M35 PolarHBondContact O-N 3.4Å; R33-M35 VanDerWaalsContact C-N 3.26Å; R33-M35 PolarHBondContact O-N 3.2Å; M35-R38 PolarHBondContact O-N 3.37Å; M35-A39 WeakPolarHBondContact O-CB 3.43Å; M35-A39 PolarHBondContact O-N 3.39Å
36D78.3Confident80.4Confident73 Ų7379.6 Ų79.639%0.3940%0.399SS..Hα-helixtrans-69.2-41.7178.3-170.233.1000112.3D32 R33 R38 A39 H40 R43D32-D36 PolarHBondContact O-N 3.43Å; R33-D36 IonicContact NH1-OD2 3.8Å; R33-D36 PolarHBondContact O-N 3.42Å; D36-R38 VanDerWaalsContact C-N 3.34Å; D36-R38 PolarHBondContact O-N 2.96Å; D36-A39 CarbonylContact O-C 3.58Å; D36-A39 PolarHBondContact O-N 2.74Å; D36-H40 WeakPolarHBondContact O-CB 3.37Å; D36-H40 PolarHBondContact O-N 2.84Å; D36-R43 IonicContact OD1-NH2 3.28Å; D36-R43 PolarHBondContact OD1-NH2 3.02Å
37D77.7Confident79.7Confident68 Ų6881.2 Ų81.236%0.36441%0.411SS..Hα-helixtrans-60-45.2173.1-176.724.8000110.7R33 A39 H40 Q41R33-D37 WeakPolarHBondContact O-CB 3.43Å; R33-D37 PolarHBondContact O-N 2.85Å; D37-A39 PolarHBondContact O-N 3.25Å; D37-H40 PolarHBondContact O-N 3.44Å; D37-Q41 WeakPolarHBondContact O-CB 3.48Å; D37-Q41 VanDerWaalsContact O-CG 3.29Å; D37-Q41 WeakPolarHBondContact O-CG 3.38Å; D37-Q41 PolarHBondContact O-N 3.2Å; D37-Q41 PolarHBondContact OD1-NE2 2.74Å; D37-Q41 PolarHBondContact OD2-NE2 2.98Å; D37-Q41 VanDerWaalsContact OD2-NE2 3.09Å
38R75.1Confident79.2Confident147 Ų14780.4 Ų80.456%0.55541%0.412SS*.Hα-helixtrans-60.4-45.2173.9-171.2-179.6-178.7176.42111.6L34 M35 D36 H40 Q41 I42L34-R38 VanDerWaalsContact O-CB 3.27Å; L34-R38 WeakPolarHBondContact O-CB 3.46Å; L34-R38 PolarHBondContact O-N 3.32Å; M35-R38 PolarHBondContact O-N 3.37Å; D36-R38 VanDerWaalsContact C-N 3.34Å; D36-R38 PolarHBondContact O-N 2.96Å; R38-H40 VanDerWaalsContact C-N 3.32Å; R38-H40 PolarHBondContact O-N 2.95Å; R38-Q41 PolarHBondContact O-N 2.71Å; R38-I42 HydrophobicContact CG-CD1 3.89Å; R38-I42 VanDerWaalsContact O-CD1 3.29Å; R38-I42 WeakPolarHBondContact O-CD1 3.41Å; R38-I42 WeakPolarHBondContact O-CG1 3.37Å; R38-I42 PolarHBondContact O-N 3.31Å
39A74.7Confident78.6Confident31 Ų3179.4 Ų79.426%0.25640%0.4SS..Hα-helixtrans-62.7-39.8177.600000111.6M35 D36 D37 I42 R43M35-A39 WeakPolarHBondContact O-CB 3.43Å; M35-A39 PolarHBondContact O-N 3.39Å; D36-A39 CarbonylContact O-C 3.58Å; D36-A39 PolarHBondContact O-N 2.74Å; D37-A39 PolarHBondContact O-N 3.25Å; A39-I42 PolarHBondContact O-N 3.41Å; A39-R43 WeakPolarHBondContact O-CB 3.38Å; A39-R43 VanDerWaalsContact O-CG 3.26Å; A39-R43 WeakPolarHBondContact O-CG 3.32Å; A39-R43 PolarHBondContact O-N 3.36Å
40H76.2Confident78.1Confident98 Ų9883.9 Ų83.945%0.45442%0.419SS..Hα-helixtrans-63.2-47.9174.5-174-74000111.4D36 D37 R38 I42 R43 Q44D36-H40 WeakPolarHBondContact O-CB 3.37Å; D36-H40 PolarHBondContact O-N 2.84Å; D37-H40 PolarHBondContact O-N 3.44Å; R38-H40 VanDerWaalsContact C-N 3.32Å; R38-H40 PolarHBondContact O-N 2.95Å; H40-I42 VanDerWaalsContact C-N 3.31Å; H40-I42 PolarHBondContact O-N 3.39Å; H40-R43 WeakPolarHBondContact O-CB 3.1Å; H40-R43 PolarHBondContact O-N 2.97Å; H40-Q44 WeakPolarHBondContact O-CB 3.39Å; H40-Q44 PolarHBondContact O-N 3.09Å
41Q74.2Confident77.7Confident102 Ų10281.8 Ų81.848%0.47740%0.403SS..Hα-helixtrans-59.6-41.4176.6-72.217235.100111.9D37 R38 Q44 A45D37-Q41 WeakPolarHBondContact O-CB 3.48Å; D37-Q41 VanDerWaalsContact O-CG 3.29Å; D37-Q41 WeakPolarHBondContact O-CG 3.38Å; D37-Q41 PolarHBondContact O-N 3.2Å; D37-Q41 PolarHBondContact OD1-NE2 2.74Å; D37-Q41 PolarHBondContact OD2-NE2 2.98Å; D37-Q41 VanDerWaalsContact OD2-NE2 3.09Å; R38-Q41 PolarHBondContact O-N 2.71Å; Q41-Q44 PolarHBondContact O-N 3.28Å; Q41-A45 VanDerWaalsContact O-CB 3.25Å; Q41-A45 WeakPolarHBondContact O-CB 3.5Å; Q41-A45 PolarHBondContact O-N 3.4Å
42I73.8Confident76.9Confident27 Ų2781.2 Ų81.214%0.13841%0.41CS..Hα-helixtrans-63.5-49.3174.5-67156.4000110.2R38 A39 H40 Q44 A45 I46 M67 P68R38-I42 HydrophobicContact CG-CD1 3.89Å; R38-I42 VanDerWaalsContact O-CD1 3.29Å; R38-I42 WeakPolarHBondContact O-CD1 3.41Å; R38-I42 WeakPolarHBondContact O-CG1 3.37Å; R38-I42 PolarHBondContact O-N 3.31Å; A39-I42 PolarHBondContact O-N 3.41Å; H40-I42 VanDerWaalsContact C-N 3.31Å; H40-I42 PolarHBondContact O-N 3.39Å; I42-Q44 VanDerWaalsContact C-N 3.29Å; I42-Q44 PolarHBondContact O-N 3.1Å; I42-A45 PolarHBondContact O-N 3.44Å; I42-I46 HydrophobicContact CG2-CD1 3.48Å; I42-I46 VanDerWaalsContact CG2-CD1 3.48Å; I42-I46 HydrophobicContact CG2-CG1 4.27Å; I42-I46 VanDerWaalsContact O-CB 3.27Å; I42-I46 WeakPolarHBondContact O-CB 3.43Å; I42-I46 WeakPolarHBondContact O-CG1 3.42Å; I42-I46 PolarHBondContact O-N 3.26Å; I42-M67 HydrophobicContact CG2-SD 3.9Å; I42-P68 HydrophobicContact CD1-CB 4.11Å; I42-P68 HydrophobicContact CD1-CG 3.59Å
43R74.5Confident76.4Confident128 Ų12880.1 Ų80.148%0.48342%0.424SS..Hα-helixtrans-56.6-44.3177.2-77.1-177.4-65.6-114.52.7111.4D36 A39 H40 T47D36-R43 IonicContact OD1-NH2 3.28Å; D36-R43 PolarHBondContact OD1-NH2 3.02Å; A39-R43 WeakPolarHBondContact O-CB 3.38Å; A39-R43 VanDerWaalsContact O-CG 3.26Å; A39-R43 WeakPolarHBondContact O-CG 3.32Å; A39-R43 PolarHBondContact O-N 3.36Å; H40-R43 WeakPolarHBondContact O-CB 3.1Å; H40-R43 PolarHBondContact O-N 2.97Å; R43-T47 WeakPolarHBondContact O-CB 3.25Å; R43-T47 PolarHBondContact O-N 3.4Å; R43-T47 PolarHBondContact O-OG1 3.21Å
44Q76.4Confident76.4Confident98 Ų9879.4 Ų79.446%0.45842%0.422SS..Hα-helixtrans-65.3-52.9178.7-175.9175.97.300110.9H40 Q41 I42 I46 T47 D48H40-Q44 WeakPolarHBondContact O-CB 3.39Å; H40-Q44 PolarHBondContact O-N 3.09Å; Q41-Q44 PolarHBondContact O-N 3.28Å; I42-Q44 VanDerWaalsContact C-N 3.29Å; I42-Q44 PolarHBondContact O-N 3.1Å; Q44-I46 PolarHBondContact O-N 3.21Å; Q44-T47 PolarHBondContact O-N 3.38Å; Q44-D48 WeakPolarHBondContact CG-OD2 3.46Å; Q44-D48 WeakPolarHBondContact O-CB 3.36Å; Q44-D48 VanDerWaalsContact O-CG 3.3Å; Q44-D48 PolarHBondContact O-N 3.1Å
45A74.7Confident76.8Confident33 Ų3377 Ų7727%0.27341%0.412SS..Hα-helixtrans-56.3-38.4178.500000112.2Q41 I42 E49 L66Q41-A45 VanDerWaalsContact O-CB 3.25Å; Q41-A45 WeakPolarHBondContact O-CB 3.5Å; Q41-A45 PolarHBondContact O-N 3.4Å; I42-A45 PolarHBondContact O-N 3.44Å; A45-E49 WeakPolarHBondContact O-CB 3.47Å; A45-E49 PolarHBondContact O-N 2.96Å; A45-L66 HydrophobicContact CB-CD1 4.08Å; A45-L66 HydrophobicContact CB-CD2 3.92Å
46I72.8Confident77.2Confident13 Ų1370.8 Ų70.87%0.06738%0.382CS..Hα-helixtrans-72.8-35.8176.9-70.4174.3000112.2I42 Q44 L63 L66 M67 L82I42-I46 HydrophobicContact CG2-CD1 3.48Å; I42-I46 VanDerWaalsContact CG2-CD1 3.48Å; I42-I46 HydrophobicContact CG2-CG1 4.27Å; I42-I46 VanDerWaalsContact O-CB 3.27Å; I42-I46 WeakPolarHBondContact O-CB 3.43Å; I42-I46 WeakPolarHBondContact O-CG1 3.42Å; I42-I46 PolarHBondContact O-N 3.26Å; Q44-I46 PolarHBondContact O-N 3.21Å; I46-L63 HydrophobicContact CG2-CD2 4.37Å; I46-L66 HydrophobicContact CG1-CB 4.14Å; I46-L66 HydrophobicContact CG1-CD1 4.08Å; I46-M67 HydrophobicContact CD1-CG 4.22Å; I46-M67 HydrophobicContact CD1-SD 3.4Å; I46-M67 WeakPolarHBondContact CD1-SD 3.29Å; I46-L82 HydrophobicContact CG2-CD1 3.27Å; I46-L82 HydrophobicContact CG2-CD2 3.26Å; I46-L82 HydrophobicContact CG2-CG 3.83Å
47T75.7Confident77.9Confident86 Ų8668.3 Ų68.353%0.52837%0.371SS..Hα-helixtrans-70.1-37.8178.4-58.60000111.4R43 Q44 E49 R86R43-T47 WeakPolarHBondContact O-CB 3.25Å; R43-T47 PolarHBondContact O-N 3.4Å; R43-T47 PolarHBondContact O-OG1 3.21Å; Q44-T47 PolarHBondContact O-N 3.38Å; T47-E49 VanDerWaalsContact C-N 3.33Å; T47-R86 PolarHBondContact O-NH2 2.84Å
48D77.5Confident78.5Confident109 Ų10967.7 Ų67.758%0.58337%0.369SS*.Hα-helixtrans-78.7-16.9179.7-63.5-19.3000112.5Q44 E50Q44-D48 WeakPolarHBondContact CG-OD2 3.46Å; Q44-D48 WeakPolarHBondContact O-CB 3.36Å; Q44-D48 VanDerWaalsContact O-CG 3.3Å; Q44-D48 PolarHBondContact O-N 3.1Å; D48-E50 PolarHBondContact O-N 3.26Å
49E77.4Confident79.3Confident25 Ų2560.7 Ų60.712%0.11734%0.343CS..  trans-77.8109.7-179.1-156.181.4-140.200110.8A45 T47 R54 F59 R62 L66A45-E49 WeakPolarHBondContact O-CB 3.47Å; A45-E49 PolarHBondContact O-N 2.96Å; T47-E49 VanDerWaalsContact C-N 3.33Å; E49-R54 IonicContact OE1-CZ 3.25Å; E49-R54 VanDerWaalsContact OE1-CZ 3.25Å; E49-R54 IonicContact OE1-NH1 2.83Å; E49-R54 PolarHBondContact OE1-NH1 3.17Å; E49-R54 IonicContact OE1-NH2 2.71Å; E49-R54 PolarHBondContact OE1-NH2 3.22Å; E49-F59 HydrophobicContact CB-CE2 4.2Å; E49-F59 HydrophobicContact CG-CD2 4.18Å; E49-F59 HydrophobicContact CG-CE2 3.81Å; E49-R62 HydrophobicContact CG-CG 3.93Å; E49-R62 WeakPolarHBondContact OE1-CG 3.34Å; E49-R62 IonicContact OE1-NE 3.66Å; E49-R62 WeakPolarHBondContact OE2-CG 3.38Å; E49-R62 IonicContact OE2-CZ 3.8Å; E49-R62 IonicContact OE2-NE 2.96Å; E49-R62 PolarHBondContact OE2-NE 2.99Å; E49-R62 IonicContact OE2-NH2 3.71Å; E49-L66 HydrophobicContact CB-CD1 4.41Å; E49-L66 HydrophobicContact CG-CD1 4.44Å
50E76.8Confident80.1Confident128 Ų12859.5 Ų59.560%0.59833%0.332SS*.  trans-100.8154.1176.3-64.8-174.7164.700112.2D48 A52 R54D48-E50 PolarHBondContact O-N 3.26Å; E50-A52 HydrophobicContact CB-CB 4.13Å; E50-A52 PolarHBondContact O-N 3.23Å; E50-R54 PolarHBondContact O-NH2 3.35Å
51L78.3Confident80.7Confident23 Ų2361.4 Ų61.412%0.1234%0.335CS..  trans-60.5-33.8174-172.263.9000111.2G53 R54 P56 F59 L87 L114L51-G53 VanDerWaalsContact C-N 3.31Å; L51-G53 PolarHBondContact O-N 3.03Å; L51-R54 WeakPolarHBondContact CD1-O 3.45Å; L51-R54 WeakPolarHBondContact O-CB 3.38Å; L51-R54 PolarHBondContact O-N 3.38Å; L51-P56 HydrophobicContact CD1-CG 4.21Å; L51-F59 HydrophobicContact CD1-CB 3.64Å; L51-F59 HydrophobicContact CD1-CD1 4.01Å; L51-F59 HydrophobicContact CD1-CG 3.87Å; L51-L87 HydrophobicContact CD2-CD2 4.08Å; L51-L114 HydrophobicContact CD2-CD1 4.31Å
52A71.6Confident81.3Confident73 Ų7361.2 Ų61.260%0.60333%0.33SS*.THydrogen-bonded Turntrans35.651.3167.200000115.7E50 R54E50-A52 HydrophobicContact CB-CB 4.13Å; E50-A52 PolarHBondContact O-N 3.23Å; A52-R54 PolarHBondContact O-N 2.76Å; A52-R54 VanDerWaalsContact O-N 3.11Å
53G75Confident81.9Confident83 Ų8360 Ų6086%0.85632%0.324SS*.THydrogen-bonded Turntrans70.21.5178.400000115.6L51L51-G53 VanDerWaalsContact C-N 3.31Å; L51-G53 PolarHBondContact O-N 3.03Å
54R82.5Confident82.4Confident79 Ų7958.5 Ų58.530%0.29832%0.322SS..SBendtrans-80.2147.9173.4-63.5179.2-71-177.3-1.8109.8E49 E50 L51 A52E49-R54 IonicContact OE1-CZ 3.25Å; E49-R54 VanDerWaalsContact OE1-CZ 3.25Å; E49-R54 IonicContact OE1-NH1 2.83Å; E49-R54 PolarHBondContact OE1-NH1 3.17Å; E49-R54 IonicContact OE1-NH2 2.71Å; E49-R54 PolarHBondContact OE1-NH2 3.22Å; E50-R54 PolarHBondContact O-NH2 3.35Å; L51-R54 WeakPolarHBondContact CD1-O 3.45Å; L51-R54 WeakPolarHBondContact O-CB 3.38Å; L51-R54 PolarHBondContact O-N 3.38Å; A52-R54 PolarHBondContact O-N 2.76Å; A52-R54 VanDerWaalsContact O-N 3.11Å
55P89.5Confident82.8Confident62 Ų6260.7 Ų60.740%0.40333%0.332SS..  trans-62135172.924.2-31.7000109.9S57 V58 F59 D111P55-S57 PolarHBondContact O-N 3.05Å; P55-V58 HydrophobicContact CG-CB 3.97Å; P55-V58 HydrophobicContact CG-CG2 3.64Å; P55-V58 WeakPolarHBondContact O-CB 3.43Å; P55-V58 PolarHBondContact O-N 3.17Å; P55-F59 PolarHBondContact O-N 3.1Å; P55-F59 VanDerWaalsContact O-N 3.13Å; P55-D111 VanDerWaalsContact C-OD1 3.31Å; P55-D111 WeakPolarHBondContact CB-OD1 3.47Å
56P89.8Confident83.1Confident1 Ų160.7 Ų60.71%0.00633%0.328CS..Hα-helixtrans-42-38.3174-33.233.5000115.3L51 V58 F59 L60 F83 L87 A110 D111 L114L51-P56 HydrophobicContact CD1-CG 4.21Å; P56-V58 VanDerWaalsContact C-N 3.31Å; P56-V58 PolarHBondContact O-N 3.34Å; P56-F59 PolarHBondContact O-N 2.86Å; P56-L60 WeakPolarHBondContact O-CB 3.37Å; P56-L60 PolarHBondContact O-N 3.07Å; P56-F83 HydrophobicContact CB-CE2 3.9Å; P56-F83 HydrophobicContact CB-CZ 3.81Å; P56-F83 WeakPolarHBondContact O-CE2 3.25Å; P56-L87 HydrophobicContact CB-CD2 3.99Å; P56-L87 HydrophobicContact CG-CD2 3.85Å; P56-A110 HydrophobicContact CB-CB 3.57Å; P56-A110 HydrophobicContact CG-CB 3.65Å; P56-D111 WeakPolarHBondContact CA-OD1 3.5Å; P56-D111 WeakPolarHBondContact CB-OD1 3.33Å; P56-D111 WeakPolarHBondContact CD-OD1 3.39Å; P56-L114 HydrophobicContact CG-CD1 3.46Å; P56-L114 VanDerWaalsContact CG-CD1 3.46Å
57S92.3Very high83.4Confident21 Ų2161.2 Ų61.215%0.14733%0.33CS..Hα-helixtrans-67.4-26.7177.568.70000114.9P55 R61 D111P55-S57 PolarHBondContact O-N 3.05Å; S57-R61 PolarHBondContact O-N 3.21Å; S57-R61 PolarHBondContact O-NE 2.79Å; S57-D111 WeakPolarHBondContact CB-OD2 3.47Å; S57-D111 PolarHBondContact N-OD1 3.2Å; S57-D111 PolarHBondContact OG-OD2 3.06Å
58V91Very high83.2Confident55 Ų5558.9 Ų58.933%0.33332%0.316SS..Hα-helixtrans-80-42.2173.5172.20000109.7P55 P56 L60 R61 R62P55-V58 HydrophobicContact CG-CB 3.97Å; P55-V58 HydrophobicContact CG-CG2 3.64Å; P55-V58 WeakPolarHBondContact O-CB 3.43Å; P55-V58 PolarHBondContact O-N 3.17Å; P56-V58 VanDerWaalsContact C-N 3.31Å; P56-V58 PolarHBondContact O-N 3.34Å; V58-L60 VanDerWaalsContact C-N 3.32Å; V58-L60 PolarHBondContact O-N 2.91Å; V58-R61 PolarHBondContact O-N 3.35Å; V58-R62 PolarHBondContact O-N 2.89Å
59F91Very high82.7Confident0 Ų061.1 Ų61.10%034%0.335CS..Hα-helixtrans-57.5-44.9173.9174.2-114.2000111.7E49 L51 P55 P56 R61 R62 L63 F83 R86E49-F59 HydrophobicContact CB-CE2 4.2Å; E49-F59 HydrophobicContact CG-CD2 4.18Å; E49-F59 HydrophobicContact CG-CE2 3.81Å; L51-F59 HydrophobicContact CD1-CB 3.64Å; L51-F59 HydrophobicContact CD1-CD1 4.01Å; L51-F59 HydrophobicContact CD1-CG 3.87Å; P55-F59 PolarHBondContact O-N 3.1Å; P55-F59 VanDerWaalsContact O-N 3.13Å; P56-F59 PolarHBondContact O-N 2.86Å; F59-R61 PolarHBondContact O-N 2.85Å; F59-R62 WeakPolarHBondContact O-CB 3.21Å; F59-R62 PolarHBondContact O-N 3.3Å; F59-R62 VanDerWaalsContact O-N 3.13Å; F59-L63 HydrophobicContact CD1-CD1 4.28Å; F59-L63 HydrophobicContact CE1-CD1 3.62Å; F59-L63 HydrophobicContact CE1-CG 4.16Å; F59-L63 HydrophobicContact CE2-CD1 4.38Å; F59-L63 HydrophobicContact CE2-CD2 3.95Å; F59-L63 HydrophobicContact CE2-CG 4.07Å; F59-L63 HydrophobicContact CZ-CD1 3.66Å; F59-L63 HydrophobicContact CZ-CD2 3.83Å; F59-L63 HydrophobicContact CZ-CG 3.84Å; F59-L63 PolarHBondContact O-N 3.09Å; F59-F83 AromaticContact CD1-CD2 3.76Å; F59-F83 HydrophobicContact CD1-CD2 3.76Å; F59-F83 HydrophobicContact CD1-CE2 4.1Å; F59-F83 HydrophobicContact CE1-CD2 4.07Å; F59-R86 HydrophobicContact CE1-CB 3.75Å; F59-R86 HydrophobicContact CE1-CG 4.14Å; F59-R86 HydrophobicContact CZ-CB 3.87Å; F59-R86 HydrophobicContact CZ-CG 3.81Å
60L90.5Very high82.1Confident5 Ų561.7 Ų61.73%0.02635%0.347CS..Hα-helixtrans-58.3-47.1175176.361.9000112.5P56 V58 R62 L63 Q64 I79 F83 L103 A107P56-L60 WeakPolarHBondContact O-CB 3.37Å; P56-L60 PolarHBondContact O-N 3.07Å; V58-L60 VanDerWaalsContact C-N 3.32Å; V58-L60 PolarHBondContact O-N 2.91Å; L60-R62 PolarHBondContact O-N 2.91Å; L60-L63 PolarHBondContact O-N 3.19Å; L60-Q64 HydrophobicContact CD1-CG 4.43Å; L60-Q64 WeakPolarHBondContact O-CG 3.1Å; L60-Q64 PolarHBondContact O-N 3.44Å; L60-I79 HydrophobicContact CD1-CG2 3.65Å; L60-F83 HydrophobicContact CB-CD2 3.96Å; L60-F83 HydrophobicContact CB-CE2 3.96Å; L60-F83 HydrophobicContact CD1-CD2 4.21Å; L60-F83 HydrophobicContact CD1-CG 4.37Å; L60-L103 HydrophobicContact CD1-CD2 3.36Å; L60-L103 HydrophobicContact CD1-CG 3.55Å; L60-L103 HydrophobicContact CD2-CB 4.35Å; L60-L103 HydrophobicContact CD2-CG 3.85Å; L60-L103 WeakPolarHBondContact CD2-O 3.49Å; L60-L103 HydrophobicContact CG-CG 4.36Å; L60-A107 HydrophobicContact CB-CB 4.16Å; L60-A107 HydrophobicContact CD2-CB 3.7Å
61R89Confident81.1Confident138 Ų13861.4 Ų61.452%0.52136%0.356SS..Hα-helixtrans-59.5-37.6177.3-83.9179.1-89168.8-9.8111.4S57 V58 F59 Q64 Q65S57-R61 PolarHBondContact O-N 3.21Å; S57-R61 PolarHBondContact O-NE 2.79Å; V58-R61 PolarHBondContact O-N 3.35Å; F59-R61 PolarHBondContact O-N 2.85Å; R61-Q64 PolarHBondContact O-N 2.9Å; R61-Q65 VanDerWaalsContact O-CG 3.28Å; R61-Q65 WeakPolarHBondContact O-CG 3.38Å; R61-Q65 PolarHBondContact O-N 2.99Å
62R87Confident80.3Confident98 Ų9864.5 Ų64.537%0.3738%0.38SS..Hα-helixtrans-65.7-45.8176-179.455.6174.9-172.21.8111.8E49 V58 F59 L60 Q64 Q65 L66E49-R62 HydrophobicContact CG-CG 3.93Å; E49-R62 WeakPolarHBondContact OE1-CG 3.34Å; E49-R62 IonicContact OE1-NE 3.66Å; E49-R62 WeakPolarHBondContact OE2-CG 3.38Å; E49-R62 IonicContact OE2-CZ 3.8Å; E49-R62 IonicContact OE2-NE 2.96Å; E49-R62 PolarHBondContact OE2-NE 2.99Å; E49-R62 IonicContact OE2-NH2 3.71Å; V58-R62 PolarHBondContact O-N 2.89Å; F59-R62 WeakPolarHBondContact O-CB 3.21Å; F59-R62 PolarHBondContact O-N 3.3Å; F59-R62 VanDerWaalsContact O-N 3.13Å; L60-R62 PolarHBondContact O-N 2.91Å; R62-Q64 VanDerWaalsContact C-N 3.29Å; R62-Q64 PolarHBondContact O-N 3.45Å; R62-Q65 WeakPolarHBondContact O-CB 3.45Å; R62-Q65 PolarHBondContact O-N 3.13Å; R62-Q65 VanDerWaalsContact O-N 3.1Å; R62-L66 WeakPolarHBondContact O-CG 3.29Å; R62-L66 PolarHBondContact O-N 3.47Å
63L86.6Confident79.8Confident2 Ų269.1 Ų69.11%0.0139%0.389CS..Hα-helixtrans-57.1-43.3173.8-66.7-177.1000111.9I46 F59 L60 Q65 L66 M67 I79 L82 F83I46-L63 HydrophobicContact CG2-CD2 4.37Å; F59-L63 HydrophobicContact CD1-CD1 4.28Å; F59-L63 HydrophobicContact CE1-CD1 3.62Å; F59-L63 HydrophobicContact CE1-CG 4.16Å; F59-L63 HydrophobicContact CE2-CD1 4.38Å; F59-L63 HydrophobicContact CE2-CD2 3.95Å; F59-L63 HydrophobicContact CE2-CG 4.07Å; F59-L63 HydrophobicContact CZ-CD1 3.66Å; F59-L63 HydrophobicContact CZ-CD2 3.83Å; F59-L63 HydrophobicContact CZ-CG 3.84Å; F59-L63 PolarHBondContact O-N 3.09Å; L60-L63 PolarHBondContact O-N 3.19Å; L63-Q65 VanDerWaalsContact C-N 3.3Å; L63-Q65 PolarHBondContact O-N 3.44Å; L63-L66 PolarHBondContact O-N 3.08Å; L63-M67 WeakPolarHBondContact O-CG 3.32Å; L63-M67 PolarHBondContact O-N 3.24Å; L63-I79 HydrophobicContact CB-CG2 3.94Å; L63-I79 HydrophobicContact CD1-CG2 4.21Å; L63-L82 HydrophobicContact CD1-CD2 3.85Å; L63-L82 HydrophobicContact CD2-CD2 3.56Å; L63-L82 HydrophobicContact CG-CD2 4.36Å; L63-F83 HydrophobicContact CD1-CB 4.14Å
64Q86.3Confident79.5Confident96 Ų9667.2 Ų67.245%0.44937%0.369SS..Hα-helixtrans-62.9-34.9176.9-71173.1-25.900112.8L60 R61 R62 I79L60-Q64 HydrophobicContact CD1-CG 4.43Å; L60-Q64 WeakPolarHBondContact O-CG 3.1Å; L60-Q64 PolarHBondContact O-N 3.44Å; R61-Q64 PolarHBondContact O-N 2.9Å; R62-Q64 VanDerWaalsContact C-N 3.29Å; R62-Q64 PolarHBondContact O-N 3.45Å; Q64-I79 HydrophobicContact CG-CD1 4.17Å; Q64-I79 HydrophobicContact CG-CG2 4.44Å
65Q83.6Confident79.3Confident144 Ų14465.3 Ų65.367%0.67337%0.365SS*.Hα-helixtrans-73.4-30.7176.7-73.5171.3-1000113.3R61 R62 L63 M67R61-Q65 VanDerWaalsContact O-CG 3.28Å; R61-Q65 WeakPolarHBondContact O-CG 3.38Å; R61-Q65 PolarHBondContact O-N 2.99Å; R62-Q65 WeakPolarHBondContact O-CB 3.45Å; R62-Q65 PolarHBondContact O-N 3.13Å; R62-Q65 VanDerWaalsContact O-N 3.1Å; L63-Q65 VanDerWaalsContact C-N 3.3Å; L63-Q65 PolarHBondContact O-N 3.44Å; Q65-M67 VanDerWaalsContact C-N 3.3Å
66L81.8Confident79Confident33 Ų3366.6 Ų66.617%0.17337%0.366CS..Hα-helixtrans-73.8-25.2176.4-68177.5000112.1A45 I46 E49 R62 L63A45-L66 HydrophobicContact CB-CD1 4.08Å; A45-L66 HydrophobicContact CB-CD2 3.92Å; I46-L66 HydrophobicContact CG1-CB 4.14Å; I46-L66 HydrophobicContact CG1-CD1 4.08Å; E49-L66 HydrophobicContact CB-CD1 4.41Å; E49-L66 HydrophobicContact CG-CD1 4.44Å; R62-L66 WeakPolarHBondContact O-CG 3.29Å; R62-L66 PolarHBondContact O-N 3.47Å; L63-L66 PolarHBondContact O-N 3.08Å
67M78.4Confident78.7Confident24 Ų2469.7 Ų69.712%0.11839%0.387CS..SBendtrans-77.5135.6-179.1-69.6-68.4-87.900111.2I42 I46 L63 Q65 N75 V78 I79I42-M67 HydrophobicContact CG2-SD 3.9Å; I46-M67 HydrophobicContact CD1-CG 4.22Å; I46-M67 HydrophobicContact CD1-SD 3.4Å; I46-M67 WeakPolarHBondContact CD1-SD 3.29Å; L63-M67 WeakPolarHBondContact O-CG 3.32Å; L63-M67 PolarHBondContact O-N 3.24Å; Q65-M67 VanDerWaalsContact C-N 3.3Å; M67-N75 HydrophobicContact CE-CB 3.7Å; M67-V78 HydrophobicContact CE-CB 4.18Å; M67-V78 HydrophobicContact CE-CG1 4.11Å; M67-I79 HydrophobicContact CB-CD1 4.22Å; M67-I79 HydrophobicContact CE-CG1 4.25Å; M67-I79 HydrophobicContact CG-CD1 3.78Å; M67-I79 HydrophobicContact CG-CG1 3.69Å
68P70.5Confident78.2Confident37 Ų3771.8 Ų71.824%0.2440%0.399CS..  trans-65.8141.8179.727.2-31.5000109.5I42 G70 N75I42-P68 HydrophobicContact CD1-CB 4.11Å; I42-P68 HydrophobicContact CD1-CG 3.59Å; P68-G70 PolarHBondContact O-N 2.85Å; P68-N75 PolarHBondContact O-ND2 2.77Å
69T68.1Low78.1Confident157 Ų15770 Ų7096%0.96339%0.387SS*.SBendtrans-6585173.8-38.70000109.1
70G65Low78Confident36 Ų3672.6 Ų72.637%0.37140%0.397SS..  trans-135.9178.2-178.100000110.9P68 S72P68-G70 PolarHBondContact O-N 2.85Å; G70-S72 PolarHBondContact O-N 2.99Å
71P56Low77.8Confident123 Ų12379.3 Ų79.380%0.79943%0.429SS*.  trans-51.6117.7-174.621.2-32.2000110.8Q73P71-Q73 VanDerWaalsContact C-N 3.29Å; P71-Q73 PolarHBondContact O-N 2.92Å; P71-Q73 VanDerWaalsContact O-N 3.15Å
72S60.5Low77.7Confident88 Ų8874.5 Ų74.562%0.61541%0.413SS*.Hα-helixtrans-62.8-25.5-157.644.30000115.4G70 E76G70-S72 PolarHBondContact O-N 2.99Å; S72-E76 PolarHBondContact O-N 3.41Å; S72-E76 VanDerWaalsContact O-N 3.12Å
73Q62.4Low77.8Confident169 Ų16969.8 Ų69.879%0.7940%0.395SS*.Hα-helixtrans-70.3-45-170.1-68-176.611.900113.4P71 N75 E76 S77P71-Q73 VanDerWaalsContact C-N 3.29Å; P71-Q73 PolarHBondContact O-N 2.92Å; P71-Q73 VanDerWaalsContact O-N 3.15Å; Q73-N75 VanDerWaalsContact C-N 3.34Å; Q73-E76 PolarHBondContact O-N 2.95Å; Q73-S77 PolarHBondContact O-N 3.42Å
74G68.6Low77.9Confident44 Ų4471.3 Ų71.345%0.45440%0.403SS..Hα-helixtrans-69.8-33.9-179.800000112.6S77 V78G74-S77 PolarHBondContact O-OG 3.37Å; G74-S77 VanDerWaalsContact O-OG 3.1Å; G74-V78 WeakPolarHBondContact O-CG2 3.4Å; G74-V78 PolarHBondContact O-N 3.34Å
75N78.1Confident78Confident39 Ų3970.2 Ų70.221%0.20941%0.406CS..Hα-helixtrans-69.5-38.2177.6-69.1-6000111.3M67 P68 Q73 V78 I79M67-N75 HydrophobicContact CE-CB 3.7Å; P68-N75 PolarHBondContact O-ND2 2.77Å; Q73-N75 VanDerWaalsContact C-N 3.34Å; N75-V78 PolarHBondContact O-N 2.83Å; N75-I79 HydrophobicContact CB-CD1 4.47Å; N75-I79 WeakPolarHBondContact O-CB 3.4Å; N75-I79 WeakPolarHBondContact O-CD1 3.2Å; N75-I79 WeakPolarHBondContact O-CG1 3.27Å; N75-I79 PolarHBondContact O-N 2.78Å
76E82.9Confident78.2Confident89 Ų8967.7 Ų67.742%0.41639%0.39SS..Hα-helixtrans-65.6-41.8-177.8-165.5-171.1142.300112.8S72 Q73 I79 R80S72-E76 PolarHBondContact O-N 3.41Å; S72-E76 VanDerWaalsContact O-N 3.12Å; Q73-E76 PolarHBondContact O-N 2.95Å; E76-I79 PolarHBondContact O-N 3.46Å; E76-R80 VanDerWaalsContact O-CB 3.29Å; E76-R80 WeakPolarHBondContact O-CB 3.48Å; E76-R80 PolarHBondContact O-N 3.5Å; E76-R80 IonicContact OE1-CZ 2.99Å; E76-R80 IonicContact OE1-NH1 3.24Å; E76-R80 PolarHBondContact OE1-NH1 3.01Å; E76-R80 IonicContact OE1-NH2 3.26Å; E76-R80 PolarHBondContact OE1-NH2 3.31Å
77S82.9Confident78.6Confident65 Ų6566.4 Ų66.446%0.45538%0.384SS..Hα-helixtrans-64.3-42.6178.462.20000111.8Q73 G74 R80 Q81Q73-S77 PolarHBondContact O-N 3.42Å; G74-S77 PolarHBondContact O-OG 3.37Å; G74-S77 VanDerWaalsContact O-OG 3.1Å; S77-R80 PolarHBondContact O-N 3.1Å; S77-Q81 WeakPolarHBondContact O-CB 3.26Å; S77-Q81 PolarHBondContact O-N 3.39Å
78V82.9Confident79.1Confident65 Ų6567.3 Ų67.339%0.39439%0.392SS..Hα-helixtrans-62.8-48.2175.61750000110.7M67 G74 N75 R80 Q81 L82M67-V78 HydrophobicContact CE-CB 4.18Å; M67-V78 HydrophobicContact CE-CG1 4.11Å; G74-V78 WeakPolarHBondContact O-CG2 3.4Å; G74-V78 PolarHBondContact O-N 3.34Å; N75-V78 PolarHBondContact O-N 2.83Å; V78-R80 VanDerWaalsContact C-N 3.32Å; V78-R80 PolarHBondContact O-N 3.38Å; V78-Q81 PolarHBondContact O-N 3.46Å; V78-L82 VanDerWaalsContact O-CB 3.26Å; V78-L82 WeakPolarHBondContact O-CB 3.17Å; V78-L82 PolarHBondContact O-N 3.42Å
79I87.3Confident80Confident17 Ų1772.3 Ų72.39%0.08741%0.411CS..Hα-helixtrans-61.5-41.7177.6-63160.8000110.3L60 L63 Q64 M67 N75 E76 L82 F83 L103L60-I79 HydrophobicContact CD1-CG2 3.65Å; L63-I79 HydrophobicContact CB-CG2 3.94Å; L63-I79 HydrophobicContact CD1-CG2 4.21Å; Q64-I79 HydrophobicContact CG-CD1 4.17Å; Q64-I79 HydrophobicContact CG-CG2 4.44Å; M67-I79 HydrophobicContact CB-CD1 4.22Å; M67-I79 HydrophobicContact CE-CG1 4.25Å; M67-I79 HydrophobicContact CG-CD1 3.78Å; M67-I79 HydrophobicContact CG-CG1 3.69Å; N75-I79 HydrophobicContact CB-CD1 4.47Å; N75-I79 WeakPolarHBondContact O-CB 3.4Å; N75-I79 WeakPolarHBondContact O-CD1 3.2Å; N75-I79 WeakPolarHBondContact O-CG1 3.27Å; N75-I79 PolarHBondContact O-N 2.78Å; E76-I79 PolarHBondContact O-N 3.46Å; I79-L82 PolarHBondContact O-N 3.1Å; I79-F83 WeakPolarHBondContact O-CB 3.4Å; I79-F83 PolarHBondContact O-N 2.98Å; I79-L103 HydrophobicContact CB-CD2 4.3Å; I79-L103 HydrophobicContact CG2-CD2 3.69Å
80R89Confident81Confident55 Ų5570.5 Ų70.521%0.20839%0.392CS..Hα-helixtrans-60.8-52.9178.3176.7-179-85.6101.5-2.5111.1E76 S77 V78 L82 F83 L84 K101 L103E76-R80 VanDerWaalsContact O-CB 3.29Å; E76-R80 WeakPolarHBondContact O-CB 3.48Å; E76-R80 PolarHBondContact O-N 3.5Å; E76-R80 IonicContact OE1-CZ 2.99Å; E76-R80 IonicContact OE1-NH1 3.24Å; E76-R80 PolarHBondContact OE1-NH1 3.01Å; E76-R80 IonicContact OE1-NH2 3.26Å; E76-R80 PolarHBondContact OE1-NH2 3.31Å; S77-R80 PolarHBondContact O-N 3.1Å; V78-R80 VanDerWaalsContact C-N 3.32Å; V78-R80 PolarHBondContact O-N 3.38Å; R80-L82 VanDerWaalsContact C-N 3.28Å; R80-L82 PolarHBondContact O-N 2.99Å; R80-F83 PolarHBondContact O-N 2.93Å; R80-L84 HydrophobicContact CG-CD1 4.18Å; R80-L84 WeakPolarHBondContact O-CG 3.15Å; R80-L84 PolarHBondContact O-N 3.44Å; R80-K101 PolarHBondContact NH2-O 3.26Å; R80-L103 HydrophobicContact CB-CD1 4.26Å; R80-L103 HydrophobicContact CB-CD2 4.06Å; R80-L103 HydrophobicContact CG-CD1 4.19Å
81Q87Confident82.3Confident147 Ų14769.1 Ų69.169%0.68738%0.376SS*.Hα-helixtrans-58.7-43.9-179.9-174.8-179.712.200111.2S77 V78 L84 S85S77-Q81 WeakPolarHBondContact O-CB 3.26Å; S77-Q81 PolarHBondContact O-N 3.39Å; V78-Q81 PolarHBondContact O-N 3.46Å; Q81-L84 PolarHBondContact O-N 3.19Å; Q81-S85 WeakPolarHBondContact O-CB 3.27Å; Q81-S85 PolarHBondContact O-N 3.48Å; Q81-S85 PolarHBondContact O-OG 3.34Å
82L86.6Confident84Confident36 Ų3666.5 Ų66.519%0.18835%0.353CS..Hα-helixtrans-73.3-35.1-178-156.5123.4000112.7I46 L63 V78 I79 R80 S85 R86I46-L82 HydrophobicContact CG2-CD1 3.27Å; I46-L82 HydrophobicContact CG2-CD2 3.26Å; I46-L82 HydrophobicContact CG2-CG 3.83Å; L63-L82 HydrophobicContact CD1-CD2 3.85Å; L63-L82 HydrophobicContact CD2-CD2 3.56Å; L63-L82 HydrophobicContact CG-CD2 4.36Å; V78-L82 VanDerWaalsContact O-CB 3.26Å; V78-L82 WeakPolarHBondContact O-CB 3.17Å; V78-L82 PolarHBondContact O-N 3.42Å; I79-L82 PolarHBondContact O-N 3.1Å; R80-L82 VanDerWaalsContact C-N 3.28Å; R80-L82 PolarHBondContact O-N 2.99Å; L82-S85 PolarHBondContact O-OG 2.69Å; L82-S85 VanDerWaalsContact O-OG 3.1Å; L82-R86 WeakPolarHBondContact O-CG 3.33Å; L82-R86 PolarHBondContact O-N 3.09Å
83F90Very high85.5Confident0 Ų066 Ų660%035%0.346CS..Hα-helixtrans-59.8-51.6172.4175.3-102.3000110.6P56 F59 L60 L63 I79 R80 R86 L87 L103 A107 A110P56-F83 HydrophobicContact CB-CE2 3.9Å; P56-F83 HydrophobicContact CB-CZ 3.81Å; P56-F83 WeakPolarHBondContact O-CE2 3.25Å; F59-F83 AromaticContact CD1-CD2 3.76Å; F59-F83 HydrophobicContact CD1-CD2 3.76Å; F59-F83 HydrophobicContact CD1-CE2 4.1Å; F59-F83 HydrophobicContact CE1-CD2 4.07Å; L60-F83 HydrophobicContact CB-CD2 3.96Å; L60-F83 HydrophobicContact CB-CE2 3.96Å; L60-F83 HydrophobicContact CD1-CD2 4.21Å; L60-F83 HydrophobicContact CD1-CG 4.37Å; L63-F83 HydrophobicContact CD1-CB 4.14Å; I79-F83 WeakPolarHBondContact O-CB 3.4Å; I79-F83 PolarHBondContact O-N 2.98Å; R80-F83 PolarHBondContact O-N 2.93Å; F83-R86 PolarHBondContact O-N 2.87Å; F83-L87 HydrophobicContact CD1-CD1 4.33Å; F83-L87 HydrophobicContact CE1-CD1 3.74Å; F83-L87 HydrophobicContact CE1-CG 4.44Å; F83-L87 HydrophobicContact CE2-CD2 4.31Å; F83-L87 HydrophobicContact CZ-CD1 3.99Å; F83-L87 HydrophobicContact CZ-CD2 4.11Å; F83-L87 HydrophobicContact CZ-CG 4.4Å; F83-L87 WeakPolarHBondContact O-CG 3.5Å; F83-L103 HydrophobicContact CB-CD1 4.2Å; F83-L103 HydrophobicContact CD1-CD1 3.49Å; F83-L103 VanDerWaalsContact CD1-CD1 3.49Å; F83-L103 HydrophobicContact CD1-CG 4.46Å; F83-L103 HydrophobicContact CE1-CD1 4.15Å; F83-L103 HydrophobicContact CG-CD1 4.01Å; F83-A107 HydrophobicContact CE1-CB 4.28Å; F83-A107 HydrophobicContact CE2-CB 4.03Å; F83-A107 HydrophobicContact CZ-CB 3.58Å; F83-A110 HydrophobicContact CZ-CB 4.4Å
84L89.3Confident86.9Confident33 Ų3359.9 Ų59.917%0.17333%0.325CS..Hα-helixtrans-64.5-42.4-178.9-67.3175.1000112.2R80 Q81 R86 L87 Q92R80-L84 HydrophobicContact CG-CD1 4.18Å; R80-L84 WeakPolarHBondContact O-CG 3.15Å; R80-L84 PolarHBondContact O-N 3.44Å; Q81-L84 PolarHBondContact O-N 3.19Å; L84-R86 PolarHBondContact O-N 2.91Å; L84-L87 HydrophobicContact CD2-CD1 4.37Å; L84-L87 PolarHBondContact O-N 2.8Å; L84-Q92 VanDerWaalsContact O-CD 3.23Å; L84-Q92 WeakPolarHBondContact O-CG 3.29Å; L84-Q92 PolarHBondContact O-NE2 3.37Å
85S87.6Confident88.1Confident74 Ų7458 Ų5852%0.51731%0.305SS..Hα-helixtrans-64.5-23.8-178.571.60000113.8Q81 L82Q81-S85 WeakPolarHBondContact O-CB 3.27Å; Q81-S85 PolarHBondContact O-N 3.48Å; Q81-S85 PolarHBondContact O-OG 3.34Å; L82-S85 PolarHBondContact O-OG 2.69Å; L82-S85 VanDerWaalsContact O-OG 3.1Å
86R88.3Confident88.7Confident90 Ų9061.6 Ų61.634%0.3432%0.323SS..Hα-helixtrans-90-10.7178.8-63.9-65.9-167.3-163.85.3114.1T47 F59 L82 F83 L84T47-R86 PolarHBondContact O-NH2 2.84Å; F59-R86 HydrophobicContact CE1-CB 3.75Å; F59-R86 HydrophobicContact CE1-CG 4.14Å; F59-R86 HydrophobicContact CZ-CB 3.87Å; F59-R86 HydrophobicContact CZ-CG 3.81Å; L82-R86 WeakPolarHBondContact O-CG 3.33Å; L82-R86 PolarHBondContact O-N 3.09Å; F83-R86 PolarHBondContact O-N 2.87Å; L84-R86 PolarHBondContact O-N 2.91Å
87L89.5Confident89.1Confident6 Ų662.5 Ų62.53%0.03134%0.337CS..SBendtrans-75.8150.1175.3-64-179.7000110.8L51 P56 F83 L84 V91 Q92 L95 A110L51-L87 HydrophobicContact CD2-CD2 4.08Å; P56-L87 HydrophobicContact CB-CD2 3.99Å; P56-L87 HydrophobicContact CG-CD2 3.85Å; F83-L87 HydrophobicContact CD1-CD1 4.33Å; F83-L87 HydrophobicContact CE1-CD1 3.74Å; F83-L87 HydrophobicContact CE1-CG 4.44Å; F83-L87 HydrophobicContact CE2-CD2 4.31Å; F83-L87 HydrophobicContact CZ-CD1 3.99Å; F83-L87 HydrophobicContact CZ-CD2 4.11Å; F83-L87 HydrophobicContact CZ-CG 4.4Å; F83-L87 WeakPolarHBondContact O-CG 3.5Å; L84-L87 HydrophobicContact CD2-CD1 4.37Å; L84-L87 PolarHBondContact O-N 2.8Å; L87-V91 HydrophobicContact CB-CB 4.43Å; L87-V91 HydrophobicContact CB-CG1 4.5Å; L87-V91 HydrophobicContact CD1-CG1 4.05Å; L87-Q92 HydrophobicContact CB-CG 3.94Å; L87-Q92 PolarHBondContact O-NE2 3.05Å; L87-L95 HydrophobicContact CD1-CD1 3.63Å; L87-A110 HydrophobicContact CD1-CB 4.17Å; L87-A110 HydrophobicContact CD2-CB 4.43Å
88P89.1Confident89.5Confident44 Ų4463.3 Ų63.329%0.28633%0.332SS..  trans-57.7141.8170-24.134.8000111.4Q90 V91 Q92 L114P88-Q90 PolarHBondContact O-N 3.15Å; P88-Q90 VanDerWaalsContact O-N 3.07Å; P88-V91 HydrophobicContact CB-CG2 4.33Å; P88-V91 HydrophobicContact CG-CG2 4.43Å; P88-V91 WeakPolarHBondContact O-CA 3.34Å; P88-V91 WeakPolarHBondContact O-CB 3.36Å; P88-V91 PolarHBondContact O-N 3.48Å; P88-Q92 PolarHBondContact O-N 3.48Å; P88-Q92 VanDerWaalsContact O-N 3.1Å; P88-L114 HydrophobicContact CG-CD2 4.23Å
89H89.8Confident89.6Confident141 Ų14164.9 Ų64.965%0.65334%0.335SS*.Hα-helixtrans-50.3-40.3-176.3179.662.8000113.5V91 Q92 T93H89-V91 VanDerWaalsContact C-N 3.3Å; H89-V91 PolarHBondContact O-N 3.43Å; H89-Q92 WeakPolarHBondContact O-CB 3.33Å; H89-Q92 PolarHBondContact O-N 3.1Å; H89-T93 PolarHBondContact O-N 3.17Å; H89-T93 PolarHBondContact O-OG1 3.12Å; H89-T93 VanDerWaalsContact O-OG1 3.09Å
90Q89.1Confident89.6Confident120 Ų12072.7 Ų72.756%0.56137%0.372SS*.Hα-helixtrans-59-39.5177.3-64.8168.6-8.100112.8P88 A94 R117P88-Q90 PolarHBondContact O-N 3.15Å; P88-Q90 VanDerWaalsContact O-N 3.07Å; Q90-A94 PolarHBondContact O-N 3Å; Q90-R117 VanDerWaalsContact OE1-CZ 3.26Å
91V91.9Very high89.7Confident7 Ų773.3 Ų73.34%0.04238%0.375CS..Hα-helixtrans-72.3-41177.3-177.90000110L87 P88 H89 T93 A94 L95 A110 L113 L114L87-V91 HydrophobicContact CB-CB 4.43Å; L87-V91 HydrophobicContact CB-CG1 4.5Å; L87-V91 HydrophobicContact CD1-CG1 4.05Å; P88-V91 HydrophobicContact CB-CG2 4.33Å; P88-V91 HydrophobicContact CG-CG2 4.43Å; P88-V91 WeakPolarHBondContact O-CA 3.34Å; P88-V91 WeakPolarHBondContact O-CB 3.36Å; P88-V91 PolarHBondContact O-N 3.48Å; H89-V91 VanDerWaalsContact C-N 3.3Å; H89-V91 PolarHBondContact O-N 3.43Å; V91-T93 VanDerWaalsContact C-N 3.35Å; V91-T93 PolarHBondContact O-N 2.96Å; V91-A94 PolarHBondContact O-N 3.46Å; V91-L95 HydrophobicContact CG1-CD1 3.86Å; V91-L95 HydrophobicContact CG1-CG 4.29Å; V91-L95 WeakPolarHBondContact O-CB 3.49Å; V91-L95 VanDerWaalsContact O-CG 3.25Å; V91-L95 WeakPolarHBondContact O-CG 3.39Å; V91-L95 PolarHBondContact O-N 2.87Å; V91-A110 HydrophobicContact CG1-CB 3.9Å; V91-L113 HydrophobicContact CG1-CB 4.43Å; V91-L113 HydrophobicContact CG1-CD1 4.03Å; V91-L114 HydrophobicContact CG2-CD2 3.62Å; V91-L114 HydrophobicContact CG2-CG 4.06Å
92Q91.6Very high89.9Confident68 Ų6870 Ų7032%0.31837%0.367SS..Hα-helixtrans-57.1-48.2175.6-61.7-179.825.300111.3L84 L87 P88 H89 A94 L95 L96L84-Q92 VanDerWaalsContact O-CD 3.23Å; L84-Q92 WeakPolarHBondContact O-CG 3.29Å; L84-Q92 PolarHBondContact O-NE2 3.37Å; L87-Q92 HydrophobicContact CB-CG 3.94Å; L87-Q92 PolarHBondContact O-NE2 3.05Å; P88-Q92 PolarHBondContact O-N 3.48Å; P88-Q92 VanDerWaalsContact O-N 3.1Å; H89-Q92 WeakPolarHBondContact O-CB 3.33Å; H89-Q92 PolarHBondContact O-N 3.1Å; Q92-A94 VanDerWaalsContact C-N 3.33Å; Q92-A94 PolarHBondContact O-N 3.46Å; Q92-L95 PolarHBondContact O-N 3.34Å; Q92-L95 VanDerWaalsContact O-N 3.1Å; Q92-L96 PolarHBondContact O-N 3.29Å; Q92-L96 VanDerWaalsContact O-N 3.1Å
93T92.5Very high90.1Very high76 Ų7668.7 Ų68.747%0.46636%0.36SS..Hα-helixtrans-61.6-40.6178.9-54.50000112.2H89 V91 L95 L96H89-T93 PolarHBondContact O-N 3.17Å; H89-T93 PolarHBondContact O-OG1 3.12Å; H89-T93 VanDerWaalsContact O-OG1 3.09Å; V91-T93 VanDerWaalsContact C-N 3.35Å; V91-T93 PolarHBondContact O-N 2.96Å; T93-L95 VanDerWaalsContact C-N 3.26Å; T93-L95 PolarHBondContact O-N 2.85Å; T93-L96 WeakPolarHBondContact O-CB 3.36Å; T93-L96 PolarHBondContact O-N 3.45Å
94A92Very high90.2Very high41 Ų4171.4 Ų71.434%0.33938%0.382SS..Hα-helixtrans-68.8-24.5177.100000113.3Q90 V91 Q92 L113Q90-A94 PolarHBondContact O-N 3Å; V91-A94 PolarHBondContact O-N 3.46Å; Q92-A94 VanDerWaalsContact C-N 3.33Å; Q92-A94 PolarHBondContact O-N 3.46Å; A94-L113 HydrophobicContact CB-CD1 3.64Å; A94-L113 HydrophobicContact CB-CD2 4.15Å
95L92.4Very high90.4Very high5 Ų573.2 Ų73.23%0.02639%0.39CS..Hα-helixtrans-89.1-12.5177.8-67.8175.2000113.8L87 V91 Q92 T93 P97 F98 E99 L106 L109 A110 L113L87-L95 HydrophobicContact CD1-CD1 3.63Å; V91-L95 HydrophobicContact CG1-CD1 3.86Å; V91-L95 HydrophobicContact CG1-CG 4.29Å; V91-L95 WeakPolarHBondContact O-CB 3.49Å; V91-L95 VanDerWaalsContact O-CG 3.25Å; V91-L95 WeakPolarHBondContact O-CG 3.39Å; V91-L95 PolarHBondContact O-N 2.87Å; Q92-L95 PolarHBondContact O-N 3.34Å; Q92-L95 VanDerWaalsContact O-N 3.1Å; T93-L95 VanDerWaalsContact C-N 3.26Å; T93-L95 PolarHBondContact O-N 2.85Å; L95-P97 VanDerWaalsContact C-CD 3.43Å; L95-F98 CarbonylContact O-C 3.57Å; L95-F98 WeakPolarHBondContact O-CA 3.36Å; L95-F98 WeakPolarHBondContact O-CB 3.26Å; L95-F98 PolarHBondContact O-N 3.43Å; L95-E99 PolarHBondContact O-N 3.24Å; L95-L106 HydrophobicContact CB-CD2 4.22Å; L95-L106 HydrophobicContact CD2-CD2 4Å; L95-L106 HydrophobicContact CG-CD2 4.49Å; L95-L109 HydrophobicContact CD2-CB 3.6Å; L95-L109 HydrophobicContact CD2-CD1 4.3Å; L95-A110 HydrophobicContact CD1-CB 4.02Å; L95-L113 HydrophobicContact CD2-CD1 4.04Å; L95-L113 HydrophobicContact CG-CD1 4.18Å
96L90.9Very high90.7Very high115 Ų11569.8 Ų69.860%0.60237%0.366SS*.G310 helixtrans-51.7-42.2-177.1-174.467.5000114Q92 T93 F98 E99Q92-L96 PolarHBondContact O-N 3.29Å; Q92-L96 VanDerWaalsContact O-N 3.1Å; T93-L96 WeakPolarHBondContact O-CB 3.36Å; T93-L96 PolarHBondContact O-N 3.45Å; L96-F98 PolarHBondContact O-N 2.84Å; L96-F98 VanDerWaalsContact O-N 3.08Å; L96-E99 PolarHBondContact O-N 3.18Å
97P91.7Very high90.9Very high108 Ų10865.5 Ų65.570%0.70135%0.35SS*.G310 helixtrans-67.1-9.8176.8-20.534.8000114.6L95L95-P97 VanDerWaalsContact C-CD 3.43Å
98F91.1Very high91.1Very high82 Ų8273.2 Ų73.236%0.3638%0.378SS..G310 helixtrans-113.88.4-172.1-61.6-62.4000112.8L95 L96 E100 K101 L106 L109L95-F98 CarbonylContact O-C 3.57Å; L95-F98 WeakPolarHBondContact O-CA 3.36Å; L95-F98 WeakPolarHBondContact O-CB 3.26Å; L95-F98 PolarHBondContact O-N 3.43Å; L96-F98 PolarHBondContact O-N 2.84Å; L96-F98 VanDerWaalsContact O-N 3.08Å; F98-E100 PolarHBondContact O-N 2.76Å; F98-E100 VanDerWaalsContact O-N 3.13Å; F98-K101 HydrophobicContact CB-CD 3.95Å; F98-K101 HydrophobicContact CD1-CD 3.76Å; F98-K101 HydrophobicContact CG-CD 4.23Å; F98-K101 WeakPolarHBondContact O-CB 3.36Å; F98-K101 PolarHBondContact O-N 3.43Å; F98-L106 HydrophobicContact CB-CD2 3.77Å; F98-L106 WeakPolarHBondContact O-CD2 3.41Å; F98-L109 HydrophobicContact CB-CD1 4.32Å; F98-L109 HydrophobicContact CD1-CD1 4.43Å; F98-L109 HydrophobicContact CD2-CD1 4.1Å; F98-L109 HydrophobicContact CG-CD1 4.02Å
99E85.2Confident91.4Very high97 Ų9773.1 Ų73.145%0.45338%0.375SS..THydrogen-bonded Turntrans-55.4-34.4-171.2-171.8170.6-173.800114.1L95 L96 K101L95-E99 PolarHBondContact O-N 3.24Å; L96-E99 PolarHBondContact O-N 3.18Å; E99-K101 PolarHBondContact O-N 2.89Å
100E86.6Confident91.5Very high182 Ų18266.4 Ų66.485%0.8534%0.344SS*.THydrogen-bonded Turntrans-72.9-9.8178.1-61.7-59148.300114F98F98-E100 PolarHBondContact O-N 2.76Å; F98-E100 VanDerWaalsContact O-N 3.13Å
101K90.8Very high91.7Very high67 Ų6762.4 Ų62.429%0.29133%0.327SS..SBendtrans-71.3155.8180-73.9-179.4165.9-77.60111.6R80 F98 E99 L103 E105 L106R80-K101 PolarHBondContact NH2-O 3.26Å; F98-K101 HydrophobicContact CB-CD 3.95Å; F98-K101 HydrophobicContact CD1-CD 3.76Å; F98-K101 HydrophobicContact CG-CD 4.23Å; F98-K101 WeakPolarHBondContact O-CB 3.36Å; F98-K101 PolarHBondContact O-N 3.43Å; E99-K101 PolarHBondContact O-N 2.89Å; K101-L103 PolarHBondContact O-N 2.99Å; K101-E105 HydrophobicContact CD-CG 4.41Å; K101-E105 VanDerWaalsContact NZ-CD 3.34Å; K101-E105 IonicContact NZ-OE1 3.57Å; K101-E105 PolarHBondContact NZ-OE1 3.43Å; K101-E105 IonicContact NZ-OE2 2.74Å; K101-E105 PolarHBondContact NZ-OE2 2.93Å; K101-L106 HydrophobicContact CB-CG 4.33Å
102P91.7Very high91.7Very high78 Ų7870.3 Ų70.351%0.50636%0.356SS..  trans-58.5139.9172.824.4-33.9000110.4A104 E105 L106P102-A104 PolarHBondContact O-N 3.4Å; P102-A104 VanDerWaalsContact O-N 3.09Å; P102-E105 HydrophobicContact CG-CB 3.96Å; P102-E105 WeakPolarHBondContact O-CA 3.37Å; P102-E105 WeakPolarHBondContact O-CB 3.3Å; P102-E105 PolarHBondContact O-N 3.07Å; P102-L106 PolarHBondContact O-N 3.31Å
103L91.2Very high91.7Very high8 Ų869.9 Ų69.94%0.04236%0.355CS..Hα-helixtrans-58-31.6-172.4-167.756.2000113.5L60 I79 R80 F83 K101 E105 L106 A107L60-L103 HydrophobicContact CD1-CD2 3.36Å; L60-L103 HydrophobicContact CD1-CG 3.55Å; L60-L103 HydrophobicContact CD2-CB 4.35Å; L60-L103 HydrophobicContact CD2-CG 3.85Å; L60-L103 WeakPolarHBondContact CD2-O 3.49Å; L60-L103 HydrophobicContact CG-CG 4.36Å; I79-L103 HydrophobicContact CB-CD2 4.3Å; I79-L103 HydrophobicContact CG2-CD2 3.69Å; R80-L103 HydrophobicContact CB-CD1 4.26Å; R80-L103 HydrophobicContact CB-CD2 4.06Å; R80-L103 HydrophobicContact CG-CD1 4.19Å; F83-L103 HydrophobicContact CB-CD1 4.2Å; F83-L103 HydrophobicContact CD1-CD1 3.49Å; F83-L103 VanDerWaalsContact CD1-CD1 3.49Å; F83-L103 HydrophobicContact CD1-CG 4.46Å; F83-L103 HydrophobicContact CE1-CD1 4.15Å; F83-L103 HydrophobicContact CG-CD1 4.01Å; K101-L103 PolarHBondContact O-N 2.99Å; L103-E105 VanDerWaalsContact C-N 3.32Å; L103-E105 PolarHBondContact O-N 3.24Å; L103-L106 HydrophobicContact CD1-CD1 4.25Å; L103-L106 PolarHBondContact O-N 3.16Å; L103-A107 PolarHBondContact O-N 2.83Å
104A92Very high91.6Very high57 Ų5767.5 Ų67.547%0.47134%0.339SS..Hα-helixtrans-63.8-33.8174.100000113.3P102 R108P102-A104 PolarHBondContact O-N 3.4Å; P102-A104 VanDerWaalsContact O-N 3.09Å; A104-R108 WeakPolarHBondContact O-CG 3.29Å; A104-R108 PolarHBondContact O-N 3.11Å
105E93.5Very high91.4Very high72 Ų7268.1 Ų68.134%0.33635%0.345SS..Hα-helixtrans-75.1-43.8176-168.8-178.6172.400110.7K101 P102 L103 A107 R108 L109K101-E105 HydrophobicContact CD-CG 4.41Å; K101-E105 VanDerWaalsContact NZ-CD 3.34Å; K101-E105 IonicContact NZ-OE1 3.57Å; K101-E105 PolarHBondContact NZ-OE1 3.43Å; K101-E105 IonicContact NZ-OE2 2.74Å; K101-E105 PolarHBondContact NZ-OE2 2.93Å; P102-E105 HydrophobicContact CG-CB 3.96Å; P102-E105 WeakPolarHBondContact O-CA 3.37Å; P102-E105 WeakPolarHBondContact O-CB 3.3Å; P102-E105 PolarHBondContact O-N 3.07Å; L103-E105 VanDerWaalsContact C-N 3.32Å; L103-E105 PolarHBondContact O-N 3.24Å; E105-A107 VanDerWaalsContact C-N 3.25Å; E105-A107 PolarHBondContact O-N 3.5Å; E105-R108 WeakPolarHBondContact O-CB 3.4Å; E105-R108 PolarHBondContact O-N 3.48Å; E105-R108 VanDerWaalsContact O-N 3.1Å; E105-L109 PolarHBondContact O-N 2.89Å
106L93.4Very high91.1Very high1 Ų173 Ų731%0.00537%0.37CS..Hα-helixtrans-54.3-42.8173-78.3172.9000111.9L95 F98 K101 P102 L103 R108 L109 A110L95-L106 HydrophobicContact CB-CD2 4.22Å; L95-L106 HydrophobicContact CD2-CD2 4Å; L95-L106 HydrophobicContact CG-CD2 4.49Å; F98-L106 HydrophobicContact CB-CD2 3.77Å; F98-L106 WeakPolarHBondContact O-CD2 3.41Å; K101-L106 HydrophobicContact CB-CG 4.33Å; P102-L106 PolarHBondContact O-N 3.31Å; L103-L106 HydrophobicContact CD1-CD1 4.25Å; L103-L106 PolarHBondContact O-N 3.16Å; L106-R108 PolarHBondContact O-N 3.4Å; L106-L109 PolarHBondContact O-N 2.99Å; L106-A110 WeakPolarHBondContact O-CB 3.24Å; L106-A110 PolarHBondContact O-N 3.33Å
107A93.5Very high90.7Very high0 Ų072.3 Ų72.30%036%0.36CS..Hα-helixtrans-67.2-35.9178.400000113.4L60 F83 L103 E105 A110 D111L60-A107 HydrophobicContact CB-CB 4.16Å; L60-A107 HydrophobicContact CD2-CB 3.7Å; F83-A107 HydrophobicContact CE1-CB 4.28Å; F83-A107 HydrophobicContact CE2-CB 4.03Å; F83-A107 HydrophobicContact CZ-CB 3.58Å; L103-A107 PolarHBondContact O-N 2.83Å; E105-A107 VanDerWaalsContact C-N 3.25Å; E105-A107 PolarHBondContact O-N 3.5Å; A107-A110 PolarHBondContact O-N 3.43Å; A107-D111 VanDerWaalsContact O-CG 3.23Å; A107-D111 PolarHBondContact O-N 3.36Å
108R94.1Very high90.1Very high169 Ų16973.3 Ų73.364%0.63836%0.355SS*.Hα-helixtrans-66.8-36.6172.8-70.2173.3-178.4-175.21.2112.2A104 E105 L106 R112A104-R108 WeakPolarHBondContact O-CG 3.29Å; A104-R108 PolarHBondContact O-N 3.11Å; E105-R108 WeakPolarHBondContact O-CB 3.4Å; E105-R108 PolarHBondContact O-N 3.48Å; E105-R108 VanDerWaalsContact O-N 3.1Å; L106-R108 PolarHBondContact O-N 3.4Å; R108-R112 WeakPolarHBondContact O-CG 3.46Å; R108-R112 PolarHBondContact O-N 3.48Å
109L93.7Very high89.4Confident41 Ų4173.3 Ų73.322%0.21537%0.365CS..Hα-helixtrans-66.5-43.7173.7-69.5175.2000110.8L95 F98 E105 L106 D111 R112 L113L95-L109 HydrophobicContact CD2-CB 3.6Å; L95-L109 HydrophobicContact CD2-CD1 4.3Å; F98-L109 HydrophobicContact CB-CD1 4.32Å; F98-L109 HydrophobicContact CD1-CD1 4.43Å; F98-L109 HydrophobicContact CD2-CD1 4.1Å; F98-L109 HydrophobicContact CG-CD1 4.02Å; E105-L109 PolarHBondContact O-N 2.89Å; L106-L109 PolarHBondContact O-N 2.99Å; L109-D111 PolarHBondContact O-N 3.09Å; L109-R112 PolarHBondContact O-N 3.13Å; L109-L113 WeakPolarHBondContact O-CG 3.29Å; L109-L113 PolarHBondContact O-N 2.93Å
110A93Very high89Confident0 Ų075.7 Ų75.70%038%0.376CS..Hα-helixtrans-59.2-44175.300000112.2P56 F83 L87 V91 L95 L106 A107 R112 L113 L114P56-A110 HydrophobicContact CB-CB 3.57Å; P56-A110 HydrophobicContact CG-CB 3.65Å; F83-A110 HydrophobicContact CZ-CB 4.4Å; L87-A110 HydrophobicContact CD1-CB 4.17Å; L87-A110 HydrophobicContact CD2-CB 4.43Å; V91-A110 HydrophobicContact CG1-CB 3.9Å; L95-A110 HydrophobicContact CD1-CB 4.02Å; L106-A110 WeakPolarHBondContact O-CB 3.24Å; L106-A110 PolarHBondContact O-N 3.33Å; A107-A110 PolarHBondContact O-N 3.43Å; A110-R112 VanDerWaalsContact C-N 3.32Å; A110-R112 PolarHBondContact O-N 2.91Å; A110-L113 PolarHBondContact O-N 2.99Å; A110-L114 PolarHBondContact O-N 3.4Å
111D93.5Very high88.1Confident37 Ų3773.4 Ų73.420%0.19837%0.369CS..Hα-helixtrans-55.3-47.3174.3-70.8-10.1000111.2P55 P56 S57 A107 L109 L114 A115P55-D111 VanDerWaalsContact C-OD1 3.31Å; P55-D111 WeakPolarHBondContact CB-OD1 3.47Å; P56-D111 WeakPolarHBondContact CA-OD1 3.5Å; P56-D111 WeakPolarHBondContact CB-OD1 3.33Å; P56-D111 WeakPolarHBondContact CD-OD1 3.39Å; S57-D111 WeakPolarHBondContact CB-OD2 3.47Å; S57-D111 PolarHBondContact N-OD1 3.2Å; S57-D111 PolarHBondContact OG-OD2 3.06Å; A107-D111 VanDerWaalsContact O-CG 3.23Å; A107-D111 PolarHBondContact O-N 3.36Å; L109-D111 PolarHBondContact O-N 3.09Å; D111-L114 PolarHBondContact O-N 2.99Å; D111-A115 WeakPolarHBondContact O-CB 3.45Å; D111-A115 PolarHBondContact O-N 2.83Å
112R92.3Very high87Confident172 Ų17275.2 Ų75.265%0.64939%0.39SS*.Hα-helixtrans-65.3-41.2179.5-69.5175.1-176.4-171.60.6112R108 L109 A110 A115 L116R108-R112 WeakPolarHBondContact O-CG 3.46Å; R108-R112 PolarHBondContact O-N 3.48Å; L109-R112 PolarHBondContact O-N 3.13Å; A110-R112 VanDerWaalsContact C-N 3.32Å; A110-R112 PolarHBondContact O-N 2.91Å; R112-A115 PolarHBondContact O-N 3.08Å; R112-L116 WeakPolarHBondContact O-CB 3.39Å; R112-L116 VanDerWaalsContact O-CG 3.26Å; R112-L116 WeakPolarHBondContact O-CG 3.31Å; R112-L116 PolarHBondContact O-N 3.45Å
113L91.2Very high85.4Confident59 Ų5974.6 Ų74.631%0.30939%0.392SS..Hα-helixtrans-63.3-42178.2-73.1169.4000111.8V91 A94 L95 L109 A110 R117V91-L113 HydrophobicContact CG1-CB 4.43Å; V91-L113 HydrophobicContact CG1-CD1 4.03Å; A94-L113 HydrophobicContact CB-CD1 3.64Å; A94-L113 HydrophobicContact CB-CD2 4.15Å; L95-L113 HydrophobicContact CD2-CD1 4.04Å; L95-L113 HydrophobicContact CG-CD1 4.18Å; L109-L113 WeakPolarHBondContact O-CG 3.29Å; L109-L113 PolarHBondContact O-N 2.93Å; A110-L113 PolarHBondContact O-N 2.99Å; L113-R117 PolarHBondContact O-N 3.21Å
114L89.5Confident83.6Confident26 Ų2679 Ų7914%0.13642%0.423CS..Hα-helixtrans-68.4-43.1176-71.3178.1000112.1L51 P56 P88 V91 A110 D111 L116 R117 E118L51-L114 HydrophobicContact CD2-CD1 4.31Å; P56-L114 HydrophobicContact CG-CD1 3.46Å; P56-L114 VanDerWaalsContact CG-CD1 3.46Å; P88-L114 HydrophobicContact CG-CD2 4.23Å; V91-L114 HydrophobicContact CG2-CD2 3.62Å; V91-L114 HydrophobicContact CG2-CG 4.06Å; A110-L114 PolarHBondContact O-N 3.4Å; D111-L114 PolarHBondContact O-N 2.99Å; L114-L116 VanDerWaalsContact C-N 3.32Å; L114-L116 PolarHBondContact O-N 3Å; L114-R117 WeakPolarHBondContact O-CB 3.43Å; L114-R117 PolarHBondContact O-N 3.3Å; L114-R117 VanDerWaalsContact O-N 3.1Å; L114-E118 PolarHBondContact O-N 3.44Å
115A88.2Confident82Confident54 Ų5480.7 Ų80.745%0.44643%0.43SS..Hα-helixtrans-60.8-39.4176.900000112.6D111 R112 R117 E118 S119D111-A115 WeakPolarHBondContact O-CB 3.45Å; D111-A115 PolarHBondContact O-N 2.83Å; R112-A115 PolarHBondContact O-N 3.08Å; A115-R117 VanDerWaalsContact C-N 3.32Å; A115-R117 PolarHBondContact O-N 3.03Å; A115-E118 PolarHBondContact O-N 3.48Å; A115-S119 WeakPolarHBondContact O-CB 3.25Å; A115-S119 PolarHBondContact O-N 3.37Å
116L86.4Confident80.4Confident108 Ų10883.5 Ų83.557%0.56545%0.451SS*.Hα-helixtrans-62-40.6174.3-74.7167.5000111.6R112 L114 S119 Q120R112-L116 WeakPolarHBondContact O-CB 3.39Å; R112-L116 VanDerWaalsContact O-CG 3.26Å; R112-L116 WeakPolarHBondContact O-CG 3.31Å; R112-L116 PolarHBondContact O-N 3.45Å; L114-L116 VanDerWaalsContact C-N 3.32Å; L114-L116 PolarHBondContact O-N 3Å; L116-S119 PolarHBondContact O-N 2.87Å; L116-Q120 WeakPolarHBondContact O-CG 3.45Å; L116-Q120 PolarHBondContact O-N 3.4Å
117R82.1Confident78.4Confident100 Ų10093.5 Ų93.538%0.37749%0.49SS..Hα-helixtrans-66.5-44.1177.7-173.2-178.2178.8-164.4-0.3111.8Q90 L113 L114 A115 S119 Q120 L121Q90-R117 VanDerWaalsContact OE1-CZ 3.26Å; L113-R117 PolarHBondContact O-N 3.21Å; L114-R117 WeakPolarHBondContact O-CB 3.43Å; L114-R117 PolarHBondContact O-N 3.3Å; L114-R117 VanDerWaalsContact O-N 3.1Å; A115-R117 VanDerWaalsContact C-N 3.32Å; A115-R117 PolarHBondContact O-N 3.03Å; R117-S119 VanDerWaalsContact C-N 3.3Å; R117-S119 PolarHBondContact O-N 2.94Å; R117-Q120 PolarHBondContact O-N 3.41Å; R117-Q120 VanDerWaalsContact O-N 3.16Å; R117-L121 HydrophobicContact CG-CD1 4.46Å; R117-L121 WeakPolarHBondContact O-CG 3.37Å; R117-L121 PolarHBondContact O-N 3.46Å
118E79.4Confident76.7Confident130 Ų13097.1 Ų97.161%0.60752%0.52SS*.Hα-helixtrans-60.8-41175.8-71175.1-173.600111.4L114 A115 Q120 L121 S122L114-E118 PolarHBondContact O-N 3.44Å; A115-E118 PolarHBondContact O-N 3.48Å; E118-Q120 VanDerWaalsContact C-N 3.31Å; E118-Q120 PolarHBondContact O-N 3Å; E118-L121 PolarHBondContact O-N 3.24Å; E118-S122 PolarHBondContact O-N 3.02Å
119S76.9Confident74.6Confident81 Ų8194.1 Ų94.157%0.56652%0.521SS*.Hα-helixtrans-62.6-36.3174.5-174.70000112.8A115 L116 R117 A123A115-S119 WeakPolarHBondContact O-CB 3.25Å; A115-S119 PolarHBondContact O-N 3.37Å; L116-S119 PolarHBondContact O-N 2.87Å; R117-S119 VanDerWaalsContact C-N 3.3Å; R117-S119 PolarHBondContact O-N 2.94Å; S119-A123 PolarHBondContact O-N 3.17Å
120Q75.6Confident73Confident147 Ų14797.4 Ų97.469%0.68754%0.543SS*.Hα-helixtrans-70.1-35.5176.9-74.2175.5-16.800112.3L116 R117 E118 A123L116-Q120 WeakPolarHBondContact O-CG 3.45Å; L116-Q120 PolarHBondContact O-N 3.4Å; R117-Q120 PolarHBondContact O-N 3.41Å; R117-Q120 VanDerWaalsContact O-N 3.16Å; E118-Q120 VanDerWaalsContact C-N 3.31Å; E118-Q120 PolarHBondContact O-N 3Å; Q120-A123 PolarHBondContact O-N 2.92Å
121L68.8Low71.2Confident134 Ų134105 Ų10570%0.70258%0.579SS**Hα-helixtrans-74.7-29.7177.5-63.3174.3000112.3R117 E118 A123R117-L121 HydrophobicContact CG-CD1 4.46Å; R117-L121 WeakPolarHBondContact O-CG 3.37Å; R117-L121 PolarHBondContact O-N 3.46Å; E118-L121 PolarHBondContact O-N 3.24Å; L121-A123 VanDerWaalsContact C-N 3.32Å
122S68.1Low69.1Low105 Ų105105.1 Ų105.173%0.73459%0.588SS**Hα-helixtrans-79.1-14175.4-172.40000113.5E118 S124E118-S122 PolarHBondContact O-N 3.02Å; S122-S124 PolarHBondContact O-N 3.42Å; S122-S124 VanDerWaalsContact O-N 3.15Å
123A57.4Low67.4Low66 Ų66101.4 Ų101.455%0.54558%0.584SS.*SBendtrans-76.6100.9174.700000109.1S119 Q120 L121S119-A123 PolarHBondContact O-N 3.17Å; Q120-A123 PolarHBondContact O-N 2.92Å; L121-A123 VanDerWaalsContact C-N 3.32Å
124S53.4Low65.7Low100 Ų100105 Ų10570%0.69960%0.6SS**  trans-54.1130.9171.6-159.60000109.1S122 V126S122-S124 PolarHBondContact O-N 3.42Å; S122-S124 VanDerWaalsContact O-N 3.15Å; S124-V126 PolarHBondContact O-N 3.25Å
125P58.3Low64.2Low93 Ų93107 Ų10760%0.60462%0.62SS**  trans-65.9104.818027.4-33.1000108.5Y127P125-Y127 HydrophobicContact CB-CD2 3.74Å; P125-Y127 HydrophobicContact CB-CE2 3.63Å; P125-Y127 HydrophobicContact CG-CD2 4.35Å; P125-Y127 HydrophobicContact CG-CE2 4.33Å; P125-Y127 PolarHBondContact O-N 3.34Å
126V59Low62.8Low130 Ų130113.8 Ų113.879%0.78863%0.634SS**  trans-73.475.8168.5-175.60000107S124 A128S124-V126 PolarHBondContact O-N 3.25Å; V126-A128 HydrophobicContact CG1-CB 4.1Å; V126-A128 PolarHBondContact O-N 3.3Å
127Y53.1Low61.5Low211 Ų211114.6 Ų114.683%0.82764%0.638SS**  trans-73.380156.2-70.6-75.9000106.4P125 T129P125-Y127 HydrophobicContact CB-CD2 3.74Å; P125-Y127 HydrophobicContact CB-CE2 3.63Å; P125-Y127 HydrophobicContact CG-CD2 4.35Å; P125-Y127 HydrophobicContact CG-CE2 4.33Å; P125-Y127 PolarHBondContact O-N 3.34Å; Y127-T129 PolarHBondContact O-N 3.47Å
128A56.2Low60.6Low77 Ų77115 Ų11564%0.63665%0.648SS**  trans-63.7108.1167.800000107.8V126 T130V126-A128 HydrophobicContact CG1-CB 4.1Å; V126-A128 PolarHBondContact O-N 3.3Å; A128-T130 PolarHBondContact O-N 3.37Å; A128-T130 VanDerWaalsContact O-N 3.09Å
129T51.6Low59.9Low105 Ų105115.1 Ų115.164%0.64465%0.653SS**  trans-12.798.7159.9-60.70000114.1Y127 Q131Y127-T129 PolarHBondContact O-N 3.47Å; T129-Q131 HydrophobicContact CG2-CB 3.87Å; T129-Q131 PolarHBondContact O-N 2.97Å
130T59.8Low59.2Low110 Ų110118.2 Ų118.268%0.67566%0.662SS**THydrogen-bonded Turntrans-70.7-8.7164.143.30000112.6A128 G132 V133A128-T130 PolarHBondContact O-N 3.37Å; A128-T130 VanDerWaalsContact O-N 3.09Å; T130-G132 VanDerWaalsContact C-N 3.27Å; T130-G132 PolarHBondContact O-N 3.2Å; T130-V133 WeakPolarHBondContact O-CG2 3.46Å
131Q54.1Low58.7Low161 Ų161119 Ų11975%0.75267%0.666SS**Hα-helixtrans-73.1-10178.3-80.8176.8-33.400115T129T129-Q131 HydrophobicContact CG2-CB 3.87Å; T129-Q131 PolarHBondContact O-N 2.97Å
132G49.4Very low58.4Low39 Ų39121.6 Ų121.640%0.40267%0.671SS.*Hα-helixtrans-91.9-17.317800000115T130 R136T130-G132 VanDerWaalsContact C-N 3.27Å; T130-G132 PolarHBondContact O-N 3.2Å; G132-R136 WeakPolarHBondContact O-CG 3.48Å
133V56.9Low57.5Low93 Ų93129.1 Ų129.156%0.56469%0.691SS**Hα-helixtrans-88.6-30.9178.9-80.50000112.1T130 R136 L137T130-V133 WeakPolarHBondContact O-CG2 3.46Å; V133-R136 PolarHBondContact O-N 3.28Å; V133-L137 PolarHBondContact O-N 3.01Å
134E55.6Low57.5Low136 Ų136132.3 Ų132.364%0.63670%0.698SS**Hα-helixtrans-68.3-40.8175.2-64.8-165.7135.400111.6R136 L137 D138E134-R136 PolarHBondContact O-N 3.09Å; E134-L137 PolarHBondContact O-N 3.32Å; E134-L137 VanDerWaalsContact O-N 3.1Å; E134-D138 PolarHBondContact O-N 3.34Å
135A57.8Low57.8Low68 Ų68134 Ų13456%0.56270%0.698SS**Hα-helixtrans-65.6-20176.400000114.1
136R58Low57.7Low195 Ų195136.3 Ų136.374%0.73670%0.703SS**Hα-helixtrans-90-19.1174.9-65.1-170.788.8179.57.2113.1G132 V133 E134G132-R136 WeakPolarHBondContact O-CG 3.48Å; V133-R136 PolarHBondContact O-N 3.28Å; E134-R136 PolarHBondContact O-N 3.09Å
137L59.6Low57.7Low126 Ų126136.6 Ų136.666%0.6670%0.698SS**Hα-helixtrans-76.9-40174.7-101149000110.9V133 E134 D139 L140V133-L137 PolarHBondContact O-N 3.01Å; E134-L137 PolarHBondContact O-N 3.32Å; E134-L137 VanDerWaalsContact O-N 3.1Å; L137-D139 VanDerWaalsContact C-N 3.31Å; L137-D139 PolarHBondContact O-N 3.37Å; L137-L140 PolarHBondContact O-N 3.21Å
138D63.2Low57.9Low108 Ų108132 Ų13258%0.57869%0.69SS**THydrogen-bonded Turntrans-66.8-28175.9-86.9-48.2000114E134 L140E134-D138 PolarHBondContact O-N 3.34Å; D138-L140 VanDerWaalsContact C-N 3.33Å
139D65.9Low58.1Low133 Ų133135.7 Ų135.771%0.71169%0.694SS**THydrogen-bonded Turntrans-80.8-14.4-178.9-151.945.2000112.9L137L137-D139 VanDerWaalsContact C-N 3.31Å; L137-D139 PolarHBondContact O-N 3.37Å
140L61.8Low58.5Low146 Ų146137.9 Ų137.976%0.76470%0.698SS**THydrogen-bonded Turntrans-94.5-13.3175.8-80.7166.9000113.7L137 D138L137-L140 PolarHBondContact O-N 3.21Å; D138-L140 VanDerWaalsContact C-N 3.33Å
141E65.3Low58.4Low163 Ų163140 Ų14076%0.76270%0.699SS**SBendtrans-92.5-0.2-179.6-149.1175.1174.700113.5
142K61.3Low58.8Low189 Ų189138.3 Ų138.382%0.82270%0.695SS**  trans-109.321.4-178-72-170.2179.5174.20115.7
143K50.7Low59.6Low263 Ų263147.3 Ų147.3100%1.14372%0.722SS**  trans-124.80179.2-149177.9-172.2-179.20112

Retrieved 143 of 143 residues in 66.9 ms (Link to these results)