A0A077ZA51_TRITR Loading...

Tetraspanin

AlphaFold DB , UniProt , Accession A0A077ZA51, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 264 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
1M59.3Low83.6Confident154 Ų15495.1 Ų95.176%0.75946%0.457SS*.  0115.70-177.6167.943.300108.5T5 K6 M9M1-T5 HydrophobicContact CG-CG2 4.15Å; M1-K6 HydrophobicContact CE-CD 4.09Å; M1-K6 HydrophobicContact CE-CG 3.63Å; M1-K6 HydrophobicContact CG-CG 3.7Å; M1-K6 HydrophobicContact SD-CG 3.7Å; M1-M9 HydrophobicContact SD-SD 3.92Å
2N78.6Confident84.5Confident115 Ų11597.8 Ų97.862%0.61547%0.474SS*.  trans-66149.6-179.1-162.2-0.9000110.3S4 T5 K6N2-S4 PolarHBondContact O-N 3.19Å; N2-T5 WeakPolarHBondContact O-CB 3.38Å; N2-T5 PolarHBondContact O-N 2.97Å; N2-K6 PolarHBondContact O-N 3.24Å
3E77.2Confident85.2Confident121 Ų12195.9 Ų95.957%0.56548%0.476SS*.Hα-helixtrans-60.4-34.3-175.8-166.266.1-176.300111.6T5 K6 Q7E3-T5 PolarHBondContact O-N 3.45Å; E3-K6 PolarHBondContact O-N 3.2Å; E3-K6 IonicContact OE2-NZ 3.48Å; E3-K6 PolarHBondContact OE2-NZ 3.29Å; E3-Q7 PolarHBondContact O-N 3.46Å; E3-Q7 VanDerWaalsContact O-N 3.07Å
4S80.7Confident85.8Confident55 Ų5589.2 Ų89.239%0.38544%0.443SS..Hα-helixtrans-63.1-37.1173.160.50000113.2N2 R8N2-S4 PolarHBondContact O-N 3.19Å; S4-R8 WeakPolarHBondContact O-CG 3.44Å; S4-R8 PolarHBondContact O-N 3.48Å; S4-R8 VanDerWaalsContact O-N 3.08Å
5T86.5Confident86.5Confident66 Ų6684.6 Ų84.641%0.40542%0.422SS..Hα-helixtrans-67.1-44.6176.6-48.60000110.7M1 N2 E3 Q7 R8 M9M1-T5 HydrophobicContact CG-CG2 4.15Å; N2-T5 WeakPolarHBondContact O-CB 3.38Å; N2-T5 PolarHBondContact O-N 2.97Å; E3-T5 PolarHBondContact O-N 3.45Å; T5-Q7 VanDerWaalsContact C-N 3.35Å; T5-Q7 PolarHBondContact O-N 3.08Å; T5-R8 PolarHBondContact O-N 3.07Å; T5-M9 HydrophobicContact CG2-SD 4.38Å; T5-M9 WeakPolarHBondContact O-CG 3.28Å; T5-M9 PolarHBondContact O-N 2.91Å
6K85.3Confident87.1Confident82 Ų8282.3 Ų82.336%0.35742%0.42SS..Hα-helixtrans-58.4-48.2176.7-63.9-173.9-169.1161.40111.3M1 N2 E3 R8 M9 L10M1-K6 HydrophobicContact CE-CD 4.09Å; M1-K6 HydrophobicContact CE-CG 3.63Å; M1-K6 HydrophobicContact CG-CG 3.7Å; M1-K6 HydrophobicContact SD-CG 3.7Å; N2-K6 PolarHBondContact O-N 3.24Å; E3-K6 PolarHBondContact O-N 3.2Å; E3-K6 IonicContact OE2-NZ 3.48Å; E3-K6 PolarHBondContact OE2-NZ 3.29Å; K6-R8 VanDerWaalsContact C-N 3.33Å; K6-R8 PolarHBondContact O-N 3.41Å; K6-M9 PolarHBondContact O-N 3.36Å; K6-L10 WeakPolarHBondContact O-CD1 3.36Å; K6-L10 PolarHBondContact O-N 2.99Å
7Q86.1Confident87.5Confident43 Ų4381.8 Ų81.820%0.20142%0.422CS..Hα-helixtrans-60.7-42.8-179.8-171.1-176.631.400111.7E3 T5 L10 R11 S260E3-Q7 PolarHBondContact O-N 3.46Å; E3-Q7 VanDerWaalsContact O-N 3.07Å; T5-Q7 VanDerWaalsContact C-N 3.35Å; T5-Q7 PolarHBondContact O-N 3.08Å; Q7-L10 PolarHBondContact O-N 3.47Å; Q7-R11 WeakPolarHBondContact O-CB 3.22Å; Q7-R11 VanDerWaalsContact O-CG 3.28Å; Q7-R11 WeakPolarHBondContact O-CG 3.37Å; Q7-R11 PolarHBondContact O-N 2.99Å; Q7-S260 VanDerWaalsContact CG-OG 3.3Å; Q7-S260 WeakPolarHBondContact CG-OG 3.4Å; Q7-S260 PolarHBondContact NE2-OG 3.28Å
8R89.6Confident88Confident188 Ų18877.2 Ų77.271%0.70940%0.399SS*.Hα-helixtrans-61.8-43.1175.5-74.7177.9178.9-166.50.3112.1S4 T5 K6 R11 L12S4-R8 WeakPolarHBondContact O-CG 3.44Å; S4-R8 PolarHBondContact O-N 3.48Å; S4-R8 VanDerWaalsContact O-N 3.08Å; T5-R8 PolarHBondContact O-N 3.07Å; K6-R8 VanDerWaalsContact C-N 3.33Å; K6-R8 PolarHBondContact O-N 3.41Å; R8-R11 PolarHBondContact O-N 2.82Å; R8-L12 WeakPolarHBondContact O-CB 3.34Å; R8-L12 PolarHBondContact O-N 3.32Å
9M90.9Very high88.5Confident105 Ų10577.4 Ų77.452%0.51740%0.397SS..Hα-helixtrans-63.6-48.1177.2-69.8179.875.300111.7M1 T5 K6 R11 L12 C13M1-M9 HydrophobicContact SD-SD 3.92Å; T5-M9 HydrophobicContact CG2-SD 4.38Å; T5-M9 WeakPolarHBondContact O-CG 3.28Å; T5-M9 PolarHBondContact O-N 2.91Å; K6-M9 PolarHBondContact O-N 3.36Å; M9-R11 VanDerWaalsContact C-N 3.34Å; M9-R11 PolarHBondContact O-N 3.47Å; M9-L12 PolarHBondContact O-N 3.46Å; M9-C13 WeakPolarHBondContact O-CB 3.46Å; M9-C13 PolarHBondContact O-N 3.25Å; M9-C13 PolarHBondContact O-SG 2.97Å
10L91.7Very high88.9Confident48 Ų4879.4 Ų79.425%0.25141%0.406SS..Hα-helixtrans-58.3-46.5177.3-93.174.2000111.4K6 Q7 L12 C13 T14 L256 L257K6-L10 WeakPolarHBondContact O-CD1 3.36Å; K6-L10 PolarHBondContact O-N 2.99Å; Q7-L10 PolarHBondContact O-N 3.47Å; L10-L12 PolarHBondContact O-N 2.92Å; L10-C13 PolarHBondContact O-N 2.85Å; L10-T14 WeakPolarHBondContact O-CB 3.21Å; L10-T14 PolarHBondContact O-N 3.45Å; L10-T14 PolarHBondContact O-OG1 3.42Å; L10-T14 VanDerWaalsContact O-OG1 3.1Å; L10-L256 HydrophobicContact CD2-CB 3.59Å; L10-L256 HydrophobicContact CD2-CD1 3.86Å; L10-L256 HydrophobicContact CD2-CG 4.39Å; L10-L257 HydrophobicContact CB-CD2 3.86Å; L10-L257 HydrophobicContact CB-CG 4.34Å
11R93.9Very high89.2Confident69 Ų6979.1 Ų79.126%0.2641%0.405SS..Hα-helixtrans-59.8-48178-73.2177.7-173.8-176.8-1.5111.4Q7 R8 M9 T14 C15 T83 L257Q7-R11 WeakPolarHBondContact O-CB 3.22Å; Q7-R11 VanDerWaalsContact O-CG 3.28Å; Q7-R11 WeakPolarHBondContact O-CG 3.37Å; Q7-R11 PolarHBondContact O-N 2.99Å; R8-R11 PolarHBondContact O-N 2.82Å; M9-R11 VanDerWaalsContact C-N 3.34Å; M9-R11 PolarHBondContact O-N 3.47Å; R11-T14 PolarHBondContact O-N 3.31Å; R11-C15 VanDerWaalsContact O-CB 3.24Å; R11-C15 WeakPolarHBondContact O-CB 3.3Å; R11-C15 PolarHBondContact O-N 3.28Å; R11-C15 PolarHBondContact O-SG 3.26Å; R11-T83 VanDerWaalsContact NH1-CG2 3.27Å; R11-L257 HydrophobicContact CB-CD2 4.38Å; R11-L257 HydrophobicContact CG-CD2 3.42Å; R11-L257 VanDerWaalsContact CG-CD2 3.42Å
12L93.8Very high91.1Very high127 Ų12774.9 Ų74.967%0.66538%0.381SS*.Hα-helixtrans-62.2-45.3-179.6-176.764000111.5R8 M9 L10 C15 A16R8-L12 WeakPolarHBondContact O-CB 3.34Å; R8-L12 PolarHBondContact O-N 3.32Å; M9-L12 PolarHBondContact O-N 3.46Å; L10-L12 PolarHBondContact O-N 2.92Å; L12-C15 PolarHBondContact O-N 2.9Å; L12-A16 VanDerWaalsContact O-CB 3.31Å; L12-A16 WeakPolarHBondContact O-CB 3.21Å; L12-A16 PolarHBondContact O-N 3.3Å
13C93.7Very high92Very high74 Ų7473.6 Ų73.650%0.537%0.373SS..Hα-helixtrans-61.1-52.6177.6-68.70000111.4M9 L10 C15 A16 T17M9-C13 WeakPolarHBondContact O-CB 3.46Å; M9-C13 PolarHBondContact O-N 3.25Å; M9-C13 PolarHBondContact O-SG 2.97Å; L10-C13 PolarHBondContact O-N 2.85Å; C13-C15 VanDerWaalsContact C-N 3.35Å; C13-C15 PolarHBondContact O-N 3.43Å; C13-A16 PolarHBondContact O-N 3.46Å; C13-T17 WeakPolarHBondContact O-CG2 3.4Å; C13-T17 PolarHBondContact O-N 3.23Å; C13-T17 PolarHBondContact O-OG1 3.44Å
14T94.6Very high92.9Very high2 Ų270.9 Ų70.91%0.01237%0.368CS..Hα-helixtrans-60.7-43.8179.3-58.20000111.4L10 R11 A16 T17 S18 A80 L257L10-T14 WeakPolarHBondContact O-CB 3.21Å; L10-T14 PolarHBondContact O-N 3.45Å; L10-T14 PolarHBondContact O-OG1 3.42Å; L10-T14 VanDerWaalsContact O-OG1 3.1Å; R11-T14 PolarHBondContact O-N 3.31Å; T14-A16 PolarHBondContact O-N 3.46Å; T14-T17 PolarHBondContact O-OG1 3.03Å; T14-S18 WeakPolarHBondContact O-CB 3.34Å; T14-S18 PolarHBondContact O-N 2.87Å; T14-S18 PolarHBondContact O-OG 3.49Å; T14-A80 HydrophobicContact CG2-CB 3.93Å; T14-L257 HydrophobicContact CG2-CD1 4.2Å
15C95.6Very high93.7Very high20 Ų2068.3 Ų68.314%0.13535%0.349CS..Hα-helixtrans-57-50.7174.7-79.20000111.7R11 L12 C13 F19 A80 Y81R11-C15 VanDerWaalsContact O-CB 3.24Å; R11-C15 WeakPolarHBondContact O-CB 3.3Å; R11-C15 PolarHBondContact O-N 3.28Å; R11-C15 PolarHBondContact O-SG 3.26Å; L12-C15 PolarHBondContact O-N 2.9Å; C13-C15 VanDerWaalsContact C-N 3.35Å; C13-C15 PolarHBondContact O-N 3.43Å; C15-F19 WeakPolarHBondContact O-CB 3.31Å; C15-F19 PolarHBondContact O-N 2.94Å; C15-A80 WeakPolarHBondContact SG-CB 3.46Å; C15-Y81 PolarHBondContact SG-N 2.91Å; C15-Y81 VanDerWaalsContact SG-N 3.38Å
16A95.5Very high94.2Very high47 Ų4768.2 Ų68.239%0.38835%0.346SS..Hα-helixtrans-64.6-47.8-176.900000111.8L12 C13 T14 F19 I20L12-A16 VanDerWaalsContact O-CB 3.31Å; L12-A16 WeakPolarHBondContact O-CB 3.21Å; L12-A16 PolarHBondContact O-N 3.3Å; C13-A16 PolarHBondContact O-N 3.46Å; T14-A16 PolarHBondContact O-N 3.46Å; A16-F19 PolarHBondContact O-N 2.96Å; A16-I20 WeakPolarHBondContact O-CG1 3.45Å; A16-I20 PolarHBondContact O-N 3.47Å
17T94.8Very high94.8Very high74 Ų7467.1 Ų67.145%0.45435%0.352SS..Hα-helixtrans-64.2-45179.654.50000111.5C13 T14 F19 I20 I21C13-T17 WeakPolarHBondContact O-CG2 3.4Å; C13-T17 PolarHBondContact O-N 3.23Å; C13-T17 PolarHBondContact O-OG1 3.44Å; T14-T17 PolarHBondContact O-OG1 3.03Å; T17-F19 VanDerWaalsContact C-N 3.34Å; T17-F19 PolarHBondContact O-N 3.47Å; T17-I20 PolarHBondContact O-N 3.48Å; T17-I21 VanDerWaalsContact O-CG1 3.26Å; T17-I21 WeakPolarHBondContact O-CG1 3.31Å; T17-I21 PolarHBondContact O-N 3.01Å
18S96.9Very high95.3Very high0 Ų068 Ų680%036%0.356CS..Hα-helixtrans-67.4-34.5178.9-64.60000112.1T14 I21 W22 A73 W77T14-S18 WeakPolarHBondContact O-CB 3.34Å; T14-S18 PolarHBondContact O-N 2.87Å; T14-S18 PolarHBondContact O-OG 3.49Å; S18-I21 PolarHBondContact O-N 2.9Å; S18-W22 VanDerWaalsContact O-CB 3.26Å; S18-W22 WeakPolarHBondContact O-CB 3.49Å; S18-W22 PolarHBondContact O-N 3.43Å; S18-A73 WeakPolarHBondContact CB-O 3.27Å; S18-W77 VanDerWaalsContact CB-N 3.34Å
19F96.7Very high95.7Very high81 Ų8162.1 Ų62.136%0.35534%0.336SS..Hα-helixtrans-66.6-42.3175.6-176.2-108.3000112.2C15 A16 T17 W22 I23 W77C15-F19 WeakPolarHBondContact O-CB 3.31Å; C15-F19 PolarHBondContact O-N 2.94Å; A16-F19 PolarHBondContact O-N 2.96Å; T17-F19 VanDerWaalsContact C-N 3.34Å; T17-F19 PolarHBondContact O-N 3.47Å; F19-W22 AromaticContact CD2-CE3 3.94Å; F19-W22 HydrophobicContact CD2-CE3 3.94Å; F19-W22 HydrophobicContact CD2-CZ3 4.44Å; F19-W22 AromaticContact CE2-CE3 3.73Å; F19-W22 HydrophobicContact CE2-CE3 3.73Å; F19-W22 AromaticContact CE2-CZ3 3.79Å; F19-W22 HydrophobicContact CE2-CZ3 3.79Å; F19-W22 WeakPolarHBondContact O-CB 3.43Å; F19-W22 PolarHBondContact O-N 3.41Å; F19-I23 HydrophobicContact CE1-CG1 4.35Å; F19-I23 HydrophobicContact CZ-CD1 4.27Å; F19-I23 HydrophobicContact CZ-CG1 4.32Å; F19-I23 WeakPolarHBondContact O-CG1 3.24Å; F19-I23 PolarHBondContact O-N 2.91Å; F19-W77 HydrophobicContact CB-CD2 4.39Å; F19-W77 HydrophobicContact CB-CG 4.25Å; F19-W77 AromaticContact CD2-CD2 3.67Å; F19-W77 HydrophobicContact CD2-CD2 3.67Å; F19-W77 AromaticContact CD2-CE2 3.56Å; F19-W77 AromaticContact CD2-CE3 3.74Å; F19-W77 HydrophobicContact CD2-CE3 3.74Å; F19-W77 HydrophobicContact CD2-CG 4.39Å; F19-W77 AromaticContact CD2-CH2 3.66Å; F19-W77 HydrophobicContact CD2-CH2 3.66Å; F19-W77 AromaticContact CD2-CZ2 3.57Å; F19-W77 HydrophobicContact CD2-CZ2 3.57Å; F19-W77 AromaticContact CD2-CZ3 3.73Å; F19-W77 HydrophobicContact CD2-CZ3 3.73Å; F19-W77 HydrophobicContact CE2-CD2 4.49Å; F19-W77 HydrophobicContact CE2-CE3 4.3Å; F19-W77 AromaticContact CE2-CH2 3.49Å; F19-W77 HydrophobicContact CE2-CH2 3.49Å; F19-W77 VanDerWaalsContact CE2-CH2 3.49Å; F19-W77 AromaticContact CE2-CZ2 3.7Å; F19-W77 HydrophobicContact CE2-CZ2 3.7Å; F19-W77 AromaticContact CE2-CZ3 3.81Å; F19-W77 HydrophobicContact CE2-CZ3 3.81Å; F19-W77 HydrophobicContact CG-CD2 4.49Å
20I96.5Very high95.9Very high116 Ų11660.3 Ų60.360%0.59533%0.333SS*.Hα-helixtrans-62.1-46.2175.5-66.7164.8000110.5A16 T17 W22 I23 S24A16-I20 WeakPolarHBondContact O-CG1 3.45Å; A16-I20 PolarHBondContact O-N 3.47Å; T17-I20 PolarHBondContact O-N 3.48Å; I20-W22 VanDerWaalsContact C-N 3.28Å; I20-W22 PolarHBondContact O-N 3.5Å; I20-I23 PolarHBondContact O-N 3.49Å; I20-S24 PolarHBondContact O-N 2.93Å; I20-S24 VanDerWaalsContact O-N 3.09Å
21I96.1Very high96Very high74 Ų7462.8 Ų62.838%0.37935%0.346SS..Hα-helixtrans-62.9-38.7177.4-63.7165.9000110.4T17 S18 I23 S24 G25 I69 A73T17-I21 VanDerWaalsContact O-CG1 3.26Å; T17-I21 WeakPolarHBondContact O-CG1 3.31Å; T17-I21 PolarHBondContact O-N 3.01Å; S18-I21 PolarHBondContact O-N 2.9Å; I21-I23 PolarHBondContact O-N 2.88Å; I21-S24 WeakPolarHBondContact CA-OG 3.41Å; I21-S24 PolarHBondContact O-N 3.07Å; I21-S24 PolarHBondContact O-OG 2.99Å; I21-G25 PolarHBondContact O-N 2.89Å; I21-I69 HydrophobicContact CG2-CG2 3.87Å; I21-A73 HydrophobicContact CB-CB 4.04Å; I21-A73 HydrophobicContact CG2-CB 3.75Å
22W97.9Very high96Very high65 Ų6559.7 Ų59.725%0.24633%0.334CS..Hα-helixtrans-59.4-46.7177.317868.9000112S18 F19 I20 S24 G25 I26 A70 A73 F74 W77S18-W22 VanDerWaalsContact O-CB 3.26Å; S18-W22 WeakPolarHBondContact O-CB 3.49Å; S18-W22 PolarHBondContact O-N 3.43Å; F19-W22 AromaticContact CD2-CE3 3.94Å; F19-W22 HydrophobicContact CD2-CE3 3.94Å; F19-W22 HydrophobicContact CD2-CZ3 4.44Å; F19-W22 AromaticContact CE2-CE3 3.73Å; F19-W22 HydrophobicContact CE2-CE3 3.73Å; F19-W22 AromaticContact CE2-CZ3 3.79Å; F19-W22 HydrophobicContact CE2-CZ3 3.79Å; F19-W22 WeakPolarHBondContact O-CB 3.43Å; F19-W22 PolarHBondContact O-N 3.41Å; I20-W22 VanDerWaalsContact C-N 3.28Å; I20-W22 PolarHBondContact O-N 3.5Å; W22-S24 VanDerWaalsContact C-N 3.33Å; W22-S24 PolarHBondContact O-N 3.18Å; W22-G25 PolarHBondContact O-N 3.5Å; W22-I26 HydrophobicContact CD2-CG1 4.45Å; W22-I26 HydrophobicContact CZ2-CG1 4.24Å; W22-I26 WeakPolarHBondContact O-CG1 3.42Å; W22-I26 PolarHBondContact O-N 3.24Å; W22-A70 VanDerWaalsContact CD1-O 3.27Å; W22-A73 HydrophobicContact CB-CB 3.81Å; W22-F74 AromaticContact NE1-CD2 3.95Å; W22-W77 HydrophobicContact CD2-CE3 4.42Å; W22-W77 HydrophobicContact CD2-CZ3 4.33Å; W22-W77 HydrophobicContact CE3-CE3 4.39Å; W22-W77 HydrophobicContact CE3-CZ3 4.03Å; W22-W77 HydrophobicContact CH2-CZ3 4.43Å; W22-W77 HydrophobicContact CZ3-CZ3 4.08Å
23I97.6Very high96Very high88 Ų8857.3 Ų57.345%0.45132%0.322SS..Hα-helixtrans-59.8-43.4174.9-63.5-64000111.2F19 I20 I21 G25 I26 A27F19-I23 HydrophobicContact CE1-CG1 4.35Å; F19-I23 HydrophobicContact CZ-CD1 4.27Å; F19-I23 HydrophobicContact CZ-CG1 4.32Å; F19-I23 WeakPolarHBondContact O-CG1 3.24Å; F19-I23 PolarHBondContact O-N 2.91Å; I20-I23 PolarHBondContact O-N 3.49Å; I21-I23 PolarHBondContact O-N 2.88Å; I23-G25 PolarHBondContact O-N 3.36Å; I23-I26 PolarHBondContact O-N 3.1Å; I23-A27 WeakPolarHBondContact O-CB 3.47Å; I23-A27 PolarHBondContact O-N 3.47Å
24S96.3Very high95.9Very high65 Ų6561.5 Ų61.546%0.45533%0.328SS..Hα-helixtrans-63.3-38.5176.671.40000113.1I20 I21 W22 A27 Q28I20-S24 PolarHBondContact O-N 2.93Å; I20-S24 VanDerWaalsContact O-N 3.09Å; I21-S24 WeakPolarHBondContact CA-OG 3.41Å; I21-S24 PolarHBondContact O-N 3.07Å; I21-S24 PolarHBondContact O-OG 2.99Å; W22-S24 VanDerWaalsContact C-N 3.33Å; W22-S24 PolarHBondContact O-N 3.18Å; S24-A27 PolarHBondContact O-N 3.41Å; S24-Q28 PolarHBondContact O-N 3.44Å
25G97.5Very high95.7Very high0 Ų063.2 Ų63.20%034%0.336CS..Hα-helixtrans-65.8-42.6177.100000112.2I21 W22 I23 Q28 F29I21-G25 PolarHBondContact O-N 2.89Å; W22-G25 PolarHBondContact O-N 3.5Å; I23-G25 PolarHBondContact O-N 3.36Å; G25-Q28 PolarHBondContact O-N 2.94Å; G25-F29 WeakPolarHBondContact O-CB 3.39Å; G25-F29 PolarHBondContact O-N 3.3Å
26I98Very high95.2Very high65 Ų6563.6 Ų63.633%0.33334%0.337SS..Hα-helixtrans-62.6-44.1173.5-65.1-63.6000110.7W22 I23 Q28 F29 C30 A70W22-I26 HydrophobicContact CD2-CG1 4.45Å; W22-I26 HydrophobicContact CZ2-CG1 4.24Å; W22-I26 WeakPolarHBondContact O-CG1 3.42Å; W22-I26 PolarHBondContact O-N 3.24Å; I23-I26 PolarHBondContact O-N 3.1Å; I26-Q28 PolarHBondContact O-N 3.29Å; I26-F29 PolarHBondContact O-N 3.44Å; I26-C30 WeakPolarHBondContact O-CB 3.42Å; I26-C30 PolarHBondContact O-N 2.98Å; I26-C30 PolarHBondContact O-SG 2.99Å; I26-C30 VanDerWaalsContact O-SG 3.33Å; I26-A70 HydrophobicContact CD1-CB 3.89Å; I26-A70 HydrophobicContact CG1-CB 4.3Å
27A97.6Very high94.8Very high58 Ų5870.2 Ų70.248%0.47935%0.353SS..Hα-helixtrans-59.8-45.5176.900000112I23 S24 C30 L31I23-A27 WeakPolarHBondContact O-CB 3.47Å; I23-A27 PolarHBondContact O-N 3.47Å; S24-A27 PolarHBondContact O-N 3.41Å; A27-C30 PolarHBondContact O-N 3.42Å; A27-L31 WeakPolarHBondContact O-CB 3.29Å; A27-L31 PolarHBondContact O-N 3.47Å
28Q96.1Very high94.3Very high63 Ų6368.4 Ų68.429%0.29434%0.341SS..Hα-helixtrans-63.9-41.3176.2-177.3179.1-53.400112.4S24 G25 I26 L31 S32S24-Q28 PolarHBondContact O-N 3.44Å; G25-Q28 PolarHBondContact O-N 2.94Å; I26-Q28 PolarHBondContact O-N 3.29Å; Q28-L31 PolarHBondContact O-N 2.85Å; Q28-S32 PolarHBondContact O-N 2.93Å; Q28-S32 PolarHBondContact O-OG 3.48Å
29F97.2Very high93.1Very high63 Ų6374.7 Ų74.728%0.27637%0.37SS..Hα-helixtrans-61.9-48176.5178-94.4000111.4G25 I26 L31 S32 L33 L63 A67G25-F29 WeakPolarHBondContact O-CB 3.39Å; G25-F29 PolarHBondContact O-N 3.3Å; I26-F29 PolarHBondContact O-N 3.44Å; F29-L31 VanDerWaalsContact C-N 3.34Å; F29-L31 PolarHBondContact O-N 2.95Å; F29-S32 WeakPolarHBondContact O-CB 3.35Å; F29-S32 PolarHBondContact O-N 2.9Å; F29-S32 VanDerWaalsContact O-N 3.16Å; F29-L33 HydrophobicContact CD1-CD1 3.97Å; F29-L33 HydrophobicContact CD1-CG 4.47Å; F29-L33 HydrophobicContact CE1-CD1 3.38Å; F29-L33 HydrophobicContact CE1-CG 4.09Å; F29-L33 HydrophobicContact CZ-CD1 3.92Å; F29-L33 HydrophobicContact CZ-CG 4.32Å; F29-L33 PolarHBondContact O-N 2.91Å; F29-L63 HydrophobicContact CD2-CD1 3.52Å; F29-L63 HydrophobicContact CD2-CG 4.21Å; F29-L63 HydrophobicContact CE2-CD1 3.39Å; F29-L63 HydrophobicContact CE2-CG 3.93Å; F29-L63 HydrophobicContact CG-CD1 4.2Å; F29-L63 HydrophobicContact CZ-CD1 3.98Å; F29-A67 HydrophobicContact CD2-CB 3.78Å; F29-A67 HydrophobicContact CE2-CB 3.92Å
30C96.4Very high92.1Very high68 Ų6876.3 Ų76.346%0.45938%0.382SS..Hα-helixtrans-62.2-39.7175.6-70.20000112.2I26 A27 S32 L33 W34I26-C30 WeakPolarHBondContact O-CB 3.42Å; I26-C30 PolarHBondContact O-N 2.98Å; I26-C30 PolarHBondContact O-SG 2.99Å; I26-C30 VanDerWaalsContact O-SG 3.33Å; A27-C30 PolarHBondContact O-N 3.42Å; C30-S32 VanDerWaalsContact C-N 3.29Å; C30-S32 PolarHBondContact O-N 3.06Å; C30-L33 PolarHBondContact O-N 3Å; C30-W34 WeakPolarHBondContact O-CB 3.47Å; C30-W34 PolarHBondContact O-N 3.4Å
31L94.3Very high90.8Very high100 Ų10072.6 Ų72.652%0.52437%0.365SS..Hα-helixtrans-60.4-41.3174.1178.963.6000111.2A27 Q28 F29 W34 L35A27-L31 WeakPolarHBondContact O-CB 3.29Å; A27-L31 PolarHBondContact O-N 3.47Å; Q28-L31 PolarHBondContact O-N 2.85Å; F29-L31 VanDerWaalsContact C-N 3.34Å; F29-L31 PolarHBondContact O-N 2.95Å; L31-W34 WeakPolarHBondContact O-CB 3.4Å; L31-W34 PolarHBondContact O-N 3.16Å; L31-L35 HydrophobicContact CG-CD1 4.46Å; L31-L35 WeakPolarHBondContact O-CG 3.44Å; L31-L35 PolarHBondContact O-N 2.92Å
32S93Very high89.4Confident3 Ų369.1 Ų69.12%0.02135%0.347CS..Hα-helixtrans-68.1-39.7179.3-55.60000111.8Q28 F29 C30 W34 L35 L36 L62 L63Q28-S32 PolarHBondContact O-N 2.93Å; Q28-S32 PolarHBondContact O-OG 3.48Å; F29-S32 WeakPolarHBondContact O-CB 3.35Å; F29-S32 PolarHBondContact O-N 2.9Å; F29-S32 VanDerWaalsContact O-N 3.16Å; C30-S32 VanDerWaalsContact C-N 3.29Å; C30-S32 PolarHBondContact O-N 3.06Å; S32-W34 VanDerWaalsContact C-N 3.34Å; S32-L35 PolarHBondContact O-N 2.83Å; S32-L36 WeakPolarHBondContact O-CG 3.47Å; S32-L36 PolarHBondContact O-N 3.36Å; S32-L62 PolarHBondContact OG-O 3.23Å; S32-L63 PolarHBondContact OG-N 2.93Å
33L93.7Very high87.8Confident77 Ų7774.7 Ų74.740%0.40337%0.368SS..Hα-helixtrans-62.7-41171.2-72.9179.6000112.1F29 C30 L36 Y37 L63F29-L33 HydrophobicContact CD1-CD1 3.97Å; F29-L33 HydrophobicContact CD1-CG 4.47Å; F29-L33 HydrophobicContact CE1-CD1 3.38Å; F29-L33 HydrophobicContact CE1-CG 4.09Å; F29-L33 HydrophobicContact CZ-CD1 3.92Å; F29-L33 HydrophobicContact CZ-CG 4.32Å; F29-L33 PolarHBondContact O-N 2.91Å; C30-L33 PolarHBondContact O-N 3Å; L33-L36 PolarHBondContact O-N 3.16Å; L33-Y37 WeakPolarHBondContact O-CB 3.3Å; L33-Y37 PolarHBondContact O-N 3.38Å; L33-L63 HydrophobicContact CD2-CD1 3.63Å; L33-L63 HydrophobicContact CD2-CD2 4.24Å; L33-L63 HydrophobicContact CG-CD1 3.66Å
34W92.6Very high86.4Confident163 Ų16374.5 Ų74.562%0.61737%0.368SS*.Hα-helixtrans-60.9-45.7175.7179.2-83.2000111.5C30 L31 S32 L36 Y37 N38C30-W34 WeakPolarHBondContact O-CB 3.47Å; C30-W34 PolarHBondContact O-N 3.4Å; L31-W34 WeakPolarHBondContact O-CB 3.4Å; L31-W34 PolarHBondContact O-N 3.16Å; S32-W34 VanDerWaalsContact C-N 3.34Å; W34-L36 VanDerWaalsContact C-N 3.29Å; W34-L36 PolarHBondContact O-N 2.91Å; W34-Y37 PolarHBondContact O-N 3.02Å; W34-N38 PolarHBondContact NE1-ND2 3.49Å; W34-N38 WeakPolarHBondContact O-CB 3.31Å; W34-N38 PolarHBondContact O-N 3.47Å
35L89.1Confident84.8Confident37 Ų3775.3 Ų75.319%0.19437%0.366CS..Hα-helixtrans-61.5-36.5176.7-69.7172.9000112.5L31 S32 V41 F59L31-L35 HydrophobicContact CG-CD1 4.46Å; L31-L35 WeakPolarHBondContact O-CG 3.44Å; L31-L35 PolarHBondContact O-N 2.92Å; S32-L35 PolarHBondContact O-N 2.83Å; L35-V41 HydrophobicContact CD2-CG1 3.93Å; L35-F59 HydrophobicContact CB-CD1 4.4Å; L35-F59 HydrophobicContact CB-CG 4.48Å; L35-F59 HydrophobicContact CD1-CD1 4.32Å; L35-F59 HydrophobicContact CD1-CE1 4.32Å
36L86.5Confident83.1Confident29 Ų2976.7 Ų76.715%0.15237%0.374CS..Hα-helixtrans-72.7-37.5177.6-75.9167.1000113.3S32 L33 W34 Y56 F59 Y60 L63S32-L36 WeakPolarHBondContact O-CG 3.47Å; S32-L36 PolarHBondContact O-N 3.36Å; L33-L36 PolarHBondContact O-N 3.16Å; W34-L36 VanDerWaalsContact C-N 3.29Å; W34-L36 PolarHBondContact O-N 2.91Å; L36-Y56 HydrophobicContact CD2-CD1 3.88Å; L36-Y56 HydrophobicContact CD2-CE1 4.25Å; L36-F59 HydrophobicContact CD2-CB 3.62Å; L36-F59 HydrophobicContact CD2-CD2 4.29Å; L36-F59 HydrophobicContact CD2-CG 4.46Å; L36-F59 HydrophobicContact CG-CB 3.95Å; L36-Y60 HydrophobicContact CD1-CD1 4.09Å; L36-Y60 HydrophobicContact CD1-CE1 4.03Å; L36-Y60 HydrophobicContact CD2-CD1 4.42Å; L36-Y60 HydrophobicContact CD2-CE1 4.16Å; L36-Y60 HydrophobicContact CD2-CE2 4.38Å; L36-L63 HydrophobicContact CD1-CD2 3.95Å
37Y87Confident81.2Confident186 Ų18677.3 Ų77.373%0.72938%0.376SS*.Hα-helixtrans-90-26.7-174.1-168.9-106.3000113.5L33 W34 H39L33-Y37 WeakPolarHBondContact O-CB 3.3Å; L33-Y37 PolarHBondContact O-N 3.38Å; W34-Y37 PolarHBondContact O-N 3.02Å; Y37-H39 PolarHBondContact O-N 3.41Å
38N84.4Confident79.4Confident36 Ų3677.4 Ų77.419%0.19337%0.368CS..  trans-75.395.3-180-166.3-35.6000109.9W34 D40 V41 A42W34-N38 PolarHBondContact NE1-ND2 3.49Å; W34-N38 WeakPolarHBondContact O-CB 3.31Å; W34-N38 PolarHBondContact O-N 3.47Å; N38-D40 PolarHBondContact O-N 2.91Å; N38-D40 PolarHBondContact OD1-N 2.81Å; N38-V41 HydrophobicContact CB-CB 4.18Å; N38-V41 HydrophobicContact CB-CG2 4.1Å; N38-V41 PolarHBondContact O-N 3.4Å; N38-V41 VanDerWaalsContact O-N 3.16Å; N38-V41 PolarHBondContact OD1-N 3.48Å; N38-A42 WeakPolarHBondContact O-CB 3.37Å; N38-A42 PolarHBondContact O-N 3.05Å
39H71.4Confident77.7Confident132 Ų13276 Ų7661%0.61136%0.362SS*.Hα-helixtrans-58.5-30.6-179.1-71.8-68.3000113.3Y37 R43Y37-H39 PolarHBondContact O-N 3.41Å; H39-R43 WeakPolarHBondContact O-CA 3.37Å; H39-R43 WeakPolarHBondContact O-CB 3.33Å; H39-R43 PolarHBondContact O-N 3.35Å
40D74.6Confident75.9Confident114 Ų11476.4 Ų76.461%0.6137%0.367SS*.Hα-helixtrans-70.8-42.1178.2-62.6-37.8000110.8N38 R43 N44N38-D40 PolarHBondContact O-N 2.91Å; N38-D40 PolarHBondContact OD1-N 2.81Å; D40-R43 PolarHBondContact O-N 3.36Å; D40-N44 VanDerWaalsContact O-CB 3.3Å; D40-N44 WeakPolarHBondContact O-CB 3.33Å; D40-N44 PolarHBondContact O-N 3.08Å; D40-N44 PolarHBondContact O-ND2 3.05Å; D40-N44 PolarHBondContact O-OD1 3.42Å
41V69.8Low74.4Confident38 Ų3876.9 Ų76.923%0.2337%0.365CS..Hα-helixtrans-67.7-46.9175.2178.90000110.3L35 N38 R43 N44 M45L35-V41 HydrophobicContact CD2-CG1 3.93Å; N38-V41 HydrophobicContact CB-CB 4.18Å; N38-V41 HydrophobicContact CB-CG2 4.1Å; N38-V41 PolarHBondContact O-N 3.4Å; N38-V41 VanDerWaalsContact O-N 3.16Å; N38-V41 PolarHBondContact OD1-N 3.48Å; V41-R43 VanDerWaalsContact C-N 3.31Å; V41-R43 PolarHBondContact O-N 3.25Å; V41-N44 PolarHBondContact O-N 3.05Å; V41-M45 HydrophobicContact CG1-CE 4.48Å; V41-M45 HydrophobicContact CG1-CG 4.14Å; V41-M45 VanDerWaalsContact O-CB 3.3Å; V41-M45 WeakPolarHBondContact O-CB 3.18Å; V41-M45 WeakPolarHBondContact O-CG 3.47Å; V41-M45 PolarHBondContact O-N 3.47Å
42A66.1Low72.9Confident2 Ų276 Ų762%0.01736%0.36CS..Hα-helixtrans-58.6-45.6176.700000110.4N38 M45 T46N38-A42 WeakPolarHBondContact O-CB 3.37Å; N38-A42 PolarHBondContact O-N 3.05Å; A42-M45 PolarHBondContact O-N 3.5Å; A42-T46 WeakPolarHBondContact O-CB 3.25Å; A42-T46 WeakPolarHBondContact O-CG2 3.47Å; A42-T46 PolarHBondContact O-N 3.27Å; A42-T46 PolarHBondContact O-OG1 3.46Å
43R65.7Low71.8Confident182 Ų18281.5 Ų81.569%0.68739%0.389SS*.Hα-helixtrans-62.5-49178.9-173.5177.5-176.2-175.90.5111.9H39 D40 V41 M45 T46 E47H39-R43 WeakPolarHBondContact O-CA 3.37Å; H39-R43 WeakPolarHBondContact O-CB 3.33Å; H39-R43 PolarHBondContact O-N 3.35Å; D40-R43 PolarHBondContact O-N 3.36Å; V41-R43 VanDerWaalsContact C-N 3.31Å; V41-R43 PolarHBondContact O-N 3.25Å; R43-M45 VanDerWaalsContact C-N 3.27Å; R43-M45 PolarHBondContact O-N 3.35Å; R43-T46 VanDerWaalsContact CA-OG1 3.26Å; R43-T46 WeakPolarHBondContact CA-OG1 3.23Å; R43-T46 PolarHBondContact O-N 2.92Å; R43-T46 PolarHBondContact O-OG1 3.18Å; R43-E47 WeakPolarHBondContact O-CB 3.43Å; R43-E47 PolarHBondContact O-N 3.32Å
44N66.4Low70.8Confident83 Ų8379.5 Ų79.544%0.44438%0.382SS..Hα-helixtrans-63.2-35.4177.7-67.4-13000111.5D40 V41 E47 L137D40-N44 VanDerWaalsContact O-CB 3.3Å; D40-N44 WeakPolarHBondContact O-CB 3.33Å; D40-N44 PolarHBondContact O-N 3.08Å; D40-N44 PolarHBondContact O-ND2 3.05Å; D40-N44 PolarHBondContact O-OD1 3.42Å; V41-N44 PolarHBondContact O-N 3.05Å; N44-E47 WeakPolarHBondContact O-CB 3.49Å; N44-L137 HydrophobicContact CB-CD2 4.36Å; N44-L137 WeakPolarHBondContact O-CD2 3.28Å
45M63.1Low70Confident82 Ų8273.2 Ų73.240%0.40436%0.36SS..Hα-helixtrans-76.5-42.3178-66.6-68.9-178.600111.7V41 A42 R43 E47 I48 D49 L55 F59V41-M45 HydrophobicContact CG1-CE 4.48Å; V41-M45 HydrophobicContact CG1-CG 4.14Å; V41-M45 VanDerWaalsContact O-CB 3.3Å; V41-M45 WeakPolarHBondContact O-CB 3.18Å; V41-M45 WeakPolarHBondContact O-CG 3.47Å; V41-M45 PolarHBondContact O-N 3.47Å; A42-M45 PolarHBondContact O-N 3.5Å; R43-M45 VanDerWaalsContact C-N 3.27Å; R43-M45 PolarHBondContact O-N 3.35Å; M45-E47 PolarHBondContact O-N 2.93Å; M45-I48 WeakPolarHBondContact O-CA 3.49Å; M45-I48 WeakPolarHBondContact O-CB 3.32Å; M45-I48 PolarHBondContact O-N 3.07Å; M45-I48 HydrophobicContact SD-CD1 4.17Å; M45-D49 PolarHBondContact O-N 2.94Å; M45-L55 HydrophobicContact CB-CD1 4.13Å; M45-L55 WeakPolarHBondContact O-CD1 3.29Å; M45-F59 HydrophobicContact CB-CZ 4.49Å
46T61.5Low69.7Low30 Ų3074.9 Ų74.918%0.18436%0.364CS..Hα-helixtrans-63.3-23.3172.754.70000112.4A42 R43 I48 D49 I52 L55 Y56A42-T46 WeakPolarHBondContact O-CB 3.25Å; A42-T46 WeakPolarHBondContact O-CG2 3.47Å; A42-T46 PolarHBondContact O-N 3.27Å; A42-T46 PolarHBondContact O-OG1 3.46Å; R43-T46 VanDerWaalsContact CA-OG1 3.26Å; R43-T46 WeakPolarHBondContact CA-OG1 3.23Å; R43-T46 PolarHBondContact O-N 2.92Å; R43-T46 PolarHBondContact O-OG1 3.18Å; T46-I48 VanDerWaalsContact C-N 3.31Å; T46-D49 CarbonylContact O-C 3.41Å; T46-I52 HydrophobicContact CG2-CB 4.28Å; T46-I52 HydrophobicContact CG2-CG1 3.94Å; T46-I52 HydrophobicContact CG2-CG2 3.96Å; T46-L55 HydrophobicContact CG2-CD1 4.37Å; T46-Y56 HydrophobicContact CG2-CE2 4.34Å
47E59.2Low69.7Low78 Ų7877.5 Ų77.536%0.36438%0.381SS..Hα-helixtrans-64.2-40.9169.4-164.4165.3-156.600109.3R43 N44 M45 D49 N135 L137 Y138R43-E47 WeakPolarHBondContact O-CB 3.43Å; R43-E47 PolarHBondContact O-N 3.32Å; N44-E47 WeakPolarHBondContact O-CB 3.49Å; M45-E47 PolarHBondContact O-N 2.93Å; E47-D49 PolarHBondContact O-N 3.32Å; E47-N135 WeakPolarHBondContact CG-ND2 3.33Å; E47-N135 PolarHBondContact OE1-ND2 3.4Å; E47-N135 PolarHBondContact OE1-OD1 3.38Å; E47-L137 HydrophobicContact CB-CD2 4.4Å; E47-Y138 WeakPolarHBondContact O-CE2 3.33Å; E47-Y138 PolarHBondContact O-OH 3Å
48I59.2Low69.6Low60 Ų6071.3 Ų71.331%0.30837%0.365SS..Hα-helixtrans-75.9-12.7178.3-55.8162.3000114.9M45 T46 L137 Y138M45-I48 WeakPolarHBondContact O-CA 3.49Å; M45-I48 WeakPolarHBondContact O-CB 3.32Å; M45-I48 PolarHBondContact O-N 3.07Å; M45-I48 HydrophobicContact SD-CD1 4.17Å; T46-I48 VanDerWaalsContact C-N 3.31Å; I48-L137 HydrophobicContact CD1-CD1 4.28Å; I48-L137 HydrophobicContact CD1-CD2 3.57Å; I48-L137 HydrophobicContact CD1-CG 3.83Å; I48-L137 HydrophobicContact CG1-CD2 3.38Å; I48-L137 HydrophobicContact CG1-CG 3.59Å; I48-Y138 WeakPolarHBondContact CA-OH 3.4Å; I48-Y138 HydrophobicContact CB-CE1 4.4Å; I48-Y138 HydrophobicContact CG2-CD1 4.38Å; I48-Y138 HydrophobicContact CG2-CE1 4.11Å; I48-Y138 WeakPolarHBondContact O-CE1 3.32Å; I48-Y138 PolarHBondContact O-OH 3.32Å
49D60Low69.9Low32 Ų3270.7 Ų70.717%0.17136%0.361CS..  trans-136.9109.6173-168.21.5000109.6M45 T46 E47 N51 I52 S54 L55 Y138M45-D49 PolarHBondContact O-N 2.94Å; T46-D49 CarbonylContact O-C 3.41Å; E47-D49 PolarHBondContact O-N 3.32Å; D49-N51 CarbonylContact O-C 3.54Å; D49-N51 PolarHBondContact O-N 2.91Å; D49-N51 WeakPolarHBondContact OD1-CB 3.38Å; D49-N51 PolarHBondContact OD1-N 3.03Å; D49-I52 PolarHBondContact O-N 3.4Å; D49-S54 WeakPolarHBondContact OD2-CB 3.43Å; D49-S54 PolarHBondContact OD2-OG 3.32Å; D49-L55 HydrophobicContact CB-CD1 3.57Å; D49-L55 HydrophobicContact CB-CD2 4.36Å; D49-L55 HydrophobicContact CB-CG 3.77Å; D49-Y138 WeakPolarHBondContact CA-OH 3.32Å; D49-Y138 PolarHBondContact N-OH 2.97Å; D49-Y138 VanDerWaalsContact N-OH 3.13Å
50D59.8Low70.9Confident72 Ų7270.5 Ų70.539%0.38536%0.356SS..SBendtrans-50.5-27.3171.5-72.1-34000112.6I52 K126 H131 Y138D50-I52 VanDerWaalsContact C-N 3.28Å; D50-I52 PolarHBondContact O-N 2.91Å; D50-I52 VanDerWaalsContact O-N 3.13Å; D50-K126 VanDerWaalsContact CB-NZ 3.27Å; D50-K126 WeakPolarHBondContact OD2-CE 3.38Å; D50-K126 IonicContact OD2-NZ 3.55Å; D50-K126 PolarHBondContact OD2-NZ 3.01Å; D50-H131 IonicContact OD1-CE1 3.86Å; D50-H131 PolarHBondContact OD1-CE1 2.98Å; D50-H131 IonicContact OD1-NE2 2.67Å; D50-H131 PolarHBondContact OD1-NE2 2.85Å; D50-H131 IonicContact OD2-CD2 3.57Å; D50-H131 IonicContact OD2-CE1 2.87Å; D50-H131 IonicContact OD2-NE2 2.88Å; D50-H131 PolarHBondContact OD2-NE2 3.45Å; D50-Y138 PolarHBondContact N-OH 3.47Å
51N64.8Low71.8Confident78 Ų7870.2 Ų70.242%0.41735%0.353SS..  trans-86.475.4173.8-162.58.9000110.3D49 N53 S54D49-N51 CarbonylContact O-C 3.54Å; D49-N51 PolarHBondContact O-N 2.91Å; D49-N51 WeakPolarHBondContact OD1-CB 3.38Å; D49-N51 PolarHBondContact OD1-N 3.03Å; N51-N53 PolarHBondContact O-N 3.29Å; N51-N53 WeakPolarHBondContact OD1-CB 3.43Å; N51-S54 VanDerWaalsContact O-CB 3.3Å; N51-S54 WeakPolarHBondContact O-CB 3.37Å; N51-S54 PolarHBondContact O-N 3.49Å
52I63Low72.9Confident83 Ų8372.1 Ų72.143%0.42636%0.362SS..Hα-helixtrans-42-39.4171.2-65-178.3000111.2T46 D49 D50 S54 L55 Y56T46-I52 HydrophobicContact CG2-CB 4.28Å; T46-I52 HydrophobicContact CG2-CG1 3.94Å; T46-I52 HydrophobicContact CG2-CG2 3.96Å; D49-I52 PolarHBondContact O-N 3.4Å; D50-I52 VanDerWaalsContact C-N 3.28Å; D50-I52 PolarHBondContact O-N 2.91Å; D50-I52 VanDerWaalsContact O-N 3.13Å; I52-S54 PolarHBondContact O-N 3.5Å; I52-L55 PolarHBondContact O-N 3.01Å; I52-Y56 HydrophobicContact CG2-CD2 3.51Å; I52-Y56 HydrophobicContact CG2-CE2 3.45Å; I52-Y56 VanDerWaalsContact CG2-CE2 3.45Å; I52-Y56 VanDerWaalsContact O-CD2 3.23Å; I52-Y56 WeakPolarHBondContact O-CD2 3.29Å; I52-Y56 PolarHBondContact O-N 3.22Å; I52-Y56 VanDerWaalsContact O-N 3.15Å
53N71Confident74.3Confident117 Ų11773.4 Ų73.463%0.62637%0.368SS*.Hα-helixtrans-63.4-37.7179.6-59.5-41.2000113.2N51 Y56 V57N51-N53 PolarHBondContact O-N 3.29Å; N51-N53 WeakPolarHBondContact OD1-CB 3.43Å; N53-Y56 PolarHBondContact O-N 3.41Å; N53-V57 WeakPolarHBondContact O-CB 3.46Å; N53-V57 WeakPolarHBondContact O-CG2 3.31Å; N53-V57 PolarHBondContact O-N 2.84Å
54S71.9Confident75.8Confident35 Ų3568.6 Ų68.625%0.24536%0.362CS..Hα-helixtrans-64.3-42.31801770000112D49 N51 I52 V57 S58D49-S54 WeakPolarHBondContact OD2-CB 3.43Å; D49-S54 PolarHBondContact OD2-OG 3.32Å; N51-S54 VanDerWaalsContact O-CB 3.3Å; N51-S54 WeakPolarHBondContact O-CB 3.37Å; N51-S54 PolarHBondContact O-N 3.49Å; I52-S54 PolarHBondContact O-N 3.5Å; S54-V57 PolarHBondContact O-N 2.9Å; S54-S58 PolarHBondContact O-N 3.19Å; S54-S58 PolarHBondContact O-OG 3.48Å
55L75.9Confident77.2Confident32 Ų3268.1 Ų68.117%0.16836%0.362CS..Hα-helixtrans-68-45.5176.7-71.2173.2000112.4M45 T46 D49 I52 V57 S58 F59M45-L55 HydrophobicContact CB-CD1 4.13Å; M45-L55 WeakPolarHBondContact O-CD1 3.29Å; T46-L55 HydrophobicContact CG2-CD1 4.37Å; D49-L55 HydrophobicContact CB-CD1 3.57Å; D49-L55 HydrophobicContact CB-CD2 4.36Å; D49-L55 HydrophobicContact CB-CG 3.77Å; I52-L55 PolarHBondContact O-N 3.01Å; L55-V57 VanDerWaalsContact C-N 3.31Å; L55-V57 PolarHBondContact O-N 2.96Å; L55-S58 WeakPolarHBondContact O-CB 3.43Å; L55-S58 PolarHBondContact O-N 3.47Å; L55-S58 VanDerWaalsContact O-N 3.1Å; L55-F59 WeakPolarHBondContact O-CG 3.5Å; L55-F59 PolarHBondContact O-N 3.04Å
56Y81.5Confident78.8Confident72 Ų7264.2 Ų64.228%0.28234%0.342SS..Hα-helixtrans-61.8-40.5176-83-69.9000111.8L36 T46 I52 N53 S58 F59 Y60L36-Y56 HydrophobicContact CD2-CD1 3.88Å; L36-Y56 HydrophobicContact CD2-CE1 4.25Å; T46-Y56 HydrophobicContact CG2-CE2 4.34Å; I52-Y56 HydrophobicContact CG2-CD2 3.51Å; I52-Y56 HydrophobicContact CG2-CE2 3.45Å; I52-Y56 VanDerWaalsContact CG2-CE2 3.45Å; I52-Y56 VanDerWaalsContact O-CD2 3.23Å; I52-Y56 WeakPolarHBondContact O-CD2 3.29Å; I52-Y56 PolarHBondContact O-N 3.22Å; I52-Y56 VanDerWaalsContact O-N 3.15Å; N53-Y56 PolarHBondContact O-N 3.41Å; Y56-S58 VanDerWaalsContact C-N 3.28Å; Y56-S58 PolarHBondContact O-N 3.25Å; Y56-F59 PolarHBondContact O-N 3.09Å; Y56-Y60 HydrophobicContact CD1-CE2 4.38Å; Y56-Y60 WeakPolarHBondContact O-CD2 3.39Å; Y56-Y60 PolarHBondContact O-N 3.39Å
57V86.5Confident80.5Confident84 Ų8464.2 Ų64.251%0.50935%0.345SS..Hα-helixtrans-56.4-44.8173.2167.90000110.5N53 S54 L55 F59 Y60 L61N53-V57 WeakPolarHBondContact O-CB 3.46Å; N53-V57 WeakPolarHBondContact O-CG2 3.31Å; N53-V57 PolarHBondContact O-N 2.84Å; S54-V57 PolarHBondContact O-N 2.9Å; L55-V57 VanDerWaalsContact C-N 3.31Å; L55-V57 PolarHBondContact O-N 2.96Å; V57-F59 PolarHBondContact O-N 3.3Å; V57-Y60 PolarHBondContact O-N 3.07Å; V57-L61 HydrophobicContact CG1-CD1 4.06Å; V57-L61 HydrophobicContact CG1-CG 4.43Å; V57-L61 WeakPolarHBondContact O-CB 3.28Å; V57-L61 VanDerWaalsContact O-CG 3.28Å; V57-L61 WeakPolarHBondContact O-CG 3.2Å; V57-L61 PolarHBondContact O-N 3.47Å
58S86.5Confident82.4Confident55 Ų5564.2 Ų64.239%0.38534%0.344SS..Hα-helixtrans-61.5-43.3177.6-59.50000112.6S54 L55 Y56 L61 L62S54-S58 PolarHBondContact O-N 3.19Å; S54-S58 PolarHBondContact O-OG 3.48Å; L55-S58 WeakPolarHBondContact O-CB 3.43Å; L55-S58 PolarHBondContact O-N 3.47Å; L55-S58 VanDerWaalsContact O-N 3.1Å; Y56-S58 VanDerWaalsContact C-N 3.28Å; Y56-S58 PolarHBondContact O-N 3.25Å; S58-L61 PolarHBondContact O-N 2.87Å; S58-L62 WeakPolarHBondContact O-CG 3.26Å; S58-L62 PolarHBondContact O-N 3.46Å
59F89.2Confident84.2Confident23 Ų2363.7 Ų63.710%0.10134%0.342CS..Hα-helixtrans-68.1-39.5177.7-61.5-24.5000113L35 L36 M45 L55 Y56 V57 L61 L62 L63L35-F59 HydrophobicContact CB-CD1 4.4Å; L35-F59 HydrophobicContact CB-CG 4.48Å; L35-F59 HydrophobicContact CD1-CD1 4.32Å; L35-F59 HydrophobicContact CD1-CE1 4.32Å; L36-F59 HydrophobicContact CD2-CB 3.62Å; L36-F59 HydrophobicContact CD2-CD2 4.29Å; L36-F59 HydrophobicContact CD2-CG 4.46Å; L36-F59 HydrophobicContact CG-CB 3.95Å; M45-F59 HydrophobicContact CB-CZ 4.49Å; L55-F59 WeakPolarHBondContact O-CG 3.5Å; L55-F59 PolarHBondContact O-N 3.04Å; Y56-F59 PolarHBondContact O-N 3.09Å; V57-F59 PolarHBondContact O-N 3.3Å; F59-L61 VanDerWaalsContact C-N 3.34Å; F59-L62 HydrophobicContact CD1-CD1 4.43Å; F59-L62 PolarHBondContact O-N 3.39Å; F59-L63 WeakPolarHBondContact O-CB 3.41Å; F59-L63 PolarHBondContact O-N 3.33Å
60Y92.2Very high86Confident129 Ų12962.6 Ų62.651%0.50634%0.337SS..Hα-helixtrans-65.2-37.5173.6-75.1-60.1000112.1L36 Y56 V57 L63 C64L36-Y60 HydrophobicContact CD1-CD1 4.09Å; L36-Y60 HydrophobicContact CD1-CE1 4.03Å; L36-Y60 HydrophobicContact CD2-CD1 4.42Å; L36-Y60 HydrophobicContact CD2-CE1 4.16Å; L36-Y60 HydrophobicContact CD2-CE2 4.38Å; Y56-Y60 HydrophobicContact CD1-CE2 4.38Å; Y56-Y60 WeakPolarHBondContact O-CD2 3.39Å; Y56-Y60 PolarHBondContact O-N 3.39Å; V57-Y60 PolarHBondContact O-N 3.07Å; Y60-L63 HydrophobicContact CD1-CD2 4.46Å; Y60-L63 WeakPolarHBondContact O-CB 3.42Å; Y60-L63 PolarHBondContact O-N 2.85Å; Y60-C64 WeakPolarHBondContact O-CB 3.26Å; Y60-C64 PolarHBondContact O-N 3.43Å; Y60-C64 PolarHBondContact O-SG 2.74Å
61L93.5Very high87.8Confident107 Ų10764.8 Ų64.856%0.5635%0.348SS*.Hα-helixtrans-62.8-46.2173.4-73173.9000111.5V57 S58 F59 L63 C64 V65V57-L61 HydrophobicContact CG1-CD1 4.06Å; V57-L61 HydrophobicContact CG1-CG 4.43Å; V57-L61 WeakPolarHBondContact O-CB 3.28Å; V57-L61 VanDerWaalsContact O-CG 3.28Å; V57-L61 WeakPolarHBondContact O-CG 3.2Å; V57-L61 PolarHBondContact O-N 3.47Å; S58-L61 PolarHBondContact O-N 2.87Å; F59-L61 VanDerWaalsContact C-N 3.34Å; L61-L63 VanDerWaalsContact C-N 3.29Å; L61-L63 PolarHBondContact O-N 3.28Å; L61-C64 PolarHBondContact O-N 3.1Å; L61-V65 VanDerWaalsContact O-CG2 3.28Å; L61-V65 WeakPolarHBondContact O-CG2 3.48Å; L61-V65 PolarHBondContact O-N 3.23Å
62L93.3Very high89.4Confident79 Ų7961.6 Ų61.641%0.41433%0.331SS..Hα-helixtrans-58.8-40.7175.9-73.1171.4000112.2S32 S58 F59 G66S32-L62 PolarHBondContact OG-O 3.23Å; S58-L62 WeakPolarHBondContact O-CG 3.26Å; S58-L62 PolarHBondContact O-N 3.46Å; F59-L62 HydrophobicContact CD1-CD1 4.43Å; F59-L62 PolarHBondContact O-N 3.39Å; L62-G66 PolarHBondContact O-N 3.43Å
63L95.9Very high91Very high29 Ų2957.8 Ų57.815%0.15231%0.312CS..Hα-helixtrans-62.1-50.2175.5-175.172000111.6F29 S32 L33 L36 F59 Y60 L61 V65 G66 A67F29-L63 HydrophobicContact CD2-CD1 3.52Å; F29-L63 HydrophobicContact CD2-CG 4.21Å; F29-L63 HydrophobicContact CE2-CD1 3.39Å; F29-L63 HydrophobicContact CE2-CG 3.93Å; F29-L63 HydrophobicContact CG-CD1 4.2Å; F29-L63 HydrophobicContact CZ-CD1 3.98Å; S32-L63 PolarHBondContact OG-N 2.93Å; L33-L63 HydrophobicContact CD2-CD1 3.63Å; L33-L63 HydrophobicContact CD2-CD2 4.24Å; L33-L63 HydrophobicContact CG-CD1 3.66Å; L36-L63 HydrophobicContact CD1-CD2 3.95Å; F59-L63 WeakPolarHBondContact O-CB 3.41Å; F59-L63 PolarHBondContact O-N 3.33Å; Y60-L63 HydrophobicContact CD1-CD2 4.46Å; Y60-L63 WeakPolarHBondContact O-CB 3.42Å; Y60-L63 PolarHBondContact O-N 2.85Å; L61-L63 VanDerWaalsContact C-N 3.29Å; L61-L63 PolarHBondContact O-N 3.28Å; L63-V65 VanDerWaalsContact C-N 3.35Å; L63-V65 PolarHBondContact O-N 3.02Å; L63-G66 PolarHBondContact O-N 3.37Å; L63-A67 WeakPolarHBondContact O-CB 3.22Å; L63-A67 PolarHBondContact O-N 2.98Å
64C96.6Very high92.3Very high81 Ų8156.1 Ų56.155%0.54730%0.299SS..Hα-helixtrans-60.1-44178.5-73.70000111.8Y60 L61 A67 F68Y60-C64 WeakPolarHBondContact O-CB 3.26Å; Y60-C64 PolarHBondContact O-N 3.43Å; Y60-C64 PolarHBondContact O-SG 2.74Å; L61-C64 PolarHBondContact O-N 3.1Å; C64-A67 PolarHBondContact O-N 3.23Å; C64-F68 WeakPolarHBondContact O-CB 3.45Å; C64-F68 PolarHBondContact O-N 2.88Å
65V96.4Very high93.5Very high73 Ų7355.3 Ų55.344%0.44229%0.293SS..Hα-helixtrans-63.8-44.7176.6173.60000110.7L61 L63 A67 F68 I69L61-V65 VanDerWaalsContact O-CG2 3.28Å; L61-V65 WeakPolarHBondContact O-CG2 3.48Å; L61-V65 PolarHBondContact O-N 3.23Å; L63-V65 VanDerWaalsContact C-N 3.35Å; L63-V65 PolarHBondContact O-N 3.02Å; V65-A67 PolarHBondContact O-N 3.43Å; V65-F68 PolarHBondContact O-N 3.07Å; V65-I69 HydrophobicContact CG1-CD1 3.73Å; V65-I69 HydrophobicContact CG1-CG1 4.34Å; V65-I69 VanDerWaalsContact O-CG1 3.26Å; V65-I69 WeakPolarHBondContact O-CG1 3.48Å; V65-I69 PolarHBondContact O-N 2.97Å
66G97.4Very high94.5Very high0 Ų053.8 Ų53.80%029%0.285CS..Hα-helixtrans-60.3-44.8177.400000112.6L62 L63 I69 A70L62-G66 PolarHBondContact O-N 3.43Å; L63-G66 PolarHBondContact O-N 3.37Å; G66-I69 PolarHBondContact O-N 3.39Å; G66-A70 WeakPolarHBondContact O-CB 3.32Å; G66-A70 PolarHBondContact O-N 2.89Å
67A97.7Very high95.3Very high29 Ų2953.5 Ų53.524%0.2428%0.283CS..Hα-helixtrans-61.6-45.4175.200000111.9F29 L63 C64 V65 A70 L71F29-A67 HydrophobicContact CD2-CB 3.78Å; F29-A67 HydrophobicContact CE2-CB 3.92Å; L63-A67 WeakPolarHBondContact O-CB 3.22Å; L63-A67 PolarHBondContact O-N 2.98Å; C64-A67 PolarHBondContact O-N 3.23Å; V65-A67 PolarHBondContact O-N 3.43Å; A67-A70 PolarHBondContact O-N 2.92Å; A67-L71 WeakPolarHBondContact O-CB 3.25Å; A67-L71 VanDerWaalsContact O-CG 3.31Å; A67-L71 WeakPolarHBondContact O-CG 3.49Å; A67-L71 PolarHBondContact O-N 3.48Å
68F97.8Very high95.8Very high79 Ų7951.3 Ų51.335%0.34627%0.268SS..Hα-helixtrans-62.7-42.8179178.1-93.9000112.3C64 V65 T72 C94 S98C64-F68 WeakPolarHBondContact O-CB 3.45Å; C64-F68 PolarHBondContact O-N 2.88Å; V65-F68 PolarHBondContact O-N 3.07Å; F68-T72 VanDerWaalsContact O-CB 3.26Å; F68-T72 WeakPolarHBondContact O-CB 3.49Å; F68-T72 PolarHBondContact O-N 3.28Å; F68-T72 PolarHBondContact O-OG1 3.38Å; F68-C94 HydrophobicContact CZ-CB 4.19Å; F68-S98 VanDerWaalsContact CE1-OG 3.28Å; F68-S98 WeakPolarHBondContact CE1-OG 3.39Å
69I97.2Very high96.3Very high49 Ų4948.7 Ų48.725%0.25125%0.25SS..Hα-helixtrans-60.9-48.8174.8-68.4166.8000110.1I21 V65 G66 T72 A73I21-I69 HydrophobicContact CG2-CG2 3.87Å; V65-I69 HydrophobicContact CG1-CD1 3.73Å; V65-I69 HydrophobicContact CG1-CG1 4.34Å; V65-I69 VanDerWaalsContact O-CG1 3.26Å; V65-I69 WeakPolarHBondContact O-CG1 3.48Å; V65-I69 PolarHBondContact O-N 2.97Å; G66-I69 PolarHBondContact O-N 3.39Å; I69-T72 PolarHBondContact O-N 3.27Å; I69-A73 WeakPolarHBondContact O-CB 3.4Å; I69-A73 PolarHBondContact O-N 2.91Å
70A97.9Very high96.6Very high8 Ų847.8 Ų47.87%0.06625%0.246CC..Hα-helixtrans-60.6-47.8179.600000111.7W22 I26 G66 A67 A73 F74W22-A70 VanDerWaalsContact CD1-O 3.27Å; I26-A70 HydrophobicContact CD1-CB 3.89Å; I26-A70 HydrophobicContact CG1-CB 4.3Å; G66-A70 WeakPolarHBondContact O-CB 3.32Å; G66-A70 PolarHBondContact O-N 2.89Å; A67-A70 PolarHBondContact O-N 2.92Å; A70-A73 PolarHBondContact O-N 3.13Å; A70-F74 VanDerWaalsContact O-CB 3.26Å; A70-F74 WeakPolarHBondContact O-CB 3.47Å; A70-F74 PolarHBondContact O-N 2.74Å
71L97.8Very high96.7Very high119 Ų11948.9 Ų48.962%0.62325%0.251SS*.Hα-helixtrans-63.8-44.6179.1-69.7173.5000112A67 F74 T75A67-L71 WeakPolarHBondContact O-CB 3.25Å; A67-L71 VanDerWaalsContact O-CG 3.31Å; A67-L71 WeakPolarHBondContact O-CG 3.49Å; A67-L71 PolarHBondContact O-N 3.48Å; L71-F74 PolarHBondContact O-N 3.47Å; L71-T75 WeakPolarHBondContact O-CG2 3.26Å; L71-T75 PolarHBondContact O-N 2.88Å
72T97.8Very high96.8Very high11 Ų1151.5 Ų51.57%0.06725%0.253CS..Hα-helixtrans-60-50.4177-60.90000110.4F68 I69 F74 T75 G76 Y91 C94 L95F68-T72 VanDerWaalsContact O-CB 3.26Å; F68-T72 WeakPolarHBondContact O-CB 3.49Å; F68-T72 PolarHBondContact O-N 3.28Å; F68-T72 PolarHBondContact O-OG1 3.38Å; I69-T72 PolarHBondContact O-N 3.27Å; T72-F74 VanDerWaalsContact C-N 3.33Å; T72-F74 PolarHBondContact O-N 3.47Å; T72-T75 PolarHBondContact O-N 3.31Å; T72-T75 PolarHBondContact O-OG1 2.7Å; T72-G76 PolarHBondContact O-N 2.89Å; T72-G76 VanDerWaalsContact O-N 3.1Å; T72-Y91 HydrophobicContact CG2-CD2 3.8Å; T72-Y91 HydrophobicContact CG2-CE2 3.98Å; T72-Y91 VanDerWaalsContact O-CD2 3.25Å; T72-Y91 WeakPolarHBondContact O-CD2 3.46Å; T72-C94 HydrophobicContact CG2-CB 3.58Å; T72-C94 WeakPolarHBondContact OG1-CB 3.29Å; T72-L95 HydrophobicContact CG2-CD2 4.47Å
73A97.7Very high96.8Very high3 Ų350.3 Ų50.33%0.02525%0.25CC..Hα-helixtrans-63.7-37.2179.300000112.8S18 I21 W22 I69 A70 G76 W77S18-A73 WeakPolarHBondContact CB-O 3.27Å; I21-A73 HydrophobicContact CB-CB 4.04Å; I21-A73 HydrophobicContact CG2-CB 3.75Å; W22-A73 HydrophobicContact CB-CB 3.81Å; I69-A73 WeakPolarHBondContact O-CB 3.4Å; I69-A73 PolarHBondContact O-N 2.91Å; A70-A73 PolarHBondContact O-N 3.13Å; A73-G76 PolarHBondContact O-N 3.16Å; A73-W77 WeakPolarHBondContact O-CB 3.3Å; A73-W77 PolarHBondContact O-N 3.31Å
74F97.7Very high96.8Very high81 Ų8150.7 Ų50.736%0.35525%0.254SS..Hα-helixtrans-61.4-44.4174.5-178.6-103.8000111.9W22 A70 L71 T72 G76 W77 M78W22-F74 AromaticContact NE1-CD2 3.95Å; A70-F74 VanDerWaalsContact O-CB 3.26Å; A70-F74 WeakPolarHBondContact O-CB 3.47Å; A70-F74 PolarHBondContact O-N 2.74Å; L71-F74 PolarHBondContact O-N 3.47Å; T72-F74 VanDerWaalsContact C-N 3.33Å; T72-F74 PolarHBondContact O-N 3.47Å; F74-G76 VanDerWaalsContact C-N 3.33Å; F74-G76 PolarHBondContact O-N 3.35Å; F74-W77 HydrophobicContact CD2-CE3 4.14Å; F74-W77 HydrophobicContact CD2-CZ3 4.39Å; F74-W77 HydrophobicContact CE2-CE3 4.48Å; F74-W77 HydrophobicContact CE2-CZ3 4.45Å; F74-W77 PolarHBondContact O-N 2.94Å; F74-M78 HydrophobicContact CD1-CG 4.37Å; F74-M78 HydrophobicContact CD2-CG 4.08Å; F74-M78 HydrophobicContact CE1-CG 3.96Å; F74-M78 HydrophobicContact CE2-CG 3.63Å; F74-M78 HydrophobicContact CE2-SD 4.44Å; F74-M78 HydrophobicContact CG-CG 4.44Å; F74-M78 HydrophobicContact CZ-CG 3.58Å; F74-M78 HydrophobicContact CZ-SD 4.47Å; F74-M78 WeakPolarHBondContact O-CB 3.4Å; F74-M78 PolarHBondContact O-N 3.4Å
75T97.6Very high96.7Very high19 Ų1948.5 Ų48.512%0.11724%0.238CC..Hα-helixtrans-64.8-36.1176.561.50000112.5L71 T72 G79 L87 I90L71-T75 WeakPolarHBondContact O-CG2 3.26Å; L71-T75 PolarHBondContact O-N 2.88Å; T72-T75 PolarHBondContact O-N 3.31Å; T72-T75 PolarHBondContact O-OG1 2.7Å; T75-G79 WeakPolarHBondContact O-CA 3.47Å; T75-G79 PolarHBondContact O-N 3.41Å; T75-L87 HydrophobicContact CG2-CD2 4.42Å; T75-I90 HydrophobicContact CG2-CG2 4.05Å
76G97.3Very high96.8Very high0 Ų048 Ų480%024%0.242CC..Hα-helixtrans-64.9-48.5173.600000112.7T72 A73 F74 A80T72-G76 PolarHBondContact O-N 2.89Å; T72-G76 VanDerWaalsContact O-N 3.1Å; A73-G76 PolarHBondContact O-N 3.16Å; F74-G76 VanDerWaalsContact C-N 3.33Å; F74-G76 PolarHBondContact O-N 3.35Å; G76-A80 WeakPolarHBondContact O-CB 3.4Å; G76-A80 PolarHBondContact O-N 2.76Å
77W97.3Very high96.8Very high65 Ų6550.4 Ų50.425%0.24626%0.255CS..Hα-helixtrans-62.1-54.1178.1173.236.4000111.6S18 F19 W22 A73 F74 G79 A80 Y81S18-W77 VanDerWaalsContact CB-N 3.34Å; F19-W77 HydrophobicContact CB-CD2 4.39Å; F19-W77 HydrophobicContact CB-CG 4.25Å; F19-W77 AromaticContact CD2-CD2 3.67Å; F19-W77 HydrophobicContact CD2-CD2 3.67Å; F19-W77 AromaticContact CD2-CE2 3.56Å; F19-W77 AromaticContact CD2-CE3 3.74Å; F19-W77 HydrophobicContact CD2-CE3 3.74Å; F19-W77 HydrophobicContact CD2-CG 4.39Å; F19-W77 AromaticContact CD2-CH2 3.66Å; F19-W77 HydrophobicContact CD2-CH2 3.66Å; F19-W77 AromaticContact CD2-CZ2 3.57Å; F19-W77 HydrophobicContact CD2-CZ2 3.57Å; F19-W77 AromaticContact CD2-CZ3 3.73Å; F19-W77 HydrophobicContact CD2-CZ3 3.73Å; F19-W77 HydrophobicContact CE2-CD2 4.49Å; F19-W77 HydrophobicContact CE2-CE3 4.3Å; F19-W77 AromaticContact CE2-CH2 3.49Å; F19-W77 HydrophobicContact CE2-CH2 3.49Å; F19-W77 VanDerWaalsContact CE2-CH2 3.49Å; F19-W77 AromaticContact CE2-CZ2 3.7Å; F19-W77 HydrophobicContact CE2-CZ2 3.7Å; F19-W77 AromaticContact CE2-CZ3 3.81Å; F19-W77 HydrophobicContact CE2-CZ3 3.81Å; F19-W77 HydrophobicContact CG-CD2 4.49Å; W22-W77 HydrophobicContact CD2-CE3 4.42Å; W22-W77 HydrophobicContact CD2-CZ3 4.33Å; W22-W77 HydrophobicContact CE3-CE3 4.39Å; W22-W77 HydrophobicContact CE3-CZ3 4.03Å; W22-W77 HydrophobicContact CH2-CZ3 4.43Å; W22-W77 HydrophobicContact CZ3-CZ3 4.08Å; A73-W77 WeakPolarHBondContact O-CB 3.3Å; A73-W77 PolarHBondContact O-N 3.31Å; F74-W77 HydrophobicContact CD2-CE3 4.14Å; F74-W77 HydrophobicContact CD2-CZ3 4.39Å; F74-W77 HydrophobicContact CE2-CE3 4.48Å; F74-W77 HydrophobicContact CE2-CZ3 4.45Å; F74-W77 PolarHBondContact O-N 2.94Å; W77-G79 PolarHBondContact O-N 2.92Å; W77-A80 PolarHBondContact O-N 3.26Å; W77-Y81 VanDerWaalsContact O-CB 3.29Å; W77-Y81 WeakPolarHBondContact O-CB 3.26Å; W77-Y81 PolarHBondContact O-N 3.45Å
78M97Very high96.7Very high39 Ų3949 Ų4919%0.19224%0.243CC..Hα-helixtrans-67.7-34.5-179.5-74-63.4-70.200112.5F74 Y81 R82 L87F74-M78 HydrophobicContact CD1-CG 4.37Å; F74-M78 HydrophobicContact CD2-CG 4.08Å; F74-M78 HydrophobicContact CE1-CG 3.96Å; F74-M78 HydrophobicContact CE2-CG 3.63Å; F74-M78 HydrophobicContact CE2-SD 4.44Å; F74-M78 HydrophobicContact CG-CG 4.44Å; F74-M78 HydrophobicContact CZ-CG 3.58Å; F74-M78 HydrophobicContact CZ-SD 4.47Å; F74-M78 WeakPolarHBondContact O-CB 3.4Å; F74-M78 PolarHBondContact O-N 3.4Å; M78-Y81 PolarHBondContact O-N 3Å; M78-R82 HydrophobicContact CE-CG 3.82Å; M78-R82 VanDerWaalsContact O-CB 3.23Å; M78-R82 WeakPolarHBondContact O-CB 3.43Å; M78-R82 WeakPolarHBondContact O-CG 3.47Å; M78-R82 PolarHBondContact O-N 3Å; M78-L87 HydrophobicContact CB-CD1 3.85Å
79G96.5Very high96.7Very high0 Ų046.8 Ų46.80%024%0.24CC..Hα-helixtrans-63.5-44.417600000112.5T75 W77 T83 S84T75-G79 WeakPolarHBondContact O-CA 3.47Å; T75-G79 PolarHBondContact O-N 3.41Å; W77-G79 PolarHBondContact O-N 2.92Å; G79-T83 CarbonylContact O-C 3.56Å; G79-T83 VanDerWaalsContact O-CA 3.31Å; G79-T83 WeakPolarHBondContact O-CA 3.42Å; G79-T83 PolarHBondContact O-N 3.11Å; G79-T83 VanDerWaalsContact O-N 3.07Å; G79-S84 PolarHBondContact O-N 3.14Å
80A95.7Very high96.8Very high3 Ų348.4 Ų48.43%0.02525%0.248CC..Hα-helixtrans-71-40.5175.800000112.2T14 C15 G76 W77 L257T14-A80 HydrophobicContact CG2-CB 3.93Å; C15-A80 WeakPolarHBondContact SG-CB 3.46Å; G76-A80 WeakPolarHBondContact O-CB 3.4Å; G76-A80 PolarHBondContact O-N 2.76Å; W77-A80 PolarHBondContact O-N 3.26Å; A80-L257 HydrophobicContact CB-CD1 4.23Å
81Y95.1Very high96.8Very high152 Ų15248.7 Ų48.760%0.59625%0.247SC*.Hα-helixtrans-68-48.7179.9178.7-105.7000112.8C15 W77 M78 T83C15-Y81 PolarHBondContact SG-N 2.91Å; C15-Y81 VanDerWaalsContact SG-N 3.38Å; W77-Y81 VanDerWaalsContact O-CB 3.29Å; W77-Y81 WeakPolarHBondContact O-CB 3.26Å; W77-Y81 PolarHBondContact O-N 3.45Å; M78-Y81 PolarHBondContact O-N 3Å; Y81-T83 VanDerWaalsContact C-N 3.28Å; Y81-T83 PolarHBondContact O-N 3.43Å
82R94.8Very high96.8Very high162 Ų16245.7 Ų45.761%0.61123%0.229SC*.THydrogen-bonded Turntrans-83.7-1179.6-63-67.4-172.3161.70.6113.2M78 S84M78-R82 HydrophobicContact CE-CG 3.82Å; M78-R82 VanDerWaalsContact O-CB 3.23Å; M78-R82 WeakPolarHBondContact O-CB 3.43Å; M78-R82 WeakPolarHBondContact O-CG 3.47Å; M78-R82 PolarHBondContact O-N 3Å; R82-S84 PolarHBondContact O-N 3.39Å
83T93.1Very high96.8Very high55 Ų5549.8 Ų49.834%0.33725%0.25SC..THydrogen-bonded Turntrans53.135.6-174.1610000112.7R11 G79 Y81R11-T83 VanDerWaalsContact NH1-CG2 3.27Å; G79-T83 CarbonylContact O-C 3.56Å; G79-T83 VanDerWaalsContact O-CA 3.31Å; G79-T83 WeakPolarHBondContact O-CA 3.42Å; G79-T83 PolarHBondContact O-N 3.11Å; G79-T83 VanDerWaalsContact O-N 3.07Å; Y81-T83 VanDerWaalsContact C-N 3.28Å; Y81-T83 PolarHBondContact O-N 3.43Å
84S95.8Very high96.8Very high36 Ų3650.7 Ų50.725%0.25226%0.256SS..  trans-90.5112.7-1751760000110.6G79 R82 A86 L87 L88G79-S84 PolarHBondContact O-N 3.14Å; R82-S84 PolarHBondContact O-N 3.39Å; S84-A86 VanDerWaalsContact C-N 3.26Å; S84-A86 PolarHBondContact O-N 2.98Å; S84-L87 PolarHBondContact O-N 3.01Å; S84-L87 PolarHBondContact OG-N 2.68Å; S84-L88 WeakPolarHBondContact O-CG 3.46Å; S84-L88 PolarHBondContact O-N 2.78Å; S84-L88 VanDerWaalsContact O-N 3.08Å
85V96.2Very high96.8Very high35 Ų3547.5 Ų47.521%0.21224%0.242CC..Hα-helixtrans-59.5-37.9176.7173.30000111.5L88 A89 I258 I261 R262V85-L88 PolarHBondContact O-N 3.21Å; V85-A89 VanDerWaalsContact O-CB 3.29Å; V85-A89 WeakPolarHBondContact O-CB 3.26Å; V85-A89 PolarHBondContact O-N 3.43Å; V85-I258 HydrophobicContact CG1-CG2 3.99Å; V85-I261 HydrophobicContact CG2-CB 4.14Å; V85-I261 HydrophobicContact CG2-CG2 3.67Å; V85-R262 HydrophobicContact CG2-CG 4.27Å
86A97.1Very high96.8Very high64 Ų6449.4 Ų49.453%0.52925%0.254SS..Hα-helixtrans-64.2-46-179.900000111.8S84 A89 I90S84-A86 VanDerWaalsContact C-N 3.26Å; S84-A86 PolarHBondContact O-N 2.98Å; A86-A89 PolarHBondContact O-N 3.18Å; A86-I90 WeakPolarHBondContact O-CG1 3.42Å; A86-I90 PolarHBondContact O-N 3.39Å
87L97.5Very high96.8Very high49 Ų4953.9 Ų53.926%0.25728%0.277SS..Hα-helixtrans-66.6-41.2178.2-69.3177.9000112.1T75 M78 S84 A89 I90 Y91T75-L87 HydrophobicContact CG2-CD2 4.42Å; M78-L87 HydrophobicContact CB-CD1 3.85Å; S84-L87 PolarHBondContact O-N 3.01Å; S84-L87 PolarHBondContact OG-N 2.68Å; L87-A89 VanDerWaalsContact C-N 3.3Å; L87-A89 PolarHBondContact O-N 2.94Å; L87-I90 PolarHBondContact O-N 3.46Å; L87-Y91 WeakPolarHBondContact O-CB 3.49Å; L87-Y91 PolarHBondContact O-N 3.46Å
88L97Very high96.7Very high0 Ų051.7 Ų51.70%027%0.271CS..Hα-helixtrans-64-35.4174.8-72170.3000112.2S84 V85 Y91 F92 S254 L257 I258 I261S84-L88 WeakPolarHBondContact O-CG 3.46Å; S84-L88 PolarHBondContact O-N 2.78Å; S84-L88 VanDerWaalsContact O-N 3.08Å; V85-L88 PolarHBondContact O-N 3.21Å; L88-Y91 PolarHBondContact O-N 2.85Å; L88-F92 WeakPolarHBondContact O-CB 3.35Å; L88-F92 PolarHBondContact O-N 2.93Å; L88-S254 PolarHBondContact O-OG 2.87Å; L88-L257 HydrophobicContact CD1-CB 3.85Å; L88-L257 HydrophobicContact CD2-CD1 4.32Å; L88-I258 HydrophobicContact CB-CD1 3.86Å; L88-I258 HydrophobicContact CB-CG1 3.62Å; L88-I258 HydrophobicContact CD1-CG1 4.12Å; L88-I261 HydrophobicContact CD1-CD1 3.67Å
89A97.4Very high96.6Very high33 Ų3351.2 Ų51.227%0.27327%0.272SS..Hα-helixtrans-67.3-42.5175.300000111.7V85 A86 L87 F92 I93 I258V85-A89 VanDerWaalsContact O-CB 3.29Å; V85-A89 WeakPolarHBondContact O-CB 3.26Å; V85-A89 PolarHBondContact O-N 3.43Å; A86-A89 PolarHBondContact O-N 3.18Å; L87-A89 VanDerWaalsContact C-N 3.3Å; L87-A89 PolarHBondContact O-N 2.94Å; A89-F92 WeakPolarHBondContact O-CB 3.28Å; A89-F92 PolarHBondContact O-N 2.9Å; A89-I93 VanDerWaalsContact O-CG1 3.28Å; A89-I93 WeakPolarHBondContact O-CG1 3.47Å; A89-I93 PolarHBondContact O-N 3.2Å; A89-I258 HydrophobicContact CB-CD1 4.47Å
90I97.9Very high96.6Very high83 Ų8354.6 Ų54.643%0.42630%0.296SS..Hα-helixtrans-61.2-48.5173.4-66.4166.2000110.1T75 A86 L87 F92 I93 C94T75-I90 HydrophobicContact CG2-CG2 4.05Å; A86-I90 WeakPolarHBondContact O-CG1 3.42Å; A86-I90 PolarHBondContact O-N 3.39Å; L87-I90 PolarHBondContact O-N 3.46Å; I90-F92 VanDerWaalsContact C-N 3.29Å; I90-F92 PolarHBondContact O-N 3.42Å; I90-I93 PolarHBondContact O-N 2.98Å; I90-I93 VanDerWaalsContact O-N 3.13Å; I90-C94 PolarHBondContact O-N 2.99Å; I90-C94 PolarHBondContact O-SG 3Å; I90-C94 VanDerWaalsContact O-SG 3.38Å
91Y97.8Very high96.6Very high13 Ų1357.2 Ų57.25%0.05132%0.317CS..Hα-helixtrans-53.9-46.3175.8175.2-120.5000111.8T72 L87 L88 C94 L95T72-Y91 HydrophobicContact CG2-CD2 3.8Å; T72-Y91 HydrophobicContact CG2-CE2 3.98Å; T72-Y91 VanDerWaalsContact O-CD2 3.25Å; T72-Y91 WeakPolarHBondContact O-CD2 3.46Å; L87-Y91 WeakPolarHBondContact O-CB 3.49Å; L87-Y91 PolarHBondContact O-N 3.46Å; L88-Y91 PolarHBondContact O-N 2.85Å; Y91-C94 PolarHBondContact O-N 3.32Å; Y91-L95 HydrophobicContact CD1-CD1 4.23Å; Y91-L95 HydrophobicContact CD2-CD1 4.48Å; Y91-L95 HydrophobicContact CD2-CG 4.37Å; Y91-L95 HydrophobicContact CE1-CD1 3.67Å; Y91-L95 HydrophobicContact CE2-CD1 3.96Å; Y91-L95 HydrophobicContact CE2-CD2 4.14Å; Y91-L95 HydrophobicContact CE2-CG 4Å; Y91-L95 WeakPolarHBondContact O-CG 3.47Å; Y91-L95 PolarHBondContact O-N 3.42Å
92F97.9Very high96.5Very high56 Ų5652.1 Ų52.125%0.24630%0.298CS..Hα-helixtrans-60-47.4176.2176.3-92.4000112.3L88 A89 I90 C94 L95 V96 M251 L255L88-F92 WeakPolarHBondContact O-CB 3.35Å; L88-F92 PolarHBondContact O-N 2.93Å; A89-F92 WeakPolarHBondContact O-CB 3.28Å; A89-F92 PolarHBondContact O-N 2.9Å; I90-F92 VanDerWaalsContact C-N 3.29Å; I90-F92 PolarHBondContact O-N 3.42Å; F92-C94 PolarHBondContact O-N 3.11Å; F92-L95 PolarHBondContact O-N 3.4Å; F92-V96 HydrophobicContact CD1-CG2 4.24Å; F92-V96 HydrophobicContact CE1-CG2 3.79Å; F92-V96 HydrophobicContact CE2-CG2 4.48Å; F92-V96 HydrophobicContact CZ-CG2 3.91Å; F92-V96 WeakPolarHBondContact O-CG2 3.46Å; F92-V96 PolarHBondContact O-N 3.17Å; F92-M251 HydrophobicContact CD2-CB 4.01Å; F92-M251 HydrophobicContact CD2-CG 4.02Å; F92-M251 HydrophobicContact CE2-CB 3.86Å; F92-M251 HydrophobicContact CE2-CG 4.02Å; F92-M251 HydrophobicContact CE2-SD 4.35Å; F92-L255 HydrophobicContact CD2-CD1 4.38Å; F92-L255 HydrophobicContact CD2-CD2 4.02Å; F92-L255 HydrophobicContact CD2-CG 3.84Å; F92-L255 HydrophobicContact CE2-CD1 3.61Å; F92-L255 HydrophobicContact CE2-CD2 3.8Å; F92-L255 HydrophobicContact CE2-CG 3.56Å; F92-L255 HydrophobicContact CZ-CD1 4.16Å; F92-L255 HydrophobicContact CZ-CD2 4.14Å; F92-L255 HydrophobicContact CZ-CG 4.31Å
93I97.9Very high96.4Very high97 Ų9751.4 Ų51.450%0.49730%0.3SS..Hα-helixtrans-62-43.7179.1-67.2163.3000110.8A89 I90 L95 V96 I97A89-I93 VanDerWaalsContact O-CG1 3.28Å; A89-I93 WeakPolarHBondContact O-CG1 3.47Å; A89-I93 PolarHBondContact O-N 3.2Å; I90-I93 PolarHBondContact O-N 2.98Å; I90-I93 VanDerWaalsContact O-N 3.13Å; I93-L95 VanDerWaalsContact C-N 3.32Å; I93-L95 PolarHBondContact O-N 3.46Å; I93-V96 PolarHBondContact O-N 3.38Å; I93-I97 HydrophobicContact CG2-CD1 4.03Å; I93-I97 WeakPolarHBondContact O-CG1 3.46Å; I93-I97 PolarHBondContact O-N 3.14Å
94C97.9Very high96.4Very high23 Ų2351 Ų5116%0.15530%0.302CS..Hα-helixtrans-60.5-39.6176.1-70.10000112.3F68 T72 I90 Y91 F92 I97 S98F68-C94 HydrophobicContact CZ-CB 4.19Å; T72-C94 HydrophobicContact CG2-CB 3.58Å; T72-C94 WeakPolarHBondContact OG1-CB 3.29Å; I90-C94 PolarHBondContact O-N 2.99Å; I90-C94 PolarHBondContact O-SG 3Å; I90-C94 VanDerWaalsContact O-SG 3.38Å; Y91-C94 PolarHBondContact O-N 3.32Å; F92-C94 PolarHBondContact O-N 3.11Å; C94-I97 PolarHBondContact O-N 2.85Å; C94-S98 PolarHBondContact O-N 2.82Å; C94-S98 PolarHBondContact O-OG 3.12Å
95L97.4Very high96.2Very high13 Ų1352.3 Ų52.37%0.06831%0.311CS..Hα-helixtrans-66-38.8174.7-70.4179.4000112.6T72 Y91 F92 I93 I97 S98 C99 Q247 M251T72-L95 HydrophobicContact CG2-CD2 4.47Å; Y91-L95 HydrophobicContact CD1-CD1 4.23Å; Y91-L95 HydrophobicContact CD2-CD1 4.48Å; Y91-L95 HydrophobicContact CD2-CG 4.37Å; Y91-L95 HydrophobicContact CE1-CD1 3.67Å; Y91-L95 HydrophobicContact CE2-CD1 3.96Å; Y91-L95 HydrophobicContact CE2-CD2 4.14Å; Y91-L95 HydrophobicContact CE2-CG 4Å; Y91-L95 WeakPolarHBondContact O-CG 3.47Å; Y91-L95 PolarHBondContact O-N 3.42Å; F92-L95 PolarHBondContact O-N 3.4Å; I93-L95 VanDerWaalsContact C-N 3.32Å; I93-L95 PolarHBondContact O-N 3.46Å; L95-I97 VanDerWaalsContact C-N 3.35Å; L95-S98 PolarHBondContact O-N 3.01Å; L95-C99 VanDerWaalsContact O-CB 3.31Å; L95-C99 WeakPolarHBondContact O-CB 3.33Å; L95-C99 PolarHBondContact O-N 3.4Å; L95-Q247 HydrophobicContact CD2-CG 4.23Å; L95-M251 HydrophobicContact CB-CG 3.62Å; L95-M251 HydrophobicContact CB-SD 4.19Å; L95-M251 HydrophobicContact CD1-CG 3.82Å; L95-M251 HydrophobicContact CG-CG 4.41Å
96V97.6Very high95.9Very high59 Ų5952.9 Ų52.936%0.35832%0.317SS..Hα-helixtrans-62.2-43.4174.8172.10000111F92 I93 C99 S100 M251F92-V96 HydrophobicContact CD1-CG2 4.24Å; F92-V96 HydrophobicContact CE1-CG2 3.79Å; F92-V96 HydrophobicContact CE2-CG2 4.48Å; F92-V96 HydrophobicContact CZ-CG2 3.91Å; F92-V96 WeakPolarHBondContact O-CG2 3.46Å; F92-V96 PolarHBondContact O-N 3.17Å; I93-V96 PolarHBondContact O-N 3.38Å; V96-C99 PolarHBondContact O-N 3.04Å; V96-S100 WeakPolarHBondContact O-CB 3.46Å; V96-S100 PolarHBondContact O-N 2.84Å; V96-S100 PolarHBondContact O-OG 3.36Å; V96-M251 HydrophobicContact CG2-SD 3.63Å
97I97.1Very high95.6Very high94 Ų9453.5 Ų53.548%0.48231%0.311SS..Hα-helixtrans-61.9-45.7176-66.7167.1000110.4I93 C94 L95 S100 A101I93-I97 HydrophobicContact CG2-CD1 4.03Å; I93-I97 WeakPolarHBondContact O-CG1 3.46Å; I93-I97 PolarHBondContact O-N 3.14Å; C94-I97 PolarHBondContact O-N 2.85Å; L95-I97 VanDerWaalsContact C-N 3.35Å; I97-S100 PolarHBondContact O-N 3.4Å; I97-A101 WeakPolarHBondContact O-CB 3.24Å; I97-A101 PolarHBondContact O-N 2.91Å
98S96.1Very high95.4Very high19 Ų1955.8 Ų55.813%0.13332%0.323CS..Hα-helixtrans-60.5-47.7178.6-52.80000111.8F68 C94 L95 S100 A101 E102F68-S98 VanDerWaalsContact CE1-OG 3.28Å; F68-S98 WeakPolarHBondContact CE1-OG 3.39Å; C94-S98 PolarHBondContact O-N 2.82Å; C94-S98 PolarHBondContact O-OG 3.12Å; L95-S98 PolarHBondContact O-N 3.01Å; S98-S100 VanDerWaalsContact C-N 3.28Å; S98-S100 PolarHBondContact O-N 3.23Å; S98-A101 PolarHBondContact O-N 3.21Å; S98-A101 VanDerWaalsContact O-N 3.16Å; S98-E102 WeakPolarHBondContact O-CG 3.43Å; S98-E102 PolarHBondContact O-N 2.89Å
99C95.6Very high94.9Very high29 Ų2957.9 Ų57.920%0.19634%0.34CS..Hα-helixtrans-59.7-39.9177.5178.30000111.7L95 V96 F103 L244 Q247 M251L95-C99 VanDerWaalsContact O-CB 3.31Å; L95-C99 WeakPolarHBondContact O-CB 3.33Å; L95-C99 PolarHBondContact O-N 3.4Å; V96-C99 PolarHBondContact O-N 3.04Å; C99-F103 PolarHBondContact O-N 3.43Å; C99-F103 VanDerWaalsContact O-N 3.14Å; C99-L244 WeakPolarHBondContact SG-CD1 2.92Å; C99-Q247 VanDerWaalsContact CA-OE1 3.25Å; C99-M251 HydrophobicContact CB-CE 4.28Å
100S95.7Very high94.4Very high72 Ų7258.9 Ų58.950%0.50335%0.345SS..Hα-helixtrans-68.1-40.8177.3-54.40000111.5V96 I97 S98 F103 A104V96-S100 WeakPolarHBondContact O-CB 3.46Å; V96-S100 PolarHBondContact O-N 2.84Å; V96-S100 PolarHBondContact O-OG 3.36Å; I97-S100 PolarHBondContact O-N 3.4Å; S98-S100 VanDerWaalsContact C-N 3.28Å; S98-S100 PolarHBondContact O-N 3.23Å; S100-F103 PolarHBondContact O-N 2.85Å; S100-A104 WeakPolarHBondContact O-CB 3.27Å; S100-A104 PolarHBondContact O-N 2.92Å
101A95.4Very high94.1Very high57 Ų5759.8 Ų59.847%0.47135%0.354SS..Hα-helixtrans-66.4-39.1177.300000112.3I97 S98 A104 S105I97-A101 WeakPolarHBondContact O-CB 3.24Å; I97-A101 PolarHBondContact O-N 2.91Å; S98-A101 PolarHBondContact O-N 3.21Å; S98-A101 VanDerWaalsContact O-N 3.16Å; A101-A104 PolarHBondContact O-N 3.46Å; A101-S105 WeakPolarHBondContact O-CB 3.48Å; A101-S105 PolarHBondContact O-N 2.93Å; A101-S105 PolarHBondContact O-OG 2.91Å
102E93.3Very high93.7Very high45 Ų4562.2 Ų62.221%0.2137%0.366CS..Hα-helixtrans-64.8-40.8175-76.4-177.3-174.900112.4S98 S105 S106 Q247S98-E102 WeakPolarHBondContact O-CG 3.43Å; S98-E102 PolarHBondContact O-N 2.89Å; E102-S105 WeakPolarHBondContact CA-OG 3.38Å; E102-S105 PolarHBondContact O-OG 3.33Å; E102-S106 VanDerWaalsContact O-CB 3.3Å; E102-S106 WeakPolarHBondContact O-CB 3.38Å; E102-S106 PolarHBondContact O-N 3.31Å; E102-S106 PolarHBondContact O-OG 2.88Å; E102-Q247 VanDerWaalsContact CD-NE2 3.3Å; E102-Q247 PolarHBondContact OE1-NE2 2.92Å; E102-Q247 PolarHBondContact OE2-OE1 3.39Å
103F91.8Very high93.2Very high147 Ų14764.8 Ų64.865%0.64537%0.374SS*.Hα-helixtrans-65.6-45.6176.1-173.8-108.7000111.3C99 S100 S106 I107C99-F103 PolarHBondContact O-N 3.43Å; C99-F103 VanDerWaalsContact O-N 3.14Å; S100-F103 PolarHBondContact O-N 2.85Å; F103-S106 PolarHBondContact O-N 2.92Å; F103-I107 HydrophobicContact CD1-CD1 3.75Å; F103-I107 HydrophobicContact CE1-CD1 3.33Å; F103-I107 HydrophobicContact CE1-CG1 4.47Å; F103-I107 HydrophobicContact CE2-CD1 4.3Å; F103-I107 HydrophobicContact CG-CD1 4.41Å; F103-I107 HydrophobicContact CZ-CD1 3.65Å; F103-I107 HydrophobicContact CZ-CG1 4.48Å; F103-I107 WeakPolarHBondContact O-CG1 3.33Å; F103-I107 PolarHBondContact O-N 3.39Å; F103-I107 VanDerWaalsContact O-N 3.11Å
104A94.3Very high92.8Very high46 Ų4663.2 Ų63.238%0.3838%0.376SS..Hα-helixtrans-61.6-46.2176.300000112S100 A101 S106 I107 L108S100-A104 WeakPolarHBondContact O-CB 3.27Å; S100-A104 PolarHBondContact O-N 2.92Å; A101-A104 PolarHBondContact O-N 3.46Å; A104-S106 VanDerWaalsContact C-N 3.33Å; A104-S106 PolarHBondContact O-N 3.33Å; A104-I107 PolarHBondContact O-N 2.93Å; A104-L108 WeakPolarHBondContact O-CB 3.45Å; A104-L108 VanDerWaalsContact O-CG 3.27Å; A104-L108 WeakPolarHBondContact O-CG 3.31Å; A104-L108 PolarHBondContact O-N 3.4Å
105S91.7Very high92.5Very high64 Ų6467.8 Ų67.845%0.44839%0.394SS..Hα-helixtrans-64.1-37.5179.270.30000112.1A101 E102 L108 A109A101-S105 WeakPolarHBondContact O-CB 3.48Å; A101-S105 PolarHBondContact O-N 2.93Å; A101-S105 PolarHBondContact O-OG 2.91Å; E102-S105 WeakPolarHBondContact CA-OG 3.38Å; E102-S105 PolarHBondContact O-OG 3.33Å; S105-L108 PolarHBondContact O-N 3.28Å; S105-A109 VanDerWaalsContact O-CB 3.24Å; S105-A109 WeakPolarHBondContact O-CB 3.46Å; S105-A109 PolarHBondContact O-N 3.47Å
106S89.8Confident92.1Very high48 Ų4870.4 Ų70.434%0.33641%0.411SS..Hα-helixtrans-64.5-41.4176.6-61.70000112.4E102 F103 A104 S110E102-S106 VanDerWaalsContact O-CB 3.3Å; E102-S106 WeakPolarHBondContact O-CB 3.38Å; E102-S106 PolarHBondContact O-N 3.31Å; E102-S106 PolarHBondContact O-OG 2.88Å; F103-S106 PolarHBondContact O-N 2.92Å; A104-S106 VanDerWaalsContact C-N 3.33Å; A104-S106 PolarHBondContact O-N 3.33Å; S106-S110 WeakPolarHBondContact O-CB 3.28Å; S106-S110 PolarHBondContact O-N 3.44Å; S106-S110 VanDerWaalsContact O-N 3.12Å; S106-S110 PolarHBondContact O-OG 3.06Å
107I91.5Very high91.9Very high77 Ų7772.7 Ų72.740%0.39541%0.413SS..Hα-helixtrans-65.3-50.6174.3-67.7168.6000109.9F103 A104 A109 S110 V111F103-I107 HydrophobicContact CD1-CD1 3.75Å; F103-I107 HydrophobicContact CE1-CD1 3.33Å; F103-I107 HydrophobicContact CE1-CG1 4.47Å; F103-I107 HydrophobicContact CE2-CD1 4.3Å; F103-I107 HydrophobicContact CG-CD1 4.41Å; F103-I107 HydrophobicContact CZ-CD1 3.65Å; F103-I107 HydrophobicContact CZ-CG1 4.48Å; F103-I107 WeakPolarHBondContact O-CG1 3.33Å; F103-I107 PolarHBondContact O-N 3.39Å; F103-I107 VanDerWaalsContact O-N 3.11Å; A104-I107 PolarHBondContact O-N 2.93Å; I107-A109 VanDerWaalsContact C-N 3.32Å; I107-A109 PolarHBondContact O-N 3.45Å; I107-S110 WeakPolarHBondContact O-CB 3.34Å; I107-S110 PolarHBondContact O-N 3.26Å; I107-V111 HydrophobicContact CG2-CG2 4.16Å; I107-V111 WeakPolarHBondContact O-CG2 3.5Å; I107-V111 PolarHBondContact O-N 3.29Å
108L91.7Very high91.8Very high97 Ų9773 Ų7351%0.50842%0.416SS..Hα-helixtrans-59-43.2-179.2-70.7172.6000111.5A104 S105 S110 V111 H112A104-L108 WeakPolarHBondContact O-CB 3.45Å; A104-L108 VanDerWaalsContact O-CG 3.27Å; A104-L108 WeakPolarHBondContact O-CG 3.31Å; A104-L108 PolarHBondContact O-N 3.4Å; S105-L108 PolarHBondContact O-N 3.28Å; L108-S110 VanDerWaalsContact C-N 3.28Å; L108-S110 PolarHBondContact O-N 2.91Å; L108-V111 PolarHBondContact O-N 3.5Å; L108-H112 WeakPolarHBondContact O-CB 3.38Å; L108-H112 PolarHBondContact O-N 2.89Å; L108-H112 PolarHBondContact O-ND1 2.89Å
109A87.5Confident91.5Very high43 Ų4378.5 Ų78.536%0.35544%0.435SS..Hα-helixtrans-64.6-31.7176.400000112.8S105 I107 Y233S105-A109 VanDerWaalsContact O-CB 3.24Å; S105-A109 WeakPolarHBondContact O-CB 3.46Å; S105-A109 PolarHBondContact O-N 3.47Å; I107-A109 VanDerWaalsContact C-N 3.32Å; I107-A109 PolarHBondContact O-N 3.45Å; A109-Y233 HydrophobicContact CB-CE2 3.84Å
110S86.1Confident91.4Very high54 Ų5478.1 Ų78.138%0.37843%0.431SS..Hα-helixtrans-75.3-39.4177.1-63.30000112.6S106 I107 L108 Y233S106-S110 WeakPolarHBondContact O-CB 3.28Å; S106-S110 PolarHBondContact O-N 3.44Å; S106-S110 VanDerWaalsContact O-N 3.12Å; S106-S110 PolarHBondContact O-OG 3.06Å; I107-S110 WeakPolarHBondContact O-CB 3.34Å; I107-S110 PolarHBondContact O-N 3.26Å; L108-S110 VanDerWaalsContact C-N 3.28Å; L108-S110 PolarHBondContact O-N 2.91Å; S110-Y233 PolarHBondContact OG-OH 3.44Å
111V91.5Very high91.3Very high102 Ų10275.9 Ų75.962%0.61842%0.416SS*.Hα-helixtrans-75.6-38.4-177.7174.50000111.5I107 L108 R113I107-V111 HydrophobicContact CG2-CG2 4.16Å; I107-V111 WeakPolarHBondContact O-CG2 3.5Å; I107-V111 PolarHBondContact O-N 3.29Å; L108-V111 PolarHBondContact O-N 3.5Å; V111-R113 VanDerWaalsContact C-N 3.34Å; V111-R113 PolarHBondContact O-N 3.26Å
112H90Very high91.2Very high64 Ų6479.6 Ų79.630%0.29642%0.423SS..THydrogen-bonded Turntrans-93.126.1-172.2-59.8102.9000114.3L108 A114 Q115 V116L108-H112 WeakPolarHBondContact O-CB 3.38Å; L108-H112 PolarHBondContact O-N 2.89Å; L108-H112 PolarHBondContact O-ND1 2.89Å; H112-A114 VanDerWaalsContact C-N 3.27Å; H112-A114 PolarHBondContact O-N 3.43Å; H112-Q115 HydrophobicContact CB-CB 4.34Å; H112-Q115 PolarHBondContact CD2-NE2 3.36Å; H112-Q115 PolarHBondContact CD2-OE1 2.84Å; H112-Q115 PolarHBondContact O-N 3.46Å; H112-V116 PolarHBondContact O-N 3.47Å; H112-V116 VanDerWaalsContact O-N 3.1Å
113R87.1Confident91Very high110 Ų11080 Ų8042%0.41543%0.431SS..Hα-helixtrans-60.1-35.4179.2-71.6-175.4-174169.16.5113.6V111 V116 R117 Y230V111-R113 VanDerWaalsContact C-N 3.34Å; V111-R113 PolarHBondContact O-N 3.26Å; R113-V116 PolarHBondContact O-N 2.92Å; R113-R117 PolarHBondContact O-N 3.05Å; R113-Y230 HydrophobicContact CB-CE1 4.1Å; R113-Y230 HydrophobicContact CG-CE1 4.06Å; R113-Y230 PolarHBondContact O-OH 2.75Å; R113-Y230 VanDerWaalsContact O-OH 3.05Å
114A90.1Very high91.1Very high65 Ų6573.6 Ų73.654%0.53740%0.403SS..Hα-helixtrans-65.4-45.8176.500000111.1H112 V116 R117 D118H112-A114 VanDerWaalsContact C-N 3.27Å; H112-A114 PolarHBondContact O-N 3.43Å; A114-V116 VanDerWaalsContact C-N 3.26Å; A114-V116 PolarHBondContact O-N 2.94Å; A114-R117 WeakPolarHBondContact O-CA 3.46Å; A114-R117 WeakPolarHBondContact O-CB 3.39Å; A114-R117 PolarHBondContact O-N 3.3Å; A114-D118 PolarHBondContact O-N 3.2Å
115Q91.6Very high91.1Very high118 Ų11874 Ų7455%0.55140%0.399SS*.Hα-helixtrans-61.4-35.3177.4-65.2178-7.700112.3H112 D118 Y119H112-Q115 HydrophobicContact CB-CB 4.34Å; H112-Q115 PolarHBondContact CD2-NE2 3.36Å; H112-Q115 PolarHBondContact CD2-OE1 2.84Å; H112-Q115 PolarHBondContact O-N 3.46Å; Q115-D118 PolarHBondContact O-N 3.49Å; Q115-Y119 VanDerWaalsContact O-CB 3.32Å; Q115-Y119 WeakPolarHBondContact O-CB 3Å; Q115-Y119 PolarHBondContact O-N 3.27Å
116V88.6Confident91Very high69 Ų6975.2 Ų75.242%0.41840%0.396SS..Hα-helixtrans-62.5-43.5173.2174.70000110.9H112 R113 A114 Y119 V120H112-V116 PolarHBondContact O-N 3.47Å; H112-V116 VanDerWaalsContact O-N 3.1Å; R113-V116 PolarHBondContact O-N 2.92Å; A114-V116 VanDerWaalsContact C-N 3.26Å; A114-V116 PolarHBondContact O-N 2.94Å; V116-Y119 PolarHBondContact O-N 3.21Å; V116-V120 HydrophobicContact CG1-CG2 4.48Å; V116-V120 VanDerWaalsContact O-CG2 3.22Å; V116-V120 WeakPolarHBondContact O-CG2 3.42Å; V116-V120 PolarHBondContact O-N 2.85Å
117R93.8Very high91Very high107 Ų10773.7 Ų73.740%0.40439%0.385SS..Hα-helixtrans-63.8-43.2176-178.4176.3-171.7-160.43.5111.4R113 A114 V120 S121 L222 D223R113-R117 PolarHBondContact O-N 3.05Å; A114-R117 WeakPolarHBondContact O-CA 3.46Å; A114-R117 WeakPolarHBondContact O-CB 3.39Å; A114-R117 PolarHBondContact O-N 3.3Å; R117-V120 PolarHBondContact O-N 3.32Å; R117-S121 WeakPolarHBondContact O-CB 3.05Å; R117-S121 PolarHBondContact O-N 3.16Å; R117-L222 HydrophobicContact CG-CD1 4.38Å; R117-L222 HydrophobicContact CG-CD2 4.46Å; R117-D223 IonicContact CZ-OD1 3.82Å; R117-D223 IonicContact NE-OD1 2.74Å; R117-D223 IonicContact NH2-OD1 2.82Å; R117-D223 PolarHBondContact NH2-OD1 2.77Å
118D94Very high91Very high101 Ų10170.3 Ų70.354%0.5437%0.367SS..Hα-helixtrans-62.7-44.5178.8-63.5-24.9000111.1A114 Q115 V120 S121 E122A114-D118 PolarHBondContact O-N 3.2Å; Q115-D118 PolarHBondContact O-N 3.49Å; D118-V120 PolarHBondContact O-N 3.4Å; D118-S121 WeakPolarHBondContact O-CB 3.43Å; D118-S121 PolarHBondContact O-N 3.46Å; D118-E122 WeakPolarHBondContact O-CB 3.37Å; D118-E122 PolarHBondContact O-N 3.01Å
119Y90.3Very high90.9Very high133 Ų13368.9 Ų68.952%0.52236%0.363SS..Hα-helixtrans-61.5-44.1175.4-180-94.6000112.4Q115 V116 S121 E122 S123Q115-Y119 VanDerWaalsContact O-CB 3.32Å; Q115-Y119 WeakPolarHBondContact O-CB 3Å; Q115-Y119 PolarHBondContact O-N 3.27Å; V116-Y119 PolarHBondContact O-N 3.21Å; Y119-S121 VanDerWaalsContact C-N 3.35Å; Y119-E122 PolarHBondContact O-N 2.84Å; Y119-S123 VanDerWaalsContact O-CB 3.26Å; Y119-S123 WeakPolarHBondContact O-CB 3.46Å; Y119-S123 PolarHBondContact O-N 2.97Å
120V93.1Very high90.9Very high21 Ų2168.9 Ų68.913%0.12736%0.363CS..Hα-helixtrans-63.9-42.7176173.40000110.5V116 R117 D118 S123 M124 L222 V225 L229V116-V120 HydrophobicContact CG1-CG2 4.48Å; V116-V120 VanDerWaalsContact O-CG2 3.22Å; V116-V120 WeakPolarHBondContact O-CG2 3.42Å; V116-V120 PolarHBondContact O-N 2.85Å; R117-V120 PolarHBondContact O-N 3.32Å; D118-V120 PolarHBondContact O-N 3.4Å; V120-S123 PolarHBondContact O-N 2.95Å; V120-M124 HydrophobicContact CG1-CG 4.24Å; V120-M124 HydrophobicContact CG1-SD 3.82Å; V120-M124 WeakPolarHBondContact O-CB 3.46Å; V120-M124 VanDerWaalsContact O-CG 3.23Å; V120-M124 WeakPolarHBondContact O-CG 3.49Å; V120-M124 PolarHBondContact O-N 3.44Å; V120-L222 HydrophobicContact CB-CD1 4.15Å; V120-L222 HydrophobicContact CG1-CD1 3.71Å; V120-V225 HydrophobicContact CG1-CG1 3.93Å; V120-L229 HydrophobicContact CG2-CD1 3.86Å
121S95.3Very high90.8Very high25 Ų2567.4 Ų67.418%0.17535%0.35CS..Hα-helixtrans-59.9-47.8176.3-176.30000111.8R117 D118 Y119 M124 N125R117-S121 WeakPolarHBondContact O-CB 3.05Å; R117-S121 PolarHBondContact O-N 3.16Å; D118-S121 WeakPolarHBondContact O-CB 3.43Å; D118-S121 PolarHBondContact O-N 3.46Å; Y119-S121 VanDerWaalsContact C-N 3.35Å; S121-M124 PolarHBondContact O-N 3.44Å; S121-N125 WeakPolarHBondContact O-CB 3.39Å; S121-N125 PolarHBondContact O-N 3.49Å; S121-N125 PolarHBondContact O-ND2 2.67Å; S121-N125 PolarHBondContact OG-ND2 3.43Å
122E92.6Very high90.8Very high135 Ų13563.2 Ų63.263%0.63132%0.324SS*.Hα-helixtrans-61.7-47.3177.3-174178.8176.100111.3D118 Y119 M124 N125 K126D118-E122 WeakPolarHBondContact O-CB 3.37Å; D118-E122 PolarHBondContact O-N 3.01Å; Y119-E122 PolarHBondContact O-N 2.84Å; E122-M124 PolarHBondContact O-N 2.98Å; E122-N125 PolarHBondContact O-N 3.45Å; E122-K126 VanDerWaalsContact O-CB 3.27Å; E122-K126 WeakPolarHBondContact O-CB 3.47Å; E122-K126 PolarHBondContact O-N 2.89Å
123S89.6Confident90.6Very high53 Ų5362.9 Ų62.937%0.37134%0.337SS..Hα-helixtrans-60.2-44.6177.9179.50000112.2Y119 V120 K126 T127Y119-S123 VanDerWaalsContact O-CB 3.26Å; Y119-S123 WeakPolarHBondContact O-CB 3.46Å; Y119-S123 PolarHBondContact O-N 2.97Å; V120-S123 PolarHBondContact O-N 2.95Å; S123-K126 PolarHBondContact O-N 3.37Å; S123-T127 WeakPolarHBondContact O-CB 3.45Å; S123-T127 PolarHBondContact O-N 2.89Å; S123-T127 PolarHBondContact O-OG1 3.35Å
124M93.7Very high90.5Very high13 Ų1363.8 Ų63.86%0.06435%0.349CS..Hα-helixtrans-67.5-43.9177.9-70.8-177.973.700112.1V120 S121 E122 K126 T127 M128 F142 V154 C221 L222 V225V120-M124 HydrophobicContact CG1-CG 4.24Å; V120-M124 HydrophobicContact CG1-SD 3.82Å; V120-M124 WeakPolarHBondContact O-CB 3.46Å; V120-M124 VanDerWaalsContact O-CG 3.23Å; V120-M124 WeakPolarHBondContact O-CG 3.49Å; V120-M124 PolarHBondContact O-N 3.44Å; S121-M124 PolarHBondContact O-N 3.44Å; E122-M124 PolarHBondContact O-N 2.98Å; M124-K126 VanDerWaalsContact C-N 3.34Å; M124-K126 PolarHBondContact O-N 2.84Å; M124-T127 PolarHBondContact O-N 3.27Å; M124-M128 WeakPolarHBondContact O-CB 3.49Å; M124-M128 PolarHBondContact O-N 3.36Å; M124-F142 HydrophobicContact CB-CE2 4.21Å; M124-F142 HydrophobicContact CE-CE2 4.14Å; M124-F142 HydrophobicContact CE-CZ 4.3Å; M124-V154 HydrophobicContact CB-CG1 4.2Å; M124-V154 HydrophobicContact CB-CG2 3.85Å; M124-C221 HydrophobicContact CE-CB 3.48Å; M124-C221 VanDerWaalsContact CE-CB 3.48Å; M124-L222 HydrophobicContact SD-CD1 4.36Å; M124-V225 HydrophobicContact CE-CG2 4.42Å; M124-V225 HydrophobicContact SD-CG2 4.38Å
125N93.8Very high90.3Very high54 Ų5461.6 Ų61.629%0.28933%0.328SS..Hα-helixtrans-61.2-43.7176.1-81.7-52000111.5S121 E122 M128 T129 V154S121-N125 WeakPolarHBondContact O-CB 3.39Å; S121-N125 PolarHBondContact O-N 3.49Å; S121-N125 PolarHBondContact O-ND2 2.67Å; S121-N125 PolarHBondContact OG-ND2 3.43Å; E122-N125 PolarHBondContact O-N 3.45Å; N125-M128 PolarHBondContact O-N 2.92Å; N125-T129 WeakPolarHBondContact O-CB 3.36Å; N125-T129 WeakPolarHBondContact O-CG2 3.29Å; N125-T129 PolarHBondContact O-N 2.94Å; N125-T129 PolarHBondContact O-OG1 2.74Å; N125-V154 WeakPolarHBondContact OD1-CG2 3.17Å
126K90.3Very high90.1Very high91 Ų9162.4 Ų62.440%0.39634%0.336SS..Hα-helixtrans-64.3-44.7177.7-168-178.8-169.5-161.40111.6D50 E122 S123 M124 M128 T129 A130D50-K126 VanDerWaalsContact CB-NZ 3.27Å; D50-K126 WeakPolarHBondContact OD2-CE 3.38Å; D50-K126 IonicContact OD2-NZ 3.55Å; D50-K126 PolarHBondContact OD2-NZ 3.01Å; E122-K126 VanDerWaalsContact O-CB 3.27Å; E122-K126 WeakPolarHBondContact O-CB 3.47Å; E122-K126 PolarHBondContact O-N 2.89Å; S123-K126 PolarHBondContact O-N 3.37Å; M124-K126 VanDerWaalsContact C-N 3.34Å; M124-K126 PolarHBondContact O-N 2.84Å; K126-M128 VanDerWaalsContact C-N 3.32Å; K126-M128 PolarHBondContact O-N 3.29Å; K126-T129 PolarHBondContact O-N 3.37Å; K126-T129 PolarHBondContact O-OG1 3Å; K126-A130 VanDerWaalsContact O-CB 3.29Å; K126-A130 WeakPolarHBondContact O-CB 3.28Å; K126-A130 PolarHBondContact O-N 3.36Å
127T89.1Confident89.8Confident16 Ų1661.4 Ų61.410%0.09833%0.328CS..Iπ-helixtrans-57.2-47.5175.4-61.30000111.2S123 M124 H131 Y132 Y138 F142S123-T127 WeakPolarHBondContact O-CB 3.45Å; S123-T127 PolarHBondContact O-N 2.89Å; S123-T127 PolarHBondContact O-OG1 3.35Å; M124-T127 PolarHBondContact O-N 3.27Å; T127-H131 CarbonylContact O-C 3.58Å; T127-H131 WeakPolarHBondContact O-CA 3.42Å; T127-H131 WeakPolarHBondContact O-CB 3.48Å; T127-H131 PolarHBondContact O-N 3.38Å; T127-H131 VanDerWaalsContact O-N 3.08Å; T127-Y132 PolarHBondContact O-N 3.47Å; T127-Y138 HydrophobicContact CG2-CD1 3.54Å; T127-Y138 HydrophobicContact CG2-CE1 4.37Å; T127-Y138 HydrophobicContact CG2-CG 4.1Å; T127-F142 HydrophobicContact CG2-CD2 3.8Å
128M91.7Very high89.4Confident5 Ų556.8 Ų56.83%0.02531%0.31CS..Iπ-helixtrans-68.5-36.5-177-164.8-171.160.300112.8M124 N125 K126 F142 V154 D159 W160 T163M124-M128 WeakPolarHBondContact O-CB 3.49Å; M124-M128 PolarHBondContact O-N 3.36Å; N125-M128 PolarHBondContact O-N 2.92Å; K126-M128 VanDerWaalsContact C-N 3.32Å; K126-M128 PolarHBondContact O-N 3.29Å; M128-F142 HydrophobicContact CB-CE2 4.22Å; M128-F142 HydrophobicContact CB-CZ 4.03Å; M128-F142 HydrophobicContact CG-CE1 4.32Å; M128-F142 HydrophobicContact CG-CZ 4.13Å; M128-F142 HydrophobicContact SD-CZ 4.31Å; M128-V154 HydrophobicContact CE-CG2 4.28Å; M128-V154 HydrophobicContact SD-CG2 4.3Å; M128-D159 HydrophobicContact CE-CB 3.62Å; M128-D159 HydrophobicContact SD-CB 4.09Å; M128-W160 HydrophobicContact CG-CD2 4.36Å; M128-W160 HydrophobicContact CG-CE3 3.96Å; M128-W160 HydrophobicContact CG-CH2 3.75Å; M128-W160 HydrophobicContact CG-CZ2 4.18Å; M128-W160 HydrophobicContact CG-CZ3 3.64Å; M128-W160 HydrophobicContact SD-CD2 4.11Å; M128-W160 HydrophobicContact SD-CE3 4.25Å; M128-W160 HydrophobicContact SD-CZ2 4.38Å; M128-W160 HydrophobicContact SD-CZ3 4.44Å; M128-T163 HydrophobicContact CB-CG2 4.45Å; M128-T163 HydrophobicContact CE-CG2 3.5Å; M128-T163 HydrophobicContact CG-CG2 3.65Å; M128-T163 HydrophobicContact SD-CG2 3.98Å
129T90.3Very high89.2Confident67 Ų6752.8 Ų52.841%0.41129%0.289SS..Iπ-helixtrans-89-36.3-176.152.60000114.1N125 K126 T163N125-T129 WeakPolarHBondContact O-CB 3.36Å; N125-T129 WeakPolarHBondContact O-CG2 3.29Å; N125-T129 PolarHBondContact O-N 2.94Å; N125-T129 PolarHBondContact O-OG1 2.74Å; K126-T129 PolarHBondContact O-N 3.37Å; K126-T129 PolarHBondContact O-OG1 3Å; T129-T163 HydrophobicContact CG2-CG2 4.15Å
130A86.4Confident89.3Confident44 Ų4450.7 Ų50.736%0.36429%0.287SS..Iπ-helixtrans-105-24-172.400000114.2K126 I134K126-A130 VanDerWaalsContact O-CB 3.29Å; K126-A130 WeakPolarHBondContact O-CB 3.28Å; K126-A130 PolarHBondContact O-N 3.36Å; A130-I134 WeakPolarHBondContact O-CD1 3.43Å
131H85.1Confident89.2Confident22 Ų2252.9 Ų52.910%0.10230%0.298CS..Iπ-helixtrans-120.6-28.1-169.9-67.6-60.2000115.2D50 T127 G133 I134 N135 Y138D50-H131 IonicContact OD1-CE1 3.86Å; D50-H131 PolarHBondContact OD1-CE1 2.98Å; D50-H131 IonicContact OD1-NE2 2.67Å; D50-H131 PolarHBondContact OD1-NE2 2.85Å; D50-H131 IonicContact OD2-CD2 3.57Å; D50-H131 IonicContact OD2-CE1 2.87Å; D50-H131 IonicContact OD2-NE2 2.88Å; D50-H131 PolarHBondContact OD2-NE2 3.45Å; T127-H131 CarbonylContact O-C 3.58Å; T127-H131 WeakPolarHBondContact O-CA 3.42Å; T127-H131 WeakPolarHBondContact O-CB 3.48Å; T127-H131 PolarHBondContact O-N 3.38Å; T127-H131 VanDerWaalsContact O-N 3.08Å; H131-G133 PolarHBondContact O-N 3.34Å; H131-I134 PolarHBondContact O-N 2.88Å; H131-I134 VanDerWaalsContact O-N 3.07Å; H131-N135 HydrophobicContact CB-CB 4.37Å; H131-N135 PolarHBondContact O-N 3.34Å; H131-Y138 HydrophobicContact CB-CD1 4.25Å; H131-Y138 HydrophobicContact CB-CD2 3.49Å; H131-Y138 VanDerWaalsContact CB-CD2 3.49Å; H131-Y138 HydrophobicContact CB-CE2 3.75Å; H131-Y138 HydrophobicContact CB-CG 3.68Å; H131-Y138 AromaticContact CD2-CE2 3.64Å; H131-Y138 AromaticContact CD2-CZ 3.57Å; H131-Y138 AromaticContact CE1-CE2 3.85Å; H131-Y138 AromaticContact CG-CD2 3.61Å; H131-Y138 AromaticContact CG-CE2 3.3Å; H131-Y138 AromaticContact CG-CZ 3.75Å; H131-Y138 AromaticContact ND1-CD2 3.96Å; H131-Y138 AromaticContact ND1-CE2 3.47Å; H131-Y138 WeakPolarHBondContact ND1-CE2 3.22Å; H131-Y138 AromaticContact NE2-CE2 3.95Å; H131-Y138 AromaticContact NE2-CZ 3.89Å
132Y89.6Confident89.1Confident15 Ų1551.9 Ų51.96%0.05929%0.291CS..THydrogen-bonded Turntrans-63.1126.8-177-167.1-85.8000111.7T127 I134 T139 F142 D143 W160 F165 P184T127-Y132 PolarHBondContact O-N 3.47Å; Y132-I134 PolarHBondContact O-N 3.45Å; Y132-T139 HydrophobicContact CD2-CG2 4.17Å; Y132-T139 HydrophobicContact CE1-CG2 4.32Å; Y132-T139 HydrophobicContact CE2-CG2 3.69Å; Y132-F142 HydrophobicContact CD2-CB 4.14Å; Y132-F142 HydrophobicContact CD2-CD1 4.41Å; Y132-F142 HydrophobicContact CD2-CG 4.45Å; Y132-F142 HydrophobicContact CE2-CB 4.3Å; Y132-F142 HydrophobicContact CE2-CD1 4.48Å; Y132-D143 WeakPolarHBondContact CE2-OD1 3.36Å; Y132-D143 PolarHBondContact OH-OD1 3.24Å; Y132-D143 PolarHBondContact OH-OD2 2.97Å; Y132-W160 AromaticContact CD1-CH2 3.65Å; Y132-W160 HydrophobicContact CD1-CH2 3.65Å; Y132-W160 AromaticContact CD1-CZ3 3.47Å; Y132-W160 HydrophobicContact CD1-CZ3 3.47Å; Y132-W160 VanDerWaalsContact CD1-CZ3 3.47Å; Y132-W160 AromaticContact CD2-CH2 3.62Å; Y132-W160 HydrophobicContact CD2-CH2 3.62Å; Y132-W160 HydrophobicContact CD2-CZ3 4.22Å; Y132-W160 AromaticContact CE1-CH2 3.74Å; Y132-W160 HydrophobicContact CE1-CH2 3.74Å; Y132-W160 AromaticContact CE1-CZ3 3.82Å; Y132-W160 HydrophobicContact CE1-CZ3 3.82Å; Y132-W160 AromaticContact CE2-CH2 3.7Å; Y132-W160 HydrophobicContact CE2-CH2 3.7Å; Y132-W160 AromaticContact CG-CH2 3.6Å; Y132-W160 HydrophobicContact CG-CH2 3.6Å; Y132-W160 AromaticContact CG-CZ3 3.71Å; Y132-W160 HydrophobicContact CG-CZ3 3.71Å; Y132-W160 AromaticContact CZ-CH2 3.78Å; Y132-F165 HydrophobicContact CD1-CB 3.8Å; Y132-F165 HydrophobicContact CD1-CD1 4.17Å; Y132-F165 AromaticContact CD1-CD2 3.85Å; Y132-F165 HydrophobicContact CD1-CD2 3.85Å; Y132-F165 HydrophobicContact CD1-CE2 4.49Å; Y132-F165 AromaticContact CD1-CG 3.66Å; Y132-F165 HydrophobicContact CD1-CG 3.66Å; Y132-F165 HydrophobicContact CE1-CB 4.33Å; Y132-F165 AromaticContact CE1-CD1 3.89Å; Y132-F165 HydrophobicContact CE1-CD1 3.89Å; Y132-F165 AromaticContact CE1-CD2 3.63Å; Y132-F165 HydrophobicContact CE1-CD2 3.63Å; Y132-F165 HydrophobicContact CE1-CE1 4.09Å; Y132-F165 AromaticContact CE1-CE2 3.83Å; Y132-F165 HydrophobicContact CE1-CE2 3.83Å; Y132-F165 AromaticContact CE1-CG 3.67Å; Y132-F165 HydrophobicContact CE1-CG 3.67Å; Y132-F165 HydrophobicContact CE1-CZ 4.05Å; Y132-P184 HydrophobicContact CE1-CG 3.68Å; Y132-P184 HydrophobicContact CE2-CG 4.18Å; Y132-P184 WeakPolarHBondContact OH-CB 3.03Å; Y132-P184 WeakPolarHBondContact OH-CG 3.32Å
133G86.4Confident89.3Confident57 Ų5747 Ų4759%0.58827%0.269SS*.THydrogen-bonded Turntrans79-10.6-176.300000115.4H131 T139H131-G133 PolarHBondContact O-N 3.34Å; G133-T139 PolarHBondContact N-OG1 3.1Å
134I86.3Confident89.5Confident129 Ų12947.2 Ų47.266%0.66227%0.271SS*.THydrogen-bonded Turntrans-95.7-45.4172.4-57.2-176.7000109.2A130 H131 Y132A130-I134 WeakPolarHBondContact O-CD1 3.43Å; H131-I134 PolarHBondContact O-N 2.88Å; H131-I134 VanDerWaalsContact O-N 3.07Å; Y132-I134 PolarHBondContact O-N 3.45Å
135N84.1Confident89.7Confident19 Ų1949.2 Ų49.210%0.10228%0.281CS..  trans-112117.9-174.3-164-69.4000111.4E47 H131 L137 Y138 T139E47-N135 WeakPolarHBondContact CG-ND2 3.33Å; E47-N135 PolarHBondContact OE1-ND2 3.4Å; E47-N135 PolarHBondContact OE1-OD1 3.38Å; H131-N135 HydrophobicContact CB-CB 4.37Å; H131-N135 PolarHBondContact O-N 3.34Å; N135-L137 VanDerWaalsContact C-N 3.29Å; N135-L137 PolarHBondContact O-N 2.86Å; N135-L137 WeakPolarHBondContact OD1-CB 3.42Å; N135-L137 PolarHBondContact OD1-N 2.67Å; N135-Y138 HydrophobicContact CB-CD2 3.64Å; N135-Y138 HydrophobicContact CB-CE2 4.43Å; N135-Y138 PolarHBondContact OD1-N 3.24Å; N135-T139 VanDerWaalsContact O-CB 3.27Å; N135-T139 WeakPolarHBondContact O-CB 3Å; N135-T139 PolarHBondContact O-N 3.45Å; N135-T139 PolarHBondContact O-OG1 2.88Å
136L87.4Confident89.8Confident135 Ų13546.6 Ų46.671%0.70727%0.267SS*.Hα-helixtrans-62.9-34.8-175.9-70.8173.4000112.6T139 N140L136-T139 PolarHBondContact O-N 3.29Å; L136-N140 VanDerWaalsContact O-CB 3.27Å; L136-N140 WeakPolarHBondContact O-CB 3.25Å; L136-N140 PolarHBondContact O-N 3.38Å; L136-N140 PolarHBondContact O-ND2 2.89Å
137L83.3Confident90.1Very high48 Ų4844.8 Ų44.825%0.25127%0.269SS..Hα-helixtrans-71.3-47.3-176.4-176.656.1000111.7N44 E47 I48 N135 T139 N140 N141N44-L137 HydrophobicContact CB-CD2 4.36Å; N44-L137 WeakPolarHBondContact O-CD2 3.28Å; E47-L137 HydrophobicContact CB-CD2 4.4Å; I48-L137 HydrophobicContact CD1-CD1 4.28Å; I48-L137 HydrophobicContact CD1-CD2 3.57Å; I48-L137 HydrophobicContact CD1-CG 3.83Å; I48-L137 HydrophobicContact CG1-CD2 3.38Å; I48-L137 HydrophobicContact CG1-CG 3.59Å; N135-L137 VanDerWaalsContact C-N 3.29Å; N135-L137 PolarHBondContact O-N 2.86Å; N135-L137 WeakPolarHBondContact OD1-CB 3.42Å; N135-L137 PolarHBondContact OD1-N 2.67Å; L137-T139 VanDerWaalsContact C-N 3.34Å; L137-N140 PolarHBondContact O-N 3.47Å; L137-N141 WeakPolarHBondContact O-CB 3.03Å; L137-N141 PolarHBondContact O-N 2.93Å; L137-N141 PolarHBondContact O-ND2 2.95Å
138Y85.3Confident90.5Very high10 Ų1050.1 Ų50.14%0.03930%0.297CS..Hα-helixtrans-62.5-42.3172-75.6-80.3000112.5E47 I48 D49 D50 T127 H131 N135 N141 F142E47-Y138 WeakPolarHBondContact O-CE2 3.33Å; E47-Y138 PolarHBondContact O-OH 3Å; I48-Y138 WeakPolarHBondContact CA-OH 3.4Å; I48-Y138 HydrophobicContact CB-CE1 4.4Å; I48-Y138 HydrophobicContact CG2-CD1 4.38Å; I48-Y138 HydrophobicContact CG2-CE1 4.11Å; I48-Y138 WeakPolarHBondContact O-CE1 3.32Å; I48-Y138 PolarHBondContact O-OH 3.32Å; D49-Y138 WeakPolarHBondContact CA-OH 3.32Å; D49-Y138 PolarHBondContact N-OH 2.97Å; D49-Y138 VanDerWaalsContact N-OH 3.13Å; D50-Y138 PolarHBondContact N-OH 3.47Å; T127-Y138 HydrophobicContact CG2-CD1 3.54Å; T127-Y138 HydrophobicContact CG2-CE1 4.37Å; T127-Y138 HydrophobicContact CG2-CG 4.1Å; H131-Y138 HydrophobicContact CB-CD1 4.25Å; H131-Y138 HydrophobicContact CB-CD2 3.49Å; H131-Y138 VanDerWaalsContact CB-CD2 3.49Å; H131-Y138 HydrophobicContact CB-CE2 3.75Å; H131-Y138 HydrophobicContact CB-CG 3.68Å; H131-Y138 AromaticContact CD2-CE2 3.64Å; H131-Y138 AromaticContact CD2-CZ 3.57Å; H131-Y138 AromaticContact CE1-CE2 3.85Å; H131-Y138 AromaticContact CG-CD2 3.61Å; H131-Y138 AromaticContact CG-CE2 3.3Å; H131-Y138 AromaticContact CG-CZ 3.75Å; H131-Y138 AromaticContact ND1-CD2 3.96Å; H131-Y138 AromaticContact ND1-CE2 3.47Å; H131-Y138 WeakPolarHBondContact ND1-CE2 3.22Å; H131-Y138 AromaticContact NE2-CE2 3.95Å; H131-Y138 AromaticContact NE2-CZ 3.89Å; N135-Y138 HydrophobicContact CB-CD2 3.64Å; N135-Y138 HydrophobicContact CB-CE2 4.43Å; N135-Y138 PolarHBondContact OD1-N 3.24Å; Y138-N141 PolarHBondContact O-N 3.38Å; Y138-F142 WeakPolarHBondContact O-CB 3.16Å; Y138-F142 PolarHBondContact O-N 3.29Å
139T90.6Very high90.7Very high16 Ų1651.6 Ų51.610%0.09831%0.305CS..Hα-helixtrans-58.3-51.8179-58.30000109.8Y132 G133 N135 L136 L137 N141 F142 D143Y132-T139 HydrophobicContact CD2-CG2 4.17Å; Y132-T139 HydrophobicContact CE1-CG2 4.32Å; Y132-T139 HydrophobicContact CE2-CG2 3.69Å; G133-T139 PolarHBondContact N-OG1 3.1Å; N135-T139 VanDerWaalsContact O-CB 3.27Å; N135-T139 WeakPolarHBondContact O-CB 3Å; N135-T139 PolarHBondContact O-N 3.45Å; N135-T139 PolarHBondContact O-OG1 2.88Å; L136-T139 PolarHBondContact O-N 3.29Å; L137-T139 VanDerWaalsContact C-N 3.34Å; T139-N141 PolarHBondContact O-N 3.27Å; T139-F142 PolarHBondContact O-N 2.9Å; T139-D143 WeakPolarHBondContact O-CB 3.24Å; T139-D143 VanDerWaalsContact O-CG 3.25Å; T139-D143 PolarHBondContact O-N 2.93Å
140N91.8Very high91Very high89 Ų8953.9 Ų53.948%0.47631%0.311SS..Hα-helixtrans-63.4-38.6179-69.9-18.5000112.8L136 L137 S144L136-N140 VanDerWaalsContact O-CB 3.27Å; L136-N140 WeakPolarHBondContact O-CB 3.25Å; L136-N140 PolarHBondContact O-N 3.38Å; L136-N140 PolarHBondContact O-ND2 2.89Å; L137-N140 PolarHBondContact O-N 3.47Å; N140-S144 VanDerWaalsContact O-CB 3.29Å; N140-S144 WeakPolarHBondContact O-CB 3.46Å; N140-S144 PolarHBondContact O-N 3.06Å; N140-S144 PolarHBondContact O-OG 2.89Å
141N90.3Very high91.6Very high67 Ų6751.8 Ų51.836%0.35829%0.293SS..Hα-helixtrans-66.3-45.9177.3-76.1-21.5000111.3L137 Y138 T139 S144 I145L137-N141 WeakPolarHBondContact O-CB 3.03Å; L137-N141 PolarHBondContact O-N 2.93Å; L137-N141 PolarHBondContact O-ND2 2.95Å; Y138-N141 PolarHBondContact O-N 3.38Å; T139-N141 PolarHBondContact O-N 3.27Å; N141-S144 WeakPolarHBondContact O-CB 3.04Å; N141-S144 PolarHBondContact O-N 2.03Å; N141-I145 WeakPolarHBondContact O-CG1 3.26Å; N141-I145 PolarHBondContact O-N 3.38Å
142F94Very high92.1Very high5 Ų550.8 Ų50.82%0.02229%0.289CS..Hα-helixtrans-66.5-41.9178.3-153.8-87000111.3M124 T127 M128 Y132 Y138 T139 S144 I145 Q146 V154 W160M124-F142 HydrophobicContact CB-CE2 4.21Å; M124-F142 HydrophobicContact CE-CE2 4.14Å; M124-F142 HydrophobicContact CE-CZ 4.3Å; T127-F142 HydrophobicContact CG2-CD2 3.8Å; M128-F142 HydrophobicContact CB-CE2 4.22Å; M128-F142 HydrophobicContact CB-CZ 4.03Å; M128-F142 HydrophobicContact CG-CE1 4.32Å; M128-F142 HydrophobicContact CG-CZ 4.13Å; M128-F142 HydrophobicContact SD-CZ 4.31Å; Y132-F142 HydrophobicContact CD2-CB 4.14Å; Y132-F142 HydrophobicContact CD2-CD1 4.41Å; Y132-F142 HydrophobicContact CD2-CG 4.45Å; Y132-F142 HydrophobicContact CE2-CB 4.3Å; Y132-F142 HydrophobicContact CE2-CD1 4.48Å; Y138-F142 WeakPolarHBondContact O-CB 3.16Å; Y138-F142 PolarHBondContact O-N 3.29Å; T139-F142 PolarHBondContact O-N 2.9Å; F142-S144 VanDerWaalsContact C-N 3.32Å; F142-S144 PolarHBondContact O-N 3.43Å; F142-I145 WeakPolarHBondContact O-CB 3.35Å; F142-I145 PolarHBondContact O-N 3.21Å; F142-I145 VanDerWaalsContact O-N 3.17Å; F142-Q146 HydrophobicContact CD1-CG 4.16Å; F142-Q146 HydrophobicContact CE1-CG 4.23Å; F142-Q146 WeakPolarHBondContact O-CG 3.26Å; F142-Q146 PolarHBondContact O-N 3Å; F142-V154 HydrophobicContact CZ-CG2 4.47Å; F142-W160 HydrophobicContact CD1-CH2 4.21Å; F142-W160 HydrophobicContact CD1-CZ2 4.05Å; F142-W160 HydrophobicContact CE1-CH2 4.16Å; F142-W160 AromaticContact CE1-CZ2 3.76Å; F142-W160 HydrophobicContact CE1-CZ2 3.76Å
143D95.6Very high92.5Very high32 Ų3250 Ų5017%0.17129%0.286CS..Hα-helixtrans-59.2-42173.1-82.5-11.5000111.9Y132 T139 I145 Q146 A147 T186Y132-D143 WeakPolarHBondContact CE2-OD1 3.36Å; Y132-D143 PolarHBondContact OH-OD1 3.24Å; Y132-D143 PolarHBondContact OH-OD2 2.97Å; T139-D143 WeakPolarHBondContact O-CB 3.24Å; T139-D143 VanDerWaalsContact O-CG 3.25Å; T139-D143 PolarHBondContact O-N 2.93Å; D143-I145 VanDerWaalsContact C-N 3.35Å; D143-Q146 PolarHBondContact O-N 3.47Å; D143-A147 VanDerWaalsContact O-CB 3.3Å; D143-A147 WeakPolarHBondContact O-CB 3.39Å; D143-A147 PolarHBondContact O-N 3.42Å; D143-T186 HydrophobicContact CB-CG2 3.58Å; D143-T186 PolarHBondContact OD1-OG1 3.43Å
144S95.3Very high92.9Very high58 Ų5847.3 Ų47.341%0.40626%0.258SS..Hα-helixtrans-64.5-39.3175.8-63.20000111.8N140 N141 F142 N148N140-S144 VanDerWaalsContact O-CB 3.29Å; N140-S144 WeakPolarHBondContact O-CB 3.46Å; N140-S144 PolarHBondContact O-N 3.06Å; N140-S144 PolarHBondContact O-OG 2.89Å; N141-S144 WeakPolarHBondContact O-CB 3.04Å; N141-S144 PolarHBondContact O-N 2.03Å; F142-S144 VanDerWaalsContact C-N 3.32Å; F142-S144 PolarHBondContact O-N 3.43Å; S144-N148 WeakPolarHBondContact O-CB 3.23Å; S144-N148 PolarHBondContact O-N 3.02Å; S144-N148 PolarHBondContact O-ND2 3.08Å
145I96.3Very high93.4Very high54 Ų5445.5 Ų45.528%0.27725%0.249SC..Hα-helixtrans-61.6-49.7174.6-69.1166000109.6N141 F142 D143 L149 C221 V225N141-I145 WeakPolarHBondContact O-CG1 3.26Å; N141-I145 PolarHBondContact O-N 3.38Å; F142-I145 WeakPolarHBondContact O-CB 3.35Å; F142-I145 PolarHBondContact O-N 3.21Å; F142-I145 VanDerWaalsContact O-N 3.17Å; D143-I145 VanDerWaalsContact C-N 3.35Å; I145-L149 HydrophobicContact CG2-CD1 3.96Å; I145-L149 HydrophobicContact CG2-CG 4.48Å; I145-L149 WeakPolarHBondContact O-CB 3.22Å; I145-L149 WeakPolarHBondContact O-CG 3.34Å; I145-L149 PolarHBondContact O-N 3.19Å; I145-C221 HydrophobicContact CG2-CB 4.03Å; I145-V225 HydrophobicContact CG2-CG2 3.84Å
146Q97.5Very high94Very high0 Ų045.9 Ų45.90%025%0.254CS..Hα-helixtrans-62.4-47-178.5-72.6-175.2-36.900112.7F142 D143 Q150 C151 T186 C187F142-Q146 HydrophobicContact CD1-CG 4.16Å; F142-Q146 HydrophobicContact CE1-CG 4.23Å; F142-Q146 WeakPolarHBondContact O-CG 3.26Å; F142-Q146 PolarHBondContact O-N 3Å; D143-Q146 PolarHBondContact O-N 3.47Å; Q146-Q150 VanDerWaalsContact O-CA 3.28Å; Q146-Q150 WeakPolarHBondContact O-CA 3.37Å; Q146-Q150 PolarHBondContact O-N 3.41Å; Q146-C151 WeakPolarHBondContact CB-O 3.2Å; Q146-C151 PolarHBondContact O-N 3.38Å; Q146-T186 PolarHBondContact OE1-OG1 3.31Å; Q146-C187 VanDerWaalsContact CD-SG 3.51Å; Q146-C187 PolarHBondContact NE2-SG 3.1Å
147A95.9Very high94.3Very high52 Ų5240.6 Ų40.643%0.4322%0.224SC..Hα-helixtrans-66.3-46.9-179.800000112.2D143 T186D143-A147 VanDerWaalsContact O-CB 3.3Å; D143-A147 WeakPolarHBondContact O-CB 3.39Å; D143-A147 PolarHBondContact O-N 3.42Å; A147-T186 HydrophobicContact CB-CG2 4.25Å
148N96.3Very high94.8Very high128 Ų12840.7 Ų40.768%0.68423%0.227SC*.Hα-helixtrans-73-35.8-176.7-69.9-40.6000112.6S144S144-N148 WeakPolarHBondContact O-CB 3.23Å; S144-N148 PolarHBondContact O-N 3.02Å; S144-N148 PolarHBondContact O-ND2 3.08Å
149L96.7Very high95.2Very high37 Ų3741.7 Ų41.719%0.19423%0.233CC..Hα-helixtrans-95-3.6-177.5-54-170.9000112.9I145 C151 K224 V225 I228I145-L149 HydrophobicContact CG2-CD1 3.96Å; I145-L149 HydrophobicContact CG2-CG 4.48Å; I145-L149 WeakPolarHBondContact O-CB 3.22Å; I145-L149 WeakPolarHBondContact O-CG 3.34Å; I145-L149 PolarHBondContact O-N 3.19Å; L149-C151 VanDerWaalsContact C-N 3.35Å; L149-C151 PolarHBondContact O-N 2.88Å; L149-K224 HydrophobicContact CB-CB 4.28Å; L149-K224 HydrophobicContact CB-CD 4.04Å; L149-K224 HydrophobicContact CD1-CB 3.99Å; L149-K224 WeakPolarHBondContact O-CD 3.05Å; L149-K224 WeakPolarHBondContact O-CE 3.27Å; L149-K224 PolarHBondContact O-NZ 3.17Å; L149-V225 HydrophobicContact CD1-CG2 3.72Å; L149-I228 HydrophobicContact CD1-CD1 3.93Å; L149-I228 HydrophobicContact CD2-CD1 3.24Å; L149-I228 HydrophobicContact CG-CD1 4.24Å
150Q97Very high95.3Very high115 Ų11541 Ų4154%0.53723%0.228SC..THydrogen-bonded Turntrans50.654.8-177.6-56.2-178.6-53.300111.3Q146 N217 K224Q146-Q150 VanDerWaalsContact O-CA 3.28Å; Q146-Q150 WeakPolarHBondContact O-CA 3.37Å; Q146-Q150 PolarHBondContact O-N 3.41Å; Q150-N217 VanDerWaalsContact C-CG 3.44Å; Q150-N217 WeakPolarHBondContact O-CB 3.22Å; Q150-K224 PolarHBondContact O-NZ 2.86Å
151C98Very high95.2Very high0 Ų038.6 Ų38.60%022%0.216CC..  trans-133.4168-179.857.40000109.9Q146 L149 G219 C221 K224Q146-C151 WeakPolarHBondContact CB-O 3.2Å; Q146-C151 PolarHBondContact O-N 3.38Å; L149-C151 VanDerWaalsContact C-N 3.35Å; L149-C151 PolarHBondContact O-N 2.88Å; C151-G219 CarbonylContact C-O 3.5Å; C151-G219 VanDerWaalsContact CA-O 3.26Å; C151-G219 WeakPolarHBondContact CA-O 3.12Å; C151-G219 VanDerWaalsContact CB-O 3.25Å; C151-G219 WeakPolarHBondContact CB-O 3.38Å; C151-C221 VanDerWaalsContact C-SG 3.53Å; C151-C221 HydrophobicContact CB-CB 3.92Å; C151-C221 WeakPolarHBondContact CB-SG 3.35Å; C151-C221 WeakPolarHBondContact SG-CA 3.43Å; C151-C221 WeakPolarHBondContact SG-CB 3.45Å; C151-C221 CovalentContact SG-SG 2.03Å; C151-C221 PolarHBondContact SG-SG 2.87Å; C151-K224 HydrophobicContact CB-CD 4.02Å
152C97.4Very high95.1Very high0 Ų039.4 Ų39.40%023%0.232CC..  trans-144.9138.9176.3-170.70000111.3S156 Y157 W160 C187 N217 G219C152-S156 CarbonylContact O-C 3.47Å; C152-Y157 PolarHBondContact O-N 2.92Å; C152-Y157 VanDerWaalsContact SG-CA 3.57Å; C152-Y157 WeakPolarHBondContact SG-CB 3.46Å; C152-W160 VanDerWaalsContact SG-CD1 3.53Å; C152-W160 PolarHBondContact SG-NE1 3.26Å; C152-C187 VanDerWaalsContact CA-SG 3.56Å; C152-C187 HydrophobicContact CB-CB 3.65Å; C152-C187 WeakPolarHBondContact CB-SG 3.23Å; C152-C187 WeakPolarHBondContact SG-CB 3.39Å; C152-C187 CovalentContact SG-SG 2.03Å; C152-C187 PolarHBondContact SG-SG 3.33Å; C152-N217 WeakPolarHBondContact CB-O 2.95Å; C152-G219 PolarHBondContact N-O 3.4Å
153G96Very high94.9Very high0 Ų039.3 Ų39.30%023%0.232CC..SBendtrans63.3-169.9-172.500000113.6S156 C221G153-S156 WeakPolarHBondContact CA-O 3.34Å; G153-C221 VanDerWaalsContact O-CB 3.26Å; G153-C221 WeakPolarHBondContact O-CB 3.32Å; G153-C221 PolarHBondContact O-N 3.12Å; G153-C221 PolarHBondContact O-SG 3.04Å
154V96.7Very high94.3Very high0 Ų044.7 Ų44.70%025%0.251CS..SBendtrans-83.1-57.6-179.9-178.60000109.5M124 N125 M128 F142 D159 G220 C221 L222M124-V154 HydrophobicContact CB-CG1 4.2Å; M124-V154 HydrophobicContact CB-CG2 3.85Å; N125-V154 WeakPolarHBondContact OD1-CG2 3.17Å; M128-V154 HydrophobicContact CE-CG2 4.28Å; M128-V154 HydrophobicContact SD-CG2 4.3Å; F142-V154 HydrophobicContact CZ-CG2 4.47Å; V154-D159 WeakPolarHBondContact CA-OD2 3.47Å; V154-D159 PolarHBondContact N-OD2 3.01Å; V154-G220 CarbonylContact O-C 3.06Å; V154-G220 WeakPolarHBondContact O-CA 3.26Å; V154-C221 PolarHBondContact O-N 3.4Å; V154-C221 VanDerWaalsContact O-N 3.08Å; V154-L222 HydrophobicContact CG1-CB 3.98Å; V154-L222 HydrophobicContact CG1-CD2 4.33Å; V154-L222 WeakPolarHBondContact O-CB 3.43Å; V154-L222 PolarHBondContact O-N 3.21Å
155N96.8Very high94Very high90 Ų9043.5 Ų43.548%0.48124%0.238SC..SBendtrans-100.7-32.1174.7-57.3-62.1000112D159 G220N155-D159 WeakPolarHBondContact CA-OD2 3.47Å; N155-D159 PolarHBondContact N-OD2 2.91Å; N155-G220 WeakPolarHBondContact O-CA 3.37Å; N155-G220 PolarHBondContact O-N 3.39Å
156S95.7Very high93.4Very high28 Ų2841 Ų4120%0.19623%0.225CC..BIsolated β-bridgetrans-164161.6-178.9177.80000111.8C152 G153 V158 D159C152-S156 CarbonylContact O-C 3.47Å; G153-S156 WeakPolarHBondContact CA-O 3.34Å; S156-V158 PolarHBondContact O-N 3.06Å; S156-V158 VanDerWaalsContact O-N 3.07Å; S156-D159 PolarHBondContact N-OD2 3.33Å; S156-D159 VanDerWaalsContact O-CB 3.28Å; S156-D159 WeakPolarHBondContact O-CB 3.45Å; S156-D159 PolarHBondContact O-N 3.47Å
157Y94.1Very high92.3Very high23 Ų2343 Ų439%0.0924%0.236CC..G310 helixtrans-56.2-24.4174.968.6-79.1000113.9C152 D159 W160 L209 T210 V216 T218C152-Y157 PolarHBondContact O-N 2.92Å; C152-Y157 VanDerWaalsContact SG-CA 3.57Å; C152-Y157 WeakPolarHBondContact SG-CB 3.46Å; Y157-D159 PolarHBondContact O-N 2.84Å; Y157-W160 VanDerWaalsContact O-CD1 3.31Å; Y157-L209 HydrophobicContact CD2-CD1 4.29Å; Y157-L209 HydrophobicContact CD2-CD2 3.94Å; Y157-L209 HydrophobicContact CD2-CG 3.7Å; Y157-L209 HydrophobicContact CE2-CD2 4.44Å; Y157-L209 HydrophobicContact CE2-CG 3.84Å; Y157-L209 WeakPolarHBondContact CE2-O 3.37Å; Y157-T210 WeakPolarHBondContact OH-CA 3.27Å; Y157-V216 HydrophobicContact CD1-CG2 4.35Å; Y157-V216 HydrophobicContact CD2-CG2 3.93Å; Y157-V216 HydrophobicContact CE2-CG2 4.47Å; Y157-V216 HydrophobicContact CG-CG2 3.86Å; Y157-T218 HydrophobicContact CD1-CG2 4.11Å; Y157-T218 HydrophobicContact CE1-CG2 3.88Å
158V93.1Very high90.6Very high51 Ų5146.7 Ų46.731%0.30924%0.242SC..G310 helixtrans-70.1-16.7176.7-60.70000113.5S156 W160 L161 T210S156-V158 PolarHBondContact O-N 3.06Å; S156-V158 VanDerWaalsContact O-N 3.07Å; V158-W160 PolarHBondContact O-N 3.5Å; V158-W160 VanDerWaalsContact O-N 3.12Å; V158-L161 HydrophobicContact CB-CD1 4.36Å; V158-L161 VanDerWaalsContact O-CB 3.3Å; V158-L161 WeakPolarHBondContact O-CB 3.45Å; V158-L161 WeakPolarHBondContact O-CG 3.3Å; V158-L161 PolarHBondContact O-N 2.73Å; V158-T210 HydrophobicContact CG1-CG2 4.34Å
159D93.9Very high88.6Confident31 Ų3143.1 Ų43.117%0.16622%0.222CC..G310 helixtrans-59.6-27.4178.6-61-25.2000111.6M128 V154 N155 S156 Y157 L161 A162M128-D159 HydrophobicContact CE-CB 3.62Å; M128-D159 HydrophobicContact SD-CB 4.09Å; V154-D159 WeakPolarHBondContact CA-OD2 3.47Å; V154-D159 PolarHBondContact N-OD2 3.01Å; N155-D159 WeakPolarHBondContact CA-OD2 3.47Å; N155-D159 PolarHBondContact N-OD2 2.91Å; S156-D159 PolarHBondContact N-OD2 3.33Å; S156-D159 VanDerWaalsContact O-CB 3.28Å; S156-D159 WeakPolarHBondContact O-CB 3.45Å; S156-D159 PolarHBondContact O-N 3.47Å; Y157-D159 PolarHBondContact O-N 2.84Å; D159-L161 PolarHBondContact O-N 3.2Å; D159-A162 WeakPolarHBondContact O-CB 3.45Å; D159-A162 PolarHBondContact O-N 3.26Å; D159-A162 VanDerWaalsContact O-N 3.1Å
160W93.4Very high86.5Confident0 Ų049.5 Ų49.50%025%0.248CC..G310 helixtrans-59.6-27.8175.9-73.6109.8000113.5M128 Y132 F142 C152 Y157 V158 A162 T163 F165 G166 V183 P184 C187M128-W160 HydrophobicContact CG-CD2 4.36Å; M128-W160 HydrophobicContact CG-CE3 3.96Å; M128-W160 HydrophobicContact CG-CH2 3.75Å; M128-W160 HydrophobicContact CG-CZ2 4.18Å; M128-W160 HydrophobicContact CG-CZ3 3.64Å; M128-W160 HydrophobicContact SD-CD2 4.11Å; M128-W160 HydrophobicContact SD-CE3 4.25Å; M128-W160 HydrophobicContact SD-CZ2 4.38Å; M128-W160 HydrophobicContact SD-CZ3 4.44Å; Y132-W160 AromaticContact CD1-CH2 3.65Å; Y132-W160 HydrophobicContact CD1-CH2 3.65Å; Y132-W160 AromaticContact CD1-CZ3 3.47Å; Y132-W160 HydrophobicContact CD1-CZ3 3.47Å; Y132-W160 VanDerWaalsContact CD1-CZ3 3.47Å; Y132-W160 AromaticContact CD2-CH2 3.62Å; Y132-W160 HydrophobicContact CD2-CH2 3.62Å; Y132-W160 HydrophobicContact CD2-CZ3 4.22Å; Y132-W160 AromaticContact CE1-CH2 3.74Å; Y132-W160 HydrophobicContact CE1-CH2 3.74Å; Y132-W160 AromaticContact CE1-CZ3 3.82Å; Y132-W160 HydrophobicContact CE1-CZ3 3.82Å; Y132-W160 AromaticContact CE2-CH2 3.7Å; Y132-W160 HydrophobicContact CE2-CH2 3.7Å; Y132-W160 AromaticContact CG-CH2 3.6Å; Y132-W160 HydrophobicContact CG-CH2 3.6Å; Y132-W160 AromaticContact CG-CZ3 3.71Å; Y132-W160 HydrophobicContact CG-CZ3 3.71Å; Y132-W160 AromaticContact CZ-CH2 3.78Å; F142-W160 HydrophobicContact CD1-CH2 4.21Å; F142-W160 HydrophobicContact CD1-CZ2 4.05Å; F142-W160 HydrophobicContact CE1-CH2 4.16Å; F142-W160 AromaticContact CE1-CZ2 3.76Å; F142-W160 HydrophobicContact CE1-CZ2 3.76Å; C152-W160 VanDerWaalsContact SG-CD1 3.53Å; C152-W160 PolarHBondContact SG-NE1 3.26Å; Y157-W160 VanDerWaalsContact O-CD1 3.31Å; V158-W160 PolarHBondContact O-N 3.5Å; V158-W160 VanDerWaalsContact O-N 3.12Å; W160-A162 PolarHBondContact O-N 2.9Å; W160-T163 HydrophobicContact CE3-CG2 4.07Å; W160-T163 WeakPolarHBondContact O-CB 3.44Å; W160-T163 PolarHBondContact O-N 3.43Å; W160-T163 PolarHBondContact O-OG1 2.86Å; W160-F165 AromaticContact CE3-CD1 3.87Å; W160-F165 HydrophobicContact CE3-CD1 3.87Å; W160-F165 HydrophobicContact CZ3-CB 4.29Å; W160-F165 AromaticContact CZ3-CD1 3.92Å; W160-F165 HydrophobicContact CZ3-CD1 3.92Å; W160-F165 HydrophobicContact CZ3-CG 4.35Å; W160-G166 WeakPolarHBondContact O-CA 3.49Å; W160-V183 HydrophobicContact CB-CG1 4.03Å; W160-V183 VanDerWaalsContact CD1-CG1 3.47Å; W160-V183 HydrophobicContact CG-CB 4.32Å; W160-V183 HydrophobicContact CG-CG1 3.9Å; W160-P184 HydrophobicContact CD2-CG 4.33Å; W160-P184 HydrophobicContact CE3-CG 4.41Å; W160-P184 HydrophobicContact CH2-CG 3.45Å; W160-P184 VanDerWaalsContact CH2-CG 3.45Å; W160-P184 HydrophobicContact CZ2-CG 3.29Å; W160-P184 HydrophobicContact CZ3-CG 4.02Å; W160-C187 PolarHBondContact NE1-SG 2.86Å
161L90Very high83.8Confident39 Ų3947.7 Ų47.720%0.20426%0.26CS..G310 helixtrans-61.6-25.1177.5-61.6177.2000112.5V158 D159 T163 L209V158-L161 HydrophobicContact CB-CD1 4.36Å; V158-L161 VanDerWaalsContact O-CB 3.3Å; V158-L161 WeakPolarHBondContact O-CB 3.45Å; V158-L161 WeakPolarHBondContact O-CG 3.3Å; V158-L161 PolarHBondContact O-N 2.73Å; D159-L161 PolarHBondContact O-N 3.2Å; L161-T163 VanDerWaalsContact C-N 3.32Å; L161-L209 HydrophobicContact CD1-CB 4.47Å; L161-L209 HydrophobicContact CD2-CB 4.17Å; L161-L209 HydrophobicContact CD2-CD2 3.95Å; L161-L209 HydrophobicContact CG-CD2 4.02Å
162A88Confident81.3Confident85 Ų8550.9 Ų50.970%0.70228%0.283SS*.G310 helixtrans-85-2.1177.400000113.8D159 W160D159-A162 WeakPolarHBondContact O-CB 3.45Å; D159-A162 PolarHBondContact O-N 3.26Å; D159-A162 VanDerWaalsContact O-N 3.1Å; W160-A162 PolarHBondContact O-N 2.9Å
163T88.5Confident78.8Confident3 Ų358.9 Ų58.92%0.01833%0.325CS..SBendtrans-103.8153.1-173.172.10000111.4M128 T129 W160 L161 F165 G166 N167M128-T163 HydrophobicContact CB-CG2 4.45Å; M128-T163 HydrophobicContact CE-CG2 3.5Å; M128-T163 HydrophobicContact CG-CG2 3.65Å; M128-T163 HydrophobicContact SD-CG2 3.98Å; T129-T163 HydrophobicContact CG2-CG2 4.15Å; W160-T163 HydrophobicContact CE3-CG2 4.07Å; W160-T163 WeakPolarHBondContact O-CB 3.44Å; W160-T163 PolarHBondContact O-N 3.43Å; W160-T163 PolarHBondContact O-OG1 2.86Å; L161-T163 VanDerWaalsContact C-N 3.32Å; T163-F165 PolarHBondContact O-N 3.33Å; T163-G166 PolarHBondContact O-N 3.16Å; T163-G166 PolarHBondContact OG1-N 2.86Å; T163-N167 WeakPolarHBondContact O-CB 3.29Å; T163-N167 PolarHBondContact O-N 2.9Å
164Y84.4Confident76.4Confident145 Ų14561.5 Ų61.557%0.56934%0.343SS*.THydrogen-bonded Turntrans-58.6-34.2171.1172-97.2000111.9F170Y164-F170 HydrophobicContact CD2-CB 3.94Å; Y164-F170 HydrophobicContact CD2-CD1 4.48Å; Y164-F170 AromaticContact CD2-CD2 3.77Å; Y164-F170 HydrophobicContact CD2-CD2 3.77Å; Y164-F170 HydrophobicContact CD2-CE2 4.42Å; Y164-F170 AromaticContact CD2-CG 3.8Å; Y164-F170 HydrophobicContact CD2-CG 3.8Å; Y164-F170 HydrophobicContact CE2-CB 3.84Å; Y164-F170 HydrophobicContact CE2-CG 4.12Å
165F87.6Confident73.9Confident33 Ų3368.8 Ų68.815%0.14539%0.388CS..THydrogen-bonded Turntrans-66.2-51.1177.7177-91.9000111.7Y132 W160 T163 R182 P184Y132-F165 HydrophobicContact CD1-CB 3.8Å; Y132-F165 HydrophobicContact CD1-CD1 4.17Å; Y132-F165 AromaticContact CD1-CD2 3.85Å; Y132-F165 HydrophobicContact CD1-CD2 3.85Å; Y132-F165 HydrophobicContact CD1-CE2 4.49Å; Y132-F165 AromaticContact CD1-CG 3.66Å; Y132-F165 HydrophobicContact CD1-CG 3.66Å; Y132-F165 HydrophobicContact CE1-CB 4.33Å; Y132-F165 AromaticContact CE1-CD1 3.89Å; Y132-F165 HydrophobicContact CE1-CD1 3.89Å; Y132-F165 AromaticContact CE1-CD2 3.63Å; Y132-F165 HydrophobicContact CE1-CD2 3.63Å; Y132-F165 HydrophobicContact CE1-CE1 4.09Å; Y132-F165 AromaticContact CE1-CE2 3.83Å; Y132-F165 HydrophobicContact CE1-CE2 3.83Å; Y132-F165 AromaticContact CE1-CG 3.67Å; Y132-F165 HydrophobicContact CE1-CG 3.67Å; Y132-F165 HydrophobicContact CE1-CZ 4.05Å; W160-F165 AromaticContact CE3-CD1 3.87Å; W160-F165 HydrophobicContact CE3-CD1 3.87Å; W160-F165 HydrophobicContact CZ3-CB 4.29Å; W160-F165 AromaticContact CZ3-CD1 3.92Å; W160-F165 HydrophobicContact CZ3-CD1 3.92Å; W160-F165 HydrophobicContact CZ3-CG 4.35Å; T163-F165 PolarHBondContact O-N 3.33Å; F165-R182 HydrophobicContact CD1-CG 4.35Å; F165-R182 HydrophobicContact CE1-CG 4.01Å; F165-R182 WeakPolarHBondContact O-CG 3.43Å; F165-R182 VanDerWaalsContact O-CZ 3.31Å; F165-R182 PolarHBondContact O-NE 3.17Å; F165-R182 PolarHBondContact O-NH2 3.24Å; F165-R182 VanDerWaalsContact O-NH2 3.09Å; F165-P184 HydrophobicContact CD1-CG 4.34Å; F165-P184 HydrophobicContact CE1-CG 3.82Å; F165-P184 HydrophobicContact CZ-CG 4.32Å
166G84.2Confident71.7Confident0 Ų066.5 Ų66.50%039%0.386CS..THydrogen-bonded Turntrans-75.7-29.9-173.500000113.7W160 T163 G181 R182W160-G166 WeakPolarHBondContact O-CA 3.49Å; T163-G166 PolarHBondContact O-N 3.16Å; T163-G166 PolarHBondContact OG1-N 2.86Å; G166-G181 CarbonylContact O-C 3.59Å; G166-G181 WeakPolarHBondContact O-CA 3.37Å; G166-R182 VanDerWaalsContact CA-O 3.25Å; G166-R182 WeakPolarHBondContact CA-O 3.04Å; G166-R182 PolarHBondContact O-N 2.96Å
167N75.6Confident69.7Low44 Ų4471.2 Ų71.224%0.23542%0.416CS..  trans-92.4111.4-180-166.2-15.7000111.8T163 Q169T163-N167 WeakPolarHBondContact O-CB 3.29Å; T163-N167 PolarHBondContact O-N 2.9Å; N167-Q169 PolarHBondContact O-N 3.4Å; N167-Q169 WeakPolarHBondContact OD1-CA 3.34Å; N167-Q169 WeakPolarHBondContact OD1-CB 3.35Å; N167-Q169 PolarHBondContact OD1-N 2.95Å
168K60Low68.1Low129 Ų12971.9 Ų71.956%0.56142%0.422SS*.THydrogen-bonded Turntrans-66.1-12.9173.2-81.2-170.9175.8-178.10113.5F170 D205K168-F170 PolarHBondContact O-N 3.35Å; K168-D205 IonicContact NZ-OD2 2.61Å; K168-D205 PolarHBondContact NZ-OD2 3.07Å
169Q53.8Low67.1Low53 Ų5374.5 Ų74.525%0.24843%0.431CS..THydrogen-bonded Turntrans-92.516.5-166.9-58.1-166.8-13.600116.5N167 G171 S172 S174N167-Q169 PolarHBondContact O-N 3.4Å; N167-Q169 WeakPolarHBondContact OD1-CA 3.34Å; N167-Q169 WeakPolarHBondContact OD1-CB 3.35Å; N167-Q169 PolarHBondContact OD1-N 2.95Å; Q169-G171 PolarHBondContact O-N 3.02Å; Q169-S172 PolarHBondContact O-N 3.34Å; Q169-S174 PolarHBondContact NE2-OG 3.11Å; Q169-S174 PolarHBondContact OE1-OG 2.96Å
170F51.3Low66.3Low171 Ų17175.2 Ų75.275%0.7544%0.437SS*.THydrogen-bonded Turntrans-62.26.7158.5-106.8-86.1000113.4Y164 K168Y164-F170 HydrophobicContact CD2-CB 3.94Å; Y164-F170 HydrophobicContact CD2-CD1 4.48Å; Y164-F170 AromaticContact CD2-CD2 3.77Å; Y164-F170 HydrophobicContact CD2-CD2 3.77Å; Y164-F170 HydrophobicContact CD2-CE2 4.42Å; Y164-F170 AromaticContact CD2-CG 3.8Å; Y164-F170 HydrophobicContact CD2-CG 3.8Å; Y164-F170 HydrophobicContact CE2-CB 3.84Å; Y164-F170 HydrophobicContact CE2-CG 4.12Å; K168-F170 PolarHBondContact O-N 3.35Å
171G42.2Very low65.7Low76 Ų7675.4 Ų75.478%0.78444%0.439SS*.THydrogen-bonded Turntrans-143.818.2168.100000116.9Q169Q169-G171 PolarHBondContact O-N 3.02Å
172S44.6Very low65.7Low68 Ų6877.3 Ų77.348%0.47644%0.443SS..  trans-135.6124.5177.8-168.10000112.1Q169 S174Q169-S172 PolarHBondContact O-N 3.34Å; S172-S174 PolarHBondContact O-N 2.94Å
173N45Very low65.9Low168 Ų16873.2 Ų73.290%0.89841%0.41SS*.  trans-67.851.9-175.9-72.9-20.7000114.3T175N173-T175 PolarHBondContact O-N 3.15Å
174S46.1Very low66.3Low54 Ų5473.2 Ų73.238%0.37841%0.409SS..  trans-93103.3178.8-31.60000109.5Q169 S172 G176Q169-S174 PolarHBondContact NE2-OG 3.11Å; Q169-S174 PolarHBondContact OE1-OG 2.96Å; S172-S174 PolarHBondContact O-N 2.94Å; S174-G176 VanDerWaalsContact C-N 3.35Å; S174-G176 PolarHBondContact O-N 3.23Å
175T42.7Very low66.8Low153 Ų15370.5 Ų70.594%0.93940%0.404SS*.  trans-77.280.6174.848.60000110.3N173N173-T175 PolarHBondContact O-N 3.15Å
176G51.5Low67.1Low43 Ų4370.5 Ų70.544%0.44341%0.407SS..SBendtrans-176.9156.117200000111.5S174 V178S174-G176 VanDerWaalsContact C-N 3.35Å; S174-G176 PolarHBondContact O-N 3.23Å; G176-V178 VanDerWaalsContact O-CG2 3.22Å; G176-V178 WeakPolarHBondContact O-CG2 3.12Å; G176-V178 PolarHBondContact O-N 3.07Å
177P54Low67.7Low127 Ų12770.5 Ų70.583%0.82541%0.407SS*.  trans-62.3103.6171.925.8-30.1000107.7E179P177-E179 PolarHBondContact O-N 2.88Å; P177-E179 VanDerWaalsContact O-N 3.13Å
178V59Low68.8Low36 Ų3668.9 Ų68.922%0.21840%0.399CS..  trans-81.4101.6-176.7-179.50000107.7G176 V180G176-V178 VanDerWaalsContact O-CG2 3.22Å; G176-V178 WeakPolarHBondContact O-CG2 3.12Å; G176-V178 PolarHBondContact O-N 3.07Å; V178-V180 HydrophobicContact CG1-CB 3.86Å; V178-V180 HydrophobicContact CG1-CG2 4.49Å; V178-V180 WeakPolarHBondContact CG1-O 3.3Å; V178-V180 PolarHBondContact O-N 3.33Å
179E72.1Confident70.5Confident107 Ų10763.9 Ų63.950%0.538%0.378SS..  trans-73.3-5.6174.9-59.6-173.4165.100112.4P177 P208 L209P177-E179 PolarHBondContact O-N 2.88Å; P177-E179 VanDerWaalsContact O-N 3.13Å; E179-P208 HydrophobicContact CB-CB 3.87Å; E179-P208 HydrophobicContact CB-CG 4.41Å; E179-P208 CarbonylContact O-C 3.56Å; E179-P208 WeakPolarHBondContact O-CA 3.27Å; E179-L209 WeakPolarHBondContact O-CB 3.41Å; E179-L209 PolarHBondContact O-N 2.84Å
180V77.3Confident72.6Confident46 Ų4665.3 Ų65.328%0.27939%0.392SS..  trans-90.6123-179.8-177.60000109.5V178 D205V178-V180 HydrophobicContact CG1-CB 3.86Å; V178-V180 HydrophobicContact CG1-CG2 4.49Å; V178-V180 WeakPolarHBondContact CG1-O 3.3Å; V178-V180 PolarHBondContact O-N 3.33Å; V180-D205 VanDerWaalsContact CG1-C 3.4Å; V180-D205 HydrophobicContact CG1-CB 4.4Å; V180-D205 WeakPolarHBondContact CG1-O 3.34Å
181G81.1Confident74.7Confident4 Ų461.3 Ų61.34%0.04138%0.378CS..  trans-173.5167.5177.600000112.5G166 F204G166-G181 CarbonylContact O-C 3.59Å; G166-G181 WeakPolarHBondContact O-CA 3.37Å; G181-F204 VanDerWaalsContact O-O 3.05Å
182R89.7Confident77.3Confident78 Ų7857.7 Ų57.729%0.29434%0.34SS..  trans-98.9155.6-17662.4177.2-173-175.6-0.9112.1F165 G166 G201F165-R182 HydrophobicContact CD1-CG 4.35Å; F165-R182 HydrophobicContact CE1-CG 4.01Å; F165-R182 WeakPolarHBondContact O-CG 3.43Å; F165-R182 VanDerWaalsContact O-CZ 3.31Å; F165-R182 PolarHBondContact O-NE 3.17Å; F165-R182 PolarHBondContact O-NH2 3.24Å; F165-R182 VanDerWaalsContact O-NH2 3.09Å; G166-R182 VanDerWaalsContact CA-O 3.25Å; G166-R182 WeakPolarHBondContact CA-O 3.04Å; G166-R182 PolarHBondContact O-N 2.96Å; R182-G201 WeakPolarHBondContact CA-O 3.46Å; R182-G201 WeakPolarHBondContact CB-O 3.5Å
183V94Very high79.7Confident0 Ų058.3 Ų58.30%034%0.338CS..  trans-118.6157.7166.9-57.10000109.6W160 C187 G201 L209 V216W160-V183 HydrophobicContact CB-CG1 4.03Å; W160-V183 VanDerWaalsContact CD1-CG1 3.47Å; W160-V183 HydrophobicContact CG-CB 4.32Å; W160-V183 HydrophobicContact CG-CG1 3.9Å; V183-C187 HydrophobicContact CB-CB 3.95Å; V183-C187 HydrophobicContact CG2-CB 3.71Å; V183-G201 PolarHBondContact N-O 2.86Å; V183-G201 VanDerWaalsContact N-O 3.13Å; V183-G201 CarbonylContact O-C 3.21Å; V183-G201 WeakPolarHBondContact O-CA 3.3Å; V183-L209 HydrophobicContact CG1-CD1 4.05Å; V183-L209 HydrophobicContact CG1-CD2 3.83Å; V183-V216 HydrophobicContact CG2-CG1 3.87Å
184P94.9Very high82.1Confident2 Ų256.2 Ų56.21%0.01333%0.326CS..  trans-58.3155.2171.2-29.840000112.9Y132 W160 F165 T186 C187Y132-P184 HydrophobicContact CE1-CG 3.68Å; Y132-P184 HydrophobicContact CE2-CG 4.18Å; Y132-P184 WeakPolarHBondContact OH-CB 3.03Å; Y132-P184 WeakPolarHBondContact OH-CG 3.32Å; W160-P184 HydrophobicContact CD2-CG 4.33Å; W160-P184 HydrophobicContact CE3-CG 4.41Å; W160-P184 HydrophobicContact CH2-CG 3.45Å; W160-P184 VanDerWaalsContact CH2-CG 3.45Å; W160-P184 HydrophobicContact CZ2-CG 3.29Å; W160-P184 HydrophobicContact CZ3-CG 4.02Å; F165-P184 HydrophobicContact CD1-CG 4.34Å; F165-P184 HydrophobicContact CE1-CG 3.82Å; F165-P184 HydrophobicContact CZ-CG 4.32Å; P184-T186 WeakPolarHBondContact CB-OG1 3.4Å; P184-T186 PolarHBondContact O-N 3Å; P184-C187 WeakPolarHBondContact O-CB 2.91Å; P184-C187 PolarHBondContact O-N 2.89Å
185L95.2Very high84.4Confident89 Ų8959.9 Ų59.947%0.46634%0.338SS..G310 helixtrans-57.9-31.2174.7-175.866.1000112C187 C188 L193 C200L185-C187 PolarHBondContact O-N 2.84Å; L185-C188 VanDerWaalsContact O-CB 3.26Å; L185-C188 WeakPolarHBondContact O-CB 3.03Å; L185-C188 PolarHBondContact O-N 3.41Å; L185-C188 VanDerWaalsContact O-N 3.07Å; L185-L193 HydrophobicContact CD1-CD2 3.66Å; L185-L193 HydrophobicContact CG-CD2 4.26Å; L185-C200 HydrophobicContact CD1-CB 4.03Å
186T95.6Very high86.8Confident33 Ų3355.2 Ų55.220%0.20230%0.303CS..G310 helixtrans-67.8-16.1178.149.50000114.2D143 Q146 A147 P184 C188D143-T186 HydrophobicContact CB-CG2 3.58Å; D143-T186 PolarHBondContact OD1-OG1 3.43Å; Q146-T186 PolarHBondContact OE1-OG1 3.31Å; A147-T186 HydrophobicContact CB-CG2 4.25Å; P184-T186 WeakPolarHBondContact CB-OG1 3.4Å; P184-T186 PolarHBondContact O-N 3Å; T186-C188 VanDerWaalsContact C-N 3.33Å
187C96.6Very high88.7Confident0 Ų061.2 Ų61.20%032%0.317CS..G310 helixtrans-76.7-19.1169.9-810000113.7Q146 C152 W160 V183 P184 L185 V216 N217Q146-C187 VanDerWaalsContact CD-SG 3.51Å; Q146-C187 PolarHBondContact NE2-SG 3.1Å; C152-C187 VanDerWaalsContact CA-SG 3.56Å; C152-C187 HydrophobicContact CB-CB 3.65Å; C152-C187 WeakPolarHBondContact CB-SG 3.23Å; C152-C187 WeakPolarHBondContact SG-CB 3.39Å; C152-C187 CovalentContact SG-SG 2.03Å; C152-C187 PolarHBondContact SG-SG 3.33Å; W160-C187 PolarHBondContact NE1-SG 2.86Å; V183-C187 HydrophobicContact CB-CB 3.95Å; V183-C187 HydrophobicContact CG2-CB 3.71Å; P184-C187 WeakPolarHBondContact O-CB 2.91Å; P184-C187 PolarHBondContact O-N 2.89Å; L185-C187 PolarHBondContact O-N 2.84Å; C187-V216 WeakPolarHBondContact O-CA 2.93Å; C187-N217 PolarHBondContact O-N 2.96Å; C187-N217 PolarHBondContact O-ND2 2.92Å
188C97.3Very high90.3Very high10 Ų1058.4 Ų58.47%0.06831%0.311CS..BIsolated β-bridgetrans-70.9137.6-173.2-70.30000112.2L185 T186 L193 C200L185-C188 VanDerWaalsContact O-CB 3.26Å; L185-C188 WeakPolarHBondContact O-CB 3.03Å; L185-C188 PolarHBondContact O-N 3.41Å; L185-C188 VanDerWaalsContact O-N 3.07Å; T186-C188 VanDerWaalsContact C-N 3.33Å; C188-L193 HydrophobicContact CB-CD2 3.7Å; C188-L193 HydrophobicContact CB-CG 3.89Å; C188-C200 HydrophobicContact CB-CB 3.86Å; C188-C200 WeakPolarHBondContact CB-SG 3.46Å; C188-C200 WeakPolarHBondContact SG-CB 3.34Å; C188-C200 CovalentContact SG-SG 2.02Å; C188-C200 PolarHBondContact SG-SG 2.89Å
189N97Very high91.9Very high23 Ų2359.7 Ų59.712%0.12332%0.319CS..  trans-86.1172.717372.828.4000110I191 G192 L193 L214 Y215 V216N189-I191 PolarHBondContact O-N 2.96Å; N189-I191 VanDerWaalsContact O-N 3.15Å; N189-I191 WeakPolarHBondContact OD1-CA 3.23Å; N189-I191 WeakPolarHBondContact OD1-CB 3.37Å; N189-I191 PolarHBondContact OD1-N 3.28Å; N189-G192 PolarHBondContact O-N 2.86Å; N189-G192 VanDerWaalsContact O-N 3.11Å; N189-G192 PolarHBondContact OD1-N 3.41Å; N189-L193 WeakPolarHBondContact O-CG 3.39Å; N189-L193 PolarHBondContact O-N 3.43Å; N189-L214 PolarHBondContact ND2-O 2.8Å; N189-Y215 VanDerWaalsContact CG-C 3.47Å; N189-Y215 PolarHBondContact N-O 2.95Å; N189-Y215 PolarHBondContact OD1-O 2.67Å; N189-V216 PolarHBondContact ND2-N 3.44Å; N189-V216 PolarHBondContact ND2-O 2.93Å; N189-V216 VanDerWaalsContact ND2-O 3.14Å
190P96.3Very high93Very high84 Ų8454.6 Ų54.655%0.54530%0.295SS..Hα-helixtrans-56.2-31.8-179.2-28.536.8000114.5L194P190-L194 VanDerWaalsContact O-CG 3.23Å; P190-L194 WeakPolarHBondContact O-CG 3.44Å; P190-L194 PolarHBondContact O-N 3.32Å
191I96.7Very high93.8Very high86 Ų8652.4 Ų52.444%0.44128%0.282SS..Hα-helixtrans-69-47.9177.4-55.5175.1000109.8N189 L193 L194 E195 L214 Y215N189-I191 PolarHBondContact O-N 2.96Å; N189-I191 VanDerWaalsContact O-N 3.15Å; N189-I191 WeakPolarHBondContact OD1-CA 3.23Å; N189-I191 WeakPolarHBondContact OD1-CB 3.37Å; N189-I191 PolarHBondContact OD1-N 3.28Å; I191-L193 VanDerWaalsContact C-N 3.33Å; I191-L193 PolarHBondContact O-N 3.14Å; I191-L194 PolarHBondContact O-N 3.32Å; I191-L194 VanDerWaalsContact O-N 3.12Å; I191-E195 PolarHBondContact O-N 3.36Å; I191-L214 HydrophobicContact CD1-CD1 4.44Å; I191-Y215 HydrophobicContact CG2-CD1 3.99Å; I191-Y215 HydrophobicContact CG2-CE1 4.14Å
192G96Very high94.2Very high0 Ų055 Ų550%030%0.297CS..Hα-helixtrans-60.7-39.9178.100000113.4N189 L194 Y196 C200 Y215N189-G192 PolarHBondContact O-N 2.86Å; N189-G192 VanDerWaalsContact O-N 3.11Å; N189-G192 PolarHBondContact OD1-N 3.41Å; G192-L194 VanDerWaalsContact C-N 3.27Å; G192-L194 PolarHBondContact O-N 3.37Å; G192-Y196 WeakPolarHBondContact O-CB 3.43Å; G192-Y196 PolarHBondContact O-N 2.91Å; G192-C200 VanDerWaalsContact C-SG 3.53Å; G192-C200 WeakPolarHBondContact O-CB 3.28Å; G192-Y215 WeakPolarHBondContact CA-O 3.49Å
193L95.6Very high94.2Very high81 Ų8152.9 Ų52.942%0.42429%0.294SS..Hα-helixtrans-66.5-27.7176.3-66.3175.8000113.2L185 C188 N189 I191 C200L185-L193 HydrophobicContact CD1-CD2 3.66Å; L185-L193 HydrophobicContact CG-CD2 4.26Å; C188-L193 HydrophobicContact CB-CD2 3.7Å; C188-L193 HydrophobicContact CB-CG 3.89Å; N189-L193 WeakPolarHBondContact O-CG 3.39Å; N189-L193 PolarHBondContact O-N 3.43Å; I191-L193 VanDerWaalsContact C-N 3.33Å; I191-L193 PolarHBondContact O-N 3.14Å; L193-C200 HydrophobicContact CD2-CB 4.43Å
194L95.9Very high94Very high124 Ų12452.9 Ų52.965%0.64929%0.294SS*.Hα-helixtrans-81.8-42.3177.3-73171.9000112.5P190 I191 G192 K197P190-L194 VanDerWaalsContact O-CG 3.23Å; P190-L194 WeakPolarHBondContact O-CG 3.44Å; P190-L194 PolarHBondContact O-N 3.32Å; I191-L194 PolarHBondContact O-N 3.32Å; I191-L194 VanDerWaalsContact O-N 3.12Å; G192-L194 VanDerWaalsContact C-N 3.27Å; G192-L194 PolarHBondContact O-N 3.37Å; L194-K197 WeakPolarHBondContact O-CE 3.26Å; L194-K197 WeakPolarHBondContact O-CG 3.35Å
195E94.7Very high93.4Very high132 Ų13255.7 Ų55.762%0.61731%0.309SS*.Hα-helixtrans-76.3-43.4-177.1-164.568.3-165.700111.5I191 Y215I191-E195 PolarHBondContact O-N 3.36Å; E195-Y215 HydrophobicContact CB-CD1 4.36Å; E195-Y215 HydrophobicContact CB-CE1 4.18Å; E195-Y215 HydrophobicContact CG-CE1 4.08Å
196Y93Very high92.8Very high55 Ų5557.6 Ų57.622%0.21632%0.319CS..SBendtrans-110.165.9-177.9-62.5-91.1000111.1G192 G198 T199 C200 F204 Y215G192-Y196 WeakPolarHBondContact O-CB 3.43Å; G192-Y196 PolarHBondContact O-N 2.91Å; Y196-G198 PolarHBondContact O-N 2.77Å; Y196-T199 PolarHBondContact O-N 3.05Å; Y196-C200 PolarHBondContact O-N 2.85Å; Y196-F204 AromaticContact CD1-CE1 3.97Å; Y196-F204 HydrophobicContact CD1-CE1 3.97Å; Y196-F204 AromaticContact CD2-CE1 3.82Å; Y196-F204 HydrophobicContact CD2-CE1 3.82Å; Y196-F204 HydrophobicContact CD2-CZ 4.15Å; Y196-F204 HydrophobicContact CE1-CD1 4.47Å; Y196-F204 AromaticContact CE1-CE1 3.93Å; Y196-F204 HydrophobicContact CE1-CE1 3.93Å; Y196-F204 AromaticContact CE2-CE1 3.79Å; Y196-F204 HydrophobicContact CE2-CE1 3.79Å; Y196-F204 HydrophobicContact CE2-CZ 4.25Å; Y196-F204 AromaticContact CG-CE1 3.92Å; Y196-F204 HydrophobicContact CG-CE1 3.92Å; Y196-F204 AromaticContact CZ-CE1 3.84Å; Y196-Y215 HydrophobicContact CD2-CD1 4.36Å; Y196-Y215 HydrophobicContact CD2-CG 4.26Å; Y196-Y215 AromaticContact CE2-CD1 3.99Å; Y196-Y215 HydrophobicContact CE2-CD1 3.99Å; Y196-Y215 AromaticContact CE2-CD2 3.7Å; Y196-Y215 HydrophobicContact CE2-CD2 3.7Å; Y196-Y215 HydrophobicContact CE2-CE1 4.11Å; Y196-Y215 AromaticContact CE2-CE2 3.83Å; Y196-Y215 HydrophobicContact CE2-CE2 3.83Å; Y196-Y215 AromaticContact CE2-CG 3.78Å; Y196-Y215 HydrophobicContact CE2-CG 3.78Å
197K91.2Very high92.3Very high169 Ų16959.9 Ų59.974%0.73533%0.33SS*.THydrogen-bonded Turntrans-57.4106.1-174.6-66.7-176.6-178.9174.80112.4L194 T199L194-K197 WeakPolarHBondContact O-CE 3.26Å; L194-K197 WeakPolarHBondContact O-CG 3.35Å; K197-T199 VanDerWaalsContact C-N 3.25Å; K197-T199 PolarHBondContact O-N 2.92Å
198G87.8Confident91.9Very high67 Ų6762 Ų6269%0.69135%0.345SS*.THydrogen-bonded Turntrans80.4-4.6179.300000115.2Y196Y196-G198 PolarHBondContact O-N 2.77Å
199T92.9Very high91.6Very high63 Ų6361.6 Ų61.639%0.38734%0.342SS..THydrogen-bonded Turntrans-124.82.1-178.366.10000113.6Y196 K197 G201 T202 S203Y196-T199 PolarHBondContact O-N 3.05Å; K197-T199 VanDerWaalsContact C-N 3.25Å; K197-T199 PolarHBondContact O-N 2.92Å; T199-G201 PolarHBondContact O-N 3.27Å; T199-T202 PolarHBondContact O-N 3.26Å; T199-T202 VanDerWaalsContact O-N 3.14Å; T199-T202 PolarHBondContact O-OG1 3.15Å; T199-T202 VanDerWaalsContact O-OG1 3.08Å; T199-S203 PolarHBondContact O-N 3.42Å; T199-S203 PolarHBondContact O-OG 3.18Å; T199-S203 VanDerWaalsContact O-OG 3.07Å; T199-S203 PolarHBondContact OG1-OG 3.24Å
200C94.9Very high91.3Very high0 Ų064.2 Ų64.20%036%0.359CS..THydrogen-bonded Turntrans-54.1133178-175.10000111.2L185 C188 G192 L193 Y196 T202L185-C200 HydrophobicContact CD1-CB 4.03Å; C188-C200 HydrophobicContact CB-CB 3.86Å; C188-C200 WeakPolarHBondContact CB-SG 3.46Å; C188-C200 WeakPolarHBondContact SG-CB 3.34Å; C188-C200 CovalentContact SG-SG 2.02Å; C188-C200 PolarHBondContact SG-SG 2.89Å; G192-C200 VanDerWaalsContact C-SG 3.53Å; G192-C200 WeakPolarHBondContact O-CB 3.28Å; L193-C200 HydrophobicContact CD2-CB 4.43Å; Y196-C200 PolarHBondContact O-N 2.85Å; C200-T202 PolarHBondContact O-N 3.49Å
201G93.2Very high91.1Very high0 Ų063.3 Ų63.30%035%0.354CS..THydrogen-bonded Turntrans80.4-43.2-176.900000113.7R182 V183 T199R182-G201 WeakPolarHBondContact CA-O 3.46Å; R182-G201 WeakPolarHBondContact CB-O 3.5Å; V183-G201 PolarHBondContact N-O 2.86Å; V183-G201 VanDerWaalsContact N-O 3.13Å; V183-G201 CarbonylContact O-C 3.21Å; V183-G201 WeakPolarHBondContact O-CA 3.3Å; T199-G201 PolarHBondContact O-N 3.27Å
202T90.4Very high90.9Very high59 Ų5959.8 Ų59.836%0.36234%0.335SS..THydrogen-bonded Turntrans-80.1-24.5-175.959.30000114T199 C200T199-T202 PolarHBondContact O-N 3.26Å; T199-T202 VanDerWaalsContact O-N 3.14Å; T199-T202 PolarHBondContact O-OG1 3.15Å; T199-T202 VanDerWaalsContact O-OG1 3.08Å; C200-T202 PolarHBondContact O-N 3.49Å
203S89.2Confident90.9Very high34 Ų3461.2 Ų61.224%0.23835%0.347CS..THydrogen-bonded Turntrans-97.118.6174.469.30000114.1T199 D205T199-S203 PolarHBondContact O-N 3.42Å; T199-S203 PolarHBondContact O-OG 3.18Å; T199-S203 VanDerWaalsContact O-OG 3.07Å; T199-S203 PolarHBondContact OG1-OG 3.24Å; S203-D205 VanDerWaalsContact C-OD1 3.28Å; S203-D205 PolarHBondContact O-N 2.98Å
204F89.8Confident90.8Very high0 Ų062.5 Ų62.50%035%0.354CS..  trans-88.947.8-179.9-66.1-8.4000111.6G181 Y196 L209 Y212 V216G181-F204 VanDerWaalsContact O-O 3.05Å; Y196-F204 AromaticContact CD1-CE1 3.97Å; Y196-F204 HydrophobicContact CD1-CE1 3.97Å; Y196-F204 AromaticContact CD2-CE1 3.82Å; Y196-F204 HydrophobicContact CD2-CE1 3.82Å; Y196-F204 HydrophobicContact CD2-CZ 4.15Å; Y196-F204 HydrophobicContact CE1-CD1 4.47Å; Y196-F204 AromaticContact CE1-CE1 3.93Å; Y196-F204 HydrophobicContact CE1-CE1 3.93Å; Y196-F204 AromaticContact CE2-CE1 3.79Å; Y196-F204 HydrophobicContact CE2-CE1 3.79Å; Y196-F204 HydrophobicContact CE2-CZ 4.25Å; Y196-F204 AromaticContact CG-CE1 3.92Å; Y196-F204 HydrophobicContact CG-CE1 3.92Å; Y196-F204 AromaticContact CZ-CE1 3.84Å; F204-L209 HydrophobicContact CB-CD1 4.28Å; F204-L209 HydrophobicContact CD2-CD1 4Å; F204-Y212 HydrophobicContact CB-CD2 3.56Å; F204-Y212 HydrophobicContact CB-CE2 3.67Å; F204-Y212 HydrophobicContact CB-CG 4.04Å; F204-Y212 AromaticContact CD1-CD1 3.55Å; F204-Y212 HydrophobicContact CD1-CD1 3.55Å; F204-Y212 HydrophobicContact CD1-CD2 4.1Å; F204-Y212 AromaticContact CD1-CE1 3.78Å; F204-Y212 HydrophobicContact CD1-CE1 3.78Å; F204-Y212 HydrophobicContact CD1-CE2 4.27Å; F204-Y212 AromaticContact CD1-CG 3.73Å; F204-Y212 HydrophobicContact CD1-CG 3.73Å; F204-Y212 HydrophobicContact CD2-CD1 4.35Å; F204-Y212 HydrophobicContact CD2-CD2 4.04Å; F204-Y212 AromaticContact CD2-CG 3.75Å; F204-Y212 HydrophobicContact CD2-CG 3.75Å; F204-Y212 AromaticContact CE1-CD1 3.71Å; F204-Y212 HydrophobicContact CE1-CD1 3.71Å; F204-Y212 HydrophobicContact CE1-CE1 4.2Å; F204-Y212 HydrophobicContact CE1-CG 4.09Å; F204-Y212 HydrophobicContact CE2-CD1 4.48Å; F204-Y212 HydrophobicContact CE2-CG 4.11Å; F204-Y212 AromaticContact CG-CD1 3.92Å; F204-Y212 HydrophobicContact CG-CD1 3.92Å; F204-Y212 AromaticContact CG-CD2 3.64Å; F204-Y212 HydrophobicContact CG-CD2 3.64Å; F204-Y212 HydrophobicContact CG-CE1 4.32Å; F204-Y212 HydrophobicContact CG-CE2 4.05Å; F204-Y212 AromaticContact CG-CG 3.56Å; F204-Y212 HydrophobicContact CG-CG 3.56Å; F204-Y212 HydrophobicContact CZ-CD1 4.18Å; F204-Y212 HydrophobicContact CZ-CG 4.27Å; F204-V216 HydrophobicContact CD2-CG1 4.46Å; F204-V216 HydrophobicContact CE2-CG1 3.68Å
205D81.7Confident90.9Very high61 Ų6158.9 Ų58.933%0.32633%0.332SS..  trans-110.2-0-172.656.9-25.3000114.7K168 V180 S203K168-D205 IonicContact NZ-OD2 2.61Å; K168-D205 PolarHBondContact NZ-OD2 3.07Å; V180-D205 VanDerWaalsContact CG1-C 3.4Å; V180-D205 HydrophobicContact CG1-CB 4.4Å; V180-D205 WeakPolarHBondContact CG1-O 3.34Å; S203-D205 VanDerWaalsContact C-OD1 3.28Å; S203-D205 PolarHBondContact O-N 2.98Å
206D83.2Confident91Very high128 Ų12852.8 Ų52.868%0.68430%0.303SS*.SBendtrans-93.1-23.5178.9-66.9-36.5000114.1
207N85.5Confident91.2Very high81 Ų8151.4 Ų51.443%0.43330%0.3SS..SBendtrans-139.8160.6-172.3-66.7-71.5000110.6L209 S211 Y212N207-L209 PolarHBondContact O-N 2.91Å; N207-S211 VanDerWaalsContact CB-OG 3.22Å; N207-S211 WeakPolarHBondContact CB-OG 3.02Å; N207-Y212 HydrophobicContact CB-CE2 3.88Å; N207-Y212 PolarHBondContact ND2-OH 3.41Å
208P88.8Confident91.4Very high46 Ų4647 Ų4730%0.29929%0.287SS..  trans-49.1136.8170.9-28.736.4000111.2E179 T210 S211E179-P208 HydrophobicContact CB-CB 3.87Å; E179-P208 HydrophobicContact CB-CG 4.41Å; E179-P208 CarbonylContact O-C 3.56Å; E179-P208 WeakPolarHBondContact O-CA 3.27Å; P208-T210 PolarHBondContact O-N 3.37Å; P208-S211 VanDerWaalsContact O-CB 3.31Å; P208-S211 WeakPolarHBondContact O-CB 3.3Å; P208-S211 PolarHBondContact O-N 3.44Å; P208-S211 PolarHBondContact O-OG 2.78Å
209L90Very high91.7Very high1 Ų145.4 Ų45.41%0.00527%0.271CS..G310 helixtrans-56.9-27.6-174.9-17856.2000112.1Y157 L161 E179 V183 F204 N207 S211 Y212Y157-L209 HydrophobicContact CD2-CD1 4.29Å; Y157-L209 HydrophobicContact CD2-CD2 3.94Å; Y157-L209 HydrophobicContact CD2-CG 3.7Å; Y157-L209 HydrophobicContact CE2-CD2 4.44Å; Y157-L209 HydrophobicContact CE2-CG 3.84Å; Y157-L209 WeakPolarHBondContact CE2-O 3.37Å; L161-L209 HydrophobicContact CD1-CB 4.47Å; L161-L209 HydrophobicContact CD2-CB 4.17Å; L161-L209 HydrophobicContact CD2-CD2 3.95Å; L161-L209 HydrophobicContact CG-CD2 4.02Å; E179-L209 WeakPolarHBondContact O-CB 3.41Å; E179-L209 PolarHBondContact O-N 2.84Å; V183-L209 HydrophobicContact CG1-CD1 4.05Å; V183-L209 HydrophobicContact CG1-CD2 3.83Å; F204-L209 HydrophobicContact CB-CD1 4.28Å; F204-L209 HydrophobicContact CD2-CD1 4Å; N207-L209 PolarHBondContact O-N 2.91Å; L209-S211 PolarHBondContact O-N 3.46Å; L209-Y212 PolarHBondContact O-N 2.91Å
210T90.5Very high91.9Very high78 Ų7842.8 Ų42.848%0.47926%0.256SS..G310 helixtrans-59.3-29.6173.753.30000114.2Y157 V158 P208 Y212 A213Y157-T210 WeakPolarHBondContact OH-CA 3.27Å; V158-T210 HydrophobicContact CG1-CG2 4.34Å; P208-T210 PolarHBondContact O-N 3.37Å; T210-Y212 PolarHBondContact O-N 3.49Å; T210-A213 WeakPolarHBondContact O-CB 3.47Å; T210-A213 PolarHBondContact O-N 3.06Å
211S92.3Very high92Very high64 Ų6442.8 Ų42.845%0.44826%0.256SS..G310 helixtrans-66.8-21.4174.968.30000113N207 P208 L209N207-S211 VanDerWaalsContact CB-OG 3.22Å; N207-S211 WeakPolarHBondContact CB-OG 3.02Å; P208-S211 VanDerWaalsContact O-CB 3.31Å; P208-S211 WeakPolarHBondContact O-CB 3.3Å; P208-S211 PolarHBondContact O-N 3.44Å; P208-S211 PolarHBondContact O-OG 2.78Å; L209-S211 PolarHBondContact O-N 3.46Å
212Y92.9Very high92.2Very high13 Ų1343 Ų435%0.05126%0.258CS..G310 helixtrans-97.89.5179.8-57.4-73.9000113.6F204 N207 L209 T210 L214 Y215F204-Y212 HydrophobicContact CB-CD2 3.56Å; F204-Y212 HydrophobicContact CB-CE2 3.67Å; F204-Y212 HydrophobicContact CB-CG 4.04Å; F204-Y212 AromaticContact CD1-CD1 3.55Å; F204-Y212 HydrophobicContact CD1-CD1 3.55Å; F204-Y212 HydrophobicContact CD1-CD2 4.1Å; F204-Y212 AromaticContact CD1-CE1 3.78Å; F204-Y212 HydrophobicContact CD1-CE1 3.78Å; F204-Y212 HydrophobicContact CD1-CE2 4.27Å; F204-Y212 AromaticContact CD1-CG 3.73Å; F204-Y212 HydrophobicContact CD1-CG 3.73Å; F204-Y212 HydrophobicContact CD2-CD1 4.35Å; F204-Y212 HydrophobicContact CD2-CD2 4.04Å; F204-Y212 AromaticContact CD2-CG 3.75Å; F204-Y212 HydrophobicContact CD2-CG 3.75Å; F204-Y212 AromaticContact CE1-CD1 3.71Å; F204-Y212 HydrophobicContact CE1-CD1 3.71Å; F204-Y212 HydrophobicContact CE1-CE1 4.2Å; F204-Y212 HydrophobicContact CE1-CG 4.09Å; F204-Y212 HydrophobicContact CE2-CD1 4.48Å; F204-Y212 HydrophobicContact CE2-CG 4.11Å; F204-Y212 AromaticContact CG-CD1 3.92Å; F204-Y212 HydrophobicContact CG-CD1 3.92Å; F204-Y212 AromaticContact CG-CD2 3.64Å; F204-Y212 HydrophobicContact CG-CD2 3.64Å; F204-Y212 HydrophobicContact CG-CE1 4.32Å; F204-Y212 HydrophobicContact CG-CE2 4.05Å; F204-Y212 AromaticContact CG-CG 3.56Å; F204-Y212 HydrophobicContact CG-CG 3.56Å; F204-Y212 HydrophobicContact CZ-CD1 4.18Å; F204-Y212 HydrophobicContact CZ-CG 4.27Å; N207-Y212 HydrophobicContact CB-CE2 3.88Å; N207-Y212 PolarHBondContact ND2-OH 3.41Å; L209-Y212 PolarHBondContact O-N 2.91Å; T210-Y212 PolarHBondContact O-N 3.49Å; Y212-L214 PolarHBondContact O-N 3.43Å; Y212-Y215 HydrophobicContact CD1-CD2 4.04Å; Y212-Y215 HydrophobicContact CD1-CE2 4.3Å; Y212-Y215 PolarHBondContact O-N 3.43Å
213A94.8Very high92.5Very high30 Ų3044.4 Ų44.425%0.24826%0.263CS..G310 helixtrans-53.9-29.6-178.400000113.9T210 Y215 T218T210-A213 WeakPolarHBondContact O-CB 3.47Å; T210-A213 PolarHBondContact O-N 3.06Å; A213-Y215 PolarHBondContact O-N 2.95Å; A213-T218 HydrophobicContact CB-CG2 4.03Å; A213-T218 WeakPolarHBondContact O-CG2 3.48Å
214L95.2Very high92.8Very high108 Ų10846 Ų4657%0.56527%0.266SS*.G310 helixtrans-67-23.1177.3-175.663.5000113.4N189 I191 Y212N189-L214 PolarHBondContact ND2-O 2.8Å; I191-L214 HydrophobicContact CD1-CD1 4.44Å; Y212-L214 PolarHBondContact O-N 3.43Å
215Y96.2Very high93.1Very high48 Ų4847.3 Ų47.319%0.18827%0.273CS..G310 helixtrans-102.3-5.4-172-53.7-63.7000113.2N189 I191 G192 E195 Y196 Y212 A213N189-Y215 VanDerWaalsContact CG-C 3.47Å; N189-Y215 PolarHBondContact N-O 2.95Å; N189-Y215 PolarHBondContact OD1-O 2.67Å; I191-Y215 HydrophobicContact CG2-CD1 3.99Å; I191-Y215 HydrophobicContact CG2-CE1 4.14Å; G192-Y215 WeakPolarHBondContact CA-O 3.49Å; E195-Y215 HydrophobicContact CB-CD1 4.36Å; E195-Y215 HydrophobicContact CB-CE1 4.18Å; E195-Y215 HydrophobicContact CG-CE1 4.08Å; Y196-Y215 HydrophobicContact CD2-CD1 4.36Å; Y196-Y215 HydrophobicContact CD2-CG 4.26Å; Y196-Y215 AromaticContact CE2-CD1 3.99Å; Y196-Y215 HydrophobicContact CE2-CD1 3.99Å; Y196-Y215 AromaticContact CE2-CD2 3.7Å; Y196-Y215 HydrophobicContact CE2-CD2 3.7Å; Y196-Y215 HydrophobicContact CE2-CE1 4.11Å; Y196-Y215 AromaticContact CE2-CE2 3.83Å; Y196-Y215 HydrophobicContact CE2-CE2 3.83Å; Y196-Y215 AromaticContact CE2-CG 3.78Å; Y196-Y215 HydrophobicContact CE2-CG 3.78Å; Y212-Y215 HydrophobicContact CD1-CD2 4.04Å; Y212-Y215 HydrophobicContact CD1-CE2 4.3Å; Y212-Y215 PolarHBondContact O-N 3.43Å; A213-Y215 PolarHBondContact O-N 2.95Å
216V96.9Very high93.7Very high3 Ų344.7 Ų44.72%0.01826%0.26CS..BIsolated β-bridgetrans-123160.9-178.5-59.50000111.3Y157 V183 C187 N189 F204 T218Y157-V216 HydrophobicContact CD1-CG2 4.35Å; Y157-V216 HydrophobicContact CD2-CG2 3.93Å; Y157-V216 HydrophobicContact CE2-CG2 4.47Å; Y157-V216 HydrophobicContact CG-CG2 3.86Å; V183-V216 HydrophobicContact CG2-CG1 3.87Å; C187-V216 WeakPolarHBondContact O-CA 2.93Å; N189-V216 PolarHBondContact ND2-N 3.44Å; N189-V216 PolarHBondContact ND2-O 2.93Å; N189-V216 VanDerWaalsContact ND2-O 3.14Å; F204-V216 HydrophobicContact CD2-CG1 4.46Å; F204-V216 HydrophobicContact CE2-CG1 3.68Å; V216-T218 PolarHBondContact O-N 2.88Å
217N97.3Very high94.2Very high26 Ų2644.5 Ų44.514%0.13926%0.255CS..  trans-74.5111.3167.6-64.4-54000108.8Q150 C152 C187Q150-N217 VanDerWaalsContact C-CG 3.44Å; Q150-N217 WeakPolarHBondContact O-CB 3.22Å; C152-N217 WeakPolarHBondContact CB-O 2.95Å; C187-N217 PolarHBondContact O-N 2.96Å; C187-N217 PolarHBondContact O-ND2 2.92Å
218T96Very high94.6Very high76 Ų7643.7 Ų43.747%0.46625%0.25SC..  trans-78.2-23-17353.80000114.1Y157 A213 V216Y157-T218 HydrophobicContact CD1-CG2 4.11Å; Y157-T218 HydrophobicContact CE1-CG2 3.88Å; A213-T218 HydrophobicContact CB-CG2 4.03Å; A213-T218 WeakPolarHBondContact O-CG2 3.48Å; V216-T218 PolarHBondContact O-N 2.88Å
219G94.8Very high94.7Very high35 Ų3545 Ų4536%0.36125%0.254SS..BIsolated β-bridgetrans-74.5139179.100000112.8C151 C152C151-G219 CarbonylContact C-O 3.5Å; C151-G219 VanDerWaalsContact CA-O 3.26Å; C151-G219 WeakPolarHBondContact CA-O 3.12Å; C151-G219 VanDerWaalsContact CB-O 3.25Å; C151-G219 WeakPolarHBondContact CB-O 3.38Å; C152-G219 PolarHBondContact N-O 3.4Å
220G96.4Very high94.7Very high7 Ų748.7 Ų48.77%0.07227%0.268CS..  trans-66.1152.5175.100000113.8V154 N155V154-G220 CarbonylContact O-C 3.06Å; V154-G220 WeakPolarHBondContact O-CA 3.26Å; N155-G220 WeakPolarHBondContact O-CA 3.37Å; N155-G220 PolarHBondContact O-N 3.39Å
221C97.9Very high94.7Very high0 Ų050.2 Ų50.20%027%0.27CS..Hα-helixtrans-79.8-23.8178.3-660000113.8M124 I145 C151 G153 V154 D223 K224 V225M124-C221 HydrophobicContact CE-CB 3.48Å; M124-C221 VanDerWaalsContact CE-CB 3.48Å; I145-C221 HydrophobicContact CG2-CB 4.03Å; C151-C221 VanDerWaalsContact C-SG 3.53Å; C151-C221 HydrophobicContact CB-CB 3.92Å; C151-C221 WeakPolarHBondContact CB-SG 3.35Å; C151-C221 WeakPolarHBondContact SG-CA 3.43Å; C151-C221 WeakPolarHBondContact SG-CB 3.45Å; C151-C221 CovalentContact SG-SG 2.03Å; C151-C221 PolarHBondContact SG-SG 2.87Å; G153-C221 VanDerWaalsContact O-CB 3.26Å; G153-C221 WeakPolarHBondContact O-CB 3.32Å; G153-C221 PolarHBondContact O-N 3.12Å; G153-C221 PolarHBondContact O-SG 3.04Å; V154-C221 PolarHBondContact O-N 3.4Å; V154-C221 VanDerWaalsContact O-N 3.08Å; C221-D223 PolarHBondContact O-N 2.91Å; C221-K224 PolarHBondContact O-N 2.02Å; C221-V225 WeakPolarHBondContact O-CB 3.14Å; C221-V225 VanDerWaalsContact O-CG2 3.24Å; C221-V225 WeakPolarHBondContact O-CG2 3.33Å; C221-V225 PolarHBondContact O-N 3.17Å
222L97.3Very high94.5Very high5 Ų553.5 Ų53.53%0.02628%0.276CS..Hα-helixtrans-56.9-49.6-178.2177.361.6000111.6R117 V120 M124 V154 K224 V225 C226R117-L222 HydrophobicContact CG-CD1 4.38Å; R117-L222 HydrophobicContact CG-CD2 4.46Å; V120-L222 HydrophobicContact CB-CD1 4.15Å; V120-L222 HydrophobicContact CG1-CD1 3.71Å; M124-L222 HydrophobicContact SD-CD1 4.36Å; V154-L222 HydrophobicContact CG1-CB 3.98Å; V154-L222 HydrophobicContact CG1-CD2 4.33Å; V154-L222 WeakPolarHBondContact O-CB 3.43Å; V154-L222 PolarHBondContact O-N 3.21Å; L222-K224 PolarHBondContact O-N 3.3Å; L222-V225 PolarHBondContact O-N 3.44Å; L222-C226 WeakPolarHBondContact O-CB 3.21Å; L222-C226 PolarHBondContact O-N 3.44Å; L222-C226 PolarHBondContact O-SG 3.28Å; L222-C226 VanDerWaalsContact O-SG 3.38Å
223D95.6Very high94.3Very high89 Ų8955.3 Ų55.348%0.47628%0.283SS..Hα-helixtrans-64.1-42.1-177.1-70.8-20.1000111.7R117 C221 C226 E227R117-D223 IonicContact CZ-OD1 3.82Å; R117-D223 IonicContact NE-OD1 2.74Å; R117-D223 IonicContact NH2-OD1 2.82Å; R117-D223 PolarHBondContact NH2-OD1 2.77Å; C221-D223 PolarHBondContact O-N 2.91Å; D223-C226 PolarHBondContact O-N 3.49Å; D223-E227 WeakPolarHBondContact O-CB 3.46Å; D223-E227 PolarHBondContact O-N 2.69Å
224K96.2Very high93.8Very high68 Ų6862.3 Ų62.330%0.29630%0.303SS..Hα-helixtrans-67.9-40.1177.6-61.8-166.9-179.7-177.10112.5L149 Q150 C151 C221 L222 E227 I228L149-K224 HydrophobicContact CB-CB 4.28Å; L149-K224 HydrophobicContact CB-CD 4.04Å; L149-K224 HydrophobicContact CD1-CB 3.99Å; L149-K224 WeakPolarHBondContact O-CD 3.05Å; L149-K224 WeakPolarHBondContact O-CE 3.27Å; L149-K224 PolarHBondContact O-NZ 3.17Å; Q150-K224 PolarHBondContact O-NZ 2.86Å; C151-K224 HydrophobicContact CB-CD 4.02Å; C221-K224 PolarHBondContact O-N 2.02Å; L222-K224 PolarHBondContact O-N 3.3Å; K224-E227 PolarHBondContact O-N 3.03Å; K224-I228 WeakPolarHBondContact O-CG1 3.38Å; K224-I228 PolarHBondContact O-N 3.49Å
225V96Very high93.6Very high26 Ų2661.9 Ų61.916%0.15831%0.305CS..Hα-helixtrans-63.5-46.4174.7169.90000110V120 M124 I145 L149 C221 L222 E227 I228 L229V120-V225 HydrophobicContact CG1-CG1 3.93Å; M124-V225 HydrophobicContact CE-CG2 4.42Å; M124-V225 HydrophobicContact SD-CG2 4.38Å; I145-V225 HydrophobicContact CG2-CG2 3.84Å; L149-V225 HydrophobicContact CD1-CG2 3.72Å; C221-V225 WeakPolarHBondContact O-CB 3.14Å; C221-V225 VanDerWaalsContact O-CG2 3.24Å; C221-V225 WeakPolarHBondContact O-CG2 3.33Å; C221-V225 PolarHBondContact O-N 3.17Å; L222-V225 PolarHBondContact O-N 3.44Å; V225-E227 VanDerWaalsContact C-N 3.35Å; V225-E227 PolarHBondContact O-N 2.89Å; V225-I228 PolarHBondContact O-N 2.97Å; V225-L229 HydrophobicContact CG1-CD1 3.99Å; V225-L229 HydrophobicContact CG1-CG 4.35Å; V225-L229 VanDerWaalsContact O-CG 3.29Å; V225-L229 WeakPolarHBondContact O-CG 3.35Å; V225-L229 PolarHBondContact O-N 3.32Å
226C94.3Very high93.2Very high6 Ų663.9 Ų63.94%0.04132%0.319CS..Hα-helixtrans-62.8-39.9176.9-75.30000112.4L222 D223 I228 L229 Y230L222-C226 WeakPolarHBondContact O-CB 3.21Å; L222-C226 PolarHBondContact O-N 3.44Å; L222-C226 PolarHBondContact O-SG 3.28Å; L222-C226 VanDerWaalsContact O-SG 3.38Å; D223-C226 PolarHBondContact O-N 3.49Å; C226-I228 PolarHBondContact O-N 3.44Å; C226-L229 PolarHBondContact O-N 2.82Å; C226-Y230 HydrophobicContact CB-CD2 4.39Å; C226-Y230 HydrophobicContact CB-CE2 4.02Å; C226-Y230 WeakPolarHBondContact O-CB 3.26Å; C226-Y230 WeakPolarHBondContact O-CD2 3.36Å; C226-Y230 VanDerWaalsContact O-CG 3.27Å; C226-Y230 PolarHBondContact O-N 3.4Å
227E93.7Very high92.8Very high125 Ų12567.4 Ų67.458%0.58434%0.337SS*.Hα-helixtrans-57.6-49.2173.9-174.9175.1-174.300111.2D223 K224 V225 L229 Y230 E231D223-E227 WeakPolarHBondContact O-CB 3.46Å; D223-E227 PolarHBondContact O-N 2.69Å; K224-E227 PolarHBondContact O-N 3.03Å; V225-E227 VanDerWaalsContact C-N 3.35Å; V225-E227 PolarHBondContact O-N 2.89Å; E227-L229 PolarHBondContact O-N 2.94Å; E227-Y230 PolarHBondContact O-N 3.5Å; E227-E231 WeakPolarHBondContact O-CG 2.94Å; E227-E231 PolarHBondContact O-N 3.39Å
228I93.2Very high92.6Very high63 Ų6368.4 Ų68.432%0.32335%0.353SS..Hα-helixtrans-61.9-42176.2-70.6170.2000111.8L149 K224 V225 C226 Y230 E231 K232L149-I228 HydrophobicContact CD1-CD1 3.93Å; L149-I228 HydrophobicContact CD2-CD1 3.24Å; L149-I228 HydrophobicContact CG-CD1 4.24Å; K224-I228 WeakPolarHBondContact O-CG1 3.38Å; K224-I228 PolarHBondContact O-N 3.49Å; V225-I228 PolarHBondContact O-N 2.97Å; C226-I228 PolarHBondContact O-N 3.44Å; I228-Y230 VanDerWaalsContact C-N 3.33Å; I228-Y230 PolarHBondContact O-N 3.04Å; I228-E231 PolarHBondContact O-N 3.27Å; I228-K232 HydrophobicContact CG2-CD 4.18Å; I228-K232 HydrophobicContact CG2-CG 4.45Å; I228-K232 WeakPolarHBondContact O-CB 3.01Å; I228-K232 WeakPolarHBondContact O-CG 3.48Å; I228-K232 PolarHBondContact O-N 3.3Å
229L91.6Very high92.4Very high74 Ų7469.9 Ų69.939%0.38736%0.358SS..Hα-helixtrans-61.7-42.7176.9-72.4173.7000111V120 V225 C226 E227 K232 Y233V120-L229 HydrophobicContact CG2-CD1 3.86Å; V225-L229 HydrophobicContact CG1-CD1 3.99Å; V225-L229 HydrophobicContact CG1-CG 4.35Å; V225-L229 VanDerWaalsContact O-CG 3.29Å; V225-L229 WeakPolarHBondContact O-CG 3.35Å; V225-L229 PolarHBondContact O-N 3.32Å; C226-L229 PolarHBondContact O-N 2.82Å; E227-L229 PolarHBondContact O-N 2.94Å; L229-K232 PolarHBondContact O-N 3.13Å; L229-Y233 VanDerWaalsContact O-CB 3.29Å; L229-Y233 WeakPolarHBondContact O-CB 3.47Å; L229-Y233 PolarHBondContact O-N 2.85Å
230Y88.9Confident92.2Very high78 Ų7869.8 Ų69.831%0.30635%0.354SS..Hα-helixtrans-70-35.3177.3-66.1-44.1000112.6R113 C226 E227 I228 Y233 R234R113-Y230 HydrophobicContact CB-CE1 4.1Å; R113-Y230 HydrophobicContact CG-CE1 4.06Å; R113-Y230 PolarHBondContact O-OH 2.75Å; R113-Y230 VanDerWaalsContact O-OH 3.05Å; C226-Y230 HydrophobicContact CB-CD2 4.39Å; C226-Y230 HydrophobicContact CB-CE2 4.02Å; C226-Y230 WeakPolarHBondContact O-CB 3.26Å; C226-Y230 WeakPolarHBondContact O-CD2 3.36Å; C226-Y230 VanDerWaalsContact O-CG 3.27Å; C226-Y230 PolarHBondContact O-N 3.4Å; E227-Y230 PolarHBondContact O-N 3.5Å; I228-Y230 VanDerWaalsContact C-N 3.33Å; I228-Y230 PolarHBondContact O-N 3.04Å; Y230-Y233 WeakPolarHBondContact O-CB 3.21Å; Y230-Y233 PolarHBondContact O-N 3.36Å; Y230-R234 WeakPolarHBondContact O-CG 3.39Å; Y230-R234 PolarHBondContact O-N 2.97Å; Y230-R234 VanDerWaalsContact O-N 3.14Å
231E90.6Very high92.1Very high110 Ų11073 Ų7351%0.51437%0.372SS..Hα-helixtrans-63.7-47.4171.7-74.4-138.6126.200111.9E227 I228 Y233 R234 V235E227-E231 WeakPolarHBondContact O-CG 2.94Å; E227-E231 PolarHBondContact O-N 3.39Å; I228-E231 PolarHBondContact O-N 3.27Å; E231-Y233 VanDerWaalsContact C-N 3.28Å; E231-Y233 PolarHBondContact O-N 2.87Å; E231-R234 WeakPolarHBondContact O-CB 3.46Å; E231-R234 PolarHBondContact O-N 3.31Å; E231-R234 VanDerWaalsContact O-N 3.11Å; E231-V235 PolarHBondContact O-N 2.03Å
232K89.4Confident91.9Very high134 Ų13474.6 Ų74.658%0.58339%0.388SS*.Hα-helixtrans-63.7-35.5175.6-72-176.1179-171.70111.9I228 L229 R234 V235 N236I228-K232 HydrophobicContact CG2-CD 4.18Å; I228-K232 HydrophobicContact CG2-CG 4.45Å; I228-K232 WeakPolarHBondContact O-CB 3.01Å; I228-K232 WeakPolarHBondContact O-CG 3.48Å; I228-K232 PolarHBondContact O-N 3.3Å; L229-K232 PolarHBondContact O-N 3.13Å; K232-R234 VanDerWaalsContact C-N 3.27Å; K232-R234 PolarHBondContact O-N 3.48Å; K232-V235 PolarHBondContact O-N 3.32Å; K232-V235 VanDerWaalsContact O-N 3.17Å; K232-N236 PolarHBondContact O-N 3.3Å
233Y87Confident91.7Very high50 Ų5078.2 Ų78.220%0.19641%0.407CS..Hα-helixtrans-60-36.8173.6179.1-101.4000112.1A109 S110 L229 Y230 E231 V235 N236 I237A109-Y233 HydrophobicContact CB-CE2 3.84Å; S110-Y233 PolarHBondContact OG-OH 3.44Å; L229-Y233 VanDerWaalsContact O-CB 3.29Å; L229-Y233 WeakPolarHBondContact O-CB 3.47Å; L229-Y233 PolarHBondContact O-N 2.85Å; Y230-Y233 WeakPolarHBondContact O-CB 3.21Å; Y230-Y233 PolarHBondContact O-N 3.36Å; E231-Y233 VanDerWaalsContact C-N 3.28Å; E231-Y233 PolarHBondContact O-N 2.87Å; Y233-V235 VanDerWaalsContact C-N 3.35Å; Y233-V235 PolarHBondContact O-N 3.32Å; Y233-N236 WeakPolarHBondContact O-CB 2.62Å; Y233-N236 PolarHBondContact O-N 2.86Å; Y233-I237 HydrophobicContact CD1-CD1 3.84Å; Y233-I237 HydrophobicContact CD1-CG1 4.36Å; Y233-I237 HydrophobicContact CE1-CD1 3.47Å; Y233-I237 VanDerWaalsContact CE1-CD1 3.47Å; Y233-I237 HydrophobicContact CE1-CG1 3.96Å; Y233-I237 WeakPolarHBondContact O-CG1 3.43Å; Y233-I237 PolarHBondContact O-N 3.01Å
234R86.1Confident91.7Very high177 Ų17777.1 Ų77.167%0.66840%0.401SS*.Hα-helixtrans-62-40.4174.3-68.2170.361.9-157.8-1.6112.5Y230 E231 K232 N236 I237Y230-R234 WeakPolarHBondContact O-CG 3.39Å; Y230-R234 PolarHBondContact O-N 2.97Å; Y230-R234 VanDerWaalsContact O-N 3.14Å; E231-R234 WeakPolarHBondContact O-CB 3.46Å; E231-R234 PolarHBondContact O-N 3.31Å; E231-R234 VanDerWaalsContact O-N 3.11Å; K232-R234 VanDerWaalsContact C-N 3.27Å; K232-R234 PolarHBondContact O-N 3.48Å; R234-N236 VanDerWaalsContact C-N 3.35Å; R234-I237 PolarHBondContact O-N 3.12Å
235V90.1Very high91.7Very high100 Ų10078.2 Ų78.261%0.60641%0.409SS*.Hα-helixtrans-65.5-40.9174.7179.60000110.7E231 K232 Y233 I237 G238 L239E231-V235 PolarHBondContact O-N 2.03Å; K232-V235 PolarHBondContact O-N 3.32Å; K232-V235 VanDerWaalsContact O-N 3.17Å; Y233-V235 VanDerWaalsContact C-N 3.35Å; Y233-V235 PolarHBondContact O-N 3.32Å; V235-I237 VanDerWaalsContact C-N 3.3Å; V235-I237 PolarHBondContact O-N 3.34Å; V235-G238 PolarHBondContact O-N 3.4Å; V235-L239 PolarHBondContact O-N 3.04Å
236N87.3Confident91.6Very high90 Ų9082.5 Ų82.548%0.48143%0.43SS..Hα-helixtrans-63.5-32.2177.3-72-12.7000113.1K232 Y233 R234 G238 L239 A240K232-N236 PolarHBondContact O-N 3.3Å; Y233-N236 WeakPolarHBondContact O-CB 2.62Å; Y233-N236 PolarHBondContact O-N 2.86Å; R234-N236 VanDerWaalsContact C-N 3.35Å; N236-G238 VanDerWaalsContact C-N 3.29Å; N236-G238 PolarHBondContact O-N 2.97Å; N236-L239 PolarHBondContact O-N 3.42Å; N236-A240 WeakPolarHBondContact O-CB 3.34Å; N236-A240 PolarHBondContact O-N 3.08Å
237I90Very high91.6Very high76 Ų7683.4 Ų83.439%0.3943%0.434SS..Hα-helixtrans-59.2-42.7172-69.7162.3000110.5Y233 R234 V235 L239 A240 V241Y233-I237 HydrophobicContact CD1-CD1 3.84Å; Y233-I237 HydrophobicContact CD1-CG1 4.36Å; Y233-I237 HydrophobicContact CE1-CD1 3.47Å; Y233-I237 VanDerWaalsContact CE1-CD1 3.47Å; Y233-I237 HydrophobicContact CE1-CG1 3.96Å; Y233-I237 WeakPolarHBondContact O-CG1 3.43Å; Y233-I237 PolarHBondContact O-N 3.01Å; R234-I237 PolarHBondContact O-N 3.12Å; V235-I237 VanDerWaalsContact C-N 3.3Å; V235-I237 PolarHBondContact O-N 3.34Å; I237-L239 PolarHBondContact O-N 3.38Å; I237-A240 PolarHBondContact O-N 3.36Å; I237-V241 HydrophobicContact CG2-CG2 4.5Å; I237-V241 WeakPolarHBondContact O-CG2 3.49Å; I237-V241 PolarHBondContact O-N 2.86Å
238G91.4Very high91.7Very high47 Ų4781.6 Ų81.649%0.48543%0.428SS..Hα-helixtrans-61.4-43.517700000112.6V235 N236 V241 G242V235-G238 PolarHBondContact O-N 3.4Å; N236-G238 VanDerWaalsContact C-N 3.29Å; N236-G238 PolarHBondContact O-N 2.97Å; G238-V241 PolarHBondContact O-N 3.41Å; G238-G242 PolarHBondContact O-N 2.73Å
239L92Very high91.9Very high107 Ų10783.5 Ų83.556%0.5644%0.438SS*.Hα-helixtrans-63-42.2174.8-66.5174.5000112V235 N236 I237 G242 N243V235-L239 PolarHBondContact O-N 3.04Å; N236-L239 PolarHBondContact O-N 3.42Å; I237-L239 PolarHBondContact O-N 3.38Å; L239-G242 PolarHBondContact O-N 3.47Å; L239-N243 PolarHBondContact O-N 2.95Å
240A91.9Very high92.1Very high33 Ų3380.2 Ų80.227%0.27342%0.423SS..Hα-helixtrans-62.5-43.3177.600000112N236 I237 G242 N243 L244N236-A240 WeakPolarHBondContact O-CB 3.34Å; N236-A240 PolarHBondContact O-N 3.08Å; I237-A240 PolarHBondContact O-N 3.36Å; A240-G242 VanDerWaalsContact C-N 3.34Å; A240-G242 PolarHBondContact O-N 2.82Å; A240-N243 PolarHBondContact O-N 3.13Å; A240-L244 WeakPolarHBondContact O-CB 3.29Å; A240-L244 PolarHBondContact O-N 3.1Å
241V93.6Very high92.5Very high76 Ų7677.5 Ų77.546%0.46141%0.413SS..Hα-helixtrans-62.4-41.6174.8172.90000111.3I237 G238 L244 I245I237-V241 HydrophobicContact CG2-CG2 4.5Å; I237-V241 WeakPolarHBondContact O-CG2 3.49Å; I237-V241 PolarHBondContact O-N 2.86Å; G238-V241 PolarHBondContact O-N 3.41Å; V241-L244 PolarHBondContact O-N 3.45Å; V241-I245 HydrophobicContact CG1-CD1 4.12Å; V241-I245 WeakPolarHBondContact O-CG1 3.49Å; V241-I245 PolarHBondContact O-N 2.94Å
242G94.5Very high92.7Very high32 Ų3276.1 Ų76.133%0.3341%0.412SS..Hα-helixtrans-60.1-45.9175.100000112.6G238 L239 A240 L244 I245 L246G238-G242 PolarHBondContact O-N 2.73Å; L239-G242 PolarHBondContact O-N 3.47Å; A240-G242 VanDerWaalsContact C-N 3.34Å; A240-G242 PolarHBondContact O-N 2.82Å; G242-L244 PolarHBondContact O-N 3.4Å; G242-I245 PolarHBondContact O-N 3.04Å; G242-L246 WeakPolarHBondContact O-CG 3.36Å; G242-L246 PolarHBondContact O-N 2.74Å
243N93.1Very high93Very high82 Ų8271.3 Ų71.344%0.43939%0.394SS..Hα-helixtrans-61.6-43176.1-74.2-9.6000112L239 A240 I245 L246 Q247L239-N243 PolarHBondContact O-N 2.95Å; A240-N243 PolarHBondContact O-N 3.13Å; N243-I245 VanDerWaalsContact C-N 3.35Å; N243-I245 PolarHBondContact O-N 2.95Å; N243-L246 WeakPolarHBondContact O-CB 3.3Å; N243-L246 PolarHBondContact O-N 3.02Å; N243-Q247 WeakPolarHBondContact O-CG 3.38Å; N243-Q247 PolarHBondContact O-N 3.32Å
244L94.9Very high93.4Very high65 Ų6569 Ų6934%0.3439%0.385SS..Hα-helixtrans-59.2-44.6176.5-177.964.9000111.7C99 A240 V241 G242 L246 Q247 L248C99-L244 WeakPolarHBondContact SG-CD1 2.92Å; A240-L244 WeakPolarHBondContact O-CB 3.29Å; A240-L244 PolarHBondContact O-N 3.1Å; V241-L244 PolarHBondContact O-N 3.45Å; G242-L244 PolarHBondContact O-N 3.4Å; L244-L246 VanDerWaalsContact C-N 3.35Å; L244-L246 PolarHBondContact O-N 3.14Å; L244-Q247 PolarHBondContact O-N 3Å; L244-L248 HydrophobicContact CG-CD1 4.47Å; L244-L248 VanDerWaalsContact O-CG 3.32Å; L244-L248 WeakPolarHBondContact O-CG 3.43Å; L244-L248 PolarHBondContact O-N 2.66Å
245I95.4Very high93.9Very high92 Ų9263.8 Ų63.847%0.47237%0.37SS..Hα-helixtrans-61-44.6176.4-67.9166.7000110.7V241 G242 N243 Q247 L248 L249V241-I245 HydrophobicContact CG1-CD1 4.12Å; V241-I245 WeakPolarHBondContact O-CG1 3.49Å; V241-I245 PolarHBondContact O-N 2.94Å; G242-I245 PolarHBondContact O-N 3.04Å; N243-I245 VanDerWaalsContact C-N 3.35Å; N243-I245 PolarHBondContact O-N 2.95Å; I245-Q247 VanDerWaalsContact C-N 3.33Å; I245-Q247 PolarHBondContact O-N 3.07Å; I245-L248 PolarHBondContact O-N 3.08Å; I245-L249 HydrophobicContact CG2-CD1 4.19Å; I245-L249 WeakPolarHBondContact O-CG 2.92Å; I245-L249 PolarHBondContact O-N 2.9Å
246L93.9Very high94.1Very high115 Ų11562.7 Ų62.760%0.60236%0.36SS*.Hα-helixtrans-61.4-40.4177.4-70.5172.8000112G242 N243 L244 L249 G250G242-L246 WeakPolarHBondContact O-CG 3.36Å; G242-L246 PolarHBondContact O-N 2.74Å; N243-L246 WeakPolarHBondContact O-CB 3.3Å; N243-L246 PolarHBondContact O-N 3.02Å; L244-L246 VanDerWaalsContact C-N 3.35Å; L244-L246 PolarHBondContact O-N 3.14Å; L246-L249 PolarHBondContact O-N 3.21Å; L246-G250 PolarHBondContact O-N 3.31Å
247Q95.9Very high94.5Very high25 Ų2558.4 Ų58.412%0.11734%0.337CS..Hα-helixtrans-65.7-43.4175.8-70.5175.74.300112.2L95 C99 E102 N243 L244 I245 L249 G250 M251L95-Q247 HydrophobicContact CD2-CG 4.23Å; C99-Q247 VanDerWaalsContact CA-OE1 3.25Å; E102-Q247 VanDerWaalsContact CD-NE2 3.3Å; E102-Q247 PolarHBondContact OE1-NE2 2.92Å; E102-Q247 PolarHBondContact OE2-OE1 3.39Å; N243-Q247 WeakPolarHBondContact O-CG 3.38Å; N243-Q247 PolarHBondContact O-N 3.32Å; L244-Q247 PolarHBondContact O-N 3Å; I245-Q247 VanDerWaalsContact C-N 3.33Å; I245-Q247 PolarHBondContact O-N 3.07Å; Q247-L249 VanDerWaalsContact C-N 3.32Å; Q247-L249 PolarHBondContact O-N 3.13Å; Q247-G250 PolarHBondContact O-N 3.07Å; Q247-G250 VanDerWaalsContact O-N 3.16Å; Q247-M251 HydrophobicContact CB-CE 4.49Å; Q247-M251 WeakPolarHBondContact O-CG 3.37Å; Q247-M251 PolarHBondContact O-N 2.92Å
248L96.1Very high94.7Very high87 Ų8755.6 Ų55.646%0.45532%0.323SS..Hα-helixtrans-58.8-43.7175-70.4175.5000111.4L244 I245 M251 V252L244-L248 HydrophobicContact CG-CD1 4.47Å; L244-L248 VanDerWaalsContact O-CG 3.32Å; L244-L248 WeakPolarHBondContact O-CG 3.43Å; L244-L248 PolarHBondContact O-N 2.66Å; I245-L248 PolarHBondContact O-N 3.08Å; L248-M251 HydrophobicContact CD2-CE 3.68Å; L248-M251 HydrophobicContact CG-CE 4.39Å; L248-M251 PolarHBondContact O-N 3.49Å; L248-V252 WeakPolarHBondContact O-CG2 3.49Å; L248-V252 PolarHBondContact O-N 2.69Å
249L95.7Very high94.9Very high103 Ų10361.2 Ų61.254%0.53933%0.329SS..Hα-helixtrans-63.4-41.7174.7-68.7173.5000111.9I245 L246 Q247 M251 V252 T253I245-L249 HydrophobicContact CG2-CD1 4.19Å; I245-L249 WeakPolarHBondContact O-CG 2.92Å; I245-L249 PolarHBondContact O-N 2.9Å; L246-L249 PolarHBondContact O-N 3.21Å; Q247-L249 VanDerWaalsContact C-N 3.32Å; Q247-L249 PolarHBondContact O-N 3.13Å; L249-M251 VanDerWaalsContact C-N 3.34Å; L249-M251 PolarHBondContact O-N 2.63Å; L249-V252 PolarHBondContact O-N 2.99Å; L249-T253 WeakPolarHBondContact O-CB 3.22Å; L249-T253 VanDerWaalsContact O-CG2 3.29Å; L249-T253 WeakPolarHBondContact O-CG2 3.5Å; L249-T253 PolarHBondContact O-N 3Å; L249-T253 PolarHBondContact O-OG1 2.68Å
250G96.1Very high94.8Very high6 Ų657.3 Ų57.36%0.06231%0.311CS..Hα-helixtrans-59.3-42.6173.500000112.6L246 Q247 T253 S254L246-G250 PolarHBondContact O-N 3.31Å; Q247-G250 PolarHBondContact O-N 3.07Å; Q247-G250 VanDerWaalsContact O-N 3.16Å; G250-T253 WeakPolarHBondContact CA-OG1 3.2Å; G250-T253 PolarHBondContact O-OG1 2.88Å; G250-S254 WeakPolarHBondContact O-CB 3.22Å; G250-S254 PolarHBondContact O-N 3.3Å
251M96.9Very high94.8Very high20 Ų2057 Ų5710%0.09931%0.305CS..Hα-helixtrans-65.7-47.2177.1-75.6-172.1-78.800112F92 L95 V96 C99 Q247 L248 L249 S254 L255F92-M251 HydrophobicContact CD2-CB 4.01Å; F92-M251 HydrophobicContact CD2-CG 4.02Å; F92-M251 HydrophobicContact CE2-CB 3.86Å; F92-M251 HydrophobicContact CE2-CG 4.02Å; F92-M251 HydrophobicContact CE2-SD 4.35Å; L95-M251 HydrophobicContact CB-CG 3.62Å; L95-M251 HydrophobicContact CB-SD 4.19Å; L95-M251 HydrophobicContact CD1-CG 3.82Å; L95-M251 HydrophobicContact CG-CG 4.41Å; V96-M251 HydrophobicContact CG2-SD 3.63Å; C99-M251 HydrophobicContact CB-CE 4.28Å; Q247-M251 HydrophobicContact CB-CE 4.49Å; Q247-M251 WeakPolarHBondContact O-CG 3.37Å; Q247-M251 PolarHBondContact O-N 2.92Å; L248-M251 HydrophobicContact CD2-CE 3.68Å; L248-M251 HydrophobicContact CG-CE 4.39Å; L248-M251 PolarHBondContact O-N 3.49Å; L249-M251 VanDerWaalsContact C-N 3.34Å; L249-M251 PolarHBondContact O-N 2.63Å; M251-S254 PolarHBondContact O-N 3.39Å; M251-L255 WeakPolarHBondContact O-CG 3.13Å; M251-L255 PolarHBondContact O-N 2.79Å
252V96.5Very high94.7Very high81 Ų8162.2 Ų62.249%0.49132%0.316SS..Hα-helixtrans-61.3-47.2177.8171.50000110.8L248 L249 S254 L255 L256L248-V252 WeakPolarHBondContact O-CG2 3.49Å; L248-V252 PolarHBondContact O-N 2.69Å; L249-V252 PolarHBondContact O-N 2.99Å; V252-S254 PolarHBondContact O-N 3.34Å; V252-L255 PolarHBondContact O-N 2.93Å; V252-L256 HydrophobicContact CG1-CD1 3.87Å; V252-L256 HydrophobicContact CG1-CG 4.3Å; V252-L256 WeakPolarHBondContact O-CB 3.25Å; V252-L256 VanDerWaalsContact O-CG 3.27Å; V252-L256 WeakPolarHBondContact O-CG 3.44Å; V252-L256 PolarHBondContact O-N 3.21Å
253T95Very high94.4Very high34 Ų3469.6 Ų69.621%0.20934%0.339CS..Hα-helixtrans-63.9-41.4179.453.70000112L249 G250 L255 L256 L257L249-T253 WeakPolarHBondContact O-CB 3.22Å; L249-T253 VanDerWaalsContact O-CG2 3.29Å; L249-T253 WeakPolarHBondContact O-CG2 3.5Å; L249-T253 PolarHBondContact O-N 3Å; L249-T253 PolarHBondContact O-OG1 2.68Å; G250-T253 WeakPolarHBondContact CA-OG1 3.2Å; G250-T253 PolarHBondContact O-OG1 2.88Å; T253-L255 PolarHBondContact O-N 3.19Å; T253-L256 PolarHBondContact O-N 3Å; T253-L257 WeakPolarHBondContact O-CB 3.31Å; T253-L257 VanDerWaalsContact O-CG 3.3Å; T253-L257 WeakPolarHBondContact O-CG 3.37Å; T253-L257 PolarHBondContact O-N 3.3Å
254S95.8Very high93.7Very high0 Ų071.4 Ų71.40%038%0.377CS..Hα-helixtrans-59.3-47.3174.3-174.90000111.9L88 G250 M251 V252 L256 L257 I258L88-S254 PolarHBondContact O-OG 2.87Å; G250-S254 WeakPolarHBondContact O-CB 3.22Å; G250-S254 PolarHBondContact O-N 3.3Å; M251-S254 PolarHBondContact O-N 3.39Å; V252-S254 PolarHBondContact O-N 3.34Å; S254-L256 PolarHBondContact O-N 3.09Å; S254-L257 PolarHBondContact O-N 3.32Å; S254-I258 WeakPolarHBondContact O-CB 3.34Å; S254-I258 VanDerWaalsContact O-CG1 3.25Å; S254-I258 WeakPolarHBondContact O-CG1 3.47Å; S254-I258 PolarHBondContact O-N 2.61Å
255L95.8Very high93.6Very high68 Ų6871.8 Ų71.836%0.35638%0.379SS..Hα-helixtrans-62.7-42.3177.8-71.9175.6000112.7F92 M251 V252 T253 I258 R259F92-L255 HydrophobicContact CD2-CD1 4.38Å; F92-L255 HydrophobicContact CD2-CD2 4.02Å; F92-L255 HydrophobicContact CD2-CG 3.84Å; F92-L255 HydrophobicContact CE2-CD1 3.61Å; F92-L255 HydrophobicContact CE2-CD2 3.8Å; F92-L255 HydrophobicContact CE2-CG 3.56Å; F92-L255 HydrophobicContact CZ-CD1 4.16Å; F92-L255 HydrophobicContact CZ-CD2 4.14Å; F92-L255 HydrophobicContact CZ-CG 4.31Å; M251-L255 WeakPolarHBondContact O-CG 3.13Å; M251-L255 PolarHBondContact O-N 2.79Å; V252-L255 PolarHBondContact O-N 2.93Å; T253-L255 PolarHBondContact O-N 3.19Å; L255-I258 PolarHBondContact O-N 3.17Å; L255-R259 WeakPolarHBondContact O-CB 3.43Å; L255-R259 VanDerWaalsContact O-CG 3.31Å; L255-R259 WeakPolarHBondContact O-CG 3.48Å; L255-R259 PolarHBondContact O-N 2.69Å
256L94.9Very high93.5Very high78 Ų7870.7 Ų70.741%0.40837%0.374SS..Hα-helixtrans-64.3-42.2177-70176.3000111.4L10 V252 T253 S254 R259 S260L10-L256 HydrophobicContact CD2-CB 3.59Å; L10-L256 HydrophobicContact CD2-CD1 3.86Å; L10-L256 HydrophobicContact CD2-CG 4.39Å; V252-L256 HydrophobicContact CG1-CD1 3.87Å; V252-L256 HydrophobicContact CG1-CG 4.3Å; V252-L256 WeakPolarHBondContact O-CB 3.25Å; V252-L256 VanDerWaalsContact O-CG 3.27Å; V252-L256 WeakPolarHBondContact O-CG 3.44Å; V252-L256 PolarHBondContact O-N 3.21Å; T253-L256 PolarHBondContact O-N 3Å; S254-L256 PolarHBondContact O-N 3.09Å; L256-R259 PolarHBondContact O-N 3.2Å; L256-S260 WeakPolarHBondContact O-CB 3.47Å; L256-S260 PolarHBondContact O-N 3.02Å
257L94.5Very high93.5Very high0 Ų068.2 Ų68.20%036%0.362CS..Hα-helixtrans-63.9-46.5175.5-74.5176000111.7L10 R11 T14 A80 L88 T253 S254 R259 S260 I261L10-L257 HydrophobicContact CB-CD2 3.86Å; L10-L257 HydrophobicContact CB-CG 4.34Å; R11-L257 HydrophobicContact CB-CD2 4.38Å; R11-L257 HydrophobicContact CG-CD2 3.42Å; R11-L257 VanDerWaalsContact CG-CD2 3.42Å; T14-L257 HydrophobicContact CG2-CD1 4.2Å; A80-L257 HydrophobicContact CB-CD1 4.23Å; L88-L257 HydrophobicContact CD1-CB 3.85Å; L88-L257 HydrophobicContact CD2-CD1 4.32Å; T253-L257 WeakPolarHBondContact O-CB 3.31Å; T253-L257 VanDerWaalsContact O-CG 3.3Å; T253-L257 WeakPolarHBondContact O-CG 3.37Å; T253-L257 PolarHBondContact O-N 3.3Å; S254-L257 PolarHBondContact O-N 3.32Å; L257-R259 PolarHBondContact O-N 3.13Å; L257-S260 PolarHBondContact O-N 2.9Å; L257-I261 WeakPolarHBondContact O-CB 3.49Å; L257-I261 WeakPolarHBondContact O-CD1 3.42Å; L257-I261 WeakPolarHBondContact O-CG1 3.06Å; L257-I261 PolarHBondContact O-N 3.05Å
258I95.3Very high93.4Very high16 Ų1670.8 Ų70.88%0.08238%0.376CS..Hα-helixtrans-57.8-48176.5-71.1165.1000110.7V85 L88 A89 S254 L255 S260 I261 R262V85-I258 HydrophobicContact CG1-CG2 3.99Å; L88-I258 HydrophobicContact CB-CD1 3.86Å; L88-I258 HydrophobicContact CB-CG1 3.62Å; L88-I258 HydrophobicContact CD1-CG1 4.12Å; A89-I258 HydrophobicContact CB-CD1 4.47Å; S254-I258 WeakPolarHBondContact O-CB 3.34Å; S254-I258 VanDerWaalsContact O-CG1 3.25Å; S254-I258 WeakPolarHBondContact O-CG1 3.47Å; S254-I258 PolarHBondContact O-N 2.61Å; L255-I258 PolarHBondContact O-N 3.17Å; I258-S260 VanDerWaalsContact C-N 3.33Å; I258-S260 PolarHBondContact O-N 2.73Å; I258-I261 PolarHBondContact O-N 3.43Å; I258-R262 WeakPolarHBondContact O-CG 3.22Å; I258-R262 PolarHBondContact O-N 2.84Å
259R94.3Very high93.2Very high165 Ų16569.8 Ų69.862%0.62337%0.371SS*.Hα-helixtrans-62.1-41.8178-75.5177.5177.2177.50.8111.9L255 L256 L257 K263L255-R259 WeakPolarHBondContact O-CB 3.43Å; L255-R259 VanDerWaalsContact O-CG 3.31Å; L255-R259 WeakPolarHBondContact O-CG 3.48Å; L255-R259 PolarHBondContact O-N 2.69Å; L256-R259 PolarHBondContact O-N 3.2Å; L257-R259 PolarHBondContact O-N 3.13Å; R259-K263 WeakPolarHBondContact O-CG 3.2Å; R259-K263 PolarHBondContact O-N 3.43Å
260S91.2Very high93Very high25 Ų2567.5 Ų67.518%0.17536%0.36CS..Hα-helixtrans-68.6-39.1-179.7-179.70000112.2Q7 L256 L257 I258 K263 G264Q7-S260 VanDerWaalsContact CG-OG 3.3Å; Q7-S260 WeakPolarHBondContact CG-OG 3.4Å; Q7-S260 PolarHBondContact NE2-OG 3.28Å; L256-S260 WeakPolarHBondContact O-CB 3.47Å; L256-S260 PolarHBondContact O-N 3.02Å; L257-S260 PolarHBondContact O-N 2.9Å; I258-S260 VanDerWaalsContact C-N 3.33Å; I258-S260 PolarHBondContact O-N 2.73Å; S260-K263 PolarHBondContact O-N 3.26Å; S260-G264 PolarHBondContact O-N 2.78Å
261I91Very high92.8Very high28 Ų2871.9 Ų71.914%0.14438%0.381CS..Hα-helixtrans-69.3-37.5176.8-66.8159.9000111.3V85 L88 L257 I258 K263 G264V85-I261 HydrophobicContact CG2-CB 4.14Å; V85-I261 HydrophobicContact CG2-CG2 3.67Å; L88-I261 HydrophobicContact CD1-CD1 3.67Å; L257-I261 WeakPolarHBondContact O-CB 3.49Å; L257-I261 WeakPolarHBondContact O-CD1 3.42Å; L257-I261 WeakPolarHBondContact O-CG1 3.06Å; L257-I261 PolarHBondContact O-N 3.05Å; I258-I261 PolarHBondContact O-N 3.43Å; I261-K263 VanDerWaalsContact C-N 3.3Å; I261-K263 PolarHBondContact O-N 2.87Å; I261-G264 VanDerWaalsContact O-OXT 3.1Å
262R91.6Very high92.5Very high185 Ų18575.9 Ų75.970%0.69840%0.403SS*.Hα-helixtrans-71.8-21.3177.6-73.4-177.7-179.3178.51.9114.2V85 I258V85-R262 HydrophobicContact CG2-CG 4.27Å; I258-R262 WeakPolarHBondContact O-CG 3.22Å; I258-R262 PolarHBondContact O-N 2.84Å
263K88Confident92.2Very high187 Ų18775.5 Ų75.581%0.81340%0.395SS*.Hα-helixtrans-88.7-24.2179.8-78.7-174.8178.6-170.80113.6R259 S260 I261R259-K263 WeakPolarHBondContact O-CG 3.2Å; R259-K263 PolarHBondContact O-N 3.43Å; S260-K263 PolarHBondContact O-N 3.26Å; I261-K263 VanDerWaalsContact C-N 3.3Å; I261-K263 PolarHBondContact O-N 2.87Å
264G78.7Confident91.9Very high120 Ų12079.3 Ų79.3100%1.23741%0.412SS*.  trans-95.10178.700000111.2S260 I261S260-G264 PolarHBondContact O-N 2.78Å; I261-G264 VanDerWaalsContact O-OXT 3.1Å

Retrieved 264 of 264 residues in 363.9 ms (Link to these results)

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