A0A2K5XC84_MANLE Loading...

Probable G-protein coupled receptor 160

Orphan receptor.

AlphaFold DB , UniProt , Accession A0A2K5XC84, Species MANLE (Mandrillus leucophaeus, Drill), Gene GPR160, Length 338 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
1M42.8Very low39.1Very low242 Ų242137.4 Ų137.4100%1.19279%0.793SS**  0110.70-82.7177.5-175.300108.4
2T32.8Very low38.6Very low145 Ų145139.2 Ų139.289%0.8979%0.789SS**  trans-161100.4154.436.60000106.2
3A36.7Very low38.4Very low108 Ų108143.3 Ų143.389%0.89379%0.786SS**PPolyproline II helixtrans-77.9123.6175.800000108.9
4L39.1Very low38.2Very low172 Ų172142.2 Ų142.290%0.90177%0.773SS**PPolyproline II helixtrans-75.7125.9168.2-93.8142.6000108.6
5S38.7Very low37.7Very low107 Ų107141.9 Ų141.975%0.74877%0.77SS**PPolyproline II helixtrans-61.5131.1-179.353.90000111.7E7S5-E7 PolarHBondContact O-N 3.19Å
6S37.8Very low37.4Very low111 Ų111146.1 Ų146.178%0.77677%0.771SS**  trans-71.2109.2171.967.50000110N8S6-N8 PolarHBondContact O-N 2.98Å
7E40.8Very low37.5Very low170 Ų170145.1 Ų145.179%0.79476%0.761SS**  trans-65.5130.3165.3-76-178.6151.400109.7S5 C9S5-E7 PolarHBondContact O-N 3.19Å; E7-C9 VanDerWaalsContact C-N 3.34Å; E7-C9 PolarHBondContact O-N 3.35Å
8N40.5Very low37.2Very low141 Ų141142.7 Ų142.775%0.75475%0.753SS**  trans-66.985.9177.3-90-30000110.8S6 S10S6-N8 PolarHBondContact O-N 2.98Å; N8-S10 PolarHBondContact O-N 3.19Å; N8-S10 VanDerWaalsContact O-N 3.16Å
9C43.1Very low37.1Very low87 Ų87142.8 Ų142.859%0.58875%0.754SS**THydrogen-bonded Turntrans-70.84.2171.9-78.20000114.5E7E7-C9 VanDerWaalsContact C-N 3.34Å; E7-C9 PolarHBondContact O-N 3.35Å
10S41.8Very low37.4Very low72 Ų72142.7 Ų142.750%0.50375%0.749SS.*Hα-helixtrans-74.1-33.3-177.554.70000113.2N8N8-S10 PolarHBondContact O-N 3.19Å; N8-S10 VanDerWaalsContact O-N 3.16Å
11F35.9Very low37.9Very low156 Ų156141.4 Ų141.468%0.68475%0.75SS**Hα-helixtrans-77-28.1-175.2-121.1-91.6000113.4Y13 L15F11-Y13 VanDerWaalsContact C-N 3.33Å; F11-Y13 PolarHBondContact O-N 2.99Å; F11-L15 PolarHBondContact O-N 2.95Å
12Q33.1Very low38.4Very low159 Ų159135.2 Ų135.274%0.74372%0.721SS**Hα-helixtrans-76.5-21.4-179.1-132.1173.2-8.700112.7
13Y36.7Very low40.2Very low193 Ų193132.2 Ų132.276%0.75770%0.699SS**Hα-helixtrans-77.2-36175.1-115.1-88.9000112.6F11F11-Y13 VanDerWaalsContact C-N 3.33Å; F11-Y13 PolarHBondContact O-N 2.99Å
14Q35.7Very low41.9Very low128 Ų128130 Ų13060%0.59868%0.675SS**Hα-helixtrans-73.3-36.7-179.5-84.7176.3-42.800112.9R16 Q17Q14-R16 VanDerWaalsContact C-N 3.27Å; Q14-R16 PolarHBondContact O-N 3.16Å; Q14-Q17 PolarHBondContact O-N 3.07Å
15L30.9Very low43.6Very low138 Ų138122.8 Ų122.872%0.72364%0.637SS**Hα-helixtrans-74-17.1179.9-151.475.8000113.4F11 T18F11-L15 PolarHBondContact O-N 2.95Å; L15-T18 PolarHBondContact O-OG1 3.34Å
16R32.7Very low45.5Very low209 Ų209120.5 Ų120.579%0.78962%0.62SS**THydrogen-bonded Turntrans-83.6-13.2175.4-155.6175-143.4-143.23.7113.2Q14Q14-R16 VanDerWaalsContact C-N 3.27Å; Q14-R16 PolarHBondContact O-N 3.16Å
17Q38.4Very low47.7Very low128 Ų128119.3 Ų119.360%0.59861%0.605SS**THydrogen-bonded Turntrans-90.6-17.2-173.8-143.9169.67.200113.1Q14Q14-Q17 PolarHBondContact O-N 3.07Å
18T32.7Very low49.7Very low103 Ų103111.9 Ų111.963%0.63257%0.57SS**THydrogen-bonded Turntrans-79.3-17.5-179.340.50000114.2L15L15-T18 PolarHBondContact O-OG1 3.34Å
19N35.3Very low51.8Low144 Ų144107.7 Ų107.777%0.7755%0.546SS*.THydrogen-bonded Turntrans-121.740.2178.3-69.4-22.6000111.8P21N19-P21 WeakPolarHBondContact O-CD 3.21Å
20Q42.2Very low54Low140 Ų140107.7 Ų107.765%0.65454%0.539SS*.  trans-75.8123.2170.7-89-178.1-27.500109.7L22Q20-L22 PolarHBondContact O-N 3.46Å
21P48.8Very low56.2Low116 Ų116106.9 Ų106.975%0.75353%0.529SS*.  trans-56.6142.3166.126.5-32.6000108.1N19 D23N19-P21 WeakPolarHBondContact O-CD 3.21Å; P21-D23 PolarHBondContact O-N 3.11Å; P21-D23 VanDerWaalsContact O-N 3.13Å
22L52.3Low58.7Low112 Ų11299.6 Ų99.659%0.58650%0.497SS*.  trans-32.6117.9-180-153.699.2000110.9Q20 V24 L27 L30Q20-L22 PolarHBondContact O-N 3.46Å; L22-V24 PolarHBondContact O-N 3.36Å; L22-V24 VanDerWaalsContact O-N 3.15Å; L22-L27 HydrophobicContact CD2-CB 3.96Å; L22-L27 HydrophobicContact CD2-CD1 4Å; L22-L30 HydrophobicContact CD2-CD1 4.48Å
23D71.4Confident61.4Low83 Ų8394.7 Ų94.744%0.44448%0.476SS..  trans-51.3125.4-177.1-174-17.2000108.5P21 N25 C26 L27P21-D23 PolarHBondContact O-N 3.11Å; P21-D23 VanDerWaalsContact O-N 3.13Å; D23-N25 PolarHBondContact O-N 3.15Å; D23-N25 PolarHBondContact OD1-N 3.12Å; D23-N25 PolarHBondContact OD1-ND2 2.85Å; D23-C26 HydrophobicContact CB-CB 4.28Å; D23-C26 WeakPolarHBondContact O-CA 3.07Å; D23-C26 WeakPolarHBondContact O-CB 3.39Å; D23-C26 PolarHBondContact O-N 3.26Å; D23-L27 PolarHBondContact O-N 2.95Å
24V71.9Confident63.9Low61 Ų6187.2 Ų87.237%0.3746%0.457SS..Hα-helixtrans-54.9-30.7-174.8176.60000111.4L22 L27 L28L22-V24 PolarHBondContact O-N 3.36Å; L22-V24 VanDerWaalsContact O-N 3.15Å; V24-L27 PolarHBondContact O-N 3.08Å; V24-L28 WeakPolarHBondContact O-CB 3.33Å; V24-L28 PolarHBondContact O-N 3.31Å
25N74.9Confident66.6Low20 Ų2081.6 Ų81.611%0.10743%0.431CS..Hα-helixtrans-69-34.9175.2-57.9-63.1000112.7D23 F29 L77D23-N25 PolarHBondContact O-N 3.15Å; D23-N25 PolarHBondContact OD1-N 3.12Å; D23-N25 PolarHBondContact OD1-ND2 2.85Å; N25-F29 WeakPolarHBondContact O-CB 3.4Å; N25-F29 PolarHBondContact O-N 3.21Å; N25-L77 HydrophobicContact CB-CD2 3.99Å
26C78.3Confident69.4Low59 Ų5975.5 Ų75.540%0.39940%0.399SS..Hα-helixtrans-69.8-41.5174.2-171.20000110.8D23 F29 L30D23-C26 HydrophobicContact CB-CB 4.28Å; D23-C26 WeakPolarHBondContact O-CA 3.07Å; D23-C26 WeakPolarHBondContact O-CB 3.39Å; D23-C26 PolarHBondContact O-N 3.26Å; C26-F29 PolarHBondContact O-N 2.94Å; C26-L30 WeakPolarHBondContact O-CG 3.29Å; C26-L30 PolarHBondContact O-N 3.14Å
27L83.4Confident72.2Confident86 Ų8670.4 Ų70.445%0.4539%0.386SS..Hα-helixtrans-59.7-48.4173.7-174.163.4000111.4L22 D23 V24 F29 L30 I31L22-L27 HydrophobicContact CD2-CB 3.96Å; L22-L27 HydrophobicContact CD2-CD1 4Å; D23-L27 PolarHBondContact O-N 2.95Å; V24-L27 PolarHBondContact O-N 3.08Å; L27-F29 VanDerWaalsContact C-N 3.32Å; L27-F29 PolarHBondContact O-N 3.38Å; L27-L30 PolarHBondContact O-N 3.17Å; L27-I31 HydrophobicContact CD1-CD1 4.32Å; L27-I31 HydrophobicContact CG-CD1 3.91Å; L27-I31 VanDerWaalsContact O-CG1 3.28Å; L27-I31 WeakPolarHBondContact O-CG1 3.46Å; L27-I31 PolarHBondContact O-N 3.48Å
28L83.2Confident74.7Confident14 Ų1468.1 Ų68.17%0.07338%0.378CS..Hα-helixtrans-57.6-46177.1178.567.8000111.4V24 L30 I31 I32 I94 T98 Y272V24-L28 WeakPolarHBondContact O-CB 3.33Å; V24-L28 PolarHBondContact O-N 3.31Å; L28-L30 PolarHBondContact O-N 3.24Å; L28-I31 PolarHBondContact O-N 3.28Å; L28-I32 HydrophobicContact CD1-CD1 3.94Å; L28-I32 HydrophobicContact CD1-CG1 4.36Å; L28-I32 HydrophobicContact CG-CD1 3.9Å; L28-I32 WeakPolarHBondContact O-CG1 3.39Å; L28-I32 PolarHBondContact O-N 2.89Å; L28-I94 HydrophobicContact CD2-CG2 3.8Å; L28-T98 HydrophobicContact CD1-CG2 3.93Å; L28-T98 HydrophobicContact CD2-CG2 4.33Å; L28-Y272 HydrophobicContact CD1-CE1 4.38Å; L28-Y272 HydrophobicContact CD1-CE2 3.78Å
29F85.9Confident77.5Confident54 Ų5463.2 Ų63.224%0.23735%0.348CS..Hα-helixtrans-58.3-47.7176.8177.2-94.6000112N25 C26 L27 I31 I32 L33 L70 I73 S74 L77N25-F29 WeakPolarHBondContact O-CB 3.4Å; N25-F29 PolarHBondContact O-N 3.21Å; C26-F29 PolarHBondContact O-N 2.94Å; L27-F29 VanDerWaalsContact C-N 3.32Å; L27-F29 PolarHBondContact O-N 3.38Å; F29-I31 VanDerWaalsContact C-N 3.34Å; F29-I31 PolarHBondContact O-N 2.88Å; F29-I32 PolarHBondContact O-N 3.2Å; F29-L33 HydrophobicContact CE1-CD2 4.3Å; F29-L33 VanDerWaalsContact O-CB 3.29Å; F29-L33 WeakPolarHBondContact O-CB 3.2Å; F29-L33 PolarHBondContact O-N 3.19Å; F29-L70 HydrophobicContact CD2-CD1 3.76Å; F29-L70 HydrophobicContact CE2-CD1 3.43Å; F29-L70 VanDerWaalsContact CE2-CD1 3.43Å; F29-L70 HydrophobicContact CE2-CG 4.35Å; F29-L70 HydrophobicContact CZ-CD1 4.11Å; F29-I73 HydrophobicContact CD2-CG2 4.36Å; F29-S74 WeakPolarHBondContact CE2-OG 3.09Å; F29-L77 HydrophobicContact CB-CD1 4.19Å; F29-L77 HydrophobicContact CD2-CD1 4.12Å; F29-L77 HydrophobicContact CG-CD1 4.36Å
30L87.9Confident80Confident87 Ų8761 Ų6146%0.45534%0.335SS..Hα-helixtrans-62.6-39.8178.3-71.7170.5000112.2L22 C26 L27 L28 L33 G34L22-L30 HydrophobicContact CD2-CD1 4.48Å; C26-L30 WeakPolarHBondContact O-CG 3.29Å; C26-L30 PolarHBondContact O-N 3.14Å; L27-L30 PolarHBondContact O-N 3.17Å; L28-L30 PolarHBondContact O-N 3.24Å; L30-L33 PolarHBondContact O-N 3.33Å; L30-G34 PolarHBondContact O-N 3.28Å
31I88.4Confident82.2Confident54 Ų5460.4 Ų60.428%0.27733%0.331SS..Hα-helixtrans-63.2-48.1176.6-71.3168.6000110.8L27 L28 F29 L33 G34 K35 Y272 I273L27-I31 HydrophobicContact CD1-CD1 4.32Å; L27-I31 HydrophobicContact CG-CD1 3.91Å; L27-I31 VanDerWaalsContact O-CG1 3.28Å; L27-I31 WeakPolarHBondContact O-CG1 3.46Å; L27-I31 PolarHBondContact O-N 3.48Å; L28-I31 PolarHBondContact O-N 3.28Å; F29-I31 VanDerWaalsContact C-N 3.34Å; F29-I31 PolarHBondContact O-N 2.88Å; I31-L33 VanDerWaalsContact C-N 3.35Å; I31-G34 PolarHBondContact O-N 2.83Å; I31-K35 PolarHBondContact O-N 2.89Å; I31-Y272 HydrophobicContact CG2-CE2 3.88Å; I31-I273 HydrophobicContact CG2-CD1 3.34Å; I31-I273 HydrophobicContact CG2-CG1 3.71Å
32I87.8Confident84Confident3 Ų355.5 Ų55.52%0.01530%0.299CS..Hα-helixtrans-65.2-41.3179.5-66.1171.3000110.4L28 F29 K35 I36 L69 L70 I73 Y272L28-I32 HydrophobicContact CD1-CD1 3.94Å; L28-I32 HydrophobicContact CD1-CG1 4.36Å; L28-I32 HydrophobicContact CG-CD1 3.9Å; L28-I32 WeakPolarHBondContact O-CG1 3.39Å; L28-I32 PolarHBondContact O-N 2.89Å; F29-I32 PolarHBondContact O-N 3.2Å; I32-K35 WeakPolarHBondContact O-CB 3.33Å; I32-K35 PolarHBondContact O-N 2.85Å; I32-I36 HydrophobicContact CG2-CD1 3.83Å; I32-I36 WeakPolarHBondContact O-CD1 3.25Å; I32-I36 WeakPolarHBondContact O-CG1 3.33Å; I32-I36 PolarHBondContact O-N 3.46Å; I32-L69 HydrophobicContact CD1-CD2 4.16Å; I32-L70 HydrophobicContact CG2-CB 4.15Å; I32-L70 HydrophobicContact CG2-CD1 4.04Å; I32-I73 HydrophobicContact CD1-CD1 3.42Å; I32-I73 VanDerWaalsContact CD1-CD1 3.42Å; I32-Y272 HydrophobicContact CG1-CD2 4.49Å
33L90.4Very high85.6Confident57 Ų5752.4 Ų52.430%0.29828%0.282SS..Hα-helixtrans-59.6-48.3174.4-178.767.8000111.2F29 L30 I31 K35 I36 L37 L70F29-L33 HydrophobicContact CE1-CD2 4.3Å; F29-L33 VanDerWaalsContact O-CB 3.29Å; F29-L33 WeakPolarHBondContact O-CB 3.2Å; F29-L33 PolarHBondContact O-N 3.19Å; L30-L33 PolarHBondContact O-N 3.33Å; I31-L33 VanDerWaalsContact C-N 3.35Å; L33-K35 VanDerWaalsContact C-N 3.31Å; L33-K35 PolarHBondContact O-N 2.96Å; L33-I36 PolarHBondContact O-N 3.46Å; L33-L37 HydrophobicContact CG-CD1 4.21Å; L33-L37 WeakPolarHBondContact O-CG 3.38Å; L33-L37 PolarHBondContact O-N 2.07Å; L33-L70 HydrophobicContact CB-CD1 4.48Å; L33-L70 HydrophobicContact CD1-CD2 3.91Å
34G90.2Very high86.2Confident36 Ų3651.6 Ų51.637%0.37129%0.294SS..Hα-helixtrans-58.1-42.9176.300000112.3L30 I31 I36 L37 L38L30-G34 PolarHBondContact O-N 3.28Å; I31-G34 PolarHBondContact O-N 2.83Å; G34-I36 PolarHBondContact O-N 3.35Å; G34-L37 PolarHBondContact O-N 3.39Å; G34-L38 WeakPolarHBondContact O-CB 3.23Å; G34-L38 PolarHBondContact O-N 3.41Å
35K91Very high86.7Confident10 Ų1054 Ų544%0.04330%0.302CS..Hα-helixtrans-58.5-46.2174.2-175.5-167.4179.1-1690111.9I31 I32 L33 L38 N39 D66 Y272 M275 N276I31-K35 PolarHBondContact O-N 2.89Å; I32-K35 WeakPolarHBondContact O-CB 3.33Å; I32-K35 PolarHBondContact O-N 2.85Å; L33-K35 VanDerWaalsContact C-N 3.31Å; L33-K35 PolarHBondContact O-N 2.96Å; K35-L38 WeakPolarHBondContact O-CB 3.47Å; K35-L38 PolarHBondContact O-N 3.44Å; K35-N39 WeakPolarHBondContact O-CB 3.49Å; K35-N39 VanDerWaalsContact O-CG 3.3Å; K35-N39 PolarHBondContact O-N 2.76Å; K35-D66 VanDerWaalsContact CE-OD2 3.23Å; K35-D66 WeakPolarHBondContact CE-OD2 3.26Å; K35-D66 IonicContact NZ-OD1 3.84Å; K35-D66 PolarHBondContact NZ-OD1 3.27Å; K35-D66 IonicContact NZ-OD2 2.64Å; K35-D66 PolarHBondContact NZ-OD2 3.17Å; K35-Y272 WeakPolarHBondContact CE-O 2.98Å; K35-Y272 PolarHBondContact NZ-O 2.91Å; K35-M275 WeakPolarHBondContact CE-O 3.3Å; K35-M275 PolarHBondContact NZ-O 3.39Å; K35-N276 HydrophobicContact CG-CB 4.47Å
36I90.9Very high86.8Confident9 Ų955.3 Ų55.35%0.04631%0.306CS..Hα-helixtrans-66.9-43.8-179.1-71.5159.4000111.3I32 L33 G34 L38 N39 I40 D66 L70I32-I36 HydrophobicContact CG2-CD1 3.83Å; I32-I36 WeakPolarHBondContact O-CD1 3.25Å; I32-I36 WeakPolarHBondContact O-CG1 3.33Å; I32-I36 PolarHBondContact O-N 3.46Å; L33-I36 PolarHBondContact O-N 3.46Å; G34-I36 PolarHBondContact O-N 3.35Å; I36-L38 VanDerWaalsContact C-N 3.29Å; I36-L38 PolarHBondContact O-N 3.02Å; I36-N39 WeakPolarHBondContact O-CB 3.3Å; I36-N39 PolarHBondContact O-N 3.49Å; I36-I40 HydrophobicContact CG2-CD1 3.65Å; I36-I40 HydrophobicContact CG2-CG1 4.27Å; I36-I40 WeakPolarHBondContact O-CG1 3.32Å; I36-I40 PolarHBondContact O-N 3.08Å; I36-D66 HydrophobicContact CD1-CB 4.26Å; I36-D66 WeakPolarHBondContact CD1-O 3.03Å; I36-D66 HydrophobicContact CG1-CB 3.74Å; I36-L70 HydrophobicContact CD1-CB 3.41Å; I36-L70 VanDerWaalsContact CD1-CB 3.41Å; I36-L70 HydrophobicContact CD1-CD1 4.44Å; I36-L70 HydrophobicContact CD1-CD2 3.57Å; I36-L70 HydrophobicContact CD1-CG 3.97Å
37L91.1Very high86.4Confident102 Ų10258.4 Ų58.453%0.53431%0.309SS..Hα-helixtrans-58.9-44.5175.6-70.6174.6000110.9L33 G34 N39 I40 F41L33-L37 HydrophobicContact CG-CD1 4.21Å; L33-L37 WeakPolarHBondContact O-CG 3.38Å; L33-L37 PolarHBondContact O-N 2.07Å; G34-L37 PolarHBondContact O-N 3.39Å; L37-N39 PolarHBondContact O-N 3.1Å; L37-I40 PolarHBondContact O-N 2.92Å; L37-F41 WeakPolarHBondContact O-CB 3.44Å; L37-F41 PolarHBondContact O-N 3.49Å
38L90Very high85.3Confident80 Ų8064 Ų6442%0.41933%0.33SS..Hα-helixtrans-60.2-44.9174.8-179.165.2000111.8G34 K35 I36 F41 T42 P278G34-L38 WeakPolarHBondContact O-CB 3.23Å; G34-L38 PolarHBondContact O-N 3.41Å; K35-L38 WeakPolarHBondContact O-CB 3.47Å; K35-L38 PolarHBondContact O-N 3.44Å; I36-L38 VanDerWaalsContact C-N 3.29Å; I36-L38 PolarHBondContact O-N 3.02Å; L38-F41 PolarHBondContact O-N 2.81Å; L38-T42 WeakPolarHBondContact O-CB 3.39Å; L38-T42 PolarHBondContact O-N 2.73Å; L38-T42 PolarHBondContact O-OG1 3Å; L38-P278 HydrophobicContact CD1-CG 4.13Å; L38-P278 HydrophobicContact CD2-CG 3.9Å; L38-P278 HydrophobicContact CG-CG 3.75Å
39N91.5Very high84Confident1 Ų170.2 Ų70.21%0.00536%0.363CS..Hα-helixtrans-61-48.6177.7-79.9-9000112.1K35 I36 L37 T42 L43 D66 I277K35-N39 WeakPolarHBondContact O-CB 3.49Å; K35-N39 VanDerWaalsContact O-CG 3.3Å; K35-N39 PolarHBondContact O-N 2.76Å; I36-N39 WeakPolarHBondContact O-CB 3.3Å; I36-N39 PolarHBondContact O-N 3.49Å; L37-N39 PolarHBondContact O-N 3.1Å; N39-T42 PolarHBondContact O-N 3.42Å; N39-L43 WeakPolarHBondContact O-CG 3.07Å; N39-L43 PolarHBondContact O-N 3.12Å; N39-D66 PolarHBondContact ND2-OD2 3.02Å; N39-I277 HydrophobicContact CB-CB 4.28Å; N39-I277 HydrophobicContact CB-CD1 3.68Å; N39-I277 HydrophobicContact CB-CG1 3.98Å; N39-I277 WeakPolarHBondContact OD1-CB 3.31Å; N39-I277 WeakPolarHBondContact OD1-CG1 3.34Å; N39-I277 PolarHBondContact OD1-N 2.71Å
40I88.6Confident82.7Confident96 Ų9668.5 Ų68.549%0.49236%0.357SS..Hα-helixtrans-63.7-46178.8-67.9169.6000110.6I36 L37 T42 L43 G44I36-I40 HydrophobicContact CG2-CD1 3.65Å; I36-I40 HydrophobicContact CG2-CG1 4.27Å; I36-I40 WeakPolarHBondContact O-CG1 3.32Å; I36-I40 PolarHBondContact O-N 3.08Å; L37-I40 PolarHBondContact O-N 2.92Å; I40-T42 VanDerWaalsContact C-N 3.32Å; I40-T42 PolarHBondContact O-N 3.48Å; I40-L43 PolarHBondContact O-N 3.09Å; I40-G44 PolarHBondContact O-N 2.86Å
41F88.4Confident81.2Confident129 Ų12968.1 Ų68.157%0.56636%0.36SS*.Hα-helixtrans-58.8-45.5178.3179.6-108.9000111.3L37 L38 L43 G44 M45L37-F41 WeakPolarHBondContact O-CB 3.44Å; L37-F41 PolarHBondContact O-N 3.49Å; L38-F41 PolarHBondContact O-N 2.81Å; F41-L43 PolarHBondContact O-N 3.1Å; F41-G44 PolarHBondContact O-N 3.35Å; F41-G44 VanDerWaalsContact O-N 3.12Å; F41-M45 HydrophobicContact CD1-CG 4.38Å; F41-M45 HydrophobicContact CD1-SD 3.75Å; F41-M45 HydrophobicContact CD2-CG 4.48Å; F41-M45 HydrophobicContact CE1-CE 4.45Å; F41-M45 HydrophobicContact CE1-CG 4.07Å; F41-M45 HydrophobicContact CE1-SD 3.08Å; F41-M45 WeakPolarHBondContact CE1-SD 3.41Å; F41-M45 HydrophobicContact CE2-CG 4.14Å; F41-M45 HydrophobicContact CE2-SD 4.07Å; F41-M45 HydrophobicContact CG-SD 4.49Å; F41-M45 HydrophobicContact CZ-CE 4.33Å; F41-M45 HydrophobicContact CZ-CG 3.93Å; F41-M45 HydrophobicContact CZ-SD 3.26Å; F41-M45 WeakPolarHBondContact CZ-SD 3.21Å; F41-M45 WeakPolarHBondContact O-CG 3.42Å; F41-M45 PolarHBondContact O-N 2.84Å
42T86.4Confident80.3Confident13 Ų1368.1 Ų68.18%0.0836%0.359CS..Hα-helixtrans-64.2-42.1178.4-52.40000111.7L38 N39 I40 G44 M45 I277 P278 Y281 F311L38-T42 WeakPolarHBondContact O-CB 3.39Å; L38-T42 PolarHBondContact O-N 2.73Å; L38-T42 PolarHBondContact O-OG1 3Å; N39-T42 PolarHBondContact O-N 3.42Å; I40-T42 VanDerWaalsContact C-N 3.32Å; I40-T42 PolarHBondContact O-N 3.48Å; T42-G44 VanDerWaalsContact C-N 3.29Å; T42-G44 PolarHBondContact O-N 3.06Å; T42-M45 PolarHBondContact O-N 3.22Å; T42-I277 HydrophobicContact CG2-CG2 3.88Å; T42-P278 HydrophobicContact CG2-CG 4.27Å; T42-P278 WeakPolarHBondContact OG1-CG 3.19Å; T42-Y281 HydrophobicContact CG2-CD2 3.69Å; T42-Y281 HydrophobicContact CG2-CE2 4.01Å; T42-F311 HydrophobicContact CG2-CE1 4.48Å; T42-F311 HydrophobicContact CG2-CE2 4.2Å; T42-F311 HydrophobicContact CG2-CZ 3.65Å; T42-F311 WeakPolarHBondContact O-CZ 3.23Å
43L85.9Confident79.9Confident47 Ų4768.9 Ų68.925%0.24636%0.363CS..Hα-helixtrans-61.8-37.1172.9-75.2173.5000112.2N39 I40 F41 C59 A63 I277 Y281N39-L43 WeakPolarHBondContact O-CG 3.07Å; N39-L43 PolarHBondContact O-N 3.12Å; I40-L43 PolarHBondContact O-N 3.09Å; F41-L43 PolarHBondContact O-N 3.1Å; L43-C59 HydrophobicContact CD2-CB 4.23Å; L43-A63 HydrophobicContact CD1-CB 3.93Å; L43-I277 HydrophobicContact CD1-CD1 3.53Å; L43-I277 HydrophobicContact CD2-CD1 4.06Å; L43-I277 HydrophobicContact CD2-CG2 4.34Å; L43-I277 HydrophobicContact CG-CD1 3.6Å; L43-I277 HydrophobicContact CG-CG2 4.3Å; L43-Y281 HydrophobicContact CD2-CE2 4.4Å
44G83.6Confident79.9Confident66 Ų6666.2 Ų66.268%0.6835%0.349SS*.Hα-helixtrans-71.6-34.4178.700000114.1I40 F41 T42 R46I40-G44 PolarHBondContact O-N 2.86Å; F41-G44 PolarHBondContact O-N 3.35Å; F41-G44 VanDerWaalsContact O-N 3.12Å; T42-G44 VanDerWaalsContact C-N 3.29Å; T42-G44 PolarHBondContact O-N 3.06Å; G44-R46 VanDerWaalsContact C-N 3.25Å; G44-R46 PolarHBondContact O-N 3.18Å
45M83.1Confident79.8Confident112 Ų11264.7 Ų64.755%0.55233%0.333SS*.Hα-helixtrans-74.1-12.9178.8-73.9-173.180.600114.2F41 T42 F311F41-M45 HydrophobicContact CD1-CG 4.38Å; F41-M45 HydrophobicContact CD1-SD 3.75Å; F41-M45 HydrophobicContact CD2-CG 4.48Å; F41-M45 HydrophobicContact CE1-CE 4.45Å; F41-M45 HydrophobicContact CE1-CG 4.07Å; F41-M45 HydrophobicContact CE1-SD 3.08Å; F41-M45 WeakPolarHBondContact CE1-SD 3.41Å; F41-M45 HydrophobicContact CE2-CG 4.14Å; F41-M45 HydrophobicContact CE2-SD 4.07Å; F41-M45 HydrophobicContact CG-SD 4.49Å; F41-M45 HydrophobicContact CZ-CE 4.33Å; F41-M45 HydrophobicContact CZ-CG 3.93Å; F41-M45 HydrophobicContact CZ-SD 3.26Å; F41-M45 WeakPolarHBondContact CZ-SD 3.21Å; F41-M45 WeakPolarHBondContact O-CG 3.42Å; F41-M45 PolarHBondContact O-N 2.84Å; T42-M45 PolarHBondContact O-N 3.22Å; M45-F311 HydrophobicContact CB-CE1 4.24Å
46R77.8Confident79.6Confident47 Ų4765.6 Ų65.618%0.17734%0.337CS..SBendtrans-62.6141.8-176.9162.1167.7164.2-128.7-0.6112.1G44 K48 T50 E56 Y281 P310G44-R46 VanDerWaalsContact C-N 3.25Å; G44-R46 PolarHBondContact O-N 3.18Å; R46-K48 PolarHBondContact O-N 3.03Å; R46-T50 PolarHBondContact NE-OG1 2.87Å; R46-T50 PolarHBondContact NH2-OG1 2.93Å; R46-E56 IonicContact CZ-OE1 2.66Å; R46-E56 IonicContact CZ-OE2 3.64Å; R46-E56 VanDerWaalsContact NH1-CG 3.34Å; R46-E56 IonicContact NH1-OE1 3.18Å; R46-E56 PolarHBondContact NH1-OE1 2.84Å; R46-E56 IonicContact NH1-OE2 2.85Å; R46-E56 IonicContact NH2-OE1 3.56Å; R46-E56 PolarHBondContact NH2-OE1 2.86Å; R46-E56 IonicContact NH2-OE2 3.19Å; R46-E56 PolarHBondContact NH2-OE2 3.34Å; R46-Y281 WeakPolarHBondContact CD-OH 3.4Å; R46-P310 HydrophobicContact CB-CB 4.22Å; R46-P310 HydrophobicContact CG-CB 3.53Å
47R68.4Low79.6Confident123 Ų12366.6 Ų66.646%0.46434%0.34SS..  trans-64.9130173.5-67.8174.3176.8179.6-1.1112.1N49 T50 P310R47-N49 VanDerWaalsContact C-N 3.27Å; R47-N49 PolarHBondContact O-N 3.22Å; R47-N49 VanDerWaalsContact O-N 3.17Å; R47-T50 PolarHBondContact O-OG1 3.39Å; R47-P310 WeakPolarHBondContact CG-O 3.43Å; R47-P310 PolarHBondContact N-O 3.43Å
48K60Low79.7Confident205 Ų20561.7 Ų61.789%0.89132%0.315SS*.THydrogen-bonded Turntrans-65.2-15.9-172.7-68-177.9178.5178.20116.1R46R46-K48 PolarHBondContact O-N 3.03Å
49N56.4Low79.7Confident143 Ų14357.9 Ų57.977%0.76530%0.295SS*.THydrogen-bonded Turntrans-10211.2-170.8-73.40.9000115.1R47 L308R47-N49 VanDerWaalsContact C-N 3.27Å; R47-N49 PolarHBondContact O-N 3.22Å; R47-N49 VanDerWaalsContact O-N 3.17Å; N49-L308 VanDerWaalsContact O-CD1 3.25Å; N49-L308 WeakPolarHBondContact O-CD1 3.1Å
50T59.6Low79.7Confident18 Ų1861.9 Ų61.911%0.1132%0.315CS..  trans-73.6131.3178.646.80000111.9R46 R47 L308 P310R46-T50 PolarHBondContact NE-OG1 2.87Å; R46-T50 PolarHBondContact NH2-OG1 2.93Å; R47-T50 PolarHBondContact O-OG1 3.39Å; T50-L308 HydrophobicContact CG2-CB 4.14Å; T50-P310 HydrophobicContact CG2-CB 3.98Å
51C55.7Low80Confident79 Ų7958.4 Ų58.453%0.53430%0.299SS..  trans-54.7144.7168.7-65.70000111.1N53C51-N53 PolarHBondContact O-N 3.41Å
52Q68.9Low80.2Confident55 Ų5552.2 Ų52.226%0.25727%0.272SS..  trans-73.6106.6-178.3-70.8-176.8-2.900110.9E56 Y57 F132Q52-E56 WeakPolarHBondContact CA-OE2 3.48Å; Q52-Y57 HydrophobicContact CB-CE2 4.08Å; Q52-Y57 PolarHBondContact OE1-OH 3.14Å; Q52-F132 HydrophobicContact CB-CE2 4.43Å; Q52-F132 VanDerWaalsContact CD-CZ 3.43Å; Q52-F132 HydrophobicContact CG-CE2 4.34Å; Q52-F132 HydrophobicContact CG-CZ 4.24Å
53N81.1Confident80.5Confident18 Ų1852.5 Ų52.510%0.09628%0.276CS..  trans-107.8165.7176.4-62.6-8.1000110.6C51 M55 E56 Y120C51-N53 PolarHBondContact O-N 3.41Å; N53-M55 VanDerWaalsContact C-N 3.26Å; N53-M55 PolarHBondContact O-N 3.49Å; N53-E56 WeakPolarHBondContact O-CB 3.31Å; N53-E56 PolarHBondContact O-N 2.82Å; N53-E56 VanDerWaalsContact O-N 3.12Å; N53-Y120 WeakPolarHBondContact ND2-CE1 3.4Å; N53-Y120 PolarHBondContact ND2-OH 2.7Å
54F89.1Confident80.8Confident1 Ų156.4 Ų56.40%0.00429%0.291CS..Hα-helixtrans-51.3-43.5177.9165.3-103.4000113.1E56 Y57 F58 V112 I115 A116 D119 Y139 T142 V143 I146F54-E56 PolarHBondContact O-N 3.43Å; F54-Y57 PolarHBondContact O-N 2.95Å; F54-F58 HydrophobicContact CE1-CB 4.45Å; F54-F58 HydrophobicContact CZ-CB 4.22Å; F54-F58 HydrophobicContact CZ-CD2 4.33Å; F54-F58 HydrophobicContact CZ-CG 4.42Å; F54-F58 PolarHBondContact O-N 3.35Å; F54-V112 HydrophobicContact CE1-CG1 4.14Å; F54-I115 HydrophobicContact CD1-CB 4.42Å; F54-I115 HydrophobicContact CD1-CG2 3.82Å; F54-I115 HydrophobicContact CD2-CG2 3.83Å; F54-I115 HydrophobicContact CE1-CB 3.98Å; F54-I115 HydrophobicContact CE1-CG2 3.72Å; F54-I115 HydrophobicContact CE2-CG2 3.74Å; F54-I115 HydrophobicContact CG-CG2 3.87Å; F54-I115 HydrophobicContact CZ-CB 4.08Å; F54-I115 HydrophobicContact CZ-CG2 3.69Å; F54-A116 HydrophobicContact CD1-CB 4.12Å; F54-A116 HydrophobicContact CE1-CB 4.43Å; F54-D119 HydrophobicContact CB-CB 4.12Å; F54-D119 WeakPolarHBondContact CB-OD2 3.41Å; F54-D119 PolarHBondContact N-OD2 3.37Å; F54-Y139 HydrophobicContact CB-CD1 3.9Å; F54-Y139 HydrophobicContact CB-CE1 3.91Å; F54-Y139 HydrophobicContact CD2-CD1 4.4Å; F54-T142 HydrophobicContact CD2-CG2 4.39Å; F54-T142 HydrophobicContact CE2-CG2 4.01Å; F54-V143 HydrophobicContact CD2-CG2 4.18Å; F54-V143 HydrophobicContact CE2-CG2 3.7Å; F54-I146 HydrophobicContact CE2-CD1 3.7Å; F54-I146 HydrophobicContact CZ-CD1 3.46Å; F54-I146 VanDerWaalsContact CZ-CD1 3.46Å
55M88.9Confident81.3Confident4 Ų455.1 Ų55.12%0.0227%0.268CS..Hα-helixtrans-59.2-32-177.6-78.5-64.7-121.800113.5N53 C59 V112 A116 L280 V283 N284N53-M55 VanDerWaalsContact C-N 3.26Å; N53-M55 PolarHBondContact O-N 3.49Å; M55-C59 WeakPolarHBondContact O-CB 3.49Å; M55-C59 PolarHBondContact O-N 2.89Å; M55-C59 PolarHBondContact O-SG 2.62Å; M55-V112 HydrophobicContact CE-CG1 4.43Å; M55-V112 HydrophobicContact SD-CG1 3.83Å; M55-A116 HydrophobicContact CE-CB 4.1Å; M55-A116 HydrophobicContact CG-CB 3.8Å; M55-A116 HydrophobicContact SD-CB 3.86Å; M55-L280 HydrophobicContact CE-CD2 4.24Å; M55-L280 HydrophobicContact SD-CD2 4.46Å; M55-V283 HydrophobicContact CE-CB 4.35Å; M55-V283 HydrophobicContact CE-CG1 4.02Å; M55-N284 WeakPolarHBondContact CB-OD1 3.36Å; M55-N284 HydrophobicContact CE-CB 4.31Å; M55-N284 VanDerWaalsContact CG-OD1 3.32Å; M55-N284 WeakPolarHBondContact CG-OD1 3.29Å
56E87.3Confident81.7Confident29 Ų2949.9 Ų49.914%0.13624%0.242CC..Hα-helixtrans-67.3-49.4177.3174.3-179.2-174.100111.7R46 Q52 N53 F54 F58 C59 I60R46-E56 IonicContact CZ-OE1 2.66Å; R46-E56 IonicContact CZ-OE2 3.64Å; R46-E56 VanDerWaalsContact NH1-CG 3.34Å; R46-E56 IonicContact NH1-OE1 3.18Å; R46-E56 PolarHBondContact NH1-OE1 2.84Å; R46-E56 IonicContact NH1-OE2 2.85Å; R46-E56 IonicContact NH2-OE1 3.56Å; R46-E56 PolarHBondContact NH2-OE1 2.86Å; R46-E56 IonicContact NH2-OE2 3.19Å; R46-E56 PolarHBondContact NH2-OE2 3.34Å; Q52-E56 WeakPolarHBondContact CA-OE2 3.48Å; N53-E56 WeakPolarHBondContact O-CB 3.31Å; N53-E56 PolarHBondContact O-N 2.82Å; N53-E56 VanDerWaalsContact O-N 3.12Å; F54-E56 PolarHBondContact O-N 3.43Å; E56-F58 PolarHBondContact O-N 3.28Å; E56-C59 PolarHBondContact O-N 3.34Å; E56-I60 HydrophobicContact CG-CD1 4.1Å; E56-I60 WeakPolarHBondContact O-CG1 3.31Å; E56-I60 PolarHBondContact O-N 2.91Å
57Y89.5Confident82.4Confident30 Ų3051.6 Ų51.612%0.11825%0.254CS..Hα-helixtrans-59.9-40.8177.5-77.5-84.5000111.1Q52 F54 I60 S61 K136 Y139Q52-Y57 HydrophobicContact CB-CE2 4.08Å; Q52-Y57 PolarHBondContact OE1-OH 3.14Å; F54-Y57 PolarHBondContact O-N 2.95Å; Y57-I60 PolarHBondContact O-N 3.42Å; Y57-S61 PolarHBondContact O-N 3.42Å; Y57-K136 HydrophobicContact CE1-CD 4.42Å; Y57-K136 HydrophobicContact CE1-CG 3.99Å; Y57-K136 WeakPolarHBondContact OH-CD 3.42Å; Y57-K136 VanDerWaalsContact OH-CE 3.28Å; Y57-K136 WeakPolarHBondContact OH-CE 3.48Å; Y57-K136 WeakPolarHBondContact OH-CG 3.46Å; Y57-Y139 AromaticContact CD2-CD2 3.85Å; Y57-Y139 HydrophobicContact CD2-CD2 3.85Å; Y57-Y139 HydrophobicContact CD2-CG 4.21Å; Y57-Y139 AromaticContact CE2-CD2 3.87Å; Y57-Y139 HydrophobicContact CE2-CD2 3.87Å
58F92.9Very high83.6Confident0 Ų049.9 Ų49.90%025%0.254CS..Hα-helixtrans-64.3-44.6176.7-173-95000111.9F54 E56 I60 S61 L62 L108 V112 V143 W147 M275 L280F54-F58 HydrophobicContact CE1-CB 4.45Å; F54-F58 HydrophobicContact CZ-CB 4.22Å; F54-F58 HydrophobicContact CZ-CD2 4.33Å; F54-F58 HydrophobicContact CZ-CG 4.42Å; F54-F58 PolarHBondContact O-N 3.35Å; E56-F58 PolarHBondContact O-N 3.28Å; F58-I60 PolarHBondContact O-N 3.12Å; F58-S61 PolarHBondContact O-N 3.43Å; F58-S61 VanDerWaalsContact O-N 3.17Å; F58-S61 PolarHBondContact O-OG 3.49Å; F58-L62 PolarHBondContact O-N 2.97Å; F58-L108 HydrophobicContact CE2-CD2 3.97Å; F58-L108 HydrophobicContact CE2-CG 4.14Å; F58-L108 HydrophobicContact CZ-CD2 3.45Å; F58-L108 VanDerWaalsContact CZ-CD2 3.45Å; F58-L108 HydrophobicContact CZ-CG 3.75Å; F58-V112 HydrophobicContact CD1-CG1 3.8Å; F58-V112 HydrophobicContact CD1-CG2 4.11Å; F58-V112 HydrophobicContact CD2-CG2 3.87Å; F58-V112 HydrophobicContact CE1-CB 4.44Å; F58-V112 HydrophobicContact CE1-CG1 3.93Å; F58-V112 HydrophobicContact CE1-CG2 3.7Å; F58-V112 HydrophobicContact CE2-CG2 3.42Å; F58-V112 VanDerWaalsContact CE2-CG2 3.42Å; F58-V112 HydrophobicContact CG-CG1 4.2Å; F58-V112 HydrophobicContact CG-CG2 4.21Å; F58-V112 HydrophobicContact CZ-CB 4.49Å; F58-V112 HydrophobicContact CZ-CG1 4.42Å; F58-V112 HydrophobicContact CZ-CG2 3.34Å; F58-V143 HydrophobicContact CB-CG2 4.2Å; F58-V143 HydrophobicContact CD2-CG1 4.35Å; F58-V143 HydrophobicContact CD2-CG2 4.36Å; F58-W147 HydrophobicContact CE2-CZ2 4.25Å; F58-W147 AromaticContact CE2-NE1 3.99Å; F58-W147 HydrophobicContact CZ-CZ2 4.25Å; F58-M275 HydrophobicContact CE1-CE 3.56Å; F58-M275 HydrophobicContact CZ-CE 3.68Å; F58-M275 HydrophobicContact CZ-SD 4.44Å; F58-L280 HydrophobicContact CD1-CD1 3.76Å; F58-L280 HydrophobicContact CD1-CD2 4.07Å; F58-L280 HydrophobicContact CE1-CD1 3.75Å; F58-L280 HydrophobicContact CE1-CD2 3.99Å
59C91.4Very high85.1Confident0 Ų040.6 Ų40.60%021%0.214CC..Hα-helixtrans-59.4-42.5175.5-70.70000112.7L43 M55 E56 S61 L62 A63 I277L43-C59 HydrophobicContact CD2-CB 4.23Å; M55-C59 WeakPolarHBondContact O-CB 3.49Å; M55-C59 PolarHBondContact O-N 2.89Å; M55-C59 PolarHBondContact O-SG 2.62Å; E56-C59 PolarHBondContact O-N 3.34Å; C59-S61 VanDerWaalsContact C-N 3.35Å; C59-L62 PolarHBondContact O-N 3.18Å; C59-A63 PolarHBondContact O-N 3.36Å; C59-I277 HydrophobicContact CB-CD1 4.27Å; C59-I277 HydrophobicContact CB-CG1 4.3Å; C59-I277 HydrophobicContact CB-CG2 4.45Å; C59-I277 WeakPolarHBondContact O-CD1 3.07Å
60I90.9Very high86.8Confident85 Ų8534.6 Ų34.644%0.43618%0.182SC..Hα-helixtrans-62.7-44.2175.9-65.5166.9000110.2E56 Y57 F58 L62 A63 F64E56-I60 HydrophobicContact CG-CD1 4.1Å; E56-I60 WeakPolarHBondContact O-CG1 3.31Å; E56-I60 PolarHBondContact O-N 2.91Å; Y57-I60 PolarHBondContact O-N 3.42Å; F58-I60 PolarHBondContact O-N 3.12Å; I60-L62 VanDerWaalsContact C-N 3.32Å; I60-L62 PolarHBondContact O-N 2.88Å; I60-A63 PolarHBondContact O-N 3.39Å; I60-F64 PolarHBondContact O-N 2.81Å; I60-F64 VanDerWaalsContact O-N 3.08Å
61S94.1Very high88.3Confident22 Ų2237 Ų3715%0.15420%0.197CC..Hα-helixtrans-62.6-39177.3790000112.4Y57 F58 C59 F64 I65 V143 W147Y57-S61 PolarHBondContact O-N 3.42Å; F58-S61 PolarHBondContact O-N 3.43Å; F58-S61 VanDerWaalsContact O-N 3.17Å; F58-S61 PolarHBondContact O-OG 3.49Å; C59-S61 VanDerWaalsContact C-N 3.35Å; S61-F64 WeakPolarHBondContact O-CB 3Å; S61-F64 PolarHBondContact O-N 2.91Å; S61-I65 WeakPolarHBondContact O-CG1 3.35Å; S61-I65 PolarHBondContact O-N 3.3Å; S61-V143 VanDerWaalsContact OG-CG1 3.3Å; S61-V143 WeakPolarHBondContact OG-CG1 3.35Å; S61-W147 PolarHBondContact OG-NE1 3.27Å
62L93.8Very high89.9Confident0 Ų035.8 Ų35.80%019%0.185CC..Hα-helixtrans-64-46.6177.5-177.267.2000111.3F58 C59 I60 F64 I65 D66 Y105 W147 M275 I277 L280F58-L62 PolarHBondContact O-N 2.97Å; C59-L62 PolarHBondContact O-N 3.18Å; I60-L62 VanDerWaalsContact C-N 3.32Å; I60-L62 PolarHBondContact O-N 2.88Å; L62-F64 PolarHBondContact O-N 3.07Å; L62-I65 PolarHBondContact O-N 3.42Å; L62-D66 PolarHBondContact O-N 3.4Å; L62-Y105 HydrophobicContact CD1-CD1 4.36Å; L62-Y105 HydrophobicContact CD1-CE1 3.72Å; L62-Y105 HydrophobicContact CD1-CE2 4.42Å; L62-W147 HydrophobicContact CD1-CH2 3.94Å; L62-W147 HydrophobicContact CD1-CZ2 4.14Å; L62-M275 HydrophobicContact CD2-CG 4.28Å; L62-I277 HydrophobicContact CD2-CG1 4.34Å; L62-L280 HydrophobicContact CD2-CD1 3.59Å
63A92.4Very high90.8Very high18 Ų1833.2 Ų33.215%0.14917%0.173CC..Hα-helixtrans-57.5-39.5174.900000112.1L43 C59 I60 L67 I277L43-A63 HydrophobicContact CD1-CB 3.93Å; C59-A63 PolarHBondContact O-N 3.36Å; I60-A63 PolarHBondContact O-N 3.39Å; A63-L67 WeakPolarHBondContact O-CB 3.08Å; A63-L67 PolarHBondContact O-N 3.48Å; A63-I277 HydrophobicContact CB-CD1 3.98Å
64F92.3Very high91.2Very high130 Ų13034.3 Ų34.357%0.5718%0.182SC*.Hα-helixtrans-65.5-43.9177.2-179.2-101.1000112.4I60 S61 L62 L67 L68I60-F64 PolarHBondContact O-N 2.81Å; I60-F64 VanDerWaalsContact O-N 3.08Å; S61-F64 WeakPolarHBondContact O-CB 3Å; S61-F64 PolarHBondContact O-N 2.91Å; L62-F64 PolarHBondContact O-N 3.07Å; F64-L67 PolarHBondContact O-N 3.25Å; F64-L68 WeakPolarHBondContact O-CB 3.45Å; F64-L68 PolarHBondContact O-N 2.61Å
65I93.4Very high91.2Very high38 Ų3837.4 Ų37.420%0.19520%0.198CC..Hα-helixtrans-65.9-42.3177.1-64.9-64.5000111.4S61 L62 L67 L68 L69 I101 W147S61-I65 WeakPolarHBondContact O-CG1 3.35Å; S61-I65 PolarHBondContact O-N 3.3Å; L62-I65 PolarHBondContact O-N 3.42Å; I65-L67 VanDerWaalsContact C-N 3.34Å; I65-L67 PolarHBondContact O-N 3.12Å; I65-L68 WeakPolarHBondContact O-CB 3.21Å; I65-L68 PolarHBondContact O-N 2.91Å; I65-L69 PolarHBondContact O-N 2.87Å; I65-I101 HydrophobicContact CG2-CD1 3.73Å; I65-W147 HydrophobicContact CB-CH2 4.26Å; I65-W147 HydrophobicContact CB-CZ2 4.44Å; I65-W147 HydrophobicContact CG1-CD2 4.5Å; I65-W147 HydrophobicContact CG1-CH2 4.09Å; I65-W147 HydrophobicContact CG1-CZ2 3.96Å; I65-W147 HydrophobicContact CG1-CZ3 4.39Å; I65-W147 HydrophobicContact CG2-CH2 4.18Å; I65-W147 HydrophobicContact CG2-CZ3 4.28Å
66D92.7Very high91.1Very high2 Ų237.4 Ų37.41%0.01120%0.198CC..Hα-helixtrans-61.1-43.4175.5-80.9-39.1000110.9K35 I36 N39 L62 L69 L70 Y105K35-D66 VanDerWaalsContact CE-OD2 3.23Å; K35-D66 WeakPolarHBondContact CE-OD2 3.26Å; K35-D66 IonicContact NZ-OD1 3.84Å; K35-D66 PolarHBondContact NZ-OD1 3.27Å; K35-D66 IonicContact NZ-OD2 2.64Å; K35-D66 PolarHBondContact NZ-OD2 3.17Å; I36-D66 HydrophobicContact CD1-CB 4.26Å; I36-D66 WeakPolarHBondContact CD1-O 3.03Å; I36-D66 HydrophobicContact CG1-CB 3.74Å; N39-D66 PolarHBondContact ND2-OD2 3.02Å; L62-D66 PolarHBondContact O-N 3.4Å; D66-L69 WeakPolarHBondContact O-CB 3.2Å; D66-L69 PolarHBondContact O-N 2.92Å; D66-L70 PolarHBondContact O-N 3.05Å; D66-Y105 PolarHBondContact OD1-OH 2.89Å
67L92.1Very high90.9Very high83 Ų8338.6 Ų38.644%0.43521%0.205SC..Hα-helixtrans-62.2-44.4175.6-177.368.4000111.7A63 F64 I65 L69 L70 V71A63-L67 WeakPolarHBondContact O-CB 3.08Å; A63-L67 PolarHBondContact O-N 3.48Å; F64-L67 PolarHBondContact O-N 3.25Å; I65-L67 VanDerWaalsContact C-N 3.34Å; I65-L67 PolarHBondContact O-N 3.12Å; L67-L69 VanDerWaalsContact C-N 3.31Å; L67-L69 PolarHBondContact O-N 3.44Å; L67-L70 PolarHBondContact O-N 2.99Å; L67-V71 WeakPolarHBondContact O-CG2 3.4Å; L67-V71 PolarHBondContact O-N 3.41Å
68L92.8Very high90.7Very high88 Ų8845.9 Ų45.946%0.46123%0.234SC..Hα-helixtrans-58.2-45.1176-171.491000110.6F64 I65 V71 N72F64-L68 WeakPolarHBondContact O-CB 3.45Å; F64-L68 PolarHBondContact O-N 2.61Å; I65-L68 WeakPolarHBondContact O-CB 3.21Å; I65-L68 PolarHBondContact O-N 2.91Å; L68-V71 PolarHBondContact O-N 3.44Å; L68-N72 PolarHBondContact O-N 3.15Å; L68-N72 PolarHBondContact O-ND2 3.27Å
69L91.5Very high90.2Very high10 Ų1051.5 Ų51.55%0.05226%0.258CS..Hα-helixtrans-59.9-47.6176.7179.566000111.3I32 I65 D66 L67 V71 N72 I73 F97 I101I32-L69 HydrophobicContact CD1-CD2 4.16Å; I65-L69 PolarHBondContact O-N 2.87Å; D66-L69 WeakPolarHBondContact O-CB 3.2Å; D66-L69 PolarHBondContact O-N 2.92Å; L67-L69 VanDerWaalsContact C-N 3.31Å; L67-L69 PolarHBondContact O-N 3.44Å; L69-V71 PolarHBondContact O-N 2.9Å; L69-N72 PolarHBondContact O-N 3.38Å; L69-I73 HydrophobicContact CD1-CD1 3.92Å; L69-I73 HydrophobicContact CD1-CG1 4.28Å; L69-I73 HydrophobicContact CD2-CD1 4.49Å; L69-I73 HydrophobicContact CG-CD1 3.86Å; L69-I73 WeakPolarHBondContact O-CG1 3.26Å; L69-I73 PolarHBondContact O-N 2.98Å; L69-F97 HydrophobicContact CD1-CB 3.78Å; L69-I101 HydrophobicContact CD1-CG1 4.16Å; L69-I101 HydrophobicContact CD2-CB 4.27Å; L69-I101 HydrophobicContact CD2-CG1 4.12Å; L69-I101 HydrophobicContact CD2-CG2 4.07Å
70L92Very high89.3Confident16 Ų1660.6 Ų60.68%0.08429%0.292CS..Hα-helixtrans-60.3-44.9178.5-179.470.6000111.9F29 I32 L33 I36 D66 L67 N72 I73 S74F29-L70 HydrophobicContact CD2-CD1 3.76Å; F29-L70 HydrophobicContact CE2-CD1 3.43Å; F29-L70 VanDerWaalsContact CE2-CD1 3.43Å; F29-L70 HydrophobicContact CE2-CG 4.35Å; F29-L70 HydrophobicContact CZ-CD1 4.11Å; I32-L70 HydrophobicContact CG2-CB 4.15Å; I32-L70 HydrophobicContact CG2-CD1 4.04Å; L33-L70 HydrophobicContact CB-CD1 4.48Å; L33-L70 HydrophobicContact CD1-CD2 3.91Å; I36-L70 HydrophobicContact CD1-CB 3.41Å; I36-L70 VanDerWaalsContact CD1-CB 3.41Å; I36-L70 HydrophobicContact CD1-CD1 4.44Å; I36-L70 HydrophobicContact CD1-CD2 3.57Å; I36-L70 HydrophobicContact CD1-CG 3.97Å; D66-L70 PolarHBondContact O-N 3.05Å; L67-L70 PolarHBondContact O-N 2.99Å; L70-N72 PolarHBondContact O-N 3.36Å; L70-I73 PolarHBondContact O-N 3.02Å; L70-S74 WeakPolarHBondContact O-CB 3.33Å; L70-S74 PolarHBondContact O-N 3.2Å; L70-S74 PolarHBondContact O-OG 3.32Å
71V91.1Very high88.8Confident69 Ų6959.9 Ų59.942%0.41829%0.29SS..Hα-helixtrans-60.5-46.3177.8170.30000110.4L67 L68 L69 I73 S74 I75L67-V71 WeakPolarHBondContact O-CG2 3.4Å; L67-V71 PolarHBondContact O-N 3.41Å; L68-V71 PolarHBondContact O-N 3.44Å; L69-V71 PolarHBondContact O-N 2.9Å; V71-I73 PolarHBondContact O-N 2.87Å; V71-S74 WeakPolarHBondContact O-CB 3.31Å; V71-S74 PolarHBondContact O-N 3.13Å; V71-I75 HydrophobicContact CG1-CD1 3.79Å; V71-I75 HydrophobicContact CG1-CG1 4.46Å; V71-I75 VanDerWaalsContact O-CG1 3.27Å; V71-I75 WeakPolarHBondContact O-CG1 3.44Å; V71-I75 PolarHBondContact O-N 2.98Å
72N89.5Confident88.2Confident54 Ų5460.9 Ų60.929%0.28929%0.291SS..Hα-helixtrans-61.4-46177.7-80.2-75.3000112.2L68 L69 L70 S74 I75 I76 F97L68-N72 PolarHBondContact O-N 3.15Å; L68-N72 PolarHBondContact O-ND2 3.27Å; L69-N72 PolarHBondContact O-N 3.38Å; L70-N72 PolarHBondContact O-N 3.36Å; N72-S74 VanDerWaalsContact C-N 3.32Å; N72-S74 PolarHBondContact O-N 2.74Å; N72-I75 PolarHBondContact O-N 3.3Å; N72-I76 VanDerWaalsContact O-CG1 3.28Å; N72-I76 WeakPolarHBondContact O-CG1 3.5Å; N72-I76 PolarHBondContact O-N 2.9Å; N72-F97 HydrophobicContact CB-CD2 4.48Å; N72-F97 HydrophobicContact CB-CE2 4.49Å
73I88.4Confident87.7Confident1 Ų165.7 Ų65.71%0.00532%0.32CS..Hα-helixtrans-62.3-41.9176.9-67.5173.6000110.6F29 I32 L69 L70 V71 I75 I76 L77 I94F29-I73 HydrophobicContact CD2-CG2 4.36Å; I32-I73 HydrophobicContact CD1-CD1 3.42Å; I32-I73 VanDerWaalsContact CD1-CD1 3.42Å; L69-I73 HydrophobicContact CD1-CD1 3.92Å; L69-I73 HydrophobicContact CD1-CG1 4.28Å; L69-I73 HydrophobicContact CD2-CD1 4.49Å; L69-I73 HydrophobicContact CG-CD1 3.86Å; L69-I73 WeakPolarHBondContact O-CG1 3.26Å; L69-I73 PolarHBondContact O-N 2.98Å; L70-I73 PolarHBondContact O-N 3.02Å; V71-I73 PolarHBondContact O-N 2.87Å; I73-I75 PolarHBondContact O-N 3.47Å; I73-I76 PolarHBondContact O-N 2.84Å; I73-L77 HydrophobicContact CG2-CD1 3.76Å; I73-L77 HydrophobicContact CG2-CG 4.19Å; I73-L77 WeakPolarHBondContact O-CB 3.39Å; I73-L77 VanDerWaalsContact O-CG 3.31Å; I73-L77 WeakPolarHBondContact O-CG 3.43Å; I73-L77 PolarHBondContact O-N 2.74Å; I73-I94 HydrophobicContact CD1-CG2 4.41Å; I73-I94 HydrophobicContact CG1-CG2 4.19Å; I73-I94 HydrophobicContact CG2-CG2 4.1Å
74S88.9Confident87.3Confident41 Ų4169.4 Ų69.429%0.28734%0.337SS..Hα-helixtrans-60.1-46.7178.2-55.90000111.7F29 L70 V71 N72 I76 L77 Y78F29-S74 WeakPolarHBondContact CE2-OG 3.09Å; L70-S74 WeakPolarHBondContact O-CB 3.33Å; L70-S74 PolarHBondContact O-N 3.2Å; L70-S74 PolarHBondContact O-OG 3.32Å; V71-S74 WeakPolarHBondContact O-CB 3.31Å; V71-S74 PolarHBondContact O-N 3.13Å; N72-S74 VanDerWaalsContact C-N 3.32Å; N72-S74 PolarHBondContact O-N 2.74Å; S74-I76 PolarHBondContact O-N 2.85Å; S74-L77 PolarHBondContact O-N 2.66Å; S74-Y78 VanDerWaalsContact O-CB 3.26Å; S74-Y78 WeakPolarHBondContact O-CB 3.45Å; S74-Y78 PolarHBondContact O-N 3.21Å
75I88.4Confident86.7Confident65 Ų6570.5 Ų70.533%0.33335%0.348SS..Hα-helixtrans-59.5-48.1177.5-69.7167.9000109.7V71 N72 I73 L77 Y78 F79 F82V71-I75 HydrophobicContact CG1-CD1 3.79Å; V71-I75 HydrophobicContact CG1-CG1 4.46Å; V71-I75 VanDerWaalsContact O-CG1 3.27Å; V71-I75 WeakPolarHBondContact O-CG1 3.44Å; V71-I75 PolarHBondContact O-N 2.98Å; N72-I75 PolarHBondContact O-N 3.3Å; I73-I75 PolarHBondContact O-N 3.47Å; I75-L77 PolarHBondContact O-N 3.47Å; I75-Y78 PolarHBondContact O-N 3Å; I75-F79 HydrophobicContact CG2-CD2 3.75Å; I75-F79 HydrophobicContact CG2-CE2 4.06Å; I75-F79 VanDerWaalsContact O-CD2 3.24Å; I75-F79 WeakPolarHBondContact O-CD2 3.16Å; I75-F79 PolarHBondContact O-N 3.17Å; I75-F82 HydrophobicContact CG2-CE1 3.89Å; I75-F82 HydrophobicContact CG2-CZ 3.69Å
76I86.8Confident85.9Confident5 Ų574.4 Ų74.43%0.02638%0.379CS..Hα-helixtrans-65.9-39.2-179.4-59.7162.7000111.9N72 I73 S74 R80 F82 F89 H93 I94 F97N72-I76 VanDerWaalsContact O-CG1 3.28Å; N72-I76 WeakPolarHBondContact O-CG1 3.5Å; N72-I76 PolarHBondContact O-N 2.9Å; I73-I76 PolarHBondContact O-N 2.84Å; S74-I76 PolarHBondContact O-N 2.85Å; I76-R80 WeakPolarHBondContact O-CA 3.28Å; I76-R80 PolarHBondContact O-N 3.13Å; I76-F82 HydrophobicContact CG1-CE1 4.09Å; I76-F89 HydrophobicContact CD1-CD1 4.23Å; I76-F89 HydrophobicContact CG1-CB 4.41Å; I76-F89 HydrophobicContact CG1-CD1 4.43Å; I76-H93 HydrophobicContact CD1-CB 3.99Å; I76-I94 HydrophobicContact CB-CD1 4.21Å; I76-I94 HydrophobicContact CB-CG1 3.97Å; I76-I94 HydrophobicContact CD1-CG1 4.24Å; I76-I94 HydrophobicContact CG2-CD1 3.82Å; I76-I94 HydrophobicContact CG2-CG1 3.68Å; I76-F97 HydrophobicContact CD1-CD2 4.1Å; I76-F97 HydrophobicContact CD1-CE2 3.86Å
77L83.9Confident85.3Confident54 Ų5478.8 Ų78.828%0.28340%0.401SS..Hα-helixtrans-66.9-39.5176.3-73.6175.1000112.6N25 F29 I73 S74 I75 R80 I94N25-L77 HydrophobicContact CB-CD2 3.99Å; F29-L77 HydrophobicContact CB-CD1 4.19Å; F29-L77 HydrophobicContact CD2-CD1 4.12Å; F29-L77 HydrophobicContact CG-CD1 4.36Å; I73-L77 HydrophobicContact CG2-CD1 3.76Å; I73-L77 HydrophobicContact CG2-CG 4.19Å; I73-L77 WeakPolarHBondContact O-CB 3.39Å; I73-L77 VanDerWaalsContact O-CG 3.31Å; I73-L77 WeakPolarHBondContact O-CG 3.43Å; I73-L77 PolarHBondContact O-N 2.74Å; S74-L77 PolarHBondContact O-N 2.66Å; I75-L77 PolarHBondContact O-N 3.47Å; L77-R80 WeakPolarHBondContact O-CG 3.5Å; L77-I94 HydrophobicContact CD2-CD1 3.54Å; L77-I94 HydrophobicContact CG-CD1 3.79Å
78Y85.6Confident84.9Confident183 Ų18382.1 Ų82.172%0.71841%0.408SS*.Hα-helixtrans-68.5-50.2-179.5-178.1-99.6000111.6S74 I75S74-Y78 VanDerWaalsContact O-CB 3.26Å; S74-Y78 WeakPolarHBondContact O-CB 3.45Å; S74-Y78 PolarHBondContact O-N 3.21Å; I75-Y78 PolarHBondContact O-N 3Å
79F83.3Confident84.3Confident118 Ų11879.4 Ų79.452%0.51839%0.392SS..Hα-helixtrans-82.9-16.9-178.1-67.6-70.4000113.5I75 D81 F82I75-F79 HydrophobicContact CG2-CD2 3.75Å; I75-F79 HydrophobicContact CG2-CE2 4.06Å; I75-F79 VanDerWaalsContact O-CD2 3.24Å; I75-F79 WeakPolarHBondContact O-CD2 3.16Å; I75-F79 PolarHBondContact O-N 3.17Å; F79-D81 PolarHBondContact O-N 3.45Å; F79-F82 HydrophobicContact CB-CB 4.15Å; F79-F82 HydrophobicContact CB-CD1 3.5Å; F79-F82 VanDerWaalsContact CB-CD1 3.5Å; F79-F82 HydrophobicContact CB-CE1 4.2Å; F79-F82 HydrophobicContact CB-CG 4.07Å; F79-F82 HydrophobicContact CD2-CD1 4.48Å; F79-F82 HydrophobicContact CG-CD1 4.29Å
80R72.1Confident83.9Confident191 Ų19180.7 Ų80.772%0.72140%0.401SS*.SBendtrans61.1-43.7180-62.6-176175.5-164.3-0.3116.1I76 L77I76-R80 WeakPolarHBondContact O-CA 3.28Å; I76-R80 PolarHBondContact O-N 3.13Å; L77-R80 WeakPolarHBondContact O-CG 3.5Å
81D78.8Confident83.2Confident70 Ų7085.3 Ų85.337%0.37442%0.42SS..SBendtrans-156.7110.2178.4-163.1-14.2000109.1F79 R88 F89F79-D81 PolarHBondContact O-N 3.45Å; D81-R88 WeakPolarHBondContact OD1-CG 3.1Å; D81-R88 IonicContact OD1-CZ 3.75Å; D81-R88 IonicContact OD1-NE 2.82Å; D81-R88 PolarHBondContact OD1-NE 2.92Å; D81-R88 IonicContact OD1-NH2 2.74Å; D81-R88 IonicContact OD2-CZ 3.24Å; D81-R88 VanDerWaalsContact OD2-CZ 3.24Å; D81-R88 IonicContact OD2-NE 3.09Å; D81-R88 PolarHBondContact OD2-NE 3.49Å; D81-R88 VanDerWaalsContact OD2-NE 3.09Å; D81-R88 IonicContact OD2-NH2 3.51Å; D81-R88 PolarHBondContact OD2-NH2 3.1Å; D81-F89 WeakPolarHBondContact CA-O 3.45Å
82F83.3Confident82.7Confident43 Ų4386.3 Ų86.319%0.18942%0.417CS..EExtended strand (participates in β ladder)trans-142.9154-179.770.7-84000111.4I75 I76 F79 L84 F89I75-F82 HydrophobicContact CG2-CE1 3.89Å; I75-F82 HydrophobicContact CG2-CZ 3.69Å; I76-F82 HydrophobicContact CG1-CE1 4.09Å; F79-F82 HydrophobicContact CB-CB 4.15Å; F79-F82 HydrophobicContact CB-CD1 3.5Å; F79-F82 VanDerWaalsContact CB-CD1 3.5Å; F79-F82 HydrophobicContact CB-CE1 4.2Å; F79-F82 HydrophobicContact CB-CG 4.07Å; F79-F82 HydrophobicContact CD2-CD1 4.48Å; F79-F82 HydrophobicContact CG-CD1 4.29Å; F82-L84 HydrophobicContact CD2-CB 4.09Å; F82-L84 HydrophobicContact CE2-CB 3.82Å; F82-L84 HydrophobicContact CE2-CD2 4.4Å; F82-F89 HydrophobicContact CD1-CB 3.98Å; F82-F89 HydrophobicContact CD2-CD2 4.34Å; F82-F89 HydrophobicContact CE1-CB 3.58Å; F82-F89 HydrophobicContact CE1-CG 4.19Å; F82-F89 HydrophobicContact CE2-CB 4.17Å; F82-F89 AromaticContact CE2-CD2 3.73Å; F82-F89 HydrophobicContact CE2-CD2 3.73Å; F82-F89 HydrophobicContact CE2-CE2 4.47Å; F82-F89 HydrophobicContact CE2-CG 4.1Å; F82-F89 HydrophobicContact CG-CB 4.44Å; F82-F89 HydrophobicContact CZ-CB 3.69Å; F82-F89 AromaticContact CZ-CD2 3.89Å; F82-F89 HydrophobicContact CZ-CD2 3.89Å; F82-F89 AromaticContact CZ-CG 3.77Å; F82-F89 HydrophobicContact CZ-CG 3.77Å; F82-F89 PolarHBondContact N-O 3.26Å; F82-F89 PolarHBondContact O-N 3.25Å
83V83.5Confident82.4Confident100 Ų10085.2 Ų85.261%0.60641%0.41SS*.EExtended strand (participates in β ladder)trans-105.3124.3177.3-178.60000108.8I87 R88V83-I87 WeakPolarHBondContact CA-O 2.86Å; V83-R88 HydrophobicContact CG2-CB 4.26Å; V83-R88 HydrophobicContact CG2-CG 4.3Å
84L82.1Confident82.1Confident97 Ų9785.2 Ų85.251%0.50841%0.41SS..EExtended strand (participates in β ladder)trans-131127.8173.8-179.373.2000108.1F82 S86 I87 F89F82-L84 HydrophobicContact CD2-CB 4.09Å; F82-L84 HydrophobicContact CE2-CB 3.82Å; F82-L84 HydrophobicContact CE2-CD2 4.4Å; L84-S86 PolarHBondContact O-N 3.24Å; L84-I87 PolarHBondContact N-O 2.86Å; L84-I87 PolarHBondContact O-N 3.08Å; L84-F89 HydrophobicContact CB-CD2 4.15Å; L84-F89 HydrophobicContact CB-CE2 3.92Å; L84-F89 HydrophobicContact CD2-CE2 4.42Å
85L80.3Confident81.8Confident153 Ų15384.4 Ų84.480%0.80140%0.404SS*.THydrogen-bonded Turntrans51.641.7-178.1-63.3166.6000113I87L85-I87 PolarHBondContact O-N 3.47Å; L85-I87 VanDerWaalsContact O-N 3.15Å
86S77.4Confident81.7Confident120 Ų12082.9 Ų82.984%0.83940%0.397SS*.THydrogen-bonded Turntrans64.58.5-176.9-52.90000115.7L84L84-S86 PolarHBondContact O-N 3.24Å
87I79.8Confident81.7Confident93 Ų9385.3 Ų85.348%0.47741%0.407SS..EExtended strand (participates in β ladder)trans-102.1127.9174-57.8167.3000108.4V83 L84 L85 F89V83-I87 WeakPolarHBondContact CA-O 2.86Å; L84-I87 PolarHBondContact N-O 2.86Å; L84-I87 PolarHBondContact O-N 3.08Å; L85-I87 PolarHBondContact O-N 3.47Å; L85-I87 VanDerWaalsContact O-N 3.15Å; I87-F89 HydrophobicContact CB-CE2 4.12Å; I87-F89 HydrophobicContact CG2-CD2 4.48Å; I87-F89 HydrophobicContact CG2-CE2 4.04Å; I87-F89 HydrophobicContact CG2-CZ 4.25Å
88R82.9Confident81.8Confident154 Ų15483.1 Ų83.158%0.58140%0.396SS*.EExtended strand (participates in β ladder)trans-88.6109177.6-173.4-178.2-179176.12.9110.2D81 V83 T90 H93D81-R88 WeakPolarHBondContact OD1-CG 3.1Å; D81-R88 IonicContact OD1-CZ 3.75Å; D81-R88 IonicContact OD1-NE 2.82Å; D81-R88 PolarHBondContact OD1-NE 2.92Å; D81-R88 IonicContact OD1-NH2 2.74Å; D81-R88 IonicContact OD2-CZ 3.24Å; D81-R88 VanDerWaalsContact OD2-CZ 3.24Å; D81-R88 IonicContact OD2-NE 3.09Å; D81-R88 PolarHBondContact OD2-NE 3.49Å; D81-R88 VanDerWaalsContact OD2-NE 3.09Å; D81-R88 IonicContact OD2-NH2 3.51Å; D81-R88 PolarHBondContact OD2-NH2 3.1Å; V83-R88 HydrophobicContact CG2-CB 4.26Å; V83-R88 HydrophobicContact CG2-CG 4.3Å; R88-T90 HydrophobicContact CG-CG2 4Å; R88-H93 PolarHBondContact O-CE1 3.29Å
89F82Confident81.9Confident30 Ų3075.2 Ų75.213%0.13237%0.365CS..EExtended strand (participates in β ladder)trans-82.8125.5175.7-72.6-88.3000110.4I76 D81 F82 L84 I87 H93 F97I76-F89 HydrophobicContact CD1-CD1 4.23Å; I76-F89 HydrophobicContact CG1-CB 4.41Å; I76-F89 HydrophobicContact CG1-CD1 4.43Å; D81-F89 WeakPolarHBondContact CA-O 3.45Å; F82-F89 HydrophobicContact CD1-CB 3.98Å; F82-F89 HydrophobicContact CD2-CD2 4.34Å; F82-F89 HydrophobicContact CE1-CB 3.58Å; F82-F89 HydrophobicContact CE1-CG 4.19Å; F82-F89 HydrophobicContact CE2-CB 4.17Å; F82-F89 AromaticContact CE2-CD2 3.73Å; F82-F89 HydrophobicContact CE2-CD2 3.73Å; F82-F89 HydrophobicContact CE2-CE2 4.47Å; F82-F89 HydrophobicContact CE2-CG 4.1Å; F82-F89 HydrophobicContact CG-CB 4.44Å; F82-F89 HydrophobicContact CZ-CB 3.69Å; F82-F89 AromaticContact CZ-CD2 3.89Å; F82-F89 HydrophobicContact CZ-CD2 3.89Å; F82-F89 AromaticContact CZ-CG 3.77Å; F82-F89 HydrophobicContact CZ-CG 3.77Å; F82-F89 PolarHBondContact N-O 3.26Å; F82-F89 PolarHBondContact O-N 3.25Å; L84-F89 HydrophobicContact CB-CD2 4.15Å; L84-F89 HydrophobicContact CB-CE2 3.92Å; L84-F89 HydrophobicContact CD2-CE2 4.42Å; I87-F89 HydrophobicContact CB-CE2 4.12Å; I87-F89 HydrophobicContact CG2-CD2 4.48Å; I87-F89 HydrophobicContact CG2-CE2 4.04Å; I87-F89 HydrophobicContact CG2-CZ 4.25Å; F89-H93 HydrophobicContact CD1-CB 4.14Å; F89-H93 AromaticContact CD1-CD2 3.84Å; F89-H93 AromaticContact CD1-CG 3.95Å; F89-F97 HydrophobicContact CE1-CE2 4.29Å; F89-F97 HydrophobicContact CE1-CZ 4.05Å
90T82.6Confident82.1Confident37 Ų3771 Ų7123%0.22735%0.348CS..  trans-135.3176.4-17864.30000109.9R88 Y92 H93R88-T90 HydrophobicContact CG-CG2 4Å; T90-Y92 PolarHBondContact O-N 3.29Å; T90-Y92 WeakPolarHBondContact OG1-CB 3.45Å; T90-Y92 PolarHBondContact OG1-N 3.23Å; T90-H93 PolarHBondContact N-ND1 3.49Å; T90-H93 WeakPolarHBondContact O-CB 3.18Å; T90-H93 PolarHBondContact O-N 3.06Å
91K77.7Confident82.9Confident114 Ų11462.9 Ų62.950%0.49632%0.319SS..Hα-helixtrans-51.1-28.2172.8-64.6-170.7177.9-167.70113.8H93 I94K91-H93 VanDerWaalsContact C-N 3.25Å; K91-H93 PolarHBondContact O-N 2.94Å; K91-I94 WeakPolarHBondContact O-CB 3.48Å; K91-I94 PolarHBondContact O-N 2.91Å
92Y78.8Confident83.4Confident89 Ų8959.7 Ų59.735%0.34930%0.302SS..Hα-helixtrans-57.3-38.3174170.1-104.8000112.5T90 I94 C95 L96 L164 P166T90-Y92 PolarHBondContact O-N 3.29Å; T90-Y92 WeakPolarHBondContact OG1-CB 3.45Å; T90-Y92 PolarHBondContact OG1-N 3.23Å; Y92-I94 VanDerWaalsContact C-N 3.28Å; Y92-I94 PolarHBondContact O-N 3.4Å; Y92-C95 WeakPolarHBondContact O-CB 3.47Å; Y92-C95 PolarHBondContact O-N 3.01Å; Y92-C95 VanDerWaalsContact O-N 3.17Å; Y92-L96 HydrophobicContact CE1-CB 4.36Å; Y92-L96 HydrophobicContact CE1-CD2 4.03Å; Y92-L96 PolarHBondContact O-N 2.9Å; Y92-L164 PolarHBondContact OH-O 3.47Å; Y92-P166 HydrophobicContact CE2-CB 4.13Å; Y92-P166 HydrophobicContact CE2-CG 4.36Å
93H83.7Confident83.6Confident31 Ų3158.6 Ų58.614%0.14430%0.297CS..Hα-helixtrans-69.5-27.3-177.8-66.775.4000112.2I76 R88 F89 T90 K91 L96 F97I76-H93 HydrophobicContact CD1-CB 3.99Å; R88-H93 PolarHBondContact O-CE1 3.29Å; F89-H93 HydrophobicContact CD1-CB 4.14Å; F89-H93 AromaticContact CD1-CD2 3.84Å; F89-H93 AromaticContact CD1-CG 3.95Å; T90-H93 PolarHBondContact N-ND1 3.49Å; T90-H93 WeakPolarHBondContact O-CB 3.18Å; T90-H93 PolarHBondContact O-N 3.06Å; K91-H93 VanDerWaalsContact C-N 3.25Å; K91-H93 PolarHBondContact O-N 2.94Å; H93-L96 PolarHBondContact O-N 3.23Å; H93-F97 HydrophobicContact CB-CE2 4.3Å; H93-F97 WeakPolarHBondContact O-CB 3.43Å; H93-F97 WeakPolarHBondContact O-CD2 3.31Å; H93-F97 VanDerWaalsContact O-CG 3.29Å; H93-F97 WeakPolarHBondContact O-CG 3.46Å; H93-F97 PolarHBondContact O-N 2.93Å
94I83.4Confident83.9Confident1 Ų153.8 Ų53.81%0.00527%0.268CS..Hα-helixtrans-62.1-48.8171.3-60.2175.1000109.7L28 I73 I76 L77 K91 Y92 T98L28-I94 HydrophobicContact CD2-CG2 3.8Å; I73-I94 HydrophobicContact CD1-CG2 4.41Å; I73-I94 HydrophobicContact CG1-CG2 4.19Å; I73-I94 HydrophobicContact CG2-CG2 4.1Å; I76-I94 HydrophobicContact CB-CD1 4.21Å; I76-I94 HydrophobicContact CB-CG1 3.97Å; I76-I94 HydrophobicContact CD1-CG1 4.24Å; I76-I94 HydrophobicContact CG2-CD1 3.82Å; I76-I94 HydrophobicContact CG2-CG1 3.68Å; L77-I94 HydrophobicContact CD2-CD1 3.54Å; L77-I94 HydrophobicContact CG-CD1 3.79Å; K91-I94 WeakPolarHBondContact O-CB 3.48Å; K91-I94 PolarHBondContact O-N 2.91Å; Y92-I94 VanDerWaalsContact C-N 3.28Å; Y92-I94 PolarHBondContact O-N 3.4Å; I94-T98 WeakPolarHBondContact O-CB 3.16Å; I94-T98 PolarHBondContact O-N 3.27Å; I94-T98 VanDerWaalsContact O-N 3.12Å; I94-T98 PolarHBondContact O-OG1 2.88Å
95C82.1Confident84.3Confident25 Ų2549.2 Ų49.217%0.16924%0.244CC..Hα-helixtrans-61.5-47175.6-63.90000111.2Y92 T98 Q99 C174Y92-C95 WeakPolarHBondContact O-CB 3.47Å; Y92-C95 PolarHBondContact O-N 3.01Å; Y92-C95 VanDerWaalsContact O-N 3.17Å; C95-T98 PolarHBondContact O-N 3.49Å; C95-Q99 WeakPolarHBondContact O-CB 3.34Å; C95-Q99 VanDerWaalsContact O-CG 3.29Å; C95-Q99 WeakPolarHBondContact O-CG 3.46Å; C95-Q99 PolarHBondContact O-N 3.42Å; C95-C174 WeakPolarHBondContact CA-SG 3.4Å; C95-C174 HydrophobicContact CB-CB 3.69Å; C95-C174 WeakPolarHBondContact CB-SG 3.24Å; C95-C174 WeakPolarHBondContact SG-CB 3.21Å; C95-C174 CovalentContact SG-SG 2.03Å; C95-C174 PolarHBondContact SG-SG 3.32Å
96L85Confident84.6Confident32 Ų3241.9 Ų41.917%0.16821%0.206CC..Hα-helixtrans-59.9-50.3-177-177.466.9000111.8Y92 H93 T98 Q99 I100 L164Y92-L96 HydrophobicContact CE1-CB 4.36Å; Y92-L96 HydrophobicContact CE1-CD2 4.03Å; Y92-L96 PolarHBondContact O-N 2.9Å; H93-L96 PolarHBondContact O-N 3.23Å; L96-T98 VanDerWaalsContact C-N 3.33Å; L96-T98 PolarHBondContact O-N 3.47Å; L96-Q99 PolarHBondContact O-N 3.49Å; L96-I100 HydrophobicContact CD1-CD1 4.21Å; L96-I100 HydrophobicContact CG-CD1 3.97Å; L96-I100 WeakPolarHBondContact O-CG1 3.42Å; L96-I100 PolarHBondContact O-N 2.69Å; L96-L164 HydrophobicContact CD1-CB 4.2Å; L96-L164 HydrophobicContact CD1-CD2 4.13Å
97F88Confident85.2Confident57 Ų5737.9 Ų37.925%0.2517%0.173CC..Hα-helixtrans-62.7-41.6178.2-66.9-36.7000112.1L69 N72 I76 F89 H93 Q99 I100 I101L69-F97 HydrophobicContact CD1-CB 3.78Å; N72-F97 HydrophobicContact CB-CD2 4.48Å; N72-F97 HydrophobicContact CB-CE2 4.49Å; I76-F97 HydrophobicContact CD1-CD2 4.1Å; I76-F97 HydrophobicContact CD1-CE2 3.86Å; F89-F97 HydrophobicContact CE1-CE2 4.29Å; F89-F97 HydrophobicContact CE1-CZ 4.05Å; H93-F97 HydrophobicContact CB-CE2 4.3Å; H93-F97 WeakPolarHBondContact O-CB 3.43Å; H93-F97 WeakPolarHBondContact O-CD2 3.31Å; H93-F97 VanDerWaalsContact O-CG 3.29Å; H93-F97 WeakPolarHBondContact O-CG 3.46Å; H93-F97 PolarHBondContact O-N 2.93Å; F97-Q99 VanDerWaalsContact C-N 3.31Å; F97-Q99 PolarHBondContact O-N 3.49Å; F97-I100 PolarHBondContact O-N 2.96Å; F97-I101 WeakPolarHBondContact O-CB 3.39Å; F97-I101 WeakPolarHBondContact O-CG1 3.28Å; F97-I101 PolarHBondContact O-N 3.19Å
98T86.3Confident85.7Confident7 Ų733.4 Ų33.44%0.04315%0.15CC..Hα-helixtrans-62.6-39.6177-55.50000111.4L28 I94 C95 L96 S102 Y272L28-T98 HydrophobicContact CD1-CG2 3.93Å; L28-T98 HydrophobicContact CD2-CG2 4.33Å; I94-T98 WeakPolarHBondContact O-CB 3.16Å; I94-T98 PolarHBondContact O-N 3.27Å; I94-T98 VanDerWaalsContact O-N 3.12Å; I94-T98 PolarHBondContact O-OG1 2.88Å; C95-T98 PolarHBondContact O-N 3.49Å; L96-T98 VanDerWaalsContact C-N 3.33Å; L96-T98 PolarHBondContact O-N 3.47Å; T98-S102 WeakPolarHBondContact O-CB 3.45Å; T98-S102 PolarHBondContact O-N 3.31Å; T98-S102 PolarHBondContact O-OG 3.24Å; T98-Y272 HydrophobicContact CG2-CD1 3.87Å; T98-Y272 HydrophobicContact CG2-CE1 4.2Å; T98-Y272 HydrophobicContact CG2-CG 4.08Å
99Q86.4Confident86Confident17 Ų1726.2 Ų26.28%0.07912%0.123CC..Hα-helixtrans-69.1-46.6177.4-75.4174-9.600112.5C95 L96 F97 I101 S102 F103 L164 P175C95-Q99 WeakPolarHBondContact O-CB 3.34Å; C95-Q99 VanDerWaalsContact O-CG 3.29Å; C95-Q99 WeakPolarHBondContact O-CG 3.46Å; C95-Q99 PolarHBondContact O-N 3.42Å; L96-Q99 PolarHBondContact O-N 3.49Å; F97-Q99 VanDerWaalsContact C-N 3.31Å; F97-Q99 PolarHBondContact O-N 3.49Å; Q99-I101 VanDerWaalsContact C-N 3.25Å; Q99-I101 PolarHBondContact O-N 3.43Å; Q99-S102 WeakPolarHBondContact O-CB 3.11Å; Q99-S102 PolarHBondContact O-N 2.86Å; Q99-F103 WeakPolarHBondContact O-CD2 3.48Å; Q99-F103 PolarHBondContact O-N 3.17Å; Q99-L164 HydrophobicContact CB-CD2 3.64Å; Q99-P175 VanDerWaalsContact NE2-CD 3.28Å; Q99-P175 VanDerWaalsContact NE2-CG 3.26Å; Q99-P175 PolarHBondContact NE2-O 2.94Å
100I88.3Confident86.3Confident30 Ų3030.1 Ų30.115%0.15414%0.138CC..Hα-helixtrans-55.7-46.7176.2-68.6167.8000109.6L96 F97 F103 T104 L151 L155 L164L96-I100 HydrophobicContact CD1-CD1 4.21Å; L96-I100 HydrophobicContact CG-CD1 3.97Å; L96-I100 WeakPolarHBondContact O-CG1 3.42Å; L96-I100 PolarHBondContact O-N 2.69Å; F97-I100 PolarHBondContact O-N 2.96Å; I100-F103 PolarHBondContact O-N 2.9Å; I100-T104 WeakPolarHBondContact O-CB 3.48Å; I100-T104 PolarHBondContact O-N 3.17Å; I100-T104 PolarHBondContact O-OG1 3.37Å; I100-L151 HydrophobicContact CG2-CD2 4.18Å; I100-L155 HydrophobicContact CD1-CD2 4.3Å; I100-L155 HydrophobicContact CG1-CD2 4.5Å; I100-L164 HydrophobicContact CG1-CD1 4.25Å; I100-L164 HydrophobicContact CG1-CD2 3.89Å
101I89.7Confident86.7Confident21 Ų2130 Ų3011%0.10814%0.138CC..Hα-helixtrans-64.5-40.8176.7-70.4-65.7000111.8I65 L69 F97 Q99 F103 T104 Y105I65-I101 HydrophobicContact CG2-CD1 3.73Å; L69-I101 HydrophobicContact CD1-CG1 4.16Å; L69-I101 HydrophobicContact CD2-CB 4.27Å; L69-I101 HydrophobicContact CD2-CG1 4.12Å; L69-I101 HydrophobicContact CD2-CG2 4.07Å; F97-I101 WeakPolarHBondContact O-CB 3.39Å; F97-I101 WeakPolarHBondContact O-CG1 3.28Å; F97-I101 PolarHBondContact O-N 3.19Å; Q99-I101 VanDerWaalsContact C-N 3.25Å; Q99-I101 PolarHBondContact O-N 3.43Å; I101-F103 PolarHBondContact O-N 2.68Å; I101-T104 PolarHBondContact O-N 3.18Å; I101-Y105 HydrophobicContact CD1-CE1 4.46Å; I101-Y105 HydrophobicContact CG2-CD1 4.23Å; I101-Y105 HydrophobicContact CG2-CD2 3.73Å; I101-Y105 HydrophobicContact CG2-CE1 3.79Å; I101-Y105 HydrophobicContact CG2-CE2 3.22Å; I101-Y105 HydrophobicContact CG2-CG 4.2Å; I101-Y105 WeakPolarHBondContact O-CB 3.19Å; I101-Y105 PolarHBondContact O-N 2.99Å
102S87.9Confident87.4Confident2 Ų224.7 Ų24.71%0.01412%0.115CC..Hα-helixtrans-58.2-48.7176.9-59.80000112.1T98 Q99 G106 A271 Y272T98-S102 WeakPolarHBondContact O-CB 3.45Å; T98-S102 PolarHBondContact O-N 3.31Å; T98-S102 PolarHBondContact O-OG 3.24Å; Q99-S102 WeakPolarHBondContact O-CB 3.11Å; Q99-S102 PolarHBondContact O-N 2.86Å; S102-G106 PolarHBondContact O-N 2.9Å; S102-A271 VanDerWaalsContact O-CB 3.26Å; S102-A271 WeakPolarHBondContact O-CB 2.83Å; S102-Y272 WeakPolarHBondContact OG-CB 3.5Å; S102-Y272 WeakPolarHBondContact OG-CD1 3.47Å
103F87.4Confident88Confident20 Ų2023.4 Ų23.49%0.08811%0.111CC..Hα-helixtrans-63.7-46.6176.1-76.5-67.4000111Q99 I100 I101 Y105 G106 F107 V154 I160 S163 L164 Y177Q99-F103 WeakPolarHBondContact O-CD2 3.48Å; Q99-F103 PolarHBondContact O-N 3.17Å; I100-F103 PolarHBondContact O-N 2.9Å; I101-F103 PolarHBondContact O-N 2.68Å; F103-Y105 VanDerWaalsContact C-N 3.33Å; F103-Y105 PolarHBondContact O-N 3.36Å; F103-G106 PolarHBondContact O-N 3.27Å; F103-G106 VanDerWaalsContact O-N 3.16Å; F103-F107 HydrophobicContact CD1-CE2 4.41Å; F103-F107 WeakPolarHBondContact O-CD2 3.08Å; F103-F107 PolarHBondContact O-N 3.03Å; F103-F107 VanDerWaalsContact O-N 3.14Å; F103-V154 HydrophobicContact CB-CG1 3.76Å; F103-V154 HydrophobicContact CB-CG2 4.02Å; F103-I160 HydrophobicContact CD1-CG2 4.14Å; F103-I160 HydrophobicContact CD2-CG2 3.86Å; F103-I160 HydrophobicContact CE1-CG2 4.27Å; F103-I160 HydrophobicContact CE2-CG2 4.03Å; F103-I160 HydrophobicContact CG-CG2 3.94Å; F103-I160 HydrophobicContact CZ-CG2 4.23Å; F103-S163 WeakPolarHBondContact CE2-OG 3.31Å; F103-S163 VanDerWaalsContact CZ-OG 3.23Å; F103-S163 WeakPolarHBondContact CZ-OG 3.14Å; F103-L164 HydrophobicContact CD2-CD2 4.26Å; F103-L164 HydrophobicContact CE2-CD2 4.22Å; F103-Y177 AromaticContact CD1-CD1 3.86Å; F103-Y177 HydrophobicContact CD1-CD1 3.86Å; F103-Y177 AromaticContact CD1-CD2 3.89Å; F103-Y177 HydrophobicContact CD1-CD2 3.89Å; F103-Y177 AromaticContact CD1-CE1 3.82Å; F103-Y177 HydrophobicContact CD1-CE1 3.82Å; F103-Y177 AromaticContact CD1-CE2 3.84Å; F103-Y177 HydrophobicContact CD1-CE2 3.84Å; F103-Y177 AromaticContact CD1-CG 3.9Å; F103-Y177 HydrophobicContact CD1-CG 3.9Å; F103-Y177 AromaticContact CD1-CZ 3.8Å; F103-Y177 HydrophobicContact CE1-CD1 4.11Å; F103-Y177 AromaticContact CE1-CD2 3.27Å; F103-Y177 HydrophobicContact CE1-CD2 3.27Å; F103-Y177 HydrophobicContact CE1-CE1 4.18Å; F103-Y177 AromaticContact CE1-CE2 3.35Å; F103-Y177 HydrophobicContact CE1-CE2 3.35Å; F103-Y177 AromaticContact CE1-CG 3.67Å; F103-Y177 HydrophobicContact CE1-CG 3.67Å; F103-Y177 AromaticContact CE1-CZ 3.82Å; F103-Y177 HydrophobicContact CG-CD1 4.42Å; F103-Y177 AromaticContact CZ-CD2 3.78Å; F103-Y177 HydrophobicContact CZ-CD2 3.78Å; F103-Y177 HydrophobicContact CZ-CE2 4.28Å; F103-Y177 HydrophobicContact CZ-CG 4.1Å
104T90.5Very high88.3Confident0 Ų027 Ų270%013%0.131CC..Hα-helixtrans-54.6-50.5179.6-56.10000110.6I100 I101 G106 F107 L108 W147 V150 L151I100-T104 WeakPolarHBondContact O-CB 3.48Å; I100-T104 PolarHBondContact O-N 3.17Å; I100-T104 PolarHBondContact O-OG1 3.37Å; I101-T104 PolarHBondContact O-N 3.18Å; T104-G106 PolarHBondContact O-N 3.49Å; T104-F107 PolarHBondContact O-N 3.35Å; T104-L108 VanDerWaalsContact O-CB 3.31Å; T104-L108 WeakPolarHBondContact O-CB 3.28Å; T104-L108 PolarHBondContact O-N 3.05Å; T104-W147 HydrophobicContact CG2-CE3 3.96Å; T104-W147 HydrophobicContact CG2-CZ3 3.67Å; T104-V150 HydrophobicContact CG2-CG1 3.93Å; T104-L151 HydrophobicContact CG2-CD2 4.05Å; T104-L151 HydrophobicContact CG2-CG 4.29Å; T104-L151 WeakPolarHBondContact OG1-CD2 3.42Å
105Y90.3Very high88.8Confident0 Ų029 Ų290%014%0.142CC..Hα-helixtrans-64.4-39.1179.7-69.2-1.6000112.8L62 D66 I101 F103 F107 L108 H109 W147 M275L62-Y105 HydrophobicContact CD1-CD1 4.36Å; L62-Y105 HydrophobicContact CD1-CE1 3.72Å; L62-Y105 HydrophobicContact CD1-CE2 4.42Å; D66-Y105 PolarHBondContact OD1-OH 2.89Å; I101-Y105 HydrophobicContact CD1-CE1 4.46Å; I101-Y105 HydrophobicContact CG2-CD1 4.23Å; I101-Y105 HydrophobicContact CG2-CD2 3.73Å; I101-Y105 HydrophobicContact CG2-CE1 3.79Å; I101-Y105 HydrophobicContact CG2-CE2 3.22Å; I101-Y105 HydrophobicContact CG2-CG 4.2Å; I101-Y105 WeakPolarHBondContact O-CB 3.19Å; I101-Y105 PolarHBondContact O-N 2.99Å; F103-Y105 VanDerWaalsContact C-N 3.33Å; F103-Y105 PolarHBondContact O-N 3.36Å; Y105-F107 VanDerWaalsContact C-N 3.31Å; Y105-F107 PolarHBondContact O-N 3.42Å; Y105-L108 HydrophobicContact CD1-CD2 4.33Å; Y105-L108 PolarHBondContact O-N 2.91Å; Y105-H109 PolarHBondContact O-CD2 2.89Å; Y105-H109 PolarHBondContact O-NE2 3.31Å; Y105-W147 HydrophobicContact CD1-CH2 4.16Å; Y105-W147 HydrophobicContact CD1-CZ3 4.32Å; Y105-W147 AromaticContact CE1-CH2 3.54Å; Y105-W147 HydrophobicContact CE1-CH2 3.54Å; Y105-W147 AromaticContact CE1-CZ3 3.86Å; Y105-W147 HydrophobicContact CE1-CZ3 3.86Å; Y105-M275 HydrophobicContact CD1-SD 4.32Å; Y105-M275 HydrophobicContact CD2-CB 4.15Å; Y105-M275 HydrophobicContact CG-CB 3.97Å; Y105-M275 HydrophobicContact CG-SD 4.38Å
106G86.8Confident89.2Confident0 Ų027.9 Ų27.90%013%0.133CC..Hα-helixtrans-54.2-46.5174.700000112.6S102 F103 T104 H109 Q181S102-G106 PolarHBondContact O-N 2.9Å; F103-G106 PolarHBondContact O-N 3.27Å; F103-G106 VanDerWaalsContact O-N 3.16Å; T104-G106 PolarHBondContact O-N 3.49Å; G106-H109 PolarHBondContact O-CD2 3.42Å; G106-Q181 VanDerWaalsContact C-OE1 3.25Å; G106-Q181 PolarHBondContact O-OE1 3.32Å
107F88.8Confident89.4Confident35 Ų3528.5 Ų28.515%0.15414%0.14CC..Hα-helixtrans-79.8-25.9-179.7-68.8-70.7000114.1F103 T104 Y105 H109 P111 V150 Y153 V154 I160 Q181F103-F107 HydrophobicContact CD1-CE2 4.41Å; F103-F107 WeakPolarHBondContact O-CD2 3.08Å; F103-F107 PolarHBondContact O-N 3.03Å; F103-F107 VanDerWaalsContact O-N 3.14Å; T104-F107 PolarHBondContact O-N 3.35Å; Y105-F107 VanDerWaalsContact C-N 3.31Å; Y105-F107 PolarHBondContact O-N 3.42Å; F107-H109 PolarHBondContact O-N 3.1Å; F107-P111 WeakPolarHBondContact O-CD 3.35Å; F107-V150 HydrophobicContact CB-CG1 3.87Å; F107-Y153 AromaticContact CD1-CE1 3.98Å; F107-Y153 HydrophobicContact CD1-CE1 3.98Å; F107-Y153 HydrophobicContact CD2-CD1 4.34Å; F107-Y153 HydrophobicContact CD2-CE1 4.17Å; F107-Y153 AromaticContact CE1-CE1 3.72Å; F107-Y153 HydrophobicContact CE1-CE1 3.72Å; F107-Y153 HydrophobicContact CE2-CD1 4.49Å; F107-Y153 AromaticContact CE2-CE1 3.96Å; F107-Y153 HydrophobicContact CE2-CE1 3.96Å; F107-Y153 HydrophobicContact CG-CD1 4.41Å; F107-Y153 HydrophobicContact CG-CE1 4.21Å; F107-Y153 AromaticContact CZ-CE1 3.74Å; F107-Y153 HydrophobicContact CZ-CE1 3.74Å; F107-V154 HydrophobicContact CD2-CG2 3.91Å; F107-V154 HydrophobicContact CE2-CG2 4.35Å; F107-I160 HydrophobicContact CE2-CD1 3.73Å; F107-I160 HydrophobicContact CZ-CD1 4.02Å; F107-Q181 VanDerWaalsContact CD1-NE2 3.26Å
108L91.3Very high89.5Confident0 Ų029.8 Ų29.80%015%0.149CC..Hα-helixtrans-66.9-22.7-173.1-148.559.7000113F58 T104 Y105 Y110 P111 V112 I146 W147 V150 M275F58-L108 HydrophobicContact CE2-CD2 3.97Å; F58-L108 HydrophobicContact CE2-CG 4.14Å; F58-L108 HydrophobicContact CZ-CD2 3.45Å; F58-L108 VanDerWaalsContact CZ-CD2 3.45Å; F58-L108 HydrophobicContact CZ-CG 3.75Å; T104-L108 VanDerWaalsContact O-CB 3.31Å; T104-L108 WeakPolarHBondContact O-CB 3.28Å; T104-L108 PolarHBondContact O-N 3.05Å; Y105-L108 HydrophobicContact CD1-CD2 4.33Å; Y105-L108 PolarHBondContact O-N 2.91Å; L108-Y110 PolarHBondContact O-N 3.33Å; L108-P111 VanDerWaalsContact O-CD 3.3Å; L108-P111 WeakPolarHBondContact O-CD 3.49Å; L108-P111 WeakPolarHBondContact O-CG 3.48Å; L108-V112 HydrophobicContact CG-CG2 4.01Å; L108-V112 VanDerWaalsContact O-CB 3.3Å; L108-V112 WeakPolarHBondContact O-CB 3.36Å; L108-V112 WeakPolarHBondContact O-CG2 3.46Å; L108-V112 PolarHBondContact O-N 3.01Å; L108-I146 HydrophobicContact CD1-CG2 3.56Å; L108-W147 HydrophobicContact CD2-CD2 4.41Å; L108-W147 HydrophobicContact CD2-CE3 4.11Å; L108-W147 HydrophobicContact CD2-CH2 3.38Å; L108-W147 HydrophobicContact CD2-CZ2 3.75Å; L108-W147 HydrophobicContact CD2-CZ3 3.6Å; L108-V150 HydrophobicContact CD1-CB 4.06Å; L108-V150 HydrophobicContact CD1-CG1 4.28Å; L108-V150 HydrophobicContact CD1-CG2 3.73Å; L108-M275 HydrophobicContact CB-CE 3.74Å; L108-M275 HydrophobicContact CB-SD 3.66Å; L108-M275 HydrophobicContact CD2-CE 4.02Å; L108-M275 HydrophobicContact CD2-SD 3.67Å; L108-M275 HydrophobicContact CG-CE 3.88Å; L108-M275 HydrophobicContact CG-SD 4.02Å
109H88.6Confident89.6Confident2 Ų230 Ų301%0.00915%0.15CC..Hα-helixtrans-55.2-45.4179.2-70.5-68.8000113.1Y105 G106 F107 F113 S182 L185 W279Y105-H109 PolarHBondContact O-CD2 2.89Å; Y105-H109 PolarHBondContact O-NE2 3.31Å; G106-H109 PolarHBondContact O-CD2 3.42Å; F107-H109 PolarHBondContact O-N 3.1Å; H109-F113 WeakPolarHBondContact O-CB 3.46Å; H109-F113 PolarHBondContact O-N 3.31Å; H109-S182 PolarHBondContact CD2-OG 2.88Å; H109-S182 PolarHBondContact NE2-OG 3.22Å; H109-S182 VanDerWaalsContact NE2-OG 3.15Å; H109-L185 HydrophobicContact CB-CD2 3.88Å; H109-W279 HydrophobicContact CB-CH2 4.34Å; H109-W279 AromaticContact CE1-CE3 3.92Å; H109-W279 AromaticContact CE1-CH2 3.71Å; H109-W279 AromaticContact CE1-CZ2 3.85Å; H109-W279 AromaticContact CE1-CZ3 3.7Å; H109-W279 AromaticContact CG-CH2 3.96Å; H109-W279 AromaticContact ND1-CE3 3.85Å; H109-W279 AromaticContact ND1-CH2 2.92Å; H109-W279 WeakPolarHBondContact ND1-CH2 3.49Å; H109-W279 AromaticContact ND1-CZ2 3.39Å; H109-W279 WeakPolarHBondContact ND1-CZ2 3.42Å; H109-W279 AromaticContact ND1-CZ3 3.15Å; H109-W279 WeakPolarHBondContact ND1-CZ3 3.06Å
110Y88.1Confident89.5Confident112 Ų11229.3 Ų29.344%0.43915%0.146SC..Hα-helixtrans-68-55-178.5-67.9-56.6000114.9L108 V112 F113 L114 Q181L108-Y110 PolarHBondContact O-N 3.33Å; Y110-V112 VanDerWaalsContact C-N 3.29Å; Y110-V112 PolarHBondContact O-N 3.29Å; Y110-F113 PolarHBondContact O-N 2.99Å; Y110-L114 WeakPolarHBondContact O-CB 3.31Å; Y110-L114 PolarHBondContact O-N 2.92Å; Y110-Q181 HydrophobicContact CE2-CB 3.74Å; Y110-Q181 HydrophobicContact CE2-CG 3.72Å
111P92.1Very high89.3Confident36 Ų3630.9 Ų30.923%0.23416%0.159CC..Hα-helixtrans-63.3-36.7-178.624.4-33.5000111.8F107 L108 L114 I115 I146 V150F107-P111 WeakPolarHBondContact O-CD 3.35Å; L108-P111 VanDerWaalsContact O-CD 3.3Å; L108-P111 WeakPolarHBondContact O-CD 3.49Å; L108-P111 WeakPolarHBondContact O-CG 3.48Å; P111-L114 PolarHBondContact O-N 3.23Å; P111-I115 WeakPolarHBondContact O-CB 3.47Å; P111-I115 VanDerWaalsContact O-CG1 3.27Å; P111-I115 WeakPolarHBondContact O-CG1 3.14Å; P111-I115 PolarHBondContact O-N 3.26Å; P111-I146 HydrophobicContact CB-CG2 4.33Å; P111-I146 HydrophobicContact CG-CG2 4.25Å; P111-V150 HydrophobicContact CG-CG2 4.19Å
112V92.6Very high88.9Confident1 Ų133 Ų331%0.00617%0.171CC..Hα-helixtrans-66.5-46.1177.5174.20000111F54 M55 F58 L108 Y110 L114 I115 A116 M275 L280F54-V112 HydrophobicContact CE1-CG1 4.14Å; M55-V112 HydrophobicContact CE-CG1 4.43Å; M55-V112 HydrophobicContact SD-CG1 3.83Å; F58-V112 HydrophobicContact CD1-CG1 3.8Å; F58-V112 HydrophobicContact CD1-CG2 4.11Å; F58-V112 HydrophobicContact CD2-CG2 3.87Å; F58-V112 HydrophobicContact CE1-CB 4.44Å; F58-V112 HydrophobicContact CE1-CG1 3.93Å; F58-V112 HydrophobicContact CE1-CG2 3.7Å; F58-V112 HydrophobicContact CE2-CG2 3.42Å; F58-V112 VanDerWaalsContact CE2-CG2 3.42Å; F58-V112 HydrophobicContact CG-CG1 4.2Å; F58-V112 HydrophobicContact CG-CG2 4.21Å; F58-V112 HydrophobicContact CZ-CB 4.49Å; F58-V112 HydrophobicContact CZ-CG1 4.42Å; F58-V112 HydrophobicContact CZ-CG2 3.34Å; L108-V112 HydrophobicContact CG-CG2 4.01Å; L108-V112 VanDerWaalsContact O-CB 3.3Å; L108-V112 WeakPolarHBondContact O-CB 3.36Å; L108-V112 WeakPolarHBondContact O-CG2 3.46Å; L108-V112 PolarHBondContact O-N 3.01Å; Y110-V112 VanDerWaalsContact C-N 3.29Å; Y110-V112 PolarHBondContact O-N 3.29Å; V112-L114 PolarHBondContact O-N 2.85Å; V112-I115 PolarHBondContact O-N 3.48Å; V112-A116 WeakPolarHBondContact O-CB 3.35Å; V112-A116 PolarHBondContact O-N 3.38Å; V112-M275 HydrophobicContact CB-CE 4.46Å; V112-M275 HydrophobicContact CG2-CE 4.13Å; V112-L280 HydrophobicContact CG1-CD2 4.03Å
113F90.1Very high88.4Confident62 Ų6235.2 Ų35.227%0.27218%0.182SC..Hα-helixtrans-60.7-45.3176.8-179.1-93.9000111.9H109 Y110 A116 C117 V283 L287H109-F113 WeakPolarHBondContact O-CB 3.46Å; H109-F113 PolarHBondContact O-N 3.31Å; Y110-F113 PolarHBondContact O-N 2.99Å; F113-A116 PolarHBondContact O-N 3.46Å; F113-C117 WeakPolarHBondContact O-CB 3.44Å; F113-C117 PolarHBondContact O-N 2.91Å; F113-V283 HydrophobicContact CD2-CG1 3.72Å; F113-V283 HydrophobicContact CE2-CG1 4.13Å; F113-L287 HydrophobicContact CD2-CD1 4.32Å; F113-L287 HydrophobicContact CD2-CD2 4.37Å; F113-L287 HydrophobicContact CE2-CD1 4.31Å; F113-L287 HydrophobicContact CE2-CD2 3.61Å; F113-L287 HydrophobicContact CE2-CG 4.11Å; F113-L287 HydrophobicContact CZ-CD2 3.78Å
114L91.4Very high87.7Confident107 Ų10735 Ų3556%0.5618%0.181SC*.Hα-helixtrans-61.2-50179.3-177.170.5000111.6Y110 P111 V112 C117 I118Y110-L114 WeakPolarHBondContact O-CB 3.31Å; Y110-L114 PolarHBondContact O-N 2.92Å; P111-L114 PolarHBondContact O-N 3.23Å; V112-L114 PolarHBondContact O-N 2.85Å; L114-C117 WeakPolarHBondContact O-CB 3.3Å; L114-C117 PolarHBondContact O-N 2.81Å; L114-I118 HydrophobicContact CD1-CD1 4.5Å; L114-I118 HydrophobicContact CG-CD1 4.11Å; L114-I118 WeakPolarHBondContact O-CG1 3.1Å; L114-I118 PolarHBondContact O-N 3.34Å
115I92.6Very high86.5Confident44 Ų4438.4 Ų38.423%0.22621%0.205CC..Hα-helixtrans-68-38.2-177.9-68.6168.6000110.9F54 P111 V112 C117 I118 D119 T142 I146F54-I115 HydrophobicContact CD1-CB 4.42Å; F54-I115 HydrophobicContact CD1-CG2 3.82Å; F54-I115 HydrophobicContact CD2-CG2 3.83Å; F54-I115 HydrophobicContact CE1-CB 3.98Å; F54-I115 HydrophobicContact CE1-CG2 3.72Å; F54-I115 HydrophobicContact CE2-CG2 3.74Å; F54-I115 HydrophobicContact CG-CG2 3.87Å; F54-I115 HydrophobicContact CZ-CB 4.08Å; F54-I115 HydrophobicContact CZ-CG2 3.69Å; P111-I115 WeakPolarHBondContact O-CB 3.47Å; P111-I115 VanDerWaalsContact O-CG1 3.27Å; P111-I115 WeakPolarHBondContact O-CG1 3.14Å; P111-I115 PolarHBondContact O-N 3.26Å; V112-I115 PolarHBondContact O-N 3.48Å; I115-C117 VanDerWaalsContact C-N 3.34Å; I115-C117 PolarHBondContact O-N 2.95Å; I115-I118 PolarHBondContact O-N 3.42Å; I115-D119 WeakPolarHBondContact O-CB 3.32Å; I115-D119 PolarHBondContact O-N 3.45Å; I115-T142 HydrophobicContact CD1-CG2 4.08Å; I115-T142 HydrophobicContact CG2-CG2 4.02Å; I115-I146 HydrophobicContact CD1-CD1 3.35Å; I115-I146 HydrophobicContact CD1-CG1 3.64Å
116A90.9Very high85.4Confident0 Ų044.5 Ų44.50%023%0.231CC..Hα-helixtrans-61-43172.900000111.8F54 M55 V112 F113 D119 Y120 L287F54-A116 HydrophobicContact CD1-CB 4.12Å; F54-A116 HydrophobicContact CE1-CB 4.43Å; M55-A116 HydrophobicContact CE-CB 4.1Å; M55-A116 HydrophobicContact CG-CB 3.8Å; M55-A116 HydrophobicContact SD-CB 3.86Å; V112-A116 WeakPolarHBondContact O-CB 3.35Å; V112-A116 PolarHBondContact O-N 3.38Å; F113-A116 PolarHBondContact O-N 3.46Å; A116-D119 PolarHBondContact O-N 3.42Å; A116-Y120 WeakPolarHBondContact O-CD2 3.36Å; A116-Y120 PolarHBondContact O-N 3.2Å; A116-L287 HydrophobicContact CB-CD1 3.76Å
117C88.9Confident84.1Confident46 Ų4649.1 Ų49.131%0.31126%0.26SS..Hα-helixtrans-61.7-44.2176.3-174.50000111.9F113 L114 I115 Y120 C121 L287F113-C117 WeakPolarHBondContact O-CB 3.44Å; F113-C117 PolarHBondContact O-N 2.91Å; L114-C117 WeakPolarHBondContact O-CB 3.3Å; L114-C117 PolarHBondContact O-N 2.81Å; I115-C117 VanDerWaalsContact C-N 3.34Å; I115-C117 PolarHBondContact O-N 2.95Å; C117-Y120 PolarHBondContact O-N 3.2Å; C117-C121 WeakPolarHBondContact O-CB 3.37Å; C117-C121 PolarHBondContact O-N 2.92Å; C117-C121 PolarHBondContact O-SG 2.89Å; C117-L287 HydrophobicContact CB-CD2 4.45Å
118I89.6Confident82.8Confident83 Ų8350.6 Ų50.643%0.42627%0.272SS..Hα-helixtrans-62.4-47.1175.8-67.1166.5000110.5L114 I115 Y120 C121 L122L114-I118 HydrophobicContact CD1-CD1 4.5Å; L114-I118 HydrophobicContact CG-CD1 4.11Å; L114-I118 WeakPolarHBondContact O-CG1 3.1Å; L114-I118 PolarHBondContact O-N 3.34Å; I115-I118 PolarHBondContact O-N 3.42Å; I118-Y120 VanDerWaalsContact C-N 3.33Å; I118-Y120 PolarHBondContact O-N 3.2Å; I118-C121 PolarHBondContact O-N 2.5Å; I118-L122 HydrophobicContact CG2-CD1 3.7Å; I118-L122 HydrophobicContact CG2-CG 4.16Å; I118-L122 WeakPolarHBondContact O-CB 3.31Å; I118-L122 VanDerWaalsContact O-CG 3.31Å; I118-L122 WeakPolarHBondContact O-CG 3.43Å; I118-L122 PolarHBondContact O-N 3.36Å
119D89.3Confident81.4Confident12 Ų1260.3 Ų60.36%0.06431%0.314CS..Hα-helixtrans-56.7-47178.6-173.543.9000111.2F54 I115 A116 L122 N123 Y139F54-D119 HydrophobicContact CB-CB 4.12Å; F54-D119 WeakPolarHBondContact CB-OD2 3.41Å; F54-D119 PolarHBondContact N-OD2 3.37Å; I115-D119 WeakPolarHBondContact O-CB 3.32Å; I115-D119 PolarHBondContact O-N 3.45Å; A116-D119 PolarHBondContact O-N 3.42Å; D119-L122 PolarHBondContact O-N 3.42Å; D119-N123 VanDerWaalsContact O-CB 3.31Å; D119-N123 WeakPolarHBondContact O-CB 3.46Å; D119-N123 VanDerWaalsContact O-CG 3.31Å; D119-N123 PolarHBondContact O-N 3Å; D119-N123 PolarHBondContact O-ND2 3.01Å; D119-N123 PolarHBondContact OD1-ND2 3.01Å; D119-Y139 VanDerWaalsContact OD1-CE1 3.3Å; D119-Y139 WeakPolarHBondContact OD1-CE1 3.45Å; D119-Y139 VanDerWaalsContact OD1-CZ 3.27Å; D119-Y139 PolarHBondContact OD1-OH 2.97Å; D119-Y139 PolarHBondContact OD2-OH 3.04Å
120Y85.3Confident80.5Confident3 Ų364.3 Ų64.31%0.01234%0.335CS..Hα-helixtrans-64.1-43.3176.4-79.6-57.9000113.2N53 A116 C117 I118 L122 F124 N284 L287 I288 P307N53-Y120 WeakPolarHBondContact ND2-CE1 3.4Å; N53-Y120 PolarHBondContact ND2-OH 2.7Å; A116-Y120 WeakPolarHBondContact O-CD2 3.36Å; A116-Y120 PolarHBondContact O-N 3.2Å; C117-Y120 PolarHBondContact O-N 3.2Å; I118-Y120 VanDerWaalsContact C-N 3.33Å; I118-Y120 PolarHBondContact O-N 3.2Å; Y120-L122 VanDerWaalsContact C-N 3.35Å; Y120-L122 PolarHBondContact O-N 3.12Å; Y120-F124 WeakPolarHBondContact O-CB 3.45Å; Y120-F124 PolarHBondContact O-N 2.96Å; Y120-N284 VanDerWaalsContact OH-CG 3.23Å; Y120-N284 PolarHBondContact OH-ND2 3.44Å; Y120-N284 PolarHBondContact OH-OD1 2.93Å; Y120-L287 HydrophobicContact CD2-CB 3.99Å; Y120-L287 HydrophobicContact CD2-CD1 4.31Å; Y120-L287 HydrophobicContact CE2-CB 4.17Å; Y120-L287 HydrophobicContact CE2-CD1 4.42Å; Y120-I288 HydrophobicContact CD1-CG1 4.25Å; Y120-I288 HydrophobicContact CE1-CD1 4.1Å; Y120-I288 HydrophobicContact CE1-CG1 3.6Å; Y120-I288 HydrophobicContact CE2-CG1 4.28Å; Y120-P307 HydrophobicContact CD1-CB 4.11Å; Y120-P307 HydrophobicContact CD1-CG 4.47Å; Y120-P307 HydrophobicContact CE1-CB 3.86Å
121C82.3Confident80Confident62 Ų6262.9 Ų62.942%0.41934%0.341SS..Hα-helixtrans-61.8-42.2177.5-71.10000112.2C117 I118 S125C117-C121 WeakPolarHBondContact O-CB 3.37Å; C117-C121 PolarHBondContact O-N 2.92Å; C117-C121 PolarHBondContact O-SG 2.89Å; I118-C121 PolarHBondContact O-N 2.5Å; C121-S125 VanDerWaalsContact O-CB 3.3Å; C121-S125 WeakPolarHBondContact O-CB 3.33Å; C121-S125 PolarHBondContact O-N 2.53Å; C121-S125 PolarHBondContact O-OG 3.2Å
122L81.8Confident79.2Confident67 Ų6767 Ų6735%0.35136%0.355SS..Hα-helixtrans-70.3-46.7-179.8-70.4176.5000112.1I118 D119 Y120 F124 S125 K126 T127 T128I118-L122 HydrophobicContact CG2-CD1 3.7Å; I118-L122 HydrophobicContact CG2-CG 4.16Å; I118-L122 WeakPolarHBondContact O-CB 3.31Å; I118-L122 VanDerWaalsContact O-CG 3.31Å; I118-L122 WeakPolarHBondContact O-CG 3.43Å; I118-L122 PolarHBondContact O-N 3.36Å; D119-L122 PolarHBondContact O-N 3.42Å; Y120-L122 VanDerWaalsContact C-N 3.35Å; Y120-L122 PolarHBondContact O-N 3.12Å; L122-F124 VanDerWaalsContact C-N 3.34Å; L122-F124 PolarHBondContact O-N 3.44Å; L122-S125 PolarHBondContact O-N 2.93Å; L122-K126 PolarHBondContact O-N 3.2Å; L122-T127 PolarHBondContact O-N 3.48Å; L122-T128 HydrophobicContact CB-CG2 4.13Å; L122-T128 HydrophobicContact CD1-CG2 4.33Å
123N78.3Confident78.6Confident47 Ų4774.9 Ų74.925%0.25139%0.39SS..Hα-helixtrans-63.9-40.7177.8-74.2-32.3000111.3D119 S125 K126 Y139D119-N123 VanDerWaalsContact O-CB 3.31Å; D119-N123 WeakPolarHBondContact O-CB 3.46Å; D119-N123 VanDerWaalsContact O-CG 3.31Å; D119-N123 PolarHBondContact O-N 3Å; D119-N123 PolarHBondContact O-ND2 3.01Å; D119-N123 PolarHBondContact OD1-ND2 3.01Å; N123-S125 PolarHBondContact O-N 3.41Å; N123-K126 PolarHBondContact O-N 2.96Å; N123-Y139 PolarHBondContact ND2-OH 3.46Å
124F71.1Confident78.3Confident17 Ų1774.8 Ų74.88%0.07540%0.396CS..Hα-helixtrans-64.8-39.7176.5-172-88.7000112.3Y120 L122 K126 V291 N295 K298 L299Y120-F124 WeakPolarHBondContact O-CB 3.45Å; Y120-F124 PolarHBondContact O-N 2.96Å; L122-F124 VanDerWaalsContact C-N 3.34Å; L122-F124 PolarHBondContact O-N 3.44Å; F124-K126 PolarHBondContact O-N 3.4Å; F124-V291 HydrophobicContact CB-CG1 4Å; F124-V291 HydrophobicContact CD2-CG1 3.72Å; F124-V291 HydrophobicContact CE2-CG1 4.43Å; F124-V291 HydrophobicContact CG-CG1 3.82Å; F124-N295 HydrophobicContact CD1-CB 4.2Å; F124-N295 HydrophobicContact CE1-CB 3.28Å; F124-N295 VanDerWaalsContact CE1-OD1 3.28Å; F124-N295 WeakPolarHBondContact CE1-OD1 3.47Å; F124-N295 HydrophobicContact CE2-CB 4.07Å; F124-N295 HydrophobicContact CZ-CB 3.2Å; F124-K298 HydrophobicContact CE1-CD 4.28Å; F124-L299 HydrophobicContact CE2-CD2 3.9Å; F124-L299 HydrophobicContact CZ-CD2 4.02Å
125S67.3Low77.9Confident70 Ų7071.6 Ų71.649%0.4938%0.378SS..THydrogen-bonded Turntrans-74.6-4179.7-57.70000113.4C121 L122 N123 T127C121-S125 VanDerWaalsContact O-CB 3.3Å; C121-S125 WeakPolarHBondContact O-CB 3.33Å; C121-S125 PolarHBondContact O-N 2.53Å; C121-S125 PolarHBondContact O-OG 3.2Å; L122-S125 PolarHBondContact O-N 2.93Å; N123-S125 PolarHBondContact O-N 3.41Å; S125-T127 WeakPolarHBondContact CB-OG1 3.18Å; S125-T127 PolarHBondContact O-N 2.9Å; S125-T127 VanDerWaalsContact O-N 3.1Å
126K66.5Low77.6Confident128 Ų12874.4 Ų74.456%0.55739%0.389SS*.THydrogen-bonded Turntrans52.922.3-171.4-59.3-177.6178.9-179.80113.1L122 N123 F124 T128L122-K126 PolarHBondContact O-N 3.2Å; N123-K126 PolarHBondContact O-N 2.96Å; F124-K126 PolarHBondContact O-N 3.4Å; K126-T128 VanDerWaalsContact C-N 3.26Å; K126-T128 PolarHBondContact O-N 3.24Å
127T59.1Low77.5Confident98 Ų9879 Ų7960%0.60141%0.413SS*.  trans-69.8-28.7-175.2-52.60000111.2L122 S125 K129L122-T127 PolarHBondContact O-N 3.48Å; S125-T127 WeakPolarHBondContact CB-OG1 3.18Å; S125-T127 PolarHBondContact O-N 2.9Å; S125-T127 VanDerWaalsContact O-N 3.1Å; T127-K129 PolarHBondContact O-N 3.01Å
128T60.8Low77.5Confident66 Ų6682.6 Ų82.641%0.40542%0.424SS..  trans-94.794.3-177.441.90000111.3L122 K126 L130L122-T128 HydrophobicContact CB-CG2 4.13Å; L122-T128 HydrophobicContact CD1-CG2 4.33Å; K126-T128 VanDerWaalsContact C-N 3.26Å; K126-T128 PolarHBondContact O-N 3.24Å; T128-L130 PolarHBondContact O-N 3.35Å
129K63.4Low77.6Confident204 Ų20479 Ų7989%0.88741%0.405SS*.  trans-8750.4167.8-66.8-175.4-179178.10111.5T127T127-K129 PolarHBondContact O-N 3.01Å
130L68.4Low77.7Confident86 Ų8683.7 Ų83.745%0.4543%0.425SS..  trans-86.6142.4-179.8-148.772.9000110.1T128 C134 Q135T128-L130 PolarHBondContact O-N 3.35Å; L130-C134 HydrophobicContact CD2-CB 3.98Å; L130-C134 HydrophobicContact CG-CB 3.89Å; L130-Q135 HydrophobicContact CD2-CB 4.21Å
131S78.1Confident78Confident81 Ų8189.3 Ų89.357%0.56645%0.449SS*.  trans-61.7142.4171.9173.30000110.4K133 C134 Q135S131-K133 PolarHBondContact O-N 3.5Å; S131-K133 VanDerWaalsContact O-N 3.12Å; S131-C134 WeakPolarHBondContact O-CA 3.45Å; S131-C134 WeakPolarHBondContact O-CB 3.27Å; S131-C134 PolarHBondContact O-N 3.47Å; S131-Q135 PolarHBondContact O-N 2.95Å
132F74.9Confident78.6Confident122 Ų12287.3 Ų87.354%0.53544%0.435SS..Hα-helixtrans-50.1-40.5-178-177.3-103000113.6Q52 K136Q52-F132 HydrophobicContact CB-CE2 4.43Å; Q52-F132 VanDerWaalsContact CD-CZ 3.43Å; Q52-F132 HydrophobicContact CG-CE2 4.34Å; Q52-F132 HydrophobicContact CG-CZ 4.24Å; F132-K136 PolarHBondContact O-N 3.08Å; F132-K136 VanDerWaalsContact O-N 3.08Å
133K80.9Confident79.2Confident168 Ų16884.5 Ų84.573%0.7342%0.421SS*.Hα-helixtrans-66.3-41.1177-71.3-175.4179.4178.80112.5S131 K136 L137S131-K133 PolarHBondContact O-N 3.5Å; S131-K133 VanDerWaalsContact O-N 3.12Å; K133-K136 PolarHBondContact O-N 3.31Å; K133-L137 WeakPolarHBondContact O-CG 3.42Å; K133-L137 PolarHBondContact O-N 2.77Å; K133-L137 VanDerWaalsContact O-N 3.08Å
134C82.9Confident80Confident59 Ų5985.2 Ų85.240%0.39942%0.424SS..Hα-helixtrans-71.6-36.1-179.2-172.30000110.9L130 S131 L137 F138L130-C134 HydrophobicContact CD2-CB 3.98Å; L130-C134 HydrophobicContact CG-CB 3.89Å; S131-C134 WeakPolarHBondContact O-CA 3.45Å; S131-C134 WeakPolarHBondContact O-CB 3.27Å; S131-C134 PolarHBondContact O-N 3.47Å; C134-L137 PolarHBondContact O-N 2.84Å; C134-F138 WeakPolarHBondContact O-CB 3.28Å; C134-F138 PolarHBondContact O-N 3.46Å
135Q83.8Confident81.2Confident41 Ų4189.5 Ų89.519%0.19245%0.447CS..Hα-helixtrans-63.2-43.5173.3-173.7175.410.700112.1L130 S131 F138 Y139L130-Q135 HydrophobicContact CD2-CB 4.21Å; S131-Q135 PolarHBondContact O-N 2.95Å; Q135-F138 PolarHBondContact O-N 2.91Å; Q135-Y139 HydrophobicContact CG-CD2 4.06Å; Q135-Y139 HydrophobicContact CG-CE2 3.41Å; Q135-Y139 VanDerWaalsContact CG-CE2 3.41Å; Q135-Y139 PolarHBondContact NE2-OH 3.34Å; Q135-Y139 WeakPolarHBondContact O-CD2 3.46Å; Q135-Y139 PolarHBondContact O-N 2.96Å
136K85.6Confident82.5Confident102 Ų10286.7 Ų86.744%0.44343%0.426SS..Hα-helixtrans-59.1-47.4173.1169.6163.6-165.5-178.90112.6Y57 F132 K133 F138 Y139 F140Y57-K136 HydrophobicContact CE1-CD 4.42Å; Y57-K136 HydrophobicContact CE1-CG 3.99Å; Y57-K136 WeakPolarHBondContact OH-CD 3.42Å; Y57-K136 VanDerWaalsContact OH-CE 3.28Å; Y57-K136 WeakPolarHBondContact OH-CE 3.48Å; Y57-K136 WeakPolarHBondContact OH-CG 3.46Å; F132-K136 PolarHBondContact O-N 3.08Å; F132-K136 VanDerWaalsContact O-N 3.08Å; K133-K136 PolarHBondContact O-N 3.31Å; K136-F138 VanDerWaalsContact C-N 3.34Å; K136-Y139 PolarHBondContact O-N 3.22Å; K136-F140 WeakPolarHBondContact O-CB 3.42Å; K136-F140 PolarHBondContact O-N 3.03Å
137L88.4Confident83.9Confident98 Ų9881.5 Ų81.551%0.51340%0.404SS..Hα-helixtrans-62.4-43.9177.1-73.6171.9000111.1K133 C134 Y139 F140 F141K133-L137 WeakPolarHBondContact O-CG 3.42Å; K133-L137 PolarHBondContact O-N 2.77Å; K133-L137 VanDerWaalsContact O-N 3.08Å; C134-L137 PolarHBondContact O-N 2.84Å; L137-Y139 PolarHBondContact O-N 2.93Å; L137-F140 WeakPolarHBondContact O-CB 3.39Å; L137-F140 PolarHBondContact O-N 3.24Å; L137-F141 HydrophobicContact CB-CD2 4.46Å; L137-F141 HydrophobicContact CB-CE2 4.43Å; L137-F141 WeakPolarHBondContact O-CD2 3.45Å; L137-F141 PolarHBondContact O-N 3.03Å
138F89.8Confident85.5Confident121 Ų12181.5 Ų81.553%0.53140%0.399SS..Hα-helixtrans-56.6-52.5176.9178.9-100.5000111.3C134 Q135 K136 F140 F141 T142C134-F138 WeakPolarHBondContact O-CB 3.28Å; C134-F138 PolarHBondContact O-N 3.46Å; Q135-F138 PolarHBondContact O-N 2.91Å; K136-F138 VanDerWaalsContact C-N 3.34Å; F138-F140 VanDerWaalsContact C-N 3.31Å; F138-F140 PolarHBondContact O-N 2.92Å; F138-F141 PolarHBondContact O-N 3.43Å; F138-T142 WeakPolarHBondContact O-CB 3.32Å; F138-T142 PolarHBondContact O-N 3.29Å; F138-T142 PolarHBondContact O-OG1 3.42Å
139Y91.3Very high87.1Confident8 Ų881.9 Ų81.93%0.03140%0.404CS..Hα-helixtrans-59.6-41.2177.2-65.4-36.7000112.8F54 Y57 D119 N123 Q135 K136 L137 T142 V143F54-Y139 HydrophobicContact CB-CD1 3.9Å; F54-Y139 HydrophobicContact CB-CE1 3.91Å; F54-Y139 HydrophobicContact CD2-CD1 4.4Å; Y57-Y139 AromaticContact CD2-CD2 3.85Å; Y57-Y139 HydrophobicContact CD2-CD2 3.85Å; Y57-Y139 HydrophobicContact CD2-CG 4.21Å; Y57-Y139 AromaticContact CE2-CD2 3.87Å; Y57-Y139 HydrophobicContact CE2-CD2 3.87Å; D119-Y139 VanDerWaalsContact OD1-CE1 3.3Å; D119-Y139 WeakPolarHBondContact OD1-CE1 3.45Å; D119-Y139 VanDerWaalsContact OD1-CZ 3.27Å; D119-Y139 PolarHBondContact OD1-OH 2.97Å; D119-Y139 PolarHBondContact OD2-OH 3.04Å; N123-Y139 PolarHBondContact ND2-OH 3.46Å; Q135-Y139 HydrophobicContact CG-CD2 4.06Å; Q135-Y139 HydrophobicContact CG-CE2 3.41Å; Q135-Y139 VanDerWaalsContact CG-CE2 3.41Å; Q135-Y139 PolarHBondContact NE2-OH 3.34Å; Q135-Y139 WeakPolarHBondContact O-CD2 3.46Å; Q135-Y139 PolarHBondContact O-N 2.96Å; K136-Y139 PolarHBondContact O-N 3.22Å; L137-Y139 PolarHBondContact O-N 2.93Å; Y139-T142 PolarHBondContact O-N 2.92Å; Y139-V143 WeakPolarHBondContact O-CB 3.37Å; Y139-V143 VanDerWaalsContact O-CG2 3.28Å; Y139-V143 WeakPolarHBondContact O-CG2 3.09Å; Y139-V143 PolarHBondContact O-N 3.32Å
140F91Very high88.5Confident110 Ų11072.9 Ų72.948%0.48237%0.366SS..Hα-helixtrans-59.7-48.6176.2179.2-102.9000111.9K136 L137 F138 V143 I144K136-F140 WeakPolarHBondContact O-CB 3.42Å; K136-F140 PolarHBondContact O-N 3.03Å; L137-F140 WeakPolarHBondContact O-CB 3.39Å; L137-F140 PolarHBondContact O-N 3.24Å; F138-F140 VanDerWaalsContact C-N 3.31Å; F138-F140 PolarHBondContact O-N 2.92Å; F140-V143 PolarHBondContact O-N 3.17Å; F140-I144 HydrophobicContact CD1-CD1 3.8Å; F140-I144 HydrophobicContact CD2-CD1 4.49Å; F140-I144 HydrophobicContact CE1-CD1 3.29Å; F140-I144 HydrophobicContact CE2-CD1 4.06Å; F140-I144 HydrophobicContact CG-CD1 4.39Å; F140-I144 HydrophobicContact CZ-CD1 3.45Å; F140-I144 VanDerWaalsContact CZ-CD1 3.45Å; F140-I144 HydrophobicContact CZ-CG1 4.49Å; F140-I144 WeakPolarHBondContact O-CG1 3.34Å; F140-I144 PolarHBondContact O-N 2.85Å; F140-I144 VanDerWaalsContact O-N 3.08Å
141F93.3Very high89.7Confident120 Ų12071.4 Ų71.453%0.52636%0.359SS..Hα-helixtrans-63.6-43176.1-78.1-66000112.1L137 F138 V143 I144 L145L137-F141 HydrophobicContact CB-CD2 4.46Å; L137-F141 HydrophobicContact CB-CE2 4.43Å; L137-F141 WeakPolarHBondContact O-CD2 3.45Å; L137-F141 PolarHBondContact O-N 3.03Å; F138-F141 PolarHBondContact O-N 3.43Å; F141-V143 VanDerWaalsContact C-N 3.34Å; F141-V143 PolarHBondContact O-N 3.48Å; F141-I144 PolarHBondContact O-N 3.47Å; F141-L145 WeakPolarHBondContact O-CB 3.4Å; F141-L145 VanDerWaalsContact O-CG 3.28Å; F141-L145 WeakPolarHBondContact O-CG 3.4Å; F141-L145 PolarHBondContact O-N 3.41Å
142T93.7Very high90.3Very high21 Ų2170.3 Ų70.313%0.12935%0.354CS..Hα-helixtrans-58.6-46.2176.7-58.40000111.2F54 I115 F138 Y139 I144 L145 I146F54-T142 HydrophobicContact CD2-CG2 4.39Å; F54-T142 HydrophobicContact CE2-CG2 4.01Å; I115-T142 HydrophobicContact CD1-CG2 4.08Å; I115-T142 HydrophobicContact CG2-CG2 4.02Å; F138-T142 WeakPolarHBondContact O-CB 3.32Å; F138-T142 PolarHBondContact O-N 3.29Å; F138-T142 PolarHBondContact O-OG1 3.42Å; Y139-T142 PolarHBondContact O-N 2.92Å; T142-I144 PolarHBondContact O-N 2.86Å; T142-L145 PolarHBondContact O-N 3.4Å; T142-I146 HydrophobicContact CG2-CD1 4.05Å; T142-I146 VanDerWaalsContact O-CG1 3.23Å; T142-I146 WeakPolarHBondContact O-CG1 3.4Å; T142-I146 PolarHBondContact O-N 3.36Å
143V95.3Very high91Very high8 Ų869.9 Ų69.95%0.04835%0.35CS..Hα-helixtrans-60-46.7177.2168.70000111.2F54 F58 S61 Y139 F140 F141 L145 I146 W147F54-V143 HydrophobicContact CD2-CG2 4.18Å; F54-V143 HydrophobicContact CE2-CG2 3.7Å; F58-V143 HydrophobicContact CB-CG2 4.2Å; F58-V143 HydrophobicContact CD2-CG1 4.35Å; F58-V143 HydrophobicContact CD2-CG2 4.36Å; S61-V143 VanDerWaalsContact OG-CG1 3.3Å; S61-V143 WeakPolarHBondContact OG-CG1 3.35Å; Y139-V143 WeakPolarHBondContact O-CB 3.37Å; Y139-V143 VanDerWaalsContact O-CG2 3.28Å; Y139-V143 WeakPolarHBondContact O-CG2 3.09Å; Y139-V143 PolarHBondContact O-N 3.32Å; F140-V143 PolarHBondContact O-N 3.17Å; F141-V143 VanDerWaalsContact C-N 3.34Å; F141-V143 PolarHBondContact O-N 3.48Å; V143-L145 PolarHBondContact O-N 3.31Å; V143-I146 PolarHBondContact O-N 2.99Å; V143-W147 PolarHBondContact O-N 2.93Å
144I94.6Very high91.4Very high62 Ų6261.9 Ų61.932%0.31832%0.315SS..Hα-helixtrans-59.6-46.6177.1-71.2172000111.1F140 F141 T142 I146 W147 I148F140-I144 HydrophobicContact CD1-CD1 3.8Å; F140-I144 HydrophobicContact CD2-CD1 4.49Å; F140-I144 HydrophobicContact CE1-CD1 3.29Å; F140-I144 HydrophobicContact CE2-CD1 4.06Å; F140-I144 HydrophobicContact CG-CD1 4.39Å; F140-I144 HydrophobicContact CZ-CD1 3.45Å; F140-I144 VanDerWaalsContact CZ-CD1 3.45Å; F140-I144 HydrophobicContact CZ-CG1 4.49Å; F140-I144 WeakPolarHBondContact O-CG1 3.34Å; F140-I144 PolarHBondContact O-N 2.85Å; F140-I144 VanDerWaalsContact O-N 3.08Å; F141-I144 PolarHBondContact O-N 3.47Å; T142-I144 PolarHBondContact O-N 2.86Å; I144-I146 VanDerWaalsContact C-N 3.32Å; I144-I146 PolarHBondContact O-N 2.82Å; I144-W147 PolarHBondContact O-N 3.4Å; I144-I148 HydrophobicContact CG2-CD1 3.52Å; I144-I148 HydrophobicContact CG2-CG1 4.22Å; I144-I148 WeakPolarHBondContact O-CG1 3.19Å; I144-I148 PolarHBondContact O-N 3.3Å
145L95.3Very high91.6Very high106 Ų10663.4 Ų63.456%0.55532%0.319SS*.Hα-helixtrans-61.8-40179.7-72.8171.6000111.9F141 T142 V143 S149F141-L145 WeakPolarHBondContact O-CB 3.4Å; F141-L145 VanDerWaalsContact O-CG 3.28Å; F141-L145 WeakPolarHBondContact O-CG 3.4Å; F141-L145 PolarHBondContact O-N 3.41Å; T142-L145 PolarHBondContact O-N 3.4Å; V143-L145 PolarHBondContact O-N 3.31Å; L145-S149 WeakPolarHBondContact O-CB 3.34Å; L145-S149 PolarHBondContact O-N 3.43Å; L145-S149 PolarHBondContact O-OG 3.18Å
146I95.5Very high91.6Very high11 Ų1164.3 Ų64.36%0.05634%0.339CS..Hα-helixtrans-60.7-51174.8-66.6163.9000110.2F54 L108 P111 I115 T142 V143 I144 I148 S149 V150F54-I146 HydrophobicContact CE2-CD1 3.7Å; F54-I146 HydrophobicContact CZ-CD1 3.46Å; F54-I146 VanDerWaalsContact CZ-CD1 3.46Å; L108-I146 HydrophobicContact CD1-CG2 3.56Å; P111-I146 HydrophobicContact CB-CG2 4.33Å; P111-I146 HydrophobicContact CG-CG2 4.25Å; I115-I146 HydrophobicContact CD1-CD1 3.35Å; I115-I146 HydrophobicContact CD1-CG1 3.64Å; T142-I146 HydrophobicContact CG2-CD1 4.05Å; T142-I146 VanDerWaalsContact O-CG1 3.23Å; T142-I146 WeakPolarHBondContact O-CG1 3.4Å; T142-I146 PolarHBondContact O-N 3.36Å; V143-I146 PolarHBondContact O-N 2.99Å; I144-I146 VanDerWaalsContact C-N 3.32Å; I144-I146 PolarHBondContact O-N 2.82Å; I146-I148 PolarHBondContact O-N 2.87Å; I146-S149 PolarHBondContact O-N 2.84Å; I146-V150 HydrophobicContact CG2-CG2 4.5Å; I146-V150 WeakPolarHBondContact O-CG2 3.44Å; I146-V150 PolarHBondContact O-N 2.87Å
147W95.4Very high91.5Very high20 Ų2061.3 Ų61.38%0.07633%0.328CS..Hα-helixtrans-58.3-49.3179.3-80.6110.5000111.9F58 S61 L62 I65 T104 Y105 L108 V143 I144 S149 V150 L151F58-W147 HydrophobicContact CE2-CZ2 4.25Å; F58-W147 AromaticContact CE2-NE1 3.99Å; F58-W147 HydrophobicContact CZ-CZ2 4.25Å; S61-W147 PolarHBondContact OG-NE1 3.27Å; L62-W147 HydrophobicContact CD1-CH2 3.94Å; L62-W147 HydrophobicContact CD1-CZ2 4.14Å; I65-W147 HydrophobicContact CB-CH2 4.26Å; I65-W147 HydrophobicContact CB-CZ2 4.44Å; I65-W147 HydrophobicContact CG1-CD2 4.5Å; I65-W147 HydrophobicContact CG1-CH2 4.09Å; I65-W147 HydrophobicContact CG1-CZ2 3.96Å; I65-W147 HydrophobicContact CG1-CZ3 4.39Å; I65-W147 HydrophobicContact CG2-CH2 4.18Å; I65-W147 HydrophobicContact CG2-CZ3 4.28Å; T104-W147 HydrophobicContact CG2-CE3 3.96Å; T104-W147 HydrophobicContact CG2-CZ3 3.67Å; Y105-W147 HydrophobicContact CD1-CH2 4.16Å; Y105-W147 HydrophobicContact CD1-CZ3 4.32Å; Y105-W147 AromaticContact CE1-CH2 3.54Å; Y105-W147 HydrophobicContact CE1-CH2 3.54Å; Y105-W147 AromaticContact CE1-CZ3 3.86Å; Y105-W147 HydrophobicContact CE1-CZ3 3.86Å; L108-W147 HydrophobicContact CD2-CD2 4.41Å; L108-W147 HydrophobicContact CD2-CE3 4.11Å; L108-W147 HydrophobicContact CD2-CH2 3.38Å; L108-W147 HydrophobicContact CD2-CZ2 3.75Å; L108-W147 HydrophobicContact CD2-CZ3 3.6Å; V143-W147 PolarHBondContact O-N 2.93Å; I144-W147 PolarHBondContact O-N 3.4Å; W147-S149 PolarHBondContact O-N 2.9Å; W147-V150 PolarHBondContact O-N 3.4Å; W147-L151 VanDerWaalsContact O-CB 3.26Å; W147-L151 WeakPolarHBondContact O-CB 3.31Å; W147-L151 VanDerWaalsContact O-CG 3.24Å; W147-L151 WeakPolarHBondContact O-CG 3.48Å; W147-L151 PolarHBondContact O-N 2.93Å
148I94Very high90.8Very high98 Ų9861.3 Ų61.350%0.50333%0.334SS..Hα-helixtrans-61.9-45.3179.8-67.4172.7000110.5I144 I146 L151 A152I144-I148 HydrophobicContact CG2-CD1 3.52Å; I144-I148 HydrophobicContact CG2-CG1 4.22Å; I144-I148 WeakPolarHBondContact O-CG1 3.19Å; I144-I148 PolarHBondContact O-N 3.3Å; I146-I148 PolarHBondContact O-N 2.87Å; I148-L151 PolarHBondContact O-N 3.02Å; I148-A152 WeakPolarHBondContact O-CB 3.3Å; I148-A152 PolarHBondContact O-N 2.92Å
149S93.9Very high90.1Very high74 Ų7458.7 Ų58.752%0.51734%0.335SS..Hα-helixtrans-63.7-45.2-177.5-57.90000111.6L145 I146 W147 Y153L145-S149 WeakPolarHBondContact O-CB 3.34Å; L145-S149 PolarHBondContact O-N 3.43Å; L145-S149 PolarHBondContact O-OG 3.18Å; I146-S149 PolarHBondContact O-N 2.84Å; W147-S149 PolarHBondContact O-N 2.9Å; S149-Y153 WeakPolarHBondContact O-CB 3.1Å; S149-Y153 PolarHBondContact O-N 3.03Å
150V93.2Very high89.4Confident15 Ų1559 Ų599%0.09134%0.337CS..Hα-helixtrans-69.7-41.11791780000111.1T104 F107 L108 P111 I146 W147 Y153 V154T104-V150 HydrophobicContact CG2-CG1 3.93Å; F107-V150 HydrophobicContact CB-CG1 3.87Å; L108-V150 HydrophobicContact CD1-CB 4.06Å; L108-V150 HydrophobicContact CD1-CG1 4.28Å; L108-V150 HydrophobicContact CD1-CG2 3.73Å; P111-V150 HydrophobicContact CG-CG2 4.19Å; I146-V150 HydrophobicContact CG2-CG2 4.5Å; I146-V150 WeakPolarHBondContact O-CG2 3.44Å; I146-V150 PolarHBondContact O-N 2.87Å; W147-V150 PolarHBondContact O-N 3.4Å; V150-Y153 WeakPolarHBondContact O-CB 3.3Å; V150-Y153 PolarHBondContact O-N 3.38Å; V150-V154 HydrophobicContact CG1-CG2 4.33Å; V150-V154 VanDerWaalsContact O-CG2 3.31Å; V150-V154 WeakPolarHBondContact O-CG2 3.2Å; V150-V154 PolarHBondContact O-N 2.93Å
151L92Very high88.4Confident55 Ų5559.8 Ų59.829%0.28834%0.337SS..Hα-helixtrans-63.2-43.3175.4-75.7168.8000111.9I100 T104 W147 I148 Y153 V154 L155I100-L151 HydrophobicContact CG2-CD2 4.18Å; T104-L151 HydrophobicContact CG2-CD2 4.05Å; T104-L151 HydrophobicContact CG2-CG 4.29Å; T104-L151 WeakPolarHBondContact OG1-CD2 3.42Å; W147-L151 VanDerWaalsContact O-CB 3.26Å; W147-L151 WeakPolarHBondContact O-CB 3.31Å; W147-L151 VanDerWaalsContact O-CG 3.24Å; W147-L151 WeakPolarHBondContact O-CG 3.48Å; W147-L151 PolarHBondContact O-N 2.93Å; I148-L151 PolarHBondContact O-N 3.02Å; L151-Y153 VanDerWaalsContact C-N 3.29Å; L151-Y153 PolarHBondContact O-N 3.3Å; L151-V154 PolarHBondContact O-N 3.44Å; L151-L155 WeakPolarHBondContact O-CB 3.45Å; L151-L155 VanDerWaalsContact O-CG 3.26Å; L151-L155 WeakPolarHBondContact O-CG 3.34Å; L151-L155 PolarHBondContact O-N 3.49Å
152A91.4Very high87.1Confident58 Ų5860.6 Ų60.648%0.47934%0.343SS..Hα-helixtrans-61.7-39.2175.900000111.4I148 G156I148-A152 WeakPolarHBondContact O-CB 3.3Å; I148-A152 PolarHBondContact O-N 2.92Å; A152-G156 WeakPolarHBondContact O-CA 3.34Å; A152-G156 PolarHBondContact O-N 2.97Å
153Y90.6Very high85.9Confident112 Ų11261.6 Ų61.644%0.43935%0.35SS..Hα-helixtrans-63.2-50.2173.5175.8-106.5000112F107 S149 V150 L151 L155 G156 D157 I160F107-Y153 AromaticContact CD1-CE1 3.98Å; F107-Y153 HydrophobicContact CD1-CE1 3.98Å; F107-Y153 HydrophobicContact CD2-CD1 4.34Å; F107-Y153 HydrophobicContact CD2-CE1 4.17Å; F107-Y153 AromaticContact CE1-CE1 3.72Å; F107-Y153 HydrophobicContact CE1-CE1 3.72Å; F107-Y153 HydrophobicContact CE2-CD1 4.49Å; F107-Y153 AromaticContact CE2-CE1 3.96Å; F107-Y153 HydrophobicContact CE2-CE1 3.96Å; F107-Y153 HydrophobicContact CG-CD1 4.41Å; F107-Y153 HydrophobicContact CG-CE1 4.21Å; F107-Y153 AromaticContact CZ-CE1 3.74Å; F107-Y153 HydrophobicContact CZ-CE1 3.74Å; S149-Y153 WeakPolarHBondContact O-CB 3.1Å; S149-Y153 PolarHBondContact O-N 3.03Å; V150-Y153 WeakPolarHBondContact O-CB 3.3Å; V150-Y153 PolarHBondContact O-N 3.38Å; L151-Y153 VanDerWaalsContact C-N 3.29Å; L151-Y153 PolarHBondContact O-N 3.3Å; Y153-L155 VanDerWaalsContact C-N 3.33Å; Y153-L155 PolarHBondContact O-N 3.38Å; Y153-G156 PolarHBondContact O-N 3.48Å; Y153-D157 WeakPolarHBondContact O-CB 3.42Å; Y153-D157 PolarHBondContact O-N 2.91Å; Y153-D157 PolarHBondContact OH-OD2 3.32Å; Y153-I160 HydrophobicContact CE1-CD1 4.25Å
154V88.6Confident84.6Confident0 Ų061.6 Ų61.60%035%0.35CS..Hα-helixtrans-61.4-39.2179.9167.90000112.2F103 F107 V150 L151 I160F103-V154 HydrophobicContact CB-CG1 3.76Å; F103-V154 HydrophobicContact CB-CG2 4.02Å; F107-V154 HydrophobicContact CD2-CG2 3.91Å; F107-V154 HydrophobicContact CE2-CG2 4.35Å; V150-V154 HydrophobicContact CG1-CG2 4.33Å; V150-V154 VanDerWaalsContact O-CG2 3.31Å; V150-V154 WeakPolarHBondContact O-CG2 3.2Å; V150-V154 PolarHBondContact O-N 2.93Å; L151-V154 PolarHBondContact O-N 3.44Å; V154-I160 HydrophobicContact CG1-CG2 4.12Å; V154-I160 WeakPolarHBondContact O-CG2 3.4Å
155L87.2Confident83.1Confident92 Ų9264 Ų6448%0.48236%0.359SS..Hα-helixtrans-82.1-27.2-179.7-65.1174.7000113.2I100 L151 Y153I100-L155 HydrophobicContact CD1-CD2 4.3Å; I100-L155 HydrophobicContact CG1-CD2 4.5Å; L151-L155 WeakPolarHBondContact O-CB 3.45Å; L151-L155 VanDerWaalsContact O-CG 3.26Å; L151-L155 WeakPolarHBondContact O-CG 3.34Å; L151-L155 PolarHBondContact O-N 3.49Å; Y153-L155 VanDerWaalsContact C-N 3.33Å; Y153-L155 PolarHBondContact O-N 3.38Å
156G84.2Confident81.5Confident60 Ų6063.5 Ų63.562%0.61936%0.361SS*.Hα-helixtrans-88.6-23.4-177.700000114.4A152 Y153 P158A152-G156 WeakPolarHBondContact O-CA 3.34Å; A152-G156 PolarHBondContact O-N 2.97Å; Y153-G156 PolarHBondContact O-N 3.48Å; G156-P158 WeakPolarHBondContact O-CD 3.5Å
157D82.8Confident79.5Confident38 Ų3869.5 Ų69.520%0.20339%0.389CS..  trans-71.1118.8178.9-172.2-51.6000110.6Y153 A159 I160 Y161Y153-D157 WeakPolarHBondContact O-CB 3.42Å; Y153-D157 PolarHBondContact O-N 2.91Å; Y153-D157 PolarHBondContact OH-OD2 3.32Å; D157-A159 VanDerWaalsContact C-N 3.29Å; D157-A159 PolarHBondContact O-N 3.26Å; D157-A159 WeakPolarHBondContact OD1-CA 3.39Å; D157-A159 WeakPolarHBondContact OD1-CB 3.46Å; D157-A159 PolarHBondContact OD1-N 3.39Å; D157-I160 HydrophobicContact CB-CB 4.1Å; D157-I160 HydrophobicContact CB-CD1 3.84Å; D157-I160 HydrophobicContact CB-CG1 3.93Å; D157-I160 PolarHBondContact O-N 3.08Å; D157-I160 PolarHBondContact OD1-N 3.2Å; D157-Y161 WeakPolarHBondContact O-CB 3.29Å; D157-Y161 PolarHBondContact O-N 2.89Å
158P74.3Confident77.4Confident99 Ų9975 Ų7564%0.64342%0.42SS*.Hα-helixtrans-66.3-28.9-175.626.3-33.8000113.3G156 Q162G156-P158 WeakPolarHBondContact O-CD 3.5Å; P158-Q162 WeakPolarHBondContact O-CB 3.37Å; P158-Q162 PolarHBondContact O-N 3.02Å
159A75.3Confident75.2Confident66 Ų6675.2 Ų75.255%0.54544%0.436SS..Hα-helixtrans-72.9-40.7177.700000111D157 Q162 S163D157-A159 VanDerWaalsContact C-N 3.29Å; D157-A159 PolarHBondContact O-N 3.26Å; D157-A159 WeakPolarHBondContact OD1-CA 3.39Å; D157-A159 WeakPolarHBondContact OD1-CB 3.46Å; D157-A159 PolarHBondContact OD1-N 3.39Å; A159-Q162 PolarHBondContact O-N 2.9Å; A159-S163 PolarHBondContact O-N 2.7Å; A159-S163 VanDerWaalsContact O-N 3.15Å
160I75.6Confident72.9Confident14 Ų1481.8 Ų81.87%0.07245%0.452CS..Hα-helixtrans-67.4-44.5173.9-58.5178.2000109.8F103 F107 Y153 V154 D157 Q162 S163 L164F103-I160 HydrophobicContact CD1-CG2 4.14Å; F103-I160 HydrophobicContact CD2-CG2 3.86Å; F103-I160 HydrophobicContact CE1-CG2 4.27Å; F103-I160 HydrophobicContact CE2-CG2 4.03Å; F103-I160 HydrophobicContact CG-CG2 3.94Å; F103-I160 HydrophobicContact CZ-CG2 4.23Å; F107-I160 HydrophobicContact CE2-CD1 3.73Å; F107-I160 HydrophobicContact CZ-CD1 4.02Å; Y153-I160 HydrophobicContact CE1-CD1 4.25Å; V154-I160 HydrophobicContact CG1-CG2 4.12Å; V154-I160 WeakPolarHBondContact O-CG2 3.4Å; D157-I160 HydrophobicContact CB-CB 4.1Å; D157-I160 HydrophobicContact CB-CD1 3.84Å; D157-I160 HydrophobicContact CB-CG1 3.93Å; D157-I160 PolarHBondContact O-N 3.08Å; D157-I160 PolarHBondContact OD1-N 3.2Å; I160-Q162 VanDerWaalsContact C-N 3.26Å; I160-Q162 PolarHBondContact O-N 2.99Å; I160-S163 WeakPolarHBondContact O-CA 3.48Å; I160-S163 WeakPolarHBondContact O-CB 3.34Å; I160-S163 PolarHBondContact O-N 3.17Å; I160-S163 PolarHBondContact O-OG 3.49Å; I160-L164 HydrophobicContact CG2-CD1 4.18Å; I160-L164 HydrophobicContact CG2-CG 4.49Å; I160-L164 WeakPolarHBondContact O-CG 3.49Å; I160-L164 PolarHBondContact O-N 2.91Å
161Y69.4Low70.7Confident126 Ų12684.5 Ų84.549%0.49447%0.471SS..Hα-helixtrans-58-38.3176-175.6-104.4000112.7D157 S163 L164 K165D157-Y161 WeakPolarHBondContact O-CB 3.29Å; D157-Y161 PolarHBondContact O-N 2.89Å; Y161-S163 VanDerWaalsContact C-N 3.33Å; Y161-S163 PolarHBondContact O-N 3.49Å; Y161-L164 PolarHBondContact O-N 2.96Å; Y161-K165 PolarHBondContact O-N 3.48Å
162Q66.9Low68.9Low138 Ų13890.3 Ų90.365%0.64550%0.496SS*.Hα-helixtrans-67.7-32.1174.4-172170.4-200112.7P158 A159 I160 K165P158-Q162 WeakPolarHBondContact O-CB 3.37Å; P158-Q162 PolarHBondContact O-N 3.02Å; A159-Q162 PolarHBondContact O-N 2.9Å; I160-Q162 VanDerWaalsContact C-N 3.26Å; I160-Q162 PolarHBondContact O-N 2.99Å; Q162-K165 PolarHBondContact O-N 3.24Å
163S68Low67.3Low41 Ų4193.5 Ų93.529%0.28750%0.501SS..Hα-helixtrans-73.5-24.9173.577.60000113.8F103 A159 I160 Y161 K165F103-S163 WeakPolarHBondContact CE2-OG 3.31Å; F103-S163 VanDerWaalsContact CZ-OG 3.23Å; F103-S163 WeakPolarHBondContact CZ-OG 3.14Å; A159-S163 PolarHBondContact O-N 2.7Å; A159-S163 VanDerWaalsContact O-N 3.15Å; I160-S163 WeakPolarHBondContact O-CA 3.48Å; I160-S163 WeakPolarHBondContact O-CB 3.34Å; I160-S163 PolarHBondContact O-N 3.17Å; I160-S163 PolarHBondContact O-OG 3.49Å; Y161-S163 VanDerWaalsContact C-N 3.33Å; Y161-S163 PolarHBondContact O-N 3.49Å; S163-K165 VanDerWaalsContact C-N 3.34Å
164L67.4Low66.1Low9 Ų989.6 Ų89.65%0.04749%0.49CS..Hα-helixtrans-78.6-17.9173.9-68.5167.2000112.7Y92 L96 Q99 I100 F103 I160 Y161Y92-L164 PolarHBondContact OH-O 3.47Å; L96-L164 HydrophobicContact CD1-CB 4.2Å; L96-L164 HydrophobicContact CD1-CD2 4.13Å; Q99-L164 HydrophobicContact CB-CD2 3.64Å; I100-L164 HydrophobicContact CG1-CD1 4.25Å; I100-L164 HydrophobicContact CG1-CD2 3.89Å; F103-L164 HydrophobicContact CD2-CD2 4.26Å; F103-L164 HydrophobicContact CE2-CD2 4.22Å; I160-L164 HydrophobicContact CG2-CD1 4.18Å; I160-L164 HydrophobicContact CG2-CG 4.49Å; I160-L164 WeakPolarHBondContact O-CG 3.49Å; I160-L164 PolarHBondContact O-N 2.91Å; Y161-L164 PolarHBondContact O-N 2.96Å
165K64.1Low65Low113 Ų11393.3 Ų93.349%0.49151%0.514SS..SBendtrans-70.5142.9173.2-75.7-175.1-179.7179.30110.2Y161 Q162 S163 Q167Y161-K165 PolarHBondContact O-N 3.48Å; Q162-K165 PolarHBondContact O-N 3.24Å; S163-K165 VanDerWaalsContact C-N 3.34Å; K165-Q167 PolarHBondContact O-N 3.48Å
166P60.8Low64.1Low94 Ų9494.7 Ų94.761%0.6152%0.516SS*.  trans-60.8110.3-179.424.1-32.4000110.6Y92 N168Y92-P166 HydrophobicContact CE2-CB 4.13Å; Y92-P166 HydrophobicContact CE2-CG 4.36Å; P166-N168 PolarHBondContact O-N 3.08Å
167Q54.8Low63.6Low137 Ų13794.4 Ų94.464%0.6450%0.497SS*.SBendtrans-78.9108.2168.8-73.2-170.8-6.100108.7K165 S171K165-Q167 PolarHBondContact O-N 3.48Å; Q167-S171 PolarHBondContact O-OG 3.44Å
168N51.5Low63.1Low135 Ų13595.2 Ų95.272%0.72250%0.503SS*.  trans58116.2177.4-60.2-24.4000114.7P166 Y170 S171P166-N168 PolarHBondContact O-N 3.08Å; N168-Y170 PolarHBondContact O-N 3.48Å; N168-S171 PolarHBondContact O-N 3.27Å; N168-S171 PolarHBondContact O-OG 2.9Å
169A47.9Very low63Low103 Ų10390.6 Ų90.685%0.85147%0.473SS*.THydrogen-bonded Turntrans-57.90.8-18000000116.2
170Y44.8Very low63.1Low213 Ų21392.4 Ų92.484%0.83547%0.473SS*.THydrogen-bonded Turntrans-110.5-2.6-177-71.7-80.3000114.3N168 H172N168-Y170 PolarHBondContact O-N 3.48Å; Y170-H172 PolarHBondContact O-N 3.39Å
171S47.8Very low63.1Low71 Ų7193.4 Ų93.450%0.49748%0.477SS..  trans-88107.3175.464.40000110.6Q167 N168 H173Q167-S171 PolarHBondContact O-OG 3.44Å; N168-S171 PolarHBondContact O-N 3.27Å; N168-S171 PolarHBondContact O-OG 2.9Å; S171-H173 PolarHBondContact O-N 3.35Å
172H52.8Low63.3Low177 Ų17787.6 Ų87.682%0.81946%0.455SS*.  trans-75.55.4176.2-66.5-66.7000113.6Y170Y170-H172 PolarHBondContact O-N 3.39Å
173H57.6Low64Low126 Ų12685.4 Ų85.458%0.58344%0.441SS*.SBendtrans-114.7127.9-175.1-63.5-64.4000110.3S171 P175S171-H173 PolarHBondContact O-N 3.35Å; H173-P175 WeakPolarHBondContact O-CD 3.4Å
174C65.9Low64.9Low29 Ų2988.9 Ų88.920%0.19645%0.448CS..PPolyproline II helixtrans-67.1123.6169.8-47.50000108.5C95 F176C95-C174 WeakPolarHBondContact CA-SG 3.4Å; C95-C174 HydrophobicContact CB-CB 3.69Å; C95-C174 WeakPolarHBondContact CB-SG 3.24Å; C95-C174 WeakPolarHBondContact SG-CB 3.21Å; C95-C174 CovalentContact SG-SG 2.03Å; C95-C174 PolarHBondContact SG-SG 3.32Å; C174-F176 PolarHBondContact O-N 2.84Å
175P66Low65.5Low78 Ų7889.4 Ų89.451%0.50645%0.451SS..PPolyproline II helixtrans-64.3130.4172.319.1-23.5000109.2Q99 H173Q99-P175 VanDerWaalsContact NE2-CD 3.28Å; Q99-P175 VanDerWaalsContact NE2-CG 3.26Å; Q99-P175 PolarHBondContact NE2-O 2.94Å; H173-P175 WeakPolarHBondContact O-CD 3.4Å
176F67.9Low66.5Low122 Ų12284.7 Ų84.754%0.53543%0.432SS..PPolyproline II helixtrans-89.5127.4176.849.6-90.3000109.6C174 V178 P270C174-F176 PolarHBondContact O-N 2.84Å; F176-V178 HydrophobicContact CD2-CG2 3.89Å; F176-V178 HydrophobicContact CE2-CG2 4.19Å; F176-P270 HydrophobicContact CB-CB 4.42Å
177Y73.5Confident67.8Low54 Ų5483.2 Ų83.221%0.21242%0.416CS..PPolyproline II helixtrans-82.4125.4173.7177.1-108.5000109.6F103 A271F103-Y177 AromaticContact CD1-CD1 3.86Å; F103-Y177 HydrophobicContact CD1-CD1 3.86Å; F103-Y177 AromaticContact CD1-CD2 3.89Å; F103-Y177 HydrophobicContact CD1-CD2 3.89Å; F103-Y177 AromaticContact CD1-CE1 3.82Å; F103-Y177 HydrophobicContact CD1-CE1 3.82Å; F103-Y177 AromaticContact CD1-CE2 3.84Å; F103-Y177 HydrophobicContact CD1-CE2 3.84Å; F103-Y177 AromaticContact CD1-CG 3.9Å; F103-Y177 HydrophobicContact CD1-CG 3.9Å; F103-Y177 AromaticContact CD1-CZ 3.8Å; F103-Y177 HydrophobicContact CE1-CD1 4.11Å; F103-Y177 AromaticContact CE1-CD2 3.27Å; F103-Y177 HydrophobicContact CE1-CD2 3.27Å; F103-Y177 HydrophobicContact CE1-CE1 4.18Å; F103-Y177 AromaticContact CE1-CE2 3.35Å; F103-Y177 HydrophobicContact CE1-CE2 3.35Å; F103-Y177 AromaticContact CE1-CG 3.67Å; F103-Y177 HydrophobicContact CE1-CG 3.67Å; F103-Y177 AromaticContact CE1-CZ 3.82Å; F103-Y177 HydrophobicContact CG-CD1 4.42Å; F103-Y177 AromaticContact CZ-CD2 3.78Å; F103-Y177 HydrophobicContact CZ-CD2 3.78Å; F103-Y177 HydrophobicContact CZ-CE2 4.28Å; F103-Y177 HydrophobicContact CZ-CG 4.1Å; Y177-A271 HydrophobicContact CD1-CB 3.73Å; Y177-A271 HydrophobicContact CE1-CB 4.3Å; Y177-A271 WeakPolarHBondContact O-CB 3.23Å; Y177-A271 PolarHBondContact O-N 3.47Å
178V72.2Confident69.4Low55 Ų5582.1 Ų82.133%0.33341%0.41SS..PPolyproline II helixtrans-103.9117.9172.8-1770000107.1F176 I180 Q268F176-V178 HydrophobicContact CD2-CG2 3.89Å; F176-V178 HydrophobicContact CE2-CG2 4.19Å; V178-I180 PolarHBondContact O-N 2.99Å; V178-Q268 HydrophobicContact CG1-CB 4.47Å; V178-Q268 HydrophobicContact CG2-CB 3.99Å; V178-Q268 HydrophobicContact CG2-CG 4.5Å
179S71.8Confident71.1Confident2 Ų276.1 Ų76.11%0.01438%0.377CS..PPolyproline II helixtrans-77116.3-177.9177.20000110.5Q181 S182S179-Q181 PolarHBondContact O-N 3.17Å; S179-Q181 PolarHBondContact OG-N 3.36Å; S179-S182 VanDerWaalsContact CB-OG 3.23Å; S179-S182 WeakPolarHBondContact CB-OG 3.35Å; S179-S182 PolarHBondContact OG-N 2.83Å; S179-S182 PolarHBondContact OG-OG 2.95Å
180I77.9Confident73.1Confident104 Ų10472 Ų7253%0.53334%0.342SS..Hα-helixtrans-62.7-30.3170.4-166.868.5000111.1V178 Y183 W184V178-I180 PolarHBondContact O-N 2.99Å; I180-Y183 PolarHBondContact O-N 2.96Å; I180-W184 PolarHBondContact O-N 3.25Å
181Q76.1Confident75.3Confident34 Ų3465.8 Ų65.816%0.15932%0.321CS..Hα-helixtrans-70.1-42.4-172.8-63168.3-28.700111.2G106 F107 Y110 S179 W184 L185G106-Q181 VanDerWaalsContact C-OE1 3.25Å; G106-Q181 PolarHBondContact O-OE1 3.32Å; F107-Q181 VanDerWaalsContact CD1-NE2 3.26Å; Y110-Q181 HydrophobicContact CE2-CB 3.74Å; Y110-Q181 HydrophobicContact CE2-CG 3.72Å; S179-Q181 PolarHBondContact O-N 3.17Å; S179-Q181 PolarHBondContact OG-N 3.36Å; Q181-W184 PolarHBondContact O-N 3.49Å; Q181-L185 WeakPolarHBondContact O-CB 3.23Å; Q181-L185 PolarHBondContact O-N 2.95Å
182S74.3Confident77.3Confident5 Ų566.8 Ų66.84%0.03532%0.32CS..Hα-helixtrans-69-37179.1-45.70000112.3H109 S179 L185 S186 E274H109-S182 PolarHBondContact CD2-OG 2.88Å; H109-S182 PolarHBondContact NE2-OG 3.22Å; H109-S182 VanDerWaalsContact NE2-OG 3.15Å; S179-S182 VanDerWaalsContact CB-OG 3.23Å; S179-S182 WeakPolarHBondContact CB-OG 3.35Å; S179-S182 PolarHBondContact OG-N 2.83Å; S179-S182 PolarHBondContact OG-OG 2.95Å; S182-L185 PolarHBondContact O-N 3.31Å; S182-S186 PolarHBondContact O-N 2.96Å; S182-E274 WeakPolarHBondContact CB-OE1 3.28Å; S182-E274 WeakPolarHBondContact CB-OE2 3.33Å; S182-E274 VanDerWaalsContact OG-CD 3.26Å; S182-E274 PolarHBondContact OG-OE2 2.03Å
183Y81.7Confident79.1Confident91 Ų9159.5 Ų59.536%0.35729%0.287SS..Hα-helixtrans-56.4-51171.3172.4-90.5000111.2I180 L185 S186 F187 L263I180-Y183 PolarHBondContact O-N 2.96Å; Y183-L185 VanDerWaalsContact C-N 3.33Å; Y183-L185 PolarHBondContact O-N 3.45Å; Y183-S186 PolarHBondContact O-N 3.33Å; Y183-F187 VanDerWaalsContact O-CB 3.3Å; Y183-F187 WeakPolarHBondContact O-CB 3.35Å; Y183-F187 PolarHBondContact O-N 3.44Å; Y183-L263 HydrophobicContact CD2-CD2 3.66Å; Y183-L263 HydrophobicContact CE2-CD2 3.4Å; Y183-L263 VanDerWaalsContact CE2-CD2 3.4Å
184W85.2Confident80.6Confident114 Ų11459.1 Ų59.143%0.43228%0.284SS..Hα-helixtrans-61.3-42.4177.8-77.3112.9000111.9I180 Q181 F187 F188I180-W184 PolarHBondContact O-N 3.25Å; Q181-W184 PolarHBondContact O-N 3.49Å; W184-F187 HydrophobicContact CE3-CD1 4.34Å; W184-F187 HydrophobicContact CZ3-CD1 4.41Å; W184-F187 PolarHBondContact O-N 2.95Å; W184-F188 HydrophobicContact CB-CD2 4.32Å; W184-F188 HydrophobicContact CB-CE2 4.13Å; W184-F188 AromaticContact CE3-CE2 3.97Å; W184-F188 HydrophobicContact CE3-CE2 3.97Å; W184-F188 HydrophobicContact CE3-CZ 4.1Å; W184-F188 WeakPolarHBondContact O-CD2 3.4Å; W184-F188 WeakPolarHBondContact O-CG 3.48Å; W184-F188 PolarHBondContact O-N 3.34Å
185L81.9Confident81.8Confident20 Ų2061.8 Ų61.811%0.10530%0.299CS..Hα-helixtrans-62.7-46.2178.8-175.359.7000112H109 Q181 S182 Y183 F188 M189 W279H109-L185 HydrophobicContact CB-CD2 3.88Å; Q181-L185 WeakPolarHBondContact O-CB 3.23Å; Q181-L185 PolarHBondContact O-N 2.95Å; S182-L185 PolarHBondContact O-N 3.31Å; Y183-L185 VanDerWaalsContact C-N 3.33Å; Y183-L185 PolarHBondContact O-N 3.45Å; L185-F188 PolarHBondContact O-N 3.48Å; L185-M189 HydrophobicContact CD1-CG 4.49Å; L185-M189 WeakPolarHBondContact O-CB 3.48Å; L185-M189 WeakPolarHBondContact O-CG 3.42Å; L185-M189 PolarHBondContact O-N 2.86Å; L185-W279 HydrophobicContact CD2-CH2 3.66Å; L185-W279 HydrophobicContact CD2-CZ2 3.45Å; L185-W279 VanDerWaalsContact CD2-CZ2 3.45Å; L185-W279 HydrophobicContact CG-CZ2 4.24Å
186S83.5Confident82.9Confident15 Ų1558.9 Ų58.911%0.10528%0.282CS..Hα-helixtrans-62.2-44.1174.8179.10000111.4S182 Y183 F188 M189 V190 Q259S182-S186 PolarHBondContact O-N 2.96Å; Y183-S186 PolarHBondContact O-N 3.33Å; S186-F188 PolarHBondContact O-N 3.5Å; S186-M189 PolarHBondContact O-N 3.28Å; S186-V190 WeakPolarHBondContact O-CG2 3.23Å; S186-V190 PolarHBondContact O-N 3.45Å; S186-Q259 PolarHBondContact OG-OE1 3.35Å
187F88.4Confident83.8Confident63 Ų6355.8 Ų55.828%0.27627%0.268SS..Hα-helixtrans-58.2-50.2176.6179.8-95000112.1Y183 W184 M189 V190 M191 L263Y183-F187 VanDerWaalsContact O-CB 3.3Å; Y183-F187 WeakPolarHBondContact O-CB 3.35Å; Y183-F187 PolarHBondContact O-N 3.44Å; W184-F187 HydrophobicContact CE3-CD1 4.34Å; W184-F187 HydrophobicContact CZ3-CD1 4.41Å; W184-F187 PolarHBondContact O-N 2.95Å; F187-M189 VanDerWaalsContact C-N 3.35Å; F187-M189 PolarHBondContact O-N 2.89Å; F187-V190 PolarHBondContact O-N 2.86Å; F187-M191 HydrophobicContact CD1-CG 4.18Å; F187-M191 HydrophobicContact CD2-CE 4.14Å; F187-M191 HydrophobicContact CE1-CE 4.49Å; F187-M191 HydrophobicContact CE1-CG 3.84Å; F187-M191 HydrophobicContact CE2-CE 3.36Å; F187-M191 HydrophobicContact CE2-CG 4.2Å; F187-M191 HydrophobicContact CG-CG 4.5Å; F187-M191 HydrophobicContact CZ-CE 3.58Å; F187-M191 HydrophobicContact CZ-CG 3.85Å; F187-M191 HydrophobicContact CZ-SD 4.37Å; F187-M191 WeakPolarHBondContact O-CB 3.34Å; F187-M191 VanDerWaalsContact O-CG 3.24Å; F187-M191 WeakPolarHBondContact O-CG 3.29Å; F187-M191 PolarHBondContact O-N 3.34Å; F187-L263 HydrophobicContact CB-CD2 4.48Å
188F89.3Confident84.5Confident114 Ų11457.7 Ų57.750%0.528%0.281SS..Hα-helixtrans-61.1-42.5178.3-75.8-58.8000112.2W184 L185 S186 M191 I192W184-F188 HydrophobicContact CB-CD2 4.32Å; W184-F188 HydrophobicContact CB-CE2 4.13Å; W184-F188 AromaticContact CE3-CE2 3.97Å; W184-F188 HydrophobicContact CE3-CE2 3.97Å; W184-F188 HydrophobicContact CE3-CZ 4.1Å; W184-F188 WeakPolarHBondContact O-CD2 3.4Å; W184-F188 WeakPolarHBondContact O-CG 3.48Å; W184-F188 PolarHBondContact O-N 3.34Å; L185-F188 PolarHBondContact O-N 3.48Å; S186-F188 PolarHBondContact O-N 3.5Å; F188-M191 PolarHBondContact O-N 2.98Å; F188-I192 VanDerWaalsContact O-CG1 3.26Å; F188-I192 WeakPolarHBondContact O-CG1 3.49Å; F188-I192 PolarHBondContact O-N 3.26Å
189M86.3Confident85.1Confident8 Ų858.8 Ų58.84%0.03929%0.288CS..Hα-helixtrans-63.2-46.6178.7-70.4-77.3-69.500112L185 S186 F187 M191 I192 L193 F282 F286L185-M189 HydrophobicContact CD1-CG 4.49Å; L185-M189 WeakPolarHBondContact O-CB 3.48Å; L185-M189 WeakPolarHBondContact O-CG 3.42Å; L185-M189 PolarHBondContact O-N 2.86Å; S186-M189 PolarHBondContact O-N 3.28Å; F187-M189 VanDerWaalsContact C-N 3.35Å; F187-M189 PolarHBondContact O-N 2.89Å; M189-M191 VanDerWaalsContact C-N 3.34Å; M189-M191 PolarHBondContact O-N 2.97Å; M189-I192 PolarHBondContact O-N 2.92Å; M189-L193 WeakPolarHBondContact O-CB 3.44Å; M189-L193 WeakPolarHBondContact O-CG 3.38Å; M189-L193 PolarHBondContact O-N 3.44Å; M189-F282 HydrophobicContact CE-CD1 4.39Å; M189-F282 HydrophobicContact CE-CE1 3.76Å; M189-F282 HydrophobicContact CE-CZ 4.39Å; M189-F286 HydrophobicContact CE-CB 3.55Å; M189-F286 HydrophobicContact CE-CD1 3.36Å; M189-F286 HydrophobicContact CE-CD2 3.63Å; M189-F286 HydrophobicContact CE-CE1 3.88Å; M189-F286 HydrophobicContact CE-CE2 4.12Å; M189-F286 HydrophobicContact CE-CG 3.21Å; M189-F286 HydrophobicContact CE-CZ 4.22Å; M189-F286 HydrophobicContact SD-CD1 3.52Å; M189-F286 VanDerWaalsContact SD-CD1 3.52Å; M189-F286 HydrophobicContact SD-CD2 4.27Å; M189-F286 HydrophobicContact SD-CE1 3.42Å; M189-F286 WeakPolarHBondContact SD-CE1 3.44Å; M189-F286 HydrophobicContact SD-CE2 4.18Å; M189-F286 HydrophobicContact SD-CG 3.95Å; M189-F286 HydrophobicContact SD-CZ 3.76Å
190V89.8Confident85.6Confident18 Ų1858.7 Ų58.711%0.10929%0.287CS..Hα-helixtrans-62.8-42176.4171.20000110.8S186 F187 L193 F194 Q259 V260 L263S186-V190 WeakPolarHBondContact O-CG2 3.23Å; S186-V190 PolarHBondContact O-N 3.45Å; F187-V190 PolarHBondContact O-N 2.86Å; V190-L193 PolarHBondContact O-N 3.05Å; V190-F194 VanDerWaalsContact O-CB 3.29Å; V190-F194 WeakPolarHBondContact O-CB 3.47Å; V190-F194 PolarHBondContact O-N 3.49Å; V190-Q259 HydrophobicContact CG2-CB 4.09Å; V190-V260 HydrophobicContact CG1-CG2 3.89Å; V190-L263 HydrophobicContact CB-CD1 4.32Å; V190-L263 HydrophobicContact CG2-CD1 4.1Å
191M91.2Very high85.8Confident82 Ų8260.4 Ų60.440%0.40429%0.287SS..Hα-helixtrans-64.6-42.9177.8-73-60.7163.400112.4F187 F188 M189 F194 V195F187-M191 HydrophobicContact CD1-CG 4.18Å; F187-M191 HydrophobicContact CD2-CE 4.14Å; F187-M191 HydrophobicContact CE1-CE 4.49Å; F187-M191 HydrophobicContact CE1-CG 3.84Å; F187-M191 HydrophobicContact CE2-CE 3.36Å; F187-M191 HydrophobicContact CE2-CG 4.2Å; F187-M191 HydrophobicContact CG-CG 4.5Å; F187-M191 HydrophobicContact CZ-CE 3.58Å; F187-M191 HydrophobicContact CZ-CG 3.85Å; F187-M191 HydrophobicContact CZ-SD 4.37Å; F187-M191 WeakPolarHBondContact O-CB 3.34Å; F187-M191 VanDerWaalsContact O-CG 3.24Å; F187-M191 WeakPolarHBondContact O-CG 3.29Å; F187-M191 PolarHBondContact O-N 3.34Å; F188-M191 PolarHBondContact O-N 2.98Å; M189-M191 VanDerWaalsContact C-N 3.34Å; M189-M191 PolarHBondContact O-N 2.97Å; M191-F194 PolarHBondContact O-N 3.36Å; M191-V195 VanDerWaalsContact O-CG2 3.32Å; M191-V195 WeakPolarHBondContact O-CG2 3.35Å; M191-V195 PolarHBondContact O-N 3.4Å
192I90.8Very high86Confident92 Ų9264.9 Ų64.947%0.47231%0.308SS..Hα-helixtrans-62.1-45.4175.7-68.3164000110.5F188 M189 F194 V195 A196 F286F188-I192 VanDerWaalsContact O-CG1 3.26Å; F188-I192 WeakPolarHBondContact O-CG1 3.49Å; F188-I192 PolarHBondContact O-N 3.26Å; M189-I192 PolarHBondContact O-N 2.92Å; I192-F194 VanDerWaalsContact C-N 3.34Å; I192-F194 PolarHBondContact O-N 2.95Å; I192-V195 PolarHBondContact O-N 3.49Å; I192-A196 VanDerWaalsContact O-CB 3.23Å; I192-A196 WeakPolarHBondContact O-CB 3.21Å; I192-A196 PolarHBondContact O-N 3.32Å; I192-F286 HydrophobicContact CB-CZ 4.38Å; I192-F286 HydrophobicContact CD1-CZ 4.4Å; I192-F286 HydrophobicContact CG2-CE2 4.15Å; I192-F286 HydrophobicContact CG2-CZ 3.87Å
193L90.1Very high86.2Confident23 Ų2366.7 Ų66.712%0.1232%0.316CS..Hα-helixtrans-61.7-41.8177-73.5170.6000111.8M189 V190 A196 F197 F248 V256 F282 F286M189-L193 WeakPolarHBondContact O-CB 3.44Å; M189-L193 WeakPolarHBondContact O-CG 3.38Å; M189-L193 PolarHBondContact O-N 3.44Å; V190-L193 PolarHBondContact O-N 3.05Å; L193-A196 PolarHBondContact O-N 2.8Å; L193-F197 WeakPolarHBondContact O-CB 3.39Å; L193-F197 PolarHBondContact O-N 2.91Å; L193-F248 HydrophobicContact CD1-CE1 3.77Å; L193-F248 HydrophobicContact CD1-CZ 4.4Å; L193-F248 HydrophobicContact CD2-CD1 3.98Å; L193-F248 HydrophobicContact CD2-CE1 3.71Å; L193-F248 HydrophobicContact CD2-CZ 4.5Å; L193-F248 HydrophobicContact CG-CE1 4.42Å; L193-V256 HydrophobicContact CD1-CG2 4.12Å; L193-F282 HydrophobicContact CD1-CZ 4.1Å; L193-F286 HydrophobicContact CD2-CD2 4.12Å; L193-F286 HydrophobicContact CD2-CE2 4.08Å; L193-F286 HydrophobicContact CG-CD2 4.42Å; L193-F286 HydrophobicContact CG-CE2 4.18Å
194F90Very high85.9Confident118 Ų11862.8 Ų62.852%0.51830%0.301SS..Hα-helixtrans-63.7-46.7178.2-175.6-110.5000111.9V190 M191 I192 F197 I198V190-F194 VanDerWaalsContact O-CB 3.29Å; V190-F194 WeakPolarHBondContact O-CB 3.47Å; V190-F194 PolarHBondContact O-N 3.49Å; M191-F194 PolarHBondContact O-N 3.36Å; I192-F194 VanDerWaalsContact C-N 3.34Å; I192-F194 PolarHBondContact O-N 2.95Å; F194-F197 PolarHBondContact O-N 3.36Å; F194-I198 HydrophobicContact CD1-CD1 3.71Å; F194-I198 HydrophobicContact CD2-CD1 4.44Å; F194-I198 HydrophobicContact CE1-CD1 3.25Å; F194-I198 HydrophobicContact CE1-CG1 4.42Å; F194-I198 HydrophobicContact CE2-CD1 4.06Å; F194-I198 HydrophobicContact CG-CD1 4.29Å; F194-I198 HydrophobicContact CZ-CD1 3.46Å; F194-I198 VanDerWaalsContact CZ-CD1 3.46Å; F194-I198 HydrophobicContact CZ-CG1 4.36Å; F194-I198 WeakPolarHBondContact O-CG1 3.45Å; F194-I198 PolarHBondContact O-N 2.67Å
195V90.7Very high85.3Confident85 Ų8559.3 Ų59.352%0.51529%0.293SS..Hα-helixtrans-63.6-43.7175.71730000111M191 I192 F197 I198 T199M191-V195 VanDerWaalsContact O-CG2 3.32Å; M191-V195 WeakPolarHBondContact O-CG2 3.35Å; M191-V195 PolarHBondContact O-N 3.4Å; I192-V195 PolarHBondContact O-N 3.49Å; V195-F197 VanDerWaalsContact C-N 3.28Å; V195-F197 PolarHBondContact O-N 3.49Å; V195-I198 PolarHBondContact O-N 3.45Å; V195-T199 HydrophobicContact CG1-CG2 4.26Å; V195-T199 WeakPolarHBondContact O-CB 3.3Å; V195-T199 VanDerWaalsContact O-CG2 3.24Å; V195-T199 WeakPolarHBondContact O-CG2 3.39Å; V195-T199 PolarHBondContact O-N 2.85Å; V195-T199 PolarHBondContact O-OG1 3.37Å
196A87.9Confident84.8Confident17 Ų1761.8 Ų61.814%0.1431%0.309CS..Hα-helixtrans-62-38.3177.300000111.7I192 L193 T199 S200 I245I192-A196 VanDerWaalsContact O-CB 3.23Å; I192-A196 WeakPolarHBondContact O-CB 3.21Å; I192-A196 PolarHBondContact O-N 3.32Å; L193-A196 PolarHBondContact O-N 2.8Å; A196-T199 WeakPolarHBondContact CA-OG1 3.28Å; A196-T199 PolarHBondContact O-OG1 2.89Å; A196-S200 WeakPolarHBondContact O-CB 3.47Å; A196-S200 PolarHBondContact O-N 3.49Å; A196-S200 PolarHBondContact O-OG 3.25Å; A196-I245 HydrophobicContact CB-CD1 3.87Å; A196-I245 VanDerWaalsContact O-CD1 3.3Å; A196-I245 WeakPolarHBondContact O-CD1 3.43Å
197F87Confident84.2Confident58 Ų5861.8 Ų61.825%0.25431%0.308SS..Hα-helixtrans-69.8-45.4176.9-177.3-107.6000112.5L193 F194 V195 T199 S200 W201 V204 I245 L249L193-F197 WeakPolarHBondContact O-CB 3.39Å; L193-F197 PolarHBondContact O-N 2.91Å; F194-F197 PolarHBondContact O-N 3.36Å; V195-F197 VanDerWaalsContact C-N 3.28Å; V195-F197 PolarHBondContact O-N 3.49Å; F197-T199 PolarHBondContact O-N 3.49Å; F197-S200 CarbonylContact O-C 3.48Å; F197-S200 PolarHBondContact O-N 3.37Å; F197-S200 PolarHBondContact O-OG 2.96Å; F197-W201 HydrophobicContact CD1-CE3 4.03Å; F197-W201 HydrophobicContact CD1-CZ3 4.31Å; F197-W201 AromaticContact CE1-CE3 3.33Å; F197-W201 HydrophobicContact CE1-CE3 3.33Å; F197-W201 AromaticContact CE1-CZ3 3.24Å; F197-W201 HydrophobicContact CE1-CZ3 3.24Å; F197-W201 HydrophobicContact CE2-CE3 4.39Å; F197-W201 HydrophobicContact CE2-CZ3 4.49Å; F197-W201 AromaticContact CZ-CE3 3.54Å; F197-W201 HydrophobicContact CZ-CE3 3.54Å; F197-W201 AromaticContact CZ-CZ3 3.34Å; F197-W201 HydrophobicContact CZ-CZ3 3.34Å; F197-W201 WeakPolarHBondContact O-CA 3.37Å; F197-W201 PolarHBondContact O-N 2.98Å; F197-V204 HydrophobicContact CD2-CG1 4.47Å; F197-V204 HydrophobicContact CE2-CG1 3.9Å; F197-I245 HydrophobicContact CD2-CG2 4.05Å; F197-L249 HydrophobicContact CD2-CD1 4.27Å; F197-L249 HydrophobicContact CE2-CD1 4.45Å
198I87.6Confident83.3Confident93 Ų9362.7 Ų62.748%0.47732%0.318SS..Hα-helixtrans-60.3-48175.2-71.8172.3000110.7F194 V195 S200 W201F194-I198 HydrophobicContact CD1-CD1 3.71Å; F194-I198 HydrophobicContact CD2-CD1 4.44Å; F194-I198 HydrophobicContact CE1-CD1 3.25Å; F194-I198 HydrophobicContact CE1-CG1 4.42Å; F194-I198 HydrophobicContact CE2-CD1 4.06Å; F194-I198 HydrophobicContact CG-CD1 4.29Å; F194-I198 HydrophobicContact CZ-CD1 3.46Å; F194-I198 VanDerWaalsContact CZ-CD1 3.46Å; F194-I198 HydrophobicContact CZ-CG1 4.36Å; F194-I198 WeakPolarHBondContact O-CG1 3.45Å; F194-I198 PolarHBondContact O-N 2.67Å; V195-I198 PolarHBondContact O-N 3.45Å; I198-S200 PolarHBondContact O-N 3.26Å; I198-W201 VanDerWaalsContact O-CB 3.31Å; I198-W201 WeakPolarHBondContact O-CB 3.36Å; I198-W201 PolarHBondContact O-N 2.83Å
199T85.3Confident82.1Confident79 Ų7965 Ų6549%0.48533%0.33SS..Hα-helixtrans-64.8-26.3-177.451.90000112.9V195 A196 F197 K238V195-T199 HydrophobicContact CG1-CG2 4.26Å; V195-T199 WeakPolarHBondContact O-CB 3.3Å; V195-T199 VanDerWaalsContact O-CG2 3.24Å; V195-T199 WeakPolarHBondContact O-CG2 3.39Å; V195-T199 PolarHBondContact O-N 2.85Å; V195-T199 PolarHBondContact O-OG1 3.37Å; A196-T199 WeakPolarHBondContact CA-OG1 3.28Å; A196-T199 PolarHBondContact O-OG1 2.89Å; F197-T199 PolarHBondContact O-N 3.49Å; T199-K238 WeakPolarHBondContact O-CE 3.15Å
200S82.1Confident80.9Confident0 Ų066.2 Ų66.20%034%0.342CS..THydrogen-bonded Turntrans-104.98.1177.862.30000114A196 F197 I198 E202 E203 V204 I245A196-S200 WeakPolarHBondContact O-CB 3.47Å; A196-S200 PolarHBondContact O-N 3.49Å; A196-S200 PolarHBondContact O-OG 3.25Å; F197-S200 CarbonylContact O-C 3.48Å; F197-S200 PolarHBondContact O-N 3.37Å; F197-S200 PolarHBondContact O-OG 2.96Å; I198-S200 PolarHBondContact O-N 3.26Å; S200-E202 PolarHBondContact O-N 2.78Å; S200-E203 PolarHBondContact O-N 2.87Å; S200-V204 WeakPolarHBondContact O-CG2 3.43Å; S200-V204 PolarHBondContact O-N 3.25Å; S200-V204 WeakPolarHBondContact OG-CG2 3.46Å; S200-I245 WeakPolarHBondContact OG-CD1 3.39Å
201W83.4Confident79.5Confident139 Ų13967 Ų6753%0.52735%0.347SS..Hα-helixtrans-52.4-48.8-168.6174.2-96.2000114.1F197 I198 E203 V204 T205F197-W201 HydrophobicContact CD1-CE3 4.03Å; F197-W201 HydrophobicContact CD1-CZ3 4.31Å; F197-W201 AromaticContact CE1-CE3 3.33Å; F197-W201 HydrophobicContact CE1-CE3 3.33Å; F197-W201 AromaticContact CE1-CZ3 3.24Å; F197-W201 HydrophobicContact CE1-CZ3 3.24Å; F197-W201 HydrophobicContact CE2-CE3 4.39Å; F197-W201 HydrophobicContact CE2-CZ3 4.49Å; F197-W201 AromaticContact CZ-CE3 3.54Å; F197-W201 HydrophobicContact CZ-CE3 3.54Å; F197-W201 AromaticContact CZ-CZ3 3.34Å; F197-W201 HydrophobicContact CZ-CZ3 3.34Å; F197-W201 WeakPolarHBondContact O-CA 3.37Å; F197-W201 PolarHBondContact O-N 2.98Å; I198-W201 VanDerWaalsContact O-CB 3.31Å; I198-W201 WeakPolarHBondContact O-CB 3.36Å; I198-W201 PolarHBondContact O-N 2.83Å; W201-E203 VanDerWaalsContact C-N 3.33Å; W201-E203 PolarHBondContact O-N 2.95Å; W201-V204 PolarHBondContact O-N 3.36Å; W201-T205 HydrophobicContact CD2-CG2 3.98Å; W201-T205 HydrophobicContact CG-CG2 4.38Å; W201-T205 HydrophobicContact CH2-CG2 4.42Å; W201-T205 HydrophobicContact CZ2-CG2 3.88Å; W201-T205 WeakPolarHBondContact O-CG2 3.28Å; W201-T205 PolarHBondContact O-N 3.46Å; W201-T205 PolarHBondContact O-OG1 3.4Å; W201-T205 VanDerWaalsContact O-OG1 3.1Å
202E79.4Confident77.8Confident128 Ų12871.8 Ų71.860%0.59836%0.36SS*.Hα-helixtrans-61.5-39.1179.8-63.4173.6156.100113S200 T205 T206 K238S200-E202 PolarHBondContact O-N 2.78Å; E202-T205 PolarHBondContact O-OG1 2.9Å; E202-T205 VanDerWaalsContact O-OG1 3.09Å; E202-T206 WeakPolarHBondContact O-CB 3.45Å; E202-T206 VanDerWaalsContact O-CG2 3.23Å; E202-T206 WeakPolarHBondContact O-CG2 3.3Å; E202-T206 PolarHBondContact O-N 3.29Å; E202-T206 PolarHBondContact O-OG1 3Å; E202-K238 IonicContact OE2-NZ 2.78Å
203E78.4Confident75.9Confident44 Ų4474 Ų7421%0.20637%0.372CS..Hα-helixtrans-75.3-36178.5-62-70.4172.300109.9S200 W201 T206 L207 K238S200-E203 PolarHBondContact O-N 2.87Å; W201-E203 VanDerWaalsContact C-N 3.33Å; W201-E203 PolarHBondContact O-N 2.95Å; E203-T206 WeakPolarHBondContact CA-OG1 3.33Å; E203-T206 PolarHBondContact O-OG1 2.77Å; E203-L207 WeakPolarHBondContact O-CB 3.28Å; E203-L207 PolarHBondContact O-N 3.46Å; E203-K238 HydrophobicContact CG-CD 4.27Å; E203-K238 HydrophobicContact CG-CG 4.31Å
204V74.8Confident73.7Confident8 Ų875.8 Ų75.85%0.04838%0.384CS..Hα-helixtrans-68-43.7176.7173.50000111.2F197 S200 W201 L207 V208 V246F197-V204 HydrophobicContact CD2-CG1 4.47Å; F197-V204 HydrophobicContact CE2-CG1 3.9Å; S200-V204 WeakPolarHBondContact O-CG2 3.43Å; S200-V204 PolarHBondContact O-N 3.25Å; S200-V204 WeakPolarHBondContact OG-CG2 3.46Å; W201-V204 PolarHBondContact O-N 3.36Å; V204-L207 PolarHBondContact O-N 3.39Å; V204-V208 HydrophobicContact CG1-CG2 4.18Å; V204-V208 WeakPolarHBondContact O-CB 3.28Å; V204-V208 WeakPolarHBondContact O-CG2 3.46Å; V204-V208 PolarHBondContact O-N 3.29Å; V204-V246 HydrophobicContact CG1-CG2 3.97Å
205T74.5Confident71.3Confident42 Ų4275 Ų7526%0.25839%0.393SS..Hα-helixtrans-65.9-43.3179.653.20000111.5W201 E202 V208 Q209W201-T205 HydrophobicContact CD2-CG2 3.98Å; W201-T205 HydrophobicContact CG-CG2 4.38Å; W201-T205 HydrophobicContact CH2-CG2 4.42Å; W201-T205 HydrophobicContact CZ2-CG2 3.88Å; W201-T205 WeakPolarHBondContact O-CG2 3.28Å; W201-T205 PolarHBondContact O-N 3.46Å; W201-T205 PolarHBondContact O-OG1 3.4Å; W201-T205 VanDerWaalsContact O-OG1 3.1Å; E202-T205 PolarHBondContact O-OG1 2.9Å; E202-T205 VanDerWaalsContact O-OG1 3.09Å; T205-V208 PolarHBondContact O-N 3.04Å; T205-Q209 VanDerWaalsContact O-CB 3.3Å; T205-Q209 WeakPolarHBondContact O-CB 3.39Å; T205-Q209 WeakPolarHBondContact O-CG 3.37Å; T205-Q209 PolarHBondContact O-N 3.22Å
206T71.4Confident68.9Low71 Ų7178.1 Ų78.144%0.43640%0.397SS..Hα-helixtrans-64.3-41.9174.552.30000111.4E202 E203 Q209 A210E202-T206 WeakPolarHBondContact O-CB 3.45Å; E202-T206 VanDerWaalsContact O-CG2 3.23Å; E202-T206 WeakPolarHBondContact O-CG2 3.3Å; E202-T206 PolarHBondContact O-N 3.29Å; E202-T206 PolarHBondContact O-OG1 3Å; E203-T206 WeakPolarHBondContact CA-OG1 3.33Å; E203-T206 PolarHBondContact O-OG1 2.77Å; T206-Q209 PolarHBondContact O-N 3.37Å; T206-A210 WeakPolarHBondContact O-CB 3.33Å; T206-A210 PolarHBondContact O-N 3.05Å
207L69.4Low66.4Low15 Ų1585 Ų858%0.07943%0.428CS..Hα-helixtrans-62.3-47.1177.1-167.673.7000111.3E203 V204 A210 V211 F224 K243 V246E203-L207 WeakPolarHBondContact O-CB 3.28Å; E203-L207 PolarHBondContact O-N 3.46Å; V204-L207 PolarHBondContact O-N 3.39Å; L207-A210 CarbonylContact O-C 3.51Å; L207-A210 PolarHBondContact O-N 3.37Å; L207-V211 VanDerWaalsContact O-CG2 3.3Å; L207-V211 WeakPolarHBondContact O-CG2 3.48Å; L207-V211 PolarHBondContact O-N 2.94Å; L207-F224 HydrophobicContact CD1-CB 3.74Å; L207-F224 HydrophobicContact CD1-CD1 3.15Å; L207-F224 HydrophobicContact CD1-CE1 3.85Å; L207-F224 HydrophobicContact CD1-CG 3.63Å; L207-F224 HydrophobicContact CD2-CD1 3.88Å; L207-F224 HydrophobicContact CD2-CE1 3.66Å; L207-F224 HydrophobicContact CD2-CZ 4.26Å; L207-F224 HydrophobicContact CG-CD1 3.26Å; L207-F224 HydrophobicContact CG-CE1 3.41Å; L207-F224 VanDerWaalsContact CG-CE1 3.41Å; L207-F224 HydrophobicContact CG-CG 4.17Å; L207-F224 HydrophobicContact CG-CZ 4.43Å; L207-K243 HydrophobicContact CD2-CG 4.28Å; L207-V246 HydrophobicContact CD2-CB 4.26Å; L207-V246 HydrophobicContact CD2-CG2 3.93Å
208V69.1Low64.4Low83 Ų8390.5 Ų90.550%0.50346%0.46SS..Hα-helixtrans-65.4-41.4178.2170.30000111.9V204 T205 A210 V211 V246V204-V208 HydrophobicContact CG1-CG2 4.18Å; V204-V208 WeakPolarHBondContact O-CB 3.28Å; V204-V208 WeakPolarHBondContact O-CG2 3.46Å; V204-V208 PolarHBondContact O-N 3.29Å; T205-V208 PolarHBondContact O-N 3.04Å; V208-A210 VanDerWaalsContact C-N 3.29Å; V208-A210 PolarHBondContact O-N 2.92Å; V208-V211 WeakPolarHBondContact O-CB 3.29Å; V208-V211 PolarHBondContact O-N 3.29Å; V208-V246 HydrophobicContact CG2-CG2 4.27Å
209Q65.9Low62.1Low161 Ų16192.9 Ų92.975%0.75247%0.469SS*.Hα-helixtrans-67.5-31.8175.3-73.9173.9-6.200112.3T205 T206 V211T205-Q209 VanDerWaalsContact O-CB 3.3Å; T205-Q209 WeakPolarHBondContact O-CB 3.39Å; T205-Q209 WeakPolarHBondContact O-CG 3.37Å; T205-Q209 PolarHBondContact O-N 3.22Å; T206-Q209 PolarHBondContact O-N 3.37Å; Q209-V211 VanDerWaalsContact C-N 3.34Å
210A61.1Low60.1Low34 Ų3494.9 Ų94.928%0.28148%0.482SS..Hα-helixtrans-83.9-8.9177.200000113.4T206 L207 V208 R212 P225T206-A210 WeakPolarHBondContact O-CB 3.33Å; T206-A210 PolarHBondContact O-N 3.05Å; L207-A210 CarbonylContact O-C 3.51Å; L207-A210 PolarHBondContact O-N 3.37Å; V208-A210 VanDerWaalsContact C-N 3.29Å; V208-A210 PolarHBondContact O-N 2.92Å; A210-R212 PolarHBondContact O-N 3.5Å; A210-P225 HydrophobicContact CB-CG 3.77Å; A210-P225 WeakPolarHBondContact O-CD 3.29Å
211V59.6Low58.3Low36 Ų3697.2 Ų97.222%0.21849%0.494CS..  trans-59.8107.6172.71710000108.3L207 V208 Q209 L222 Y223 F224L207-V211 VanDerWaalsContact O-CG2 3.3Å; L207-V211 WeakPolarHBondContact O-CG2 3.48Å; L207-V211 PolarHBondContact O-N 2.94Å; V208-V211 WeakPolarHBondContact O-CB 3.29Å; V208-V211 PolarHBondContact O-N 3.29Å; Q209-V211 VanDerWaalsContact C-N 3.34Å; V211-L222 HydrophobicContact CG1-CD2 3.37Å; V211-L222 HydrophobicContact CG2-CD2 4.47Å; V211-Y223 WeakPolarHBondContact CA-O 3.42Å; V211-F224 HydrophobicContact CG2-CD1 3.87Å; V211-F224 HydrophobicContact CG2-CE1 3.4Å; V211-F224 HydrophobicContact CG2-CZ 4.29Å
212R55.2Low56.5Low181 Ų18194.3 Ų94.368%0.68349%0.488SS*.EExtended strand (participates in β ladder)trans-93.7125.3160.8-66.5-172.4179-169.60.3107.3A210 T214 Y223A210-R212 PolarHBondContact O-N 3.5Å; R212-T214 HydrophobicContact CB-CG2 4.11Å; R212-T214 PolarHBondContact O-N 3.32Å; R212-T214 VanDerWaalsContact O-N 3.15Å; R212-Y223 HydrophobicContact CB-CD1 4.15Å; R212-Y223 WeakPolarHBondContact O-CB 3.39Å; R212-Y223 PolarHBondContact O-N 2.94Å
213I51.2Low55Low140 Ų14091.8 Ų91.872%0.71847%0.473SS*.EExtended strand (participates in β ladder)trans-73.1105.7168.3-61.3170000105.7
214T44.8Very low53.8Low59 Ų5990.7 Ų90.736%0.36247%0.468SS..EExtended strand (participates in β ladder)trans-114.7131174.656.60000109R212 I221R212-T214 HydrophobicContact CB-CG2 4.11Å; R212-T214 PolarHBondContact O-N 3.32Å; R212-T214 VanDerWaalsContact O-N 3.15Å; T214-I221 PolarHBondContact N-O 2.97Å; T214-I221 PolarHBondContact O-N 3.46Å; T214-I221 VanDerWaalsContact O-N 3.11Å
215S39Very low52.2Low103 Ų10392.9 Ų92.972%0.7248%0.482SS*.EExtended strand (participates in β ladder)trans-82.6119.7172.660.50000108.7
216Y40.4Very low51.2Low149 Ų14995.8 Ų95.858%0.58449%0.491SS*.EExtended strand (participates in β ladder)trans-121.4119.6173.4-173.2-98.4000108.5N218 E219 I221Y216-N218 PolarHBondContact O-N 2.95Å; Y216-E219 PolarHBondContact N-O 3.07Å; Y216-E219 PolarHBondContact O-N 3.25Å; Y216-I221 HydrophobicContact CD1-CD1 4.12Å; Y216-I221 HydrophobicContact CG-CD1 4.35Å
217M35.3Very low49.6Very low163 Ų16397.6 Ų97.680%0.80351%0.507SS*.THydrogen-bonded Turntrans49.749-178.9-57.3-133.7108.300114.6E219M217-E219 PolarHBondContact O-N 3.31Å; M217-E219 VanDerWaalsContact O-N 3.16Å
218N43.7Very low48Very low173 Ų173102 Ų10293%0.92554%0.539SS*.THydrogen-bonded Turntrans638.6-177.5-64.7-18000116.2Y216Y216-N218 PolarHBondContact O-N 2.95Å
219E41Very low46.5Very low142 Ų142105.2 Ų105.266%0.66455%0.548SS*.EExtended strand (participates in β ladder)trans-108.1136.9168-68.1-170169.500110.7Y216 M217 I221Y216-E219 PolarHBondContact N-O 3.07Å; Y216-E219 PolarHBondContact O-N 3.25Å; M217-E219 PolarHBondContact O-N 3.31Å; M217-E219 VanDerWaalsContact O-N 3.16Å; E219-I221 PolarHBondContact O-N 3.42Å
220T42.1Very low45.3Very low122 Ų122100.3 Ų100.375%0.74853%0.532SS*.EExtended strand (participates in β ladder)trans-77.7110.8173.852.10000109
221I43.8Very low44Very low49 Ų49104.9 Ų104.925%0.25155%0.552SS.*EExtended strand (participates in β ladder)trans-107.1133178.6-52.9-174.6000108.5T214 Y216 E219 Y223T214-I221 PolarHBondContact N-O 2.97Å; T214-I221 PolarHBondContact O-N 3.46Å; T214-I221 VanDerWaalsContact O-N 3.11Å; Y216-I221 HydrophobicContact CD1-CD1 4.12Å; Y216-I221 HydrophobicContact CG-CD1 4.35Å; E219-I221 PolarHBondContact O-N 3.42Å; I221-Y223 PolarHBondContact O-N 3.3Å
222L47Very low43.6Very low77 Ų77112 Ų11240%0.40358%0.576SS.*EExtended strand (participates in β ladder)trans-76.5111.4172.1-70.9163.5000108.5V211 F224V211-L222 HydrophobicContact CG1-CD2 3.37Å; V211-L222 HydrophobicContact CG2-CD2 4.47Å; L222-F224 HydrophobicContact CB-CE2 4.21Å; L222-F224 HydrophobicContact CB-CZ 4.16Å
223Y48.3Very low43.4Very low76 Ų76108.4 Ų108.430%0.29857%0.574SS.*EExtended strand (participates in β ladder)trans-85.4131.4178.6175.5-104.5000111.1V211 R212 I221 P225 I323V211-Y223 WeakPolarHBondContact CA-O 3.42Å; R212-Y223 HydrophobicContact CB-CD1 4.15Å; R212-Y223 WeakPolarHBondContact O-CB 3.39Å; R212-Y223 PolarHBondContact O-N 2.94Å; I221-Y223 PolarHBondContact O-N 3.3Å; Y223-P225 HydrophobicContact CD1-CB 4.47Å; Y223-P225 HydrophobicContact CD1-CG 4.28Å; Y223-P225 HydrophobicContact CE1-CB 3.55Å; Y223-P225 HydrophobicContact CE1-CG 3.75Å; Y223-I323 HydrophobicContact CE2-CD1 4.12Å
224F51.5Low43.3Very low20 Ų20107.4 Ų107.49%0.08857%0.574CS.*  trans-121.9102.7174.9-59.5-65.9000109.3L207 V211 L222 F226 V246L207-F224 HydrophobicContact CD1-CB 3.74Å; L207-F224 HydrophobicContact CD1-CD1 3.15Å; L207-F224 HydrophobicContact CD1-CE1 3.85Å; L207-F224 HydrophobicContact CD1-CG 3.63Å; L207-F224 HydrophobicContact CD2-CD1 3.88Å; L207-F224 HydrophobicContact CD2-CE1 3.66Å; L207-F224 HydrophobicContact CD2-CZ 4.26Å; L207-F224 HydrophobicContact CG-CD1 3.26Å; L207-F224 HydrophobicContact CG-CE1 3.41Å; L207-F224 VanDerWaalsContact CG-CE1 3.41Å; L207-F224 HydrophobicContact CG-CG 4.17Å; L207-F224 HydrophobicContact CG-CZ 4.43Å; V211-F224 HydrophobicContact CG2-CD1 3.87Å; V211-F224 HydrophobicContact CG2-CE1 3.4Å; V211-F224 HydrophobicContact CG2-CZ 4.29Å; L222-F224 HydrophobicContact CB-CE2 4.21Å; L222-F224 HydrophobicContact CB-CZ 4.16Å; F224-F226 HydrophobicContact CB-CE2 4.38Å; F224-F226 HydrophobicContact CB-CZ 4.03Å; F224-F226 VanDerWaalsContact O-CE2 3.29Å; F224-F226 WeakPolarHBondContact O-CE2 3.36Å; F224-V246 HydrophobicContact CE1-CG1 4.28Å; F224-V246 HydrophobicContact CZ-CG1 3.97Å
225P43Very low43.7Very low55 Ų55111.5 Ų111.536%0.35758%0.583SS.*  trans-72.3134.617725.1-26.8000110.5A210 Y223A210-P225 HydrophobicContact CB-CG 3.77Å; A210-P225 WeakPolarHBondContact O-CD 3.29Å; Y223-P225 HydrophobicContact CD1-CB 4.47Å; Y223-P225 HydrophobicContact CD1-CG 4.28Å; Y223-P225 HydrophobicContact CE1-CB 3.55Å; Y223-P225 HydrophobicContact CE1-CG 3.75Å
226F52.5Low45Very low102 Ų102109.3 Ų109.345%0.44757%0.568SS.*  trans-104.3139.2176.8-66.5-70.2000111.8F224 K243F224-F226 HydrophobicContact CB-CE2 4.38Å; F224-F226 HydrophobicContact CB-CZ 4.03Å; F224-F226 VanDerWaalsContact O-CE2 3.29Å; F224-F226 WeakPolarHBondContact O-CE2 3.36Å; F226-K243 VanDerWaalsContact CE1-NZ 3.27Å; F226-K243 HydrophobicContact CZ-CD 4.43Å
227S37.8Very low46.6Very low109 Ų109106.2 Ų106.276%0.76256%0.557SS**  trans-86.3123.8158.688.90000109.1H229S227-H229 PolarHBondContact O-N 3.39Å; S227-H229 VanDerWaalsContact O-N 3.08Å
228S36.4Very low48.4Very low107 Ų107102 Ų10275%0.74853%0.534SS*.  trans-79.375.7179.358.60000110.8
229H36.1Very low50Low151 Ų15196 Ų9670%0.69950%0.502SS*.  trans-135.2109.3167.8-83.6-58.5000114.7S227S227-H229 PolarHBondContact O-N 3.39Å; S227-H229 VanDerWaalsContact O-N 3.08Å
230S41.3Very low51.8Low59 Ų5990.3 Ų90.341%0.41348%0.475SS..  trans-33.5117.7162.1520000116.2Y232S230-Y232 VanDerWaalsContact CA-CE2 3.5Å
231N34Very low53.8Low129 Ų12985.8 Ų85.869%0.6945%0.446SS*.  trans-169.4101.5137.5-90.8-18.3000107.8
232Y50.8Low55.5Low186 Ų18683.5 Ų83.573%0.72944%0.435SS*.THydrogen-bonded Turn-95.9-10.7-115.7-99.4-83.6000118.7S230 S236S230-Y232 VanDerWaalsContact CA-CE2 3.5Å; Y232-S236 VanDerWaalsContact O-CB 3.31Å; Y232-S236 WeakPolarHBondContact O-CB 3.39Å; Y232-S236 PolarHBondContact O-OG 2.96Å
233T50.5Low57Low105 Ų10581.1 Ų81.164%0.64442%0.421SS*.THydrogen-bonded Turntrans-119.3-46-171.7530000115.6S236 K237T233-S236 WeakPolarHBondContact CA-OG 3.45Å; T233-S236 PolarHBondContact O-OG 3.05Å; T233-K237 WeakPolarHBondContact O-CB 3.35Å; T233-K237 PolarHBondContact O-N 3.43Å; T233-K237 VanDerWaalsContact O-N 3.13Å
234V49.8Very low58.7Low119 Ų11977.8 Ų77.872%0.72141%0.408SS*.Hα-helixtrans-77.3-40.9-179.9-179.30000111.3K237 K238V234-K237 WeakPolarHBondContact O-CB 3.32Å; V234-K237 PolarHBondContact O-N 3.43Å; V234-K238 PolarHBondContact O-N 2.78Å
235R54.1Low60.4Low146 Ų14677.3 Ų77.355%0.55141%0.406SS*.Hα-helixtrans-67.7-37.7175.3-154.5178.2-1541708.8111.5K238 I239R235-K238 PolarHBondContact O-N 3.04Å; R235-I239 HydrophobicContact CG-CD1 4.03Å; R235-I239 WeakPolarHBondContact O-CB 3.45Å; R235-I239 WeakPolarHBondContact O-CD1 3.26Å; R235-I239 WeakPolarHBondContact O-CG1 3.42Å; R235-I239 PolarHBondContact O-N 3.43Å
236S65.6Low62.3Low56 Ų5675.7 Ų75.739%0.39240%0.396SS..Hα-helixtrans-68-36.4176.869.30000112.5Y232 T233 F240Y232-S236 VanDerWaalsContact O-CB 3.31Å; Y232-S236 WeakPolarHBondContact O-CB 3.39Å; Y232-S236 PolarHBondContact O-OG 2.96Å; T233-S236 WeakPolarHBondContact CA-OG 3.45Å; T233-S236 PolarHBondContact O-OG 3.05Å; S236-F240 WeakPolarHBondContact O-CB 3.26Å; S236-F240 PolarHBondContact O-N 3.18Å
237K73.7Confident63.7Low85 Ų8571.4 Ų71.437%0.3738%0.378SS..Hα-helixtrans-56.8-65.9165.5-90.1-173.3179.5-174.20109.8T233 V234 I239 F240 L241 W293 C296T233-K237 WeakPolarHBondContact O-CB 3.35Å; T233-K237 PolarHBondContact O-N 3.43Å; T233-K237 VanDerWaalsContact O-N 3.13Å; V234-K237 WeakPolarHBondContact O-CB 3.32Å; V234-K237 PolarHBondContact O-N 3.43Å; K237-I239 PolarHBondContact O-N 3.32Å; K237-F240 WeakPolarHBondContact O-CA 3.27Å; K237-F240 PolarHBondContact O-N 3.29Å; K237-L241 PolarHBondContact O-N 3Å; K237-W293 HydrophobicContact CB-CH2 3.4Å; K237-W293 HydrophobicContact CB-CZ2 4.27Å; K237-W293 HydrophobicContact CB-CZ3 3.77Å; K237-W293 HydrophobicContact CD-CH2 4.46Å; K237-W293 HydrophobicContact CG-CH2 3.94Å; K237-W293 HydrophobicContact CG-CZ3 4.03Å; K237-W293 WeakPolarHBondContact O-CH2 3.48Å; K237-W293 WeakPolarHBondContact O-CZ3 3.12Å; K237-C296 WeakPolarHBondContact CE-SG 3.41Å; K237-C296 WeakPolarHBondContact CG-SG 3.39Å
238K74.1Confident66.1Low73 Ų7366.4 Ų66.432%0.31734%0.342SS..Hα-helixtrans-50.7-42.5-175.5-168.6-176.3177.4-172.20113.3T199 E202 E203 V234 R235 L241 S242T199-K238 WeakPolarHBondContact O-CE 3.15Å; E202-K238 IonicContact OE2-NZ 2.78Å; E203-K238 HydrophobicContact CG-CD 4.27Å; E203-K238 HydrophobicContact CG-CG 4.31Å; V234-K238 PolarHBondContact O-N 2.78Å; R235-K238 PolarHBondContact O-N 3.04Å; K238-L241 PolarHBondContact O-N 3Å; K238-S242 PolarHBondContact O-N 3.31Å; K238-S242 VanDerWaalsContact O-N 3.12Å
239I75.9Confident68.5Low48 Ų4863.1 Ų63.125%0.24632%0.316CS..Hα-helixtrans-63.4-46174.9-67.2165.2000111.4R235 K237 L241 S242 K243R235-I239 HydrophobicContact CG-CD1 4.03Å; R235-I239 WeakPolarHBondContact O-CB 3.45Å; R235-I239 WeakPolarHBondContact O-CD1 3.26Å; R235-I239 WeakPolarHBondContact O-CG1 3.42Å; R235-I239 PolarHBondContact O-N 3.43Å; K237-I239 PolarHBondContact O-N 3.32Å; I239-L241 VanDerWaalsContact C-N 3.34Å; I239-L241 PolarHBondContact O-N 3Å; I239-S242 PolarHBondContact O-N 2.98Å; I239-S242 PolarHBondContact O-OG 3.32Å; I239-K243 PolarHBondContact O-N 2.88Å
240F79.7Confident70.7Confident23 Ų2359.5 Ų59.510%0.10131%0.308CS..Hα-helixtrans-63.3-38.3177.9-176.7-115.8000112.8S236 K237 S242 K243 L244 Y292 W293 C296 L299 F318S236-F240 WeakPolarHBondContact O-CB 3.26Å; S236-F240 PolarHBondContact O-N 3.18Å; K237-F240 WeakPolarHBondContact O-CA 3.27Å; K237-F240 PolarHBondContact O-N 3.29Å; F240-S242 PolarHBondContact O-N 3.14Å; F240-K243 PolarHBondContact O-N 2.97Å; F240-L244 HydrophobicContact CD1-CD1 3.97Å; F240-L244 HydrophobicContact CD1-CG 4.44Å; F240-L244 HydrophobicContact CE1-CD1 3.5Å; F240-L244 HydrophobicContact CE1-CD2 4.39Å; F240-L244 HydrophobicContact CE1-CG 4.02Å; F240-L244 HydrophobicContact CE2-CD2 4.33Å; F240-L244 HydrophobicContact CE2-CG 4.31Å; F240-L244 HydrophobicContact CZ-CD1 3.88Å; F240-L244 HydrophobicContact CZ-CD2 3.89Å; F240-L244 HydrophobicContact CZ-CG 3.93Å; F240-L244 WeakPolarHBondContact O-CG 2.92Å; F240-L244 PolarHBondContact O-N 2.87Å; F240-Y292 WeakPolarHBondContact CE1-O 3.49Å; F240-W293 HydrophobicContact CB-CZ3 4.39Å; F240-W293 AromaticContact CD1-CE3 3.94Å; F240-W293 HydrophobicContact CD1-CE3 3.94Å; F240-W293 HydrophobicContact CD1-CZ3 4.26Å; F240-C296 HydrophobicContact CD1-CB 3.76Å; F240-C296 HydrophobicContact CE1-CB 4.07Å; F240-L299 HydrophobicContact CE1-CD1 4.26Å; F240-L299 HydrophobicContact CZ-CD1 4.06Å; F240-F318 HydrophobicContact CD2-CE1 4.48Å; F240-F318 HydrophobicContact CE1-CE1 4.47Å; F240-F318 AromaticContact CE2-CD1 3.8Å; F240-F318 HydrophobicContact CE2-CD1 3.8Å; F240-F318 AromaticContact CE2-CE1 3.26Å; F240-F318 HydrophobicContact CE2-CE1 3.26Å; F240-F318 AromaticContact CE2-CZ 3.8Å; F240-F318 HydrophobicContact CE2-CZ 3.8Å; F240-F318 HydrophobicContact CZ-CD1 4.25Å; F240-F318 AromaticContact CZ-CE1 3.26Å; F240-F318 HydrophobicContact CZ-CE1 3.26Å; F240-F318 AromaticContact CZ-CZ 3.51Å; F240-F318 HydrophobicContact CZ-CZ 3.51Å
241L83Confident72.9Confident27 Ų2759.1 Ų59.114%0.14130%0.303CS..Hα-helixtrans-60-44.8173.3-176.159.4000111.7K237 K238 I239 K243 L244 I245 W293K237-L241 PolarHBondContact O-N 3Å; K238-L241 PolarHBondContact O-N 3Å; I239-L241 VanDerWaalsContact C-N 3.34Å; I239-L241 PolarHBondContact O-N 3Å; L241-K243 VanDerWaalsContact C-N 3.29Å; L241-K243 PolarHBondContact O-N 3.33Å; L241-L244 PolarHBondContact O-N 3.3Å; L241-L244 VanDerWaalsContact O-N 3.17Å; L241-I245 HydrophobicContact CD1-CD1 4.11Å; L241-I245 HydrophobicContact CD1-CG1 4.31Å; L241-I245 HydrophobicContact CD2-CD1 4.45Å; L241-I245 HydrophobicContact CG-CD1 3.76Å; L241-I245 HydrophobicContact CG-CG1 4.41Å; L241-I245 VanDerWaalsContact O-CG1 3.31Å; L241-I245 WeakPolarHBondContact O-CG1 3.3Å; L241-I245 PolarHBondContact O-N 3.05Å; L241-W293 HydrophobicContact CB-CD2 4.31Å; L241-W293 HydrophobicContact CB-CE3 3.79Å; L241-W293 HydrophobicContact CB-CH2 3.55Å; L241-W293 HydrophobicContact CB-CZ2 4.1Å; L241-W293 HydrophobicContact CB-CZ3 3.47Å; L241-W293 VanDerWaalsContact CB-CZ3 3.47Å; L241-W293 HydrophobicContact CD1-CD2 4.01Å; L241-W293 HydrophobicContact CD1-CE3 4.19Å; L241-W293 HydrophobicContact CD1-CG 4.35Å; L241-W293 HydrophobicContact CD2-CH2 4.22Å; L241-W293 HydrophobicContact CD2-CZ2 3.98Å; L241-W293 HydrophobicContact CG-CH2 4.38Å; L241-W293 HydrophobicContact CG-CZ2 4.46Å; L241-W293 HydrophobicContact CG-CZ3 4.49Å
242S81Confident75.6Confident1 Ų154 Ų541%0.00727%0.274CS..Hα-helixtrans-58.9-40.917874.60000111.9K238 I239 F240 I245 V246K238-S242 PolarHBondContact O-N 3.31Å; K238-S242 VanDerWaalsContact O-N 3.12Å; I239-S242 PolarHBondContact O-N 2.98Å; I239-S242 PolarHBondContact O-OG 3.32Å; F240-S242 PolarHBondContact O-N 3.14Å; S242-I245 PolarHBondContact O-N 3.43Å; S242-V246 WeakPolarHBondContact O-CG2 3.23Å; S242-V246 PolarHBondContact O-N 3.49Å
243K78.1Confident77.4Confident27 Ų2749.1 Ų49.112%0.11726%0.261CS..Hα-helixtrans-63.4-46.6174.9-63.3-179.1-173.2-173.20111.6L207 F226 I239 F240 L241 I245 V246 C247 C317L207-K243 HydrophobicContact CD2-CG 4.28Å; F226-K243 VanDerWaalsContact CE1-NZ 3.27Å; F226-K243 HydrophobicContact CZ-CD 4.43Å; I239-K243 PolarHBondContact O-N 2.88Å; F240-K243 PolarHBondContact O-N 2.97Å; L241-K243 VanDerWaalsContact C-N 3.29Å; L241-K243 PolarHBondContact O-N 3.33Å; K243-I245 VanDerWaalsContact C-N 3.29Å; K243-I245 PolarHBondContact O-N 2.86Å; K243-V246 PolarHBondContact O-N 2.93Å; K243-C247 VanDerWaalsContact O-CB 3.28Å; K243-C247 WeakPolarHBondContact O-CB 3.47Å; K243-C247 PolarHBondContact O-N 2.72Å; K243-C247 PolarHBondContact O-SG 3.46Å; K243-C317 HydrophobicContact CB-CB 4.05Å; K243-C317 WeakPolarHBondContact CD-O 3.33Å
244L83.9Confident79.3Confident5 Ų548.8 Ų48.83%0.02626%0.26CS..Hα-helixtrans-59.8-42.1177.7-70.7177000111.3F240 L241 F248 A289 Y292 W293 W314F240-L244 HydrophobicContact CD1-CD1 3.97Å; F240-L244 HydrophobicContact CD1-CG 4.44Å; F240-L244 HydrophobicContact CE1-CD1 3.5Å; F240-L244 HydrophobicContact CE1-CD2 4.39Å; F240-L244 HydrophobicContact CE1-CG 4.02Å; F240-L244 HydrophobicContact CE2-CD2 4.33Å; F240-L244 HydrophobicContact CE2-CG 4.31Å; F240-L244 HydrophobicContact CZ-CD1 3.88Å; F240-L244 HydrophobicContact CZ-CD2 3.89Å; F240-L244 HydrophobicContact CZ-CG 3.93Å; F240-L244 WeakPolarHBondContact O-CG 2.92Å; F240-L244 PolarHBondContact O-N 2.87Å; L241-L244 PolarHBondContact O-N 3.3Å; L241-L244 VanDerWaalsContact O-N 3.17Å; L244-F248 WeakPolarHBondContact O-CB 3.15Å; L244-F248 PolarHBondContact O-N 3.29Å; L244-A289 WeakPolarHBondContact CD1-O 3.12Å; L244-Y292 HydrophobicContact CD2-CD2 4.18Å; L244-W293 HydrophobicContact CD1-CB 4.04Å; L244-W314 HydrophobicContact CB-CZ3 4.38Å; L244-W314 HydrophobicContact CD2-CE3 3.61Å; L244-W314 HydrophobicContact CD2-CZ3 3.61Å
245I86Confident81.1Confident11 Ų1145 Ų456%0.05623%0.234CC..Hα-helixtrans-63.6-47.6177.7-71.1165.9000111A196 F197 S200 L241 S242 K243 F248 L249A196-I245 HydrophobicContact CB-CD1 3.87Å; A196-I245 VanDerWaalsContact O-CD1 3.3Å; A196-I245 WeakPolarHBondContact O-CD1 3.43Å; F197-I245 HydrophobicContact CD2-CG2 4.05Å; S200-I245 WeakPolarHBondContact OG-CD1 3.39Å; L241-I245 HydrophobicContact CD1-CD1 4.11Å; L241-I245 HydrophobicContact CD1-CG1 4.31Å; L241-I245 HydrophobicContact CD2-CD1 4.45Å; L241-I245 HydrophobicContact CG-CD1 3.76Å; L241-I245 HydrophobicContact CG-CG1 4.41Å; L241-I245 VanDerWaalsContact O-CG1 3.31Å; L241-I245 WeakPolarHBondContact O-CG1 3.3Å; L241-I245 PolarHBondContact O-N 3.05Å; S242-I245 PolarHBondContact O-N 3.43Å; K243-I245 VanDerWaalsContact C-N 3.29Å; K243-I245 PolarHBondContact O-N 2.86Å; I245-F248 PolarHBondContact O-N 2.94Å; I245-L249 HydrophobicContact CG2-CD1 3.59Å; I245-L249 HydrophobicContact CG2-CG 4.21Å; I245-L249 VanDerWaalsContact O-CB 3.31Å; I245-L249 WeakPolarHBondContact O-CB 3.3Å; I245-L249 WeakPolarHBondContact O-CG 3.2Å; I245-L249 PolarHBondContact O-N 3.13Å
246V83.1Confident82.9Confident21 Ų2138.8 Ų38.813%0.12721%0.212CC..Hα-helixtrans-64.1-45.9178.3171.60000111V204 L207 V208 F224 S242 K243 F248 S250V204-V246 HydrophobicContact CG1-CG2 3.97Å; L207-V246 HydrophobicContact CD2-CB 4.26Å; L207-V246 HydrophobicContact CD2-CG2 3.93Å; V208-V246 HydrophobicContact CG2-CG2 4.27Å; F224-V246 HydrophobicContact CE1-CG1 4.28Å; F224-V246 HydrophobicContact CZ-CG1 3.97Å; S242-V246 WeakPolarHBondContact O-CG2 3.23Å; S242-V246 PolarHBondContact O-N 3.49Å; K243-V246 PolarHBondContact O-N 2.93Å; V246-F248 VanDerWaalsContact C-N 3.34Å; V246-F248 PolarHBondContact O-N 2.76Å; V246-S250 VanDerWaalsContact O-CB 3.26Å; V246-S250 WeakPolarHBondContact O-CB 3.35Å; V246-S250 PolarHBondContact O-N 3.43Å; V246-S250 PolarHBondContact O-OG 3.28Å
247C82.1Confident84.1Confident11 Ų1140.5 Ų40.57%0.07422%0.216CC..Hα-helixtrans-57.5-46.4175.3-680000110.9K243 S250 V312 W314 C317K243-C247 VanDerWaalsContact O-CB 3.28Å; K243-C247 WeakPolarHBondContact O-CB 3.47Å; K243-C247 PolarHBondContact O-N 2.72Å; K243-C247 PolarHBondContact O-SG 3.46Å; C247-S250 PolarHBondContact O-OG 2.98Å; C247-V312 HydrophobicContact CB-CG1 4.25Å; C247-W314 HydrophobicContact CB-CE3 4.09Å; C247-W314 HydrophobicContact CB-CZ3 3.89Å; C247-C317 WeakPolarHBondContact CB-SG 3.48Å; C247-C317 WeakPolarHBondContact SG-CB 3.27Å; C247-C317 CovalentContact SG-SG 2.07Å; C247-C317 PolarHBondContact SG-SG 3.27Å
248F88.1Confident84.8Confident4 Ų440.7 Ų40.72%0.01822%0.221CC..Hα-helixtrans-65.6-52179.9-179.1-99.2000112.6L193 L244 I245 V246 S250 T251 W252 V256 F282 F286 W314L193-F248 HydrophobicContact CD1-CE1 3.77Å; L193-F248 HydrophobicContact CD1-CZ 4.4Å; L193-F248 HydrophobicContact CD2-CD1 3.98Å; L193-F248 HydrophobicContact CD2-CE1 3.71Å; L193-F248 HydrophobicContact CD2-CZ 4.5Å; L193-F248 HydrophobicContact CG-CE1 4.42Å; L244-F248 WeakPolarHBondContact O-CB 3.15Å; L244-F248 PolarHBondContact O-N 3.29Å; I245-F248 PolarHBondContact O-N 2.94Å; V246-F248 VanDerWaalsContact C-N 3.34Å; V246-F248 PolarHBondContact O-N 2.76Å; F248-S250 VanDerWaalsContact C-N 3.3Å; F248-S250 PolarHBondContact O-N 2.98Å; F248-T251 PolarHBondContact O-N 3.35Å; F248-W252 AromaticContact CD2-CD1 3.77Å; F248-W252 HydrophobicContact CE1-CB 4.21Å; F248-W252 AromaticContact CE2-CD1 3.67Å; F248-W252 HydrophobicContact CE2-CG 4.25Å; F248-W252 HydrophobicContact CZ-CB 4.24Å; F248-W252 HydrophobicContact CZ-CG 4.35Å; F248-W252 PolarHBondContact O-N 3.15Å; F248-V256 HydrophobicContact CE1-CG2 4.36Å; F248-F282 HydrophobicContact CE1-CD2 4.48Å; F248-F282 AromaticContact CE1-CE2 3.74Å; F248-F282 HydrophobicContact CE1-CE2 3.74Å; F248-F282 HydrophobicContact CE1-CZ 4.37Å; F248-F282 HydrophobicContact CE2-CD2 4.39Å; F248-F282 HydrophobicContact CE2-CE2 4.34Å; F248-F282 AromaticContact CZ-CD2 3.72Å; F248-F282 HydrophobicContact CZ-CD2 3.72Å; F248-F282 AromaticContact CZ-CE2 3.28Å; F248-F282 HydrophobicContact CZ-CE2 3.28Å; F248-F282 AromaticContact CZ-CZ 3.91Å; F248-F282 HydrophobicContact CZ-CZ 3.91Å; F248-F286 HydrophobicContact CE2-CB 3.98Å; F248-F286 HydrophobicContact CZ-CB 4.18Å; F248-F286 HydrophobicContact CZ-CD2 4.45Å; F248-W314 HydrophobicContact CB-CH2 4.03Å; F248-W314 HydrophobicContact CD2-CH2 4.24Å
249L88.2Confident85.5Confident38 Ų3837.8 Ų37.820%0.19921%0.209CC..Hα-helixtrans-66.2-32.8-178.7-70.1176.4000111.5F197 I245 T251 W252 L253 V256F197-L249 HydrophobicContact CD2-CD1 4.27Å; F197-L249 HydrophobicContact CE2-CD1 4.45Å; I245-L249 HydrophobicContact CG2-CD1 3.59Å; I245-L249 HydrophobicContact CG2-CG 4.21Å; I245-L249 VanDerWaalsContact O-CB 3.31Å; I245-L249 WeakPolarHBondContact O-CB 3.3Å; I245-L249 WeakPolarHBondContact O-CG 3.2Å; I245-L249 PolarHBondContact O-N 3.13Å; L249-T251 PolarHBondContact O-N 3.31Å; L249-W252 PolarHBondContact O-N 3.38Å; L249-L253 WeakPolarHBondContact O-CA 3.33Å; L249-L253 WeakPolarHBondContact O-CB 3.29Å; L249-L253 PolarHBondContact O-N 2.88Å; L249-V256 HydrophobicContact CD2-CG2 4.25Å
250S82.6Confident86.1Confident76 Ų7637.7 Ų37.753%0.53121%0.21SC..Hα-helixtrans-55.1-30.9176.274.30000113.1V246 C247 F248V246-S250 VanDerWaalsContact O-CB 3.26Å; V246-S250 WeakPolarHBondContact O-CB 3.35Å; V246-S250 PolarHBondContact O-N 3.43Å; V246-S250 PolarHBondContact O-OG 3.28Å; C247-S250 PolarHBondContact O-OG 2.98Å; F248-S250 VanDerWaalsContact C-N 3.3Å; F248-S250 PolarHBondContact O-N 2.98Å
251T86Confident86.5Confident51 Ų5140.9 Ų40.931%0.31323%0.228SC..Hα-helixtrans-96.7-43.2179.2-54.10000111.9F248 L249 F311 V312F248-T251 PolarHBondContact O-N 3.35Å; L249-T251 PolarHBondContact O-N 3.31Å; T251-F311 HydrophobicContact CG2-CB 4.06Å; T251-V312 HydrophobicContact CG2-CG2 4.19Å
252W91.1Very high86.7Confident21 Ų2142 Ų428%0.0823%0.233CC..Hα-helixtrans-103.81.6-167.5-66.5110.4000114.8F248 L249 F255 V256 P278 Y281 F282 S285 F311F248-W252 AromaticContact CD2-CD1 3.77Å; F248-W252 HydrophobicContact CE1-CB 4.21Å; F248-W252 AromaticContact CE2-CD1 3.67Å; F248-W252 HydrophobicContact CE2-CG 4.25Å; F248-W252 HydrophobicContact CZ-CB 4.24Å; F248-W252 HydrophobicContact CZ-CG 4.35Å; F248-W252 PolarHBondContact O-N 3.15Å; L249-W252 PolarHBondContact O-N 3.38Å; W252-F255 HydrophobicContact CE3-CB 4.05Å; W252-F255 HydrophobicContact CE3-CD1 4.44Å; W252-F255 HydrophobicContact CE3-CG 4.37Å; W252-F255 WeakPolarHBondContact O-CB 3.37Å; W252-F255 PolarHBondContact O-N 3.27Å; W252-V256 WeakPolarHBondContact O-CG2 3.23Å; W252-V256 PolarHBondContact O-N 3.35Å; W252-P278 WeakPolarHBondContact CH2-O 3.24Å; W252-Y281 VanDerWaalsContact CZ2-C 3.48Å; W252-F282 HydrophobicContact CB-CD2 3.84Å; W252-F282 HydrophobicContact CB-CE2 4.08Å; W252-F282 HydrophobicContact CD2-CB 4.11Å; W252-F282 AromaticContact CD2-CD2 3.81Å; W252-F282 HydrophobicContact CD2-CD2 3.81Å; W252-F282 HydrophobicContact CD2-CG 4.48Å; W252-F282 HydrophobicContact CE3-CB 3.8Å; W252-F282 AromaticContact CE3-CD2 3.87Å; W252-F282 HydrophobicContact CE3-CD2 3.87Å; W252-F282 HydrophobicContact CE3-CG 4.33Å; W252-F282 AromaticContact CG-CD2 3.81Å; W252-F282 HydrophobicContact CG-CD2 3.81Å; W252-F282 HydrophobicContact CG-CE2 4.47Å; W252-F282 HydrophobicContact CH2-CB 4.09Å; W252-F282 HydrophobicContact CZ2-CB 4.37Å; W252-F282 HydrophobicContact CZ3-CB 3.78Å; W252-S285 VanDerWaalsContact NE1-CB 3.33Å; W252-S285 PolarHBondContact NE1-OG 3Å; W252-F311 HydrophobicContact CZ2-CB 4.35Å; W252-F311 HydrophobicContact CZ2-CD2 4.32Å; W252-F311 HydrophobicContact CZ2-CG 4.42Å
253L89.1Confident87Confident84 Ų8443.1 Ų43.144%0.4424%0.239SC..Hα-helixtrans-51.9-46.5179.717869.6000113.3L249 F255 V256 L257L249-L253 WeakPolarHBondContact O-CA 3.33Å; L249-L253 WeakPolarHBondContact O-CB 3.29Å; L249-L253 PolarHBondContact O-N 2.88Å; L253-F255 PolarHBondContact O-N 3.47Å; L253-V256 PolarHBondContact O-N 3.2Å; L253-L257 HydrophobicContact CD1-CD1 4.17Å; L253-L257 HydrophobicContact CD1-CD2 4.47Å; L253-L257 HydrophobicContact CD1-CG 4.03Å; L253-L257 HydrophobicContact CG-CD1 3.96Å; L253-L257 HydrophobicContact CG-CG 4.26Å; L253-L257 WeakPolarHBondContact O-CB 3.43Å; L253-L257 WeakPolarHBondContact O-CG 3.43Å; L253-L257 PolarHBondContact O-N 3.48Å
254P89.3Confident87.4Confident98 Ų9848.3 Ų48.364%0.63627%0.267SS*.Hα-helixtrans-58-38.6177.7-24.434.8000112.7L258P254-L258 WeakPolarHBondContact O-CB 3.31Å; P254-L258 PolarHBondContact O-N 2.86Å
255F88.9Confident87.6Confident39 Ų3954 Ų5417%0.17130%0.297CS..Hα-helixtrans-72.9-38.5179.9-164.1-111.1000112.2W252 L253 L258 Q259 W279 F282W252-F255 HydrophobicContact CE3-CB 4.05Å; W252-F255 HydrophobicContact CE3-CD1 4.44Å; W252-F255 HydrophobicContact CE3-CG 4.37Å; W252-F255 WeakPolarHBondContact O-CB 3.37Å; W252-F255 PolarHBondContact O-N 3.27Å; L253-F255 PolarHBondContact O-N 3.47Å; F255-L258 PolarHBondContact O-N 3.16Å; F255-Q259 WeakPolarHBondContact O-CG 3.21Å; F255-Q259 PolarHBondContact O-N 2.86Å; F255-W279 HydrophobicContact CE1-CB 4.44Å; F255-W279 HydrophobicContact CZ-CB 3.86Å; F255-W279 AromaticContact CZ-CD1 3.82Å; F255-W279 HydrophobicContact CZ-CG 4.24Å; F255-F282 HydrophobicContact CD1-CB 3.78Å; F255-F282 AromaticContact CD1-CD1 3.94Å; F255-F282 HydrophobicContact CD1-CD1 3.94Å; F255-F282 AromaticContact CD1-CD2 3.58Å; F255-F282 HydrophobicContact CD1-CD2 3.58Å; F255-F282 HydrophobicContact CD1-CE1 4.42Å; F255-F282 HydrophobicContact CD1-CE2 4.07Å; F255-F282 AromaticContact CD1-CG 3.48Å; F255-F282 HydrophobicContact CD1-CG 3.48Å; F255-F282 VanDerWaalsContact CD1-CG 3.48Å; F255-F282 HydrophobicContact CD1-CZ 4.47Å; F255-F282 HydrophobicContact CE1-CB 3.72Å; F255-F282 AromaticContact CE1-CD1 3.74Å; F255-F282 HydrophobicContact CE1-CD1 3.74Å; F255-F282 HydrophobicContact CE1-CD2 4.21Å; F255-F282 HydrophobicContact CE1-CE1 4.4Å; F255-F282 AromaticContact CE1-CG 3.62Å; F255-F282 HydrophobicContact CE1-CG 3.62Å
256V90.9Very high87.5Confident16 Ų1661.3 Ų61.310%0.09733%0.328CS..Hα-helixtrans-64.3-45.1174.2175.90000110.7L193 F248 L249 W252 L253 L258 Q259 V260 F282L193-V256 HydrophobicContact CD1-CG2 4.12Å; F248-V256 HydrophobicContact CE1-CG2 4.36Å; L249-V256 HydrophobicContact CD2-CG2 4.25Å; W252-V256 WeakPolarHBondContact O-CG2 3.23Å; W252-V256 PolarHBondContact O-N 3.35Å; L253-V256 PolarHBondContact O-N 3.2Å; V256-L258 VanDerWaalsContact C-N 3.33Å; V256-L258 PolarHBondContact O-N 3.07Å; V256-Q259 PolarHBondContact O-N 3.14Å; V256-V260 WeakPolarHBondContact O-CG2 3.35Å; V256-V260 PolarHBondContact O-N 3.3Å; V256-F282 HydrophobicContact CG2-CE2 3.68Å; V256-F282 HydrophobicContact CG2-CZ 4.13Å
257L90.4Very high87.4Confident91 Ų9163.9 Ų63.948%0.47634%0.344SS..Hα-helixtrans-60.8-43.3176.6-71.1174.6000111.5L253 Q259 V260 I261L253-L257 HydrophobicContact CD1-CD1 4.17Å; L253-L257 HydrophobicContact CD1-CD2 4.47Å; L253-L257 HydrophobicContact CD1-CG 4.03Å; L253-L257 HydrophobicContact CG-CD1 3.96Å; L253-L257 HydrophobicContact CG-CG 4.26Å; L253-L257 WeakPolarHBondContact O-CB 3.43Å; L253-L257 WeakPolarHBondContact O-CG 3.43Å; L253-L257 PolarHBondContact O-N 3.48Å; L257-Q259 VanDerWaalsContact C-N 3.34Å; L257-Q259 PolarHBondContact O-N 3.48Å; L257-V260 PolarHBondContact O-N 3.41Å; L257-I261 VanDerWaalsContact O-CG1 3.3Å; L257-I261 WeakPolarHBondContact O-CG1 3.3Å; L257-I261 PolarHBondContact O-N 2.99Å
258L89.2Confident87.2Confident89 Ų8969.5 Ų69.547%0.46637%0.369SS..Hα-helixtrans-58.8-44.7175.2-179.563.1000111.7P254 F255 V256 I261 I262P254-L258 WeakPolarHBondContact O-CB 3.31Å; P254-L258 PolarHBondContact O-N 2.86Å; F255-L258 PolarHBondContact O-N 3.16Å; V256-L258 VanDerWaalsContact C-N 3.33Å; V256-L258 PolarHBondContact O-N 3.07Å; L258-I261 PolarHBondContact O-N 3.47Å; L258-I262 HydrophobicContact CD1-CD1 4.11Å; L258-I262 HydrophobicContact CD1-CG1 4.43Å; L258-I262 HydrophobicContact CG-CD1 3.89Å; L258-I262 VanDerWaalsContact O-CG1 3.28Å; L258-I262 WeakPolarHBondContact O-CG1 3.18Å; L258-I262 PolarHBondContact O-N 3.25Å
259Q88.4Confident86.7Confident12 Ų1270.9 Ų70.96%0.05638%0.378CS..Hα-helixtrans-61.9-43.7176.1-74.1-17743.400112.2S186 V190 F255 V256 L257 I261 I262 L263S186-Q259 PolarHBondContact OG-OE1 3.35Å; V190-Q259 HydrophobicContact CG2-CB 4.09Å; F255-Q259 WeakPolarHBondContact O-CG 3.21Å; F255-Q259 PolarHBondContact O-N 2.86Å; V256-Q259 PolarHBondContact O-N 3.14Å; L257-Q259 VanDerWaalsContact C-N 3.34Å; L257-Q259 PolarHBondContact O-N 3.48Å; Q259-I261 VanDerWaalsContact C-N 3.33Å; Q259-I261 PolarHBondContact O-N 3.43Å; Q259-I262 PolarHBondContact O-N 2.91Å; Q259-L263 WeakPolarHBondContact O-CB 3.43Å; Q259-L263 VanDerWaalsContact O-CG 3.29Å; Q259-L263 WeakPolarHBondContact O-CG 3.24Å; Q259-L263 PolarHBondContact O-N 3.11Å
260V88.8Confident86.2Confident47 Ų4770.1 Ų70.129%0.28538%0.375SS..Hα-helixtrans-59.7-45.3176.8171.30000110.8V190 V256 L257 I262 L263 L264V190-V260 HydrophobicContact CG1-CG2 3.89Å; V256-V260 WeakPolarHBondContact O-CG2 3.35Å; V256-V260 PolarHBondContact O-N 3.3Å; L257-V260 PolarHBondContact O-N 3.41Å; V260-I262 PolarHBondContact O-N 3.47Å; V260-L263 PolarHBondContact O-N 3.24Å; V260-L264 HydrophobicContact CG1-CD1 3.66Å; V260-L264 HydrophobicContact CG1-CG 4.17Å; V260-L264 WeakPolarHBondContact O-CB 3.34Å; V260-L264 VanDerWaalsContact O-CG 3.23Å; V260-L264 WeakPolarHBondContact O-CG 3.36Å; V260-L264 PolarHBondContact O-N 2.93Å
261I88.9Confident86.1Confident90 Ų9066.5 Ų66.546%0.46235%0.35SS..Hα-helixtrans-61-46.8177.4-68.2165.3000110.8L257 L258 Q259 L263 L264 L265L257-I261 VanDerWaalsContact O-CG1 3.3Å; L257-I261 WeakPolarHBondContact O-CG1 3.3Å; L257-I261 PolarHBondContact O-N 2.99Å; L258-I261 PolarHBondContact O-N 3.47Å; Q259-I261 VanDerWaalsContact C-N 3.33Å; Q259-I261 PolarHBondContact O-N 3.43Å; I261-L263 VanDerWaalsContact C-N 3.34Å; I261-L263 PolarHBondContact O-N 2.91Å; I261-L264 PolarHBondContact O-N 2.82Å; I261-L265 HydrophobicContact CG2-CD1 3.64Å; I261-L265 HydrophobicContact CG2-CG 4.31Å; I261-L265 VanDerWaalsContact O-CB 3.29Å; I261-L265 WeakPolarHBondContact O-CB 3.44Å; I261-L265 WeakPolarHBondContact O-CG 2.92Å; I261-L265 PolarHBondContact O-N 2.89Å
262I86.6Confident85.6Confident49 Ų4965.4 Ų65.425%0.25134%0.34SS..Hα-helixtrans-58.9-45.4178.4-72.1166.5000111L258 Q259 V260 K266 V267 V269L258-I262 HydrophobicContact CD1-CD1 4.11Å; L258-I262 HydrophobicContact CD1-CG1 4.43Å; L258-I262 HydrophobicContact CG-CD1 3.89Å; L258-I262 VanDerWaalsContact O-CG1 3.28Å; L258-I262 WeakPolarHBondContact O-CG1 3.18Å; L258-I262 PolarHBondContact O-N 3.25Å; Q259-I262 PolarHBondContact O-N 2.91Å; V260-I262 PolarHBondContact O-N 3.47Å; I262-K266 WeakPolarHBondContact O-CA 3.24Å; I262-K266 PolarHBondContact O-N 3.49Å; I262-V267 HydrophobicContact CG2-CB 4.27Å; I262-V267 PolarHBondContact O-N 3.48Å; I262-V269 HydrophobicContact CD1-CG2 4.32Å; I262-V269 HydrophobicContact CG2-CG2 4.11Å
263L87Confident85.1Confident25 Ų2566.5 Ų66.513%0.13135%0.347CS..Hα-helixtrans-66.9-44.5179.6-70.3173000112.1Y183 F187 V190 Q259 V260 I261 K266Y183-L263 HydrophobicContact CD2-CD2 3.66Å; Y183-L263 HydrophobicContact CE2-CD2 3.4Å; Y183-L263 VanDerWaalsContact CE2-CD2 3.4Å; F187-L263 HydrophobicContact CB-CD2 4.48Å; V190-L263 HydrophobicContact CB-CD1 4.32Å; V190-L263 HydrophobicContact CG2-CD1 4.1Å; Q259-L263 WeakPolarHBondContact O-CB 3.43Å; Q259-L263 VanDerWaalsContact O-CG 3.29Å; Q259-L263 WeakPolarHBondContact O-CG 3.24Å; Q259-L263 PolarHBondContact O-N 3.11Å; V260-L263 PolarHBondContact O-N 3.24Å; I261-L263 VanDerWaalsContact C-N 3.34Å; I261-L263 PolarHBondContact O-N 2.91Å; L263-K266 PolarHBondContact O-N 2.98Å
264L87.3Confident84.7Confident136 Ų13664.2 Ų64.271%0.71233%0.334SS*.Hα-helixtrans-64.5-43.4179.4-73.7173.8000112V260 I261 K266V260-L264 HydrophobicContact CG1-CD1 3.66Å; V260-L264 HydrophobicContact CG1-CG 4.17Å; V260-L264 WeakPolarHBondContact O-CB 3.34Å; V260-L264 VanDerWaalsContact O-CG 3.23Å; V260-L264 WeakPolarHBondContact O-CG 3.36Å; V260-L264 PolarHBondContact O-N 2.93Å; I261-L264 PolarHBondContact O-N 2.82Å; L264-K266 VanDerWaalsContact C-N 3.26Å; L264-K266 PolarHBondContact O-N 3.33Å
265L87.5Confident84.6Confident124 Ų12459.5 Ų59.565%0.64930%0.304SS*.THydrogen-bonded Turntrans-82.6-3.1179.8-64.2-179.6000113I261 V267I261-L265 HydrophobicContact CG2-CD1 3.64Å; I261-L265 HydrophobicContact CG2-CG 4.31Å; I261-L265 VanDerWaalsContact O-CB 3.29Å; I261-L265 WeakPolarHBondContact O-CB 3.44Å; I261-L265 WeakPolarHBondContact O-CG 2.92Å; I261-L265 PolarHBondContact O-N 2.89Å; L265-V267 HydrophobicContact CB-CG2 3.69Å; L265-V267 HydrophobicContact CD1-CG2 4.5Å; L265-V267 PolarHBondContact O-N 2.66Å
266K83.4Confident84.6Confident165 Ų16558.6 Ų58.672%0.71730%0.301SS*.THydrogen-bonded Turntrans49.440-175-59.5-178.1179.6178.90112.4I262 L263 L264 Q268I262-K266 WeakPolarHBondContact O-CA 3.24Å; I262-K266 PolarHBondContact O-N 3.49Å; L263-K266 PolarHBondContact O-N 2.98Å; L264-K266 VanDerWaalsContact C-N 3.26Å; L264-K266 PolarHBondContact O-N 3.33Å; K266-Q268 PolarHBondContact O-N 3.49Å
267V80.9Confident84.6Confident75 Ų7557.9 Ų57.946%0.45530%0.296SS..  trans-65.9124-179-179.10000108.7I262 L265 V269I262-V267 HydrophobicContact CG2-CB 4.27Å; I262-V267 PolarHBondContact O-N 3.48Å; L265-V267 HydrophobicContact CB-CG2 3.69Å; L265-V267 HydrophobicContact CD1-CG2 4.5Å; L265-V267 PolarHBondContact O-N 2.66Å; V267-V269 HydrophobicContact CG1-CG2 4.38Å; V267-V269 PolarHBondContact O-N 3.21Å
268Q78.8Confident84.5Confident130 Ų13054.2 Ų54.261%0.60728%0.278SS*.  trans-79.298.8176.1-68.1-178.25.400109.3V178 K266V178-Q268 HydrophobicContact CG1-CB 4.47Å; V178-Q268 HydrophobicContact CG2-CB 3.99Å; V178-Q268 HydrophobicContact CG2-CG 4.5Å; K266-Q268 PolarHBondContact O-N 3.49Å
269V76.8Confident84.5Confident33 Ų3351 Ų5120%0.226%0.26CS..  trans-85.8126.1174.6-177.50000109I262 V267 I273 E274I262-V269 HydrophobicContact CD1-CG2 4.32Å; I262-V269 HydrophobicContact CG2-CG2 4.11Å; V267-V269 HydrophobicContact CG1-CG2 4.38Å; V267-V269 PolarHBondContact O-N 3.21Å; V269-I273 HydrophobicContact CG1-CB 4.43Å; V269-E274 HydrophobicContact CG1-CB 4.37Å
270P78.7Confident84.6Confident22 Ų2250.5 Ų50.514%0.14326%0.257CS..  trans-62.9136.3174.8-21.631.5000112.3F176 Y272 I273 E274F176-P270 HydrophobicContact CB-CB 4.42Å; P270-Y272 HydrophobicContact CB-CD1 3.57Å; P270-Y272 HydrophobicContact CB-CE1 3.16Å; P270-Y272 HydrophobicContact CB-CE2 4.45Å; P270-Y272 HydrophobicContact CB-CG 4.37Å; P270-Y272 HydrophobicContact CG-CE1 3.95Å; P270-Y272 PolarHBondContact O-N 3.13Å; P270-Y272 VanDerWaalsContact O-N 3.14Å; P270-I273 HydrophobicContact CB-CD1 4.3Å; P270-I273 HydrophobicContact CB-CG1 4.38Å; P270-I273 HydrophobicContact CG-CD1 4.05Å; P270-I273 PolarHBondContact O-N 3.15Å; P270-E274 PolarHBondContact O-N 3.21Å
271A80.1Confident84.6Confident0 Ų048.5 Ų48.50%025%0.245CC..Hα-helixtrans-61.8-26.9-174.500000113.7S102 Y177 I273 E274S102-A271 VanDerWaalsContact O-CB 3.26Å; S102-A271 WeakPolarHBondContact O-CB 2.83Å; Y177-A271 HydrophobicContact CD1-CB 3.73Å; Y177-A271 HydrophobicContact CE1-CB 4.3Å; Y177-A271 WeakPolarHBondContact O-CB 3.23Å; Y177-A271 PolarHBondContact O-N 3.47Å; A271-I273 PolarHBondContact O-N 3.22Å; A271-E274 PolarHBondContact O-N 3.27Å
272Y75.1Confident84.7Confident27 Ų2744.3 Ų44.311%0.10622%0.223CC..Hα-helixtrans-66-21.7175.263.8-94.7000113.8L28 I31 I32 K35 T98 S102 P270L28-Y272 HydrophobicContact CD1-CE1 4.38Å; L28-Y272 HydrophobicContact CD1-CE2 3.78Å; I31-Y272 HydrophobicContact CG2-CE2 3.88Å; I32-Y272 HydrophobicContact CG1-CD2 4.49Å; K35-Y272 WeakPolarHBondContact CE-O 2.98Å; K35-Y272 PolarHBondContact NZ-O 2.91Å; T98-Y272 HydrophobicContact CG2-CD1 3.87Å; T98-Y272 HydrophobicContact CG2-CE1 4.2Å; T98-Y272 HydrophobicContact CG2-CG 4.08Å; S102-Y272 WeakPolarHBondContact OG-CB 3.5Å; S102-Y272 WeakPolarHBondContact OG-CD1 3.47Å; P270-Y272 HydrophobicContact CB-CD1 3.57Å; P270-Y272 HydrophobicContact CB-CE1 3.16Å; P270-Y272 HydrophobicContact CB-CE2 4.45Å; P270-Y272 HydrophobicContact CB-CG 4.37Å; P270-Y272 HydrophobicContact CG-CE1 3.95Å; P270-Y272 PolarHBondContact O-N 3.13Å; P270-Y272 VanDerWaalsContact O-N 3.14Å
273I80.8Confident84.8Confident44 Ų4442.1 Ų42.123%0.22621%0.212CC..Hα-helixtrans-93.4-31.9177.5-51.5177.8000111.2I31 V269 P270 A271 N276I31-I273 HydrophobicContact CG2-CD1 3.34Å; I31-I273 HydrophobicContact CG2-CG1 3.71Å; V269-I273 HydrophobicContact CG1-CB 4.43Å; P270-I273 HydrophobicContact CB-CD1 4.3Å; P270-I273 HydrophobicContact CB-CG1 4.38Å; P270-I273 HydrophobicContact CG-CD1 4.05Å; P270-I273 PolarHBondContact O-N 3.15Å; A271-I273 PolarHBondContact O-N 3.22Å; I273-N276 PolarHBondContact O-ND2 2.88Å
274E80.6Confident84.9Confident36 Ų3641.2 Ų41.217%0.16821%0.207CC..Hα-helixtrans-64.8-44.5-166.4-169.4168.2-148.600113.3S182 V269 P270 A271 N276S182-E274 WeakPolarHBondContact CB-OE1 3.28Å; S182-E274 WeakPolarHBondContact CB-OE2 3.33Å; S182-E274 VanDerWaalsContact OG-CD 3.26Å; S182-E274 PolarHBondContact OG-OE2 2.03Å; V269-E274 HydrophobicContact CG1-CB 4.37Å; P270-E274 PolarHBondContact O-N 3.21Å; A271-E274 PolarHBondContact O-N 3.27Å; E274-N276 PolarHBondContact O-N 2.75Å; E274-N276 PolarHBondContact O-ND2 3.02Å
275M86.9Confident85Confident0 Ų034.7 Ų34.70%017%0.173CC..SBendtrans-83.4101.2173.5-161.3-179-153.600110.6K35 F58 L62 Y105 L108 V112 L280K35-M275 WeakPolarHBondContact CE-O 3.3Å; K35-M275 PolarHBondContact NZ-O 3.39Å; F58-M275 HydrophobicContact CE1-CE 3.56Å; F58-M275 HydrophobicContact CZ-CE 3.68Å; F58-M275 HydrophobicContact CZ-SD 4.44Å; L62-M275 HydrophobicContact CD2-CG 4.28Å; Y105-M275 HydrophobicContact CD1-SD 4.32Å; Y105-M275 HydrophobicContact CD2-CB 4.15Å; Y105-M275 HydrophobicContact CG-CB 3.97Å; Y105-M275 HydrophobicContact CG-SD 4.38Å; L108-M275 HydrophobicContact CB-CE 3.74Å; L108-M275 HydrophobicContact CB-SD 3.66Å; L108-M275 HydrophobicContact CD2-CE 4.02Å; L108-M275 HydrophobicContact CD2-SD 3.67Å; L108-M275 HydrophobicContact CG-CE 3.88Å; L108-M275 HydrophobicContact CG-SD 4.02Å; V112-M275 HydrophobicContact CB-CE 4.46Å; V112-M275 HydrophobicContact CG2-CE 4.13Å; M275-L280 HydrophobicContact CE-CD2 4.13Å
276N90.6Very high85.1Confident20 Ų2029.8 Ų29.811%0.10715%0.147CC..  trans-134.7168.8177.559.157.5000111.3K35 I273 E274 P278 W279 L280K35-N276 HydrophobicContact CG-CB 4.47Å; I273-N276 PolarHBondContact O-ND2 2.88Å; E274-N276 PolarHBondContact O-N 2.75Å; E274-N276 PolarHBondContact O-ND2 3.02Å; N276-P278 WeakPolarHBondContact OD1-CD 3.4Å; N276-W279 WeakPolarHBondContact O-CB 3.41Å; N276-W279 PolarHBondContact O-N 3.33Å; N276-W279 VanDerWaalsContact OD1-CB 3.29Å; N276-W279 WeakPolarHBondContact OD1-CB 3.4Å; N276-W279 PolarHBondContact OD1-N 2.91Å; N276-L280 WeakPolarHBondContact O-CG 3.47Å; N276-L280 PolarHBondContact O-N 3.21Å
277I89.5Confident85.3Confident0 Ų022.3 Ų22.30%012%0.115CC..Hα-helixtrans-66.2-42.5-175.2-66.6-175000112.9N39 T42 L43 C59 L62 A63 W279 L280 Y281N39-I277 HydrophobicContact CB-CB 4.28Å; N39-I277 HydrophobicContact CB-CD1 3.68Å; N39-I277 HydrophobicContact CB-CG1 3.98Å; N39-I277 WeakPolarHBondContact OD1-CB 3.31Å; N39-I277 WeakPolarHBondContact OD1-CG1 3.34Å; N39-I277 PolarHBondContact OD1-N 2.71Å; T42-I277 HydrophobicContact CG2-CG2 3.88Å; L43-I277 HydrophobicContact CD1-CD1 3.53Å; L43-I277 HydrophobicContact CD2-CD1 4.06Å; L43-I277 HydrophobicContact CD2-CG2 4.34Å; L43-I277 HydrophobicContact CG-CD1 3.6Å; L43-I277 HydrophobicContact CG-CG2 4.3Å; C59-I277 HydrophobicContact CB-CD1 4.27Å; C59-I277 HydrophobicContact CB-CG1 4.3Å; C59-I277 HydrophobicContact CB-CG2 4.45Å; C59-I277 WeakPolarHBondContact O-CD1 3.07Å; L62-I277 HydrophobicContact CD2-CG1 4.34Å; A63-I277 HydrophobicContact CB-CD1 3.98Å; I277-W279 VanDerWaalsContact C-N 3.29Å; I277-W279 PolarHBondContact O-N 3.41Å; I277-L280 PolarHBondContact O-N 3.17Å; I277-L280 VanDerWaalsContact O-N 3.17Å; I277-Y281 HydrophobicContact CG2-CD2 3.42Å; I277-Y281 VanDerWaalsContact CG2-CD2 3.42Å; I277-Y281 HydrophobicContact CG2-CE2 3.24Å; I277-Y281 WeakPolarHBondContact O-CD2 3.35Å; I277-Y281 PolarHBondContact O-N 3.12Å
278P89.4Confident85.5Confident15 Ų1518.8 Ų18.810%0.0979%0.093CC..Hα-helixtrans-53.8-44.8171.2-27.433.1000113.2L38 T42 W252 N276 L280 Y281 F282L38-P278 HydrophobicContact CD1-CG 4.13Å; L38-P278 HydrophobicContact CD2-CG 3.9Å; L38-P278 HydrophobicContact CG-CG 3.75Å; T42-P278 HydrophobicContact CG2-CG 4.27Å; T42-P278 WeakPolarHBondContact OG1-CG 3.19Å; W252-P278 WeakPolarHBondContact CH2-O 3.24Å; N276-P278 WeakPolarHBondContact OD1-CD 3.4Å; P278-L280 PolarHBondContact O-N 3.37Å; P278-Y281 PolarHBondContact O-N 2.86Å; P278-F282 WeakPolarHBondContact O-CB 3.26Å; P278-F282 PolarHBondContact O-N 3.29Å
279W88.8Confident85.8Confident22 Ų2213.1 Ų13.18%0.0837%0.069CC..Hα-helixtrans-61.8-43.1176.8-178.491.3000111.9H109 L185 F255 N276 I277 Y281 F282 V283H109-W279 HydrophobicContact CB-CH2 4.34Å; H109-W279 AromaticContact CE1-CE3 3.92Å; H109-W279 AromaticContact CE1-CH2 3.71Å; H109-W279 AromaticContact CE1-CZ2 3.85Å; H109-W279 AromaticContact CE1-CZ3 3.7Å; H109-W279 AromaticContact CG-CH2 3.96Å; H109-W279 AromaticContact ND1-CE3 3.85Å; H109-W279 AromaticContact ND1-CH2 2.92Å; H109-W279 WeakPolarHBondContact ND1-CH2 3.49Å; H109-W279 AromaticContact ND1-CZ2 3.39Å; H109-W279 WeakPolarHBondContact ND1-CZ2 3.42Å; H109-W279 AromaticContact ND1-CZ3 3.15Å; H109-W279 WeakPolarHBondContact ND1-CZ3 3.06Å; L185-W279 HydrophobicContact CD2-CH2 3.66Å; L185-W279 HydrophobicContact CD2-CZ2 3.45Å; L185-W279 VanDerWaalsContact CD2-CZ2 3.45Å; L185-W279 HydrophobicContact CG-CZ2 4.24Å; F255-W279 HydrophobicContact CE1-CB 4.44Å; F255-W279 HydrophobicContact CZ-CB 3.86Å; F255-W279 AromaticContact CZ-CD1 3.82Å; F255-W279 HydrophobicContact CZ-CG 4.24Å; N276-W279 WeakPolarHBondContact O-CB 3.41Å; N276-W279 PolarHBondContact O-N 3.33Å; N276-W279 VanDerWaalsContact OD1-CB 3.29Å; N276-W279 WeakPolarHBondContact OD1-CB 3.4Å; N276-W279 PolarHBondContact OD1-N 2.91Å; I277-W279 VanDerWaalsContact C-N 3.29Å; I277-W279 PolarHBondContact O-N 3.41Å; W279-Y281 PolarHBondContact O-N 3.43Å; W279-F282 WeakPolarHBondContact O-CB 3.42Å; W279-F282 PolarHBondContact O-N 3.44Å; W279-V283 HydrophobicContact CD2-CG2 4.19Å; W279-V283 HydrophobicContact CE3-CG2 4.31Å; W279-V283 HydrophobicContact CH2-CG2 3.71Å; W279-V283 HydrophobicContact CZ2-CG2 3.63Å; W279-V283 HydrophobicContact CZ3-CG2 4.09Å; W279-V283 WeakPolarHBondContact O-CG2 3.21Å; W279-V283 PolarHBondContact O-N 3.25Å
280L90Very high86.3Confident1 Ų113.6 Ų13.61%0.0057%0.071CC..Hα-helixtrans-63-42.1176.3-73.8169.5000112.4M55 F58 L62 V112 M275 N276 I277 P278 V283 N284M55-L280 HydrophobicContact CE-CD2 4.24Å; M55-L280 HydrophobicContact SD-CD2 4.46Å; F58-L280 HydrophobicContact CD1-CD1 3.76Å; F58-L280 HydrophobicContact CD1-CD2 4.07Å; F58-L280 HydrophobicContact CE1-CD1 3.75Å; F58-L280 HydrophobicContact CE1-CD2 3.99Å; L62-L280 HydrophobicContact CD2-CD1 3.59Å; V112-L280 HydrophobicContact CG1-CD2 4.03Å; M275-L280 HydrophobicContact CE-CD2 4.13Å; N276-L280 WeakPolarHBondContact O-CG 3.47Å; N276-L280 PolarHBondContact O-N 3.21Å; I277-L280 PolarHBondContact O-N 3.17Å; I277-L280 VanDerWaalsContact O-N 3.17Å; P278-L280 PolarHBondContact O-N 3.37Å; L280-V283 PolarHBondContact O-N 3.22Å; L280-N284 VanDerWaalsContact O-CB 3.27Å; L280-N284 WeakPolarHBondContact O-CB 3.34Å; L280-N284 PolarHBondContact O-N 2.8Å
281Y88.9Confident86.5Confident5 Ų513.1 Ų13.12%0.027%0.068CC..Hα-helixtrans-69.2-33.8176.7-77.6-55.3000112.8T42 L43 R46 W252 I277 P278 W279 N284 S285 P310 F311T42-Y281 HydrophobicContact CG2-CD2 3.69Å; T42-Y281 HydrophobicContact CG2-CE2 4.01Å; L43-Y281 HydrophobicContact CD2-CE2 4.4Å; R46-Y281 WeakPolarHBondContact CD-OH 3.4Å; W252-Y281 VanDerWaalsContact CZ2-C 3.48Å; I277-Y281 HydrophobicContact CG2-CD2 3.42Å; I277-Y281 VanDerWaalsContact CG2-CD2 3.42Å; I277-Y281 HydrophobicContact CG2-CE2 3.24Å; I277-Y281 WeakPolarHBondContact O-CD2 3.35Å; I277-Y281 PolarHBondContact O-N 3.12Å; P278-Y281 PolarHBondContact O-N 2.86Å; W279-Y281 PolarHBondContact O-N 3.43Å; Y281-N284 WeakPolarHBondContact O-CB 3.45Å; Y281-N284 PolarHBondContact O-N 2.86Å; Y281-S285 PolarHBondContact O-N 2.65Å; Y281-S285 PolarHBondContact O-OG 2.92Å; Y281-P310 HydrophobicContact CD1-CG 3.58Å; Y281-P310 HydrophobicContact CE1-CB 4.35Å; Y281-P310 HydrophobicContact CE1-CG 3.52Å; Y281-F311 HydrophobicContact CD1-CD2 4.25Å; Y281-F311 AromaticContact CD1-CE2 3.96Å; Y281-F311 HydrophobicContact CD1-CE2 3.96Å; Y281-F311 HydrophobicContact CD2-CD2 4.33Å; Y281-F311 AromaticContact CD2-CE2 3.45Å; Y281-F311 HydrophobicContact CD2-CE2 3.45Å; Y281-F311 VanDerWaalsContact CD2-CE2 3.45Å; Y281-F311 HydrophobicContact CD2-CZ 4.18Å; Y281-F311 HydrophobicContact CE1-CE2 4.32Å; Y281-F311 AromaticContact CE2-CE2 3.79Å; Y281-F311 HydrophobicContact CE2-CE2 3.79Å; Y281-F311 HydrophobicContact CE2-CZ 4.37Å; Y281-F311 AromaticContact CG-CD2 3.97Å; Y281-F311 HydrophobicContact CG-CD2 3.97Å; Y281-F311 AromaticContact CG-CE2 3.52Å; Y281-F311 HydrophobicContact CG-CE2 3.52Å
282F90.1Very high86.5Confident2 Ų213.3 Ų13.31%0.0097%0.069CC..Hα-helixtrans-58.9-50.2170.8169-100.8000111.4M189 L193 F248 W252 F255 V256 P278 W279 N284 S285 F286M189-F282 HydrophobicContact CE-CD1 4.39Å; M189-F282 HydrophobicContact CE-CE1 3.76Å; M189-F282 HydrophobicContact CE-CZ 4.39Å; L193-F282 HydrophobicContact CD1-CZ 4.1Å; F248-F282 HydrophobicContact CE1-CD2 4.48Å; F248-F282 AromaticContact CE1-CE2 3.74Å; F248-F282 HydrophobicContact CE1-CE2 3.74Å; F248-F282 HydrophobicContact CE1-CZ 4.37Å; F248-F282 HydrophobicContact CE2-CD2 4.39Å; F248-F282 HydrophobicContact CE2-CE2 4.34Å; F248-F282 AromaticContact CZ-CD2 3.72Å; F248-F282 HydrophobicContact CZ-CD2 3.72Å; F248-F282 AromaticContact CZ-CE2 3.28Å; F248-F282 HydrophobicContact CZ-CE2 3.28Å; F248-F282 AromaticContact CZ-CZ 3.91Å; F248-F282 HydrophobicContact CZ-CZ 3.91Å; W252-F282 HydrophobicContact CB-CD2 3.84Å; W252-F282 HydrophobicContact CB-CE2 4.08Å; W252-F282 HydrophobicContact CD2-CB 4.11Å; W252-F282 AromaticContact CD2-CD2 3.81Å; W252-F282 HydrophobicContact CD2-CD2 3.81Å; W252-F282 HydrophobicContact CD2-CG 4.48Å; W252-F282 HydrophobicContact CE3-CB 3.8Å; W252-F282 AromaticContact CE3-CD2 3.87Å; W252-F282 HydrophobicContact CE3-CD2 3.87Å; W252-F282 HydrophobicContact CE3-CG 4.33Å; W252-F282 AromaticContact CG-CD2 3.81Å; W252-F282 HydrophobicContact CG-CD2 3.81Å; W252-F282 HydrophobicContact CG-CE2 4.47Å; W252-F282 HydrophobicContact CH2-CB 4.09Å; W252-F282 HydrophobicContact CZ2-CB 4.37Å; W252-F282 HydrophobicContact CZ3-CB 3.78Å; F255-F282 HydrophobicContact CD1-CB 3.78Å; F255-F282 AromaticContact CD1-CD1 3.94Å; F255-F282 HydrophobicContact CD1-CD1 3.94Å; F255-F282 AromaticContact CD1-CD2 3.58Å; F255-F282 HydrophobicContact CD1-CD2 3.58Å; F255-F282 HydrophobicContact CD1-CE1 4.42Å; F255-F282 HydrophobicContact CD1-CE2 4.07Å; F255-F282 AromaticContact CD1-CG 3.48Å; F255-F282 HydrophobicContact CD1-CG 3.48Å; F255-F282 VanDerWaalsContact CD1-CG 3.48Å; F255-F282 HydrophobicContact CD1-CZ 4.47Å; F255-F282 HydrophobicContact CE1-CB 3.72Å; F255-F282 AromaticContact CE1-CD1 3.74Å; F255-F282 HydrophobicContact CE1-CD1 3.74Å; F255-F282 HydrophobicContact CE1-CD2 4.21Å; F255-F282 HydrophobicContact CE1-CE1 4.4Å; F255-F282 AromaticContact CE1-CG 3.62Å; F255-F282 HydrophobicContact CE1-CG 3.62Å; V256-F282 HydrophobicContact CG2-CE2 3.68Å; V256-F282 HydrophobicContact CG2-CZ 4.13Å; P278-F282 WeakPolarHBondContact O-CB 3.26Å; P278-F282 PolarHBondContact O-N 3.29Å; W279-F282 WeakPolarHBondContact O-CB 3.42Å; W279-F282 PolarHBondContact O-N 3.44Å; F282-N284 VanDerWaalsContact C-N 3.29Å; F282-N284 PolarHBondContact O-N 3.31Å; F282-S285 PolarHBondContact O-N 3.35Å; F282-F286 PolarHBondContact O-N 3.35Å
283V89.3Confident86.9Confident3 Ų315 Ų152%0.0188%0.075CC..Hα-helixtrans-61.3-40.6175.71720000111M55 F113 W279 L280 F286 L287M55-V283 HydrophobicContact CE-CB 4.35Å; M55-V283 HydrophobicContact CE-CG1 4.02Å; F113-V283 HydrophobicContact CD2-CG1 3.72Å; F113-V283 HydrophobicContact CE2-CG1 4.13Å; W279-V283 HydrophobicContact CD2-CG2 4.19Å; W279-V283 HydrophobicContact CE3-CG2 4.31Å; W279-V283 HydrophobicContact CH2-CG2 3.71Å; W279-V283 HydrophobicContact CZ2-CG2 3.63Å; W279-V283 HydrophobicContact CZ3-CG2 4.09Å; W279-V283 WeakPolarHBondContact O-CG2 3.21Å; W279-V283 PolarHBondContact O-N 3.25Å; L280-V283 PolarHBondContact O-N 3.22Å; V283-F286 PolarHBondContact O-N 3.07Å; V283-L287 HydrophobicContact CG1-CD1 4.08Å; V283-L287 HydrophobicContact CG1-CG 4.36Å; V283-L287 WeakPolarHBondContact O-CG 3.18Å; V283-L287 PolarHBondContact O-N 2.96Å
284N89.5Confident87Confident5 Ų519.3 Ų19.33%0.0279%0.093CC..Hα-helixtrans-58.1-50.6177.1-170.475.6000112M55 Y120 L280 Y281 F282 F286 L287 I288M55-N284 WeakPolarHBondContact CB-OD1 3.36Å; M55-N284 HydrophobicContact CE-CB 4.31Å; M55-N284 VanDerWaalsContact CG-OD1 3.32Å; M55-N284 WeakPolarHBondContact CG-OD1 3.29Å; Y120-N284 VanDerWaalsContact OH-CG 3.23Å; Y120-N284 PolarHBondContact OH-ND2 3.44Å; Y120-N284 PolarHBondContact OH-OD1 2.93Å; L280-N284 VanDerWaalsContact O-CB 3.27Å; L280-N284 WeakPolarHBondContact O-CB 3.34Å; L280-N284 PolarHBondContact O-N 2.8Å; Y281-N284 WeakPolarHBondContact O-CB 3.45Å; Y281-N284 PolarHBondContact O-N 2.86Å; F282-N284 VanDerWaalsContact C-N 3.29Å; F282-N284 PolarHBondContact O-N 3.31Å; N284-F286 VanDerWaalsContact C-N 3.3Å; N284-F286 PolarHBondContact O-N 3.34Å; N284-L287 PolarHBondContact O-N 3.25Å; N284-I288 WeakPolarHBondContact ND2-CD1 3.44Å; N284-I288 WeakPolarHBondContact O-CG1 3.29Å; N284-I288 PolarHBondContact O-N 2.92Å
285S88.6Confident86.7Confident0 Ų019 Ų190%09%0.092CC..Hα-helixtrans-61.7-38.6176.9-66.10000112.3W252 Y281 F282 I288 A289 D309 W314W252-S285 VanDerWaalsContact NE1-CB 3.33Å; W252-S285 PolarHBondContact NE1-OG 3Å; Y281-S285 PolarHBondContact O-N 2.65Å; Y281-S285 PolarHBondContact O-OG 2.92Å; F282-S285 PolarHBondContact O-N 3.35Å; S285-I288 PolarHBondContact O-N 2.88Å; S285-A289 WeakPolarHBondContact O-CB 3.32Å; S285-A289 PolarHBondContact O-N 2.98Å; S285-D309 WeakPolarHBondContact CA-OD2 3.45Å; S285-D309 WeakPolarHBondContact CB-OD2 3.44Å; S285-D309 PolarHBondContact OG-OD1 3.47Å; S285-D309 PolarHBondContact OG-OD2 2.92Å; S285-W314 WeakPolarHBondContact O-CZ2 3.44Å
286F89.3Confident85.9Confident21 Ų2119.9 Ų19.99%0.09210%0.098CC..Hα-helixtrans-64.4-43.5176.4177.3-91.1000112.3M189 I192 L193 F248 F282 V283 N284 A289 T290M189-F286 HydrophobicContact CE-CB 3.55Å; M189-F286 HydrophobicContact CE-CD1 3.36Å; M189-F286 HydrophobicContact CE-CD2 3.63Å; M189-F286 HydrophobicContact CE-CE1 3.88Å; M189-F286 HydrophobicContact CE-CE2 4.12Å; M189-F286 HydrophobicContact CE-CG 3.21Å; M189-F286 HydrophobicContact CE-CZ 4.22Å; M189-F286 HydrophobicContact SD-CD1 3.52Å; M189-F286 VanDerWaalsContact SD-CD1 3.52Å; M189-F286 HydrophobicContact SD-CD2 4.27Å; M189-F286 HydrophobicContact SD-CE1 3.42Å; M189-F286 WeakPolarHBondContact SD-CE1 3.44Å; M189-F286 HydrophobicContact SD-CE2 4.18Å; M189-F286 HydrophobicContact SD-CG 3.95Å; M189-F286 HydrophobicContact SD-CZ 3.76Å; I192-F286 HydrophobicContact CB-CZ 4.38Å; I192-F286 HydrophobicContact CD1-CZ 4.4Å; I192-F286 HydrophobicContact CG2-CE2 4.15Å; I192-F286 HydrophobicContact CG2-CZ 3.87Å; L193-F286 HydrophobicContact CD2-CD2 4.12Å; L193-F286 HydrophobicContact CD2-CE2 4.08Å; L193-F286 HydrophobicContact CG-CD2 4.42Å; L193-F286 HydrophobicContact CG-CE2 4.18Å; F248-F286 HydrophobicContact CE2-CB 3.98Å; F248-F286 HydrophobicContact CZ-CB 4.18Å; F248-F286 HydrophobicContact CZ-CD2 4.45Å; F282-F286 PolarHBondContact O-N 3.35Å; V283-F286 PolarHBondContact O-N 3.07Å; N284-F286 VanDerWaalsContact C-N 3.3Å; N284-F286 PolarHBondContact O-N 3.34Å; F286-A289 PolarHBondContact O-N 3.49Å; F286-T290 WeakPolarHBondContact O-CB 3.36Å; F286-T290 PolarHBondContact O-N 2.67Å; F286-T290 PolarHBondContact O-OG1 2.96Å
287L88Confident84.8Confident8 Ų824.5 Ų24.54%0.04212%0.119CC..Hα-helixtrans-63.1-44176.7-74.3174.8000111.5F113 A116 C117 Y120 V283 N284 A289 T290 V291F113-L287 HydrophobicContact CD2-CD1 4.32Å; F113-L287 HydrophobicContact CD2-CD2 4.37Å; F113-L287 HydrophobicContact CE2-CD1 4.31Å; F113-L287 HydrophobicContact CE2-CD2 3.61Å; F113-L287 HydrophobicContact CE2-CG 4.11Å; F113-L287 HydrophobicContact CZ-CD2 3.78Å; A116-L287 HydrophobicContact CB-CD1 3.76Å; C117-L287 HydrophobicContact CB-CD2 4.45Å; Y120-L287 HydrophobicContact CD2-CB 3.99Å; Y120-L287 HydrophobicContact CD2-CD1 4.31Å; Y120-L287 HydrophobicContact CE2-CB 4.17Å; Y120-L287 HydrophobicContact CE2-CD1 4.42Å; V283-L287 HydrophobicContact CG1-CD1 4.08Å; V283-L287 HydrophobicContact CG1-CG 4.36Å; V283-L287 WeakPolarHBondContact O-CG 3.18Å; V283-L287 PolarHBondContact O-N 2.96Å; N284-L287 PolarHBondContact O-N 3.25Å; L287-A289 PolarHBondContact O-N 3.3Å; L287-T290 WeakPolarHBondContact O-CB 3.41Å; L287-T290 PolarHBondContact O-N 3.24Å; L287-V291 VanDerWaalsContact O-CG2 3.28Å; L287-V291 WeakPolarHBondContact O-CG2 3.26Å; L287-V291 PolarHBondContact O-N 3.3Å
288I85.1Confident83.6Confident0 Ų029.6 Ų29.60%014%0.141CC..Hα-helixtrans-59.5-47.6176.1-68.9169.5000110.7Y120 N284 S285 T290 V291 Y292 P307 D309Y120-I288 HydrophobicContact CD1-CG1 4.25Å; Y120-I288 HydrophobicContact CE1-CD1 4.1Å; Y120-I288 HydrophobicContact CE1-CG1 3.6Å; Y120-I288 HydrophobicContact CE2-CG1 4.28Å; N284-I288 WeakPolarHBondContact ND2-CD1 3.44Å; N284-I288 WeakPolarHBondContact O-CG1 3.29Å; N284-I288 PolarHBondContact O-N 2.92Å; S285-I288 PolarHBondContact O-N 2.88Å; I288-T290 VanDerWaalsContact C-N 3.3Å; I288-T290 PolarHBondContact O-N 2.9Å; I288-V291 PolarHBondContact O-N 3.43Å; I288-Y292 HydrophobicContact CG2-CD2 3.84Å; I288-Y292 HydrophobicContact CG2-CE1 4.5Å; I288-Y292 HydrophobicContact CG2-CE2 3.27Å; I288-Y292 WeakPolarHBondContact O-CD2 3.2Å; I288-Y292 PolarHBondContact O-N 3.27Å; I288-P307 HydrophobicContact CG1-CB 4.38Å; I288-P307 HydrophobicContact CG2-CG 4.31Å; I288-D309 HydrophobicContact CD1-CB 3.83Å
289A86.1Confident82.2Confident12 Ų1230.2 Ų30.210%0.09914%0.144CC..Hα-helixtrans-58.4-42.9176.600000111.9L244 S285 F286 L287 Y292 W293 W314L244-A289 WeakPolarHBondContact CD1-O 3.12Å; S285-A289 WeakPolarHBondContact O-CB 3.32Å; S285-A289 PolarHBondContact O-N 2.98Å; F286-A289 PolarHBondContact O-N 3.49Å; L287-A289 PolarHBondContact O-N 3.3Å; A289-Y292 PolarHBondContact O-N 3.37Å; A289-W293 WeakPolarHBondContact O-CB 3.31Å; A289-W293 PolarHBondContact O-N 3.42Å; A289-W314 HydrophobicContact CB-CH2 3.6Å; A289-W314 HydrophobicContact CB-CZ2 4.11Å; A289-W314 HydrophobicContact CB-CZ3 4.16Å
290T86.8Confident80.3Confident42 Ų4236.4 Ų36.426%0.25818%0.178SC..Hα-helixtrans-63.1-44.4178.5-59.50000111.4F286 L287 I288 Y292 W293 F294F286-T290 WeakPolarHBondContact O-CB 3.36Å; F286-T290 PolarHBondContact O-N 2.67Å; F286-T290 PolarHBondContact O-OG1 2.96Å; L287-T290 WeakPolarHBondContact O-CB 3.41Å; L287-T290 PolarHBondContact O-N 3.24Å; I288-T290 VanDerWaalsContact C-N 3.3Å; I288-T290 PolarHBondContact O-N 2.9Å; T290-Y292 VanDerWaalsContact C-N 3.34Å; T290-Y292 PolarHBondContact O-N 2.64Å; T290-W293 WeakPolarHBondContact O-CB 3.26Å; T290-W293 PolarHBondContact O-N 3.36Å; T290-F294 HydrophobicContact CG2-CD2 3.67Å; T290-F294 HydrophobicContact CG2-CE2 3.45Å; T290-F294 VanDerWaalsContact CG2-CE2 3.45Å; T290-F294 WeakPolarHBondContact O-CD2 3.34Å; T290-F294 PolarHBondContact O-N 3.22Å
291V83.9Confident78.1Confident13 Ų1342.9 Ų42.98%0.07921%0.212CC..Hα-helixtrans-63.7-41.1177.6170.80000111.1F124 L287 I288 N295F124-V291 HydrophobicContact CB-CG1 4Å; F124-V291 HydrophobicContact CD2-CG1 3.72Å; F124-V291 HydrophobicContact CE2-CG1 4.43Å; F124-V291 HydrophobicContact CG-CG1 3.82Å; L287-V291 VanDerWaalsContact O-CG2 3.28Å; L287-V291 WeakPolarHBondContact O-CG2 3.26Å; L287-V291 PolarHBondContact O-N 3.3Å; I288-V291 PolarHBondContact O-N 3.43Å; V291-N295 WeakPolarHBondContact O-CB 3.36Å; V291-N295 PolarHBondContact O-N 3.38Å; V291-N295 VanDerWaalsContact O-N 3.13Å; V291-N295 PolarHBondContact O-ND2 3.32Å
292Y80.1Confident75.8Confident4 Ų454 Ų542%0.01625%0.254CS..Hα-helixtrans-62.4-43.8172.9-69.1-28000112.4F240 L244 I288 A289 T290 N295 C296 L299 L306 P307 W314 F318F240-Y292 WeakPolarHBondContact CE1-O 3.49Å; L244-Y292 HydrophobicContact CD2-CD2 4.18Å; I288-Y292 HydrophobicContact CG2-CD2 3.84Å; I288-Y292 HydrophobicContact CG2-CE1 4.5Å; I288-Y292 HydrophobicContact CG2-CE2 3.27Å; I288-Y292 WeakPolarHBondContact O-CD2 3.2Å; I288-Y292 PolarHBondContact O-N 3.27Å; A289-Y292 PolarHBondContact O-N 3.37Å; T290-Y292 VanDerWaalsContact C-N 3.34Å; T290-Y292 PolarHBondContact O-N 2.64Å; Y292-N295 CarbonylContact O-C 3.52Å; Y292-N295 PolarHBondContact O-N 3.09Å; Y292-C296 PolarHBondContact O-N 2.82Å; Y292-L299 HydrophobicContact CD1-CD1 4.1Å; Y292-L299 HydrophobicContact CD1-CD2 4.47Å; Y292-L299 HydrophobicContact CG-CD1 4.41Å; Y292-L306 HydrophobicContact CD1-CD2 3.92Å; Y292-L306 HydrophobicContact CE1-CB 4.35Å; Y292-L306 HydrophobicContact CE1-CD2 3.2Å; Y292-L306 HydrophobicContact CE1-CG 4.36Å; Y292-L306 WeakPolarHBondContact OH-CB 3.19Å; Y292-P307 HydrophobicContact CE1-CG 3.84Å; Y292-P307 WeakPolarHBondContact OH-CD 3.36Å; Y292-P307 WeakPolarHBondContact OH-CG 3.12Å; Y292-P307 PolarHBondContact OH-O 3.35Å; Y292-W314 HydrophobicContact CD2-CD2 4.35Å; Y292-W314 HydrophobicContact CD2-CG 4.35Å; Y292-W314 HydrophobicContact CE2-CB 3.87Å; Y292-W314 AromaticContact CE2-CD1 3.87Å; Y292-W314 HydrophobicContact CE2-CD2 4.07Å; Y292-W314 AromaticContact CE2-CG 3.65Å; Y292-W314 HydrophobicContact CE2-CG 3.65Å; Y292-F318 HydrophobicContact CD1-CZ 4.14Å; Y292-F318 HydrophobicContact CD2-CE2 4.1Å; Y292-F318 AromaticContact CD2-CZ 3.9Å; Y292-F318 HydrophobicContact CD2-CZ 3.9Å; Y292-F318 HydrophobicContact CE1-CZ 4.47Å; Y292-F318 HydrophobicContact CE2-CE2 4.03Å; Y292-F318 HydrophobicContact CE2-CZ 4.23Å; Y292-F318 HydrophobicContact CG-CE2 4.48Å; Y292-F318 AromaticContact CG-CZ 3.87Å; Y292-F318 HydrophobicContact CG-CZ 3.87Å
293W83.4Confident73.6Confident61 Ų6160.9 Ų60.923%0.23129%0.291CS..Hα-helixtrans-58-51.8179.4175.8-121000112.4K237 F240 L241 L244 A289 T290 N295 C296K237-W293 HydrophobicContact CB-CH2 3.4Å; K237-W293 HydrophobicContact CB-CZ2 4.27Å; K237-W293 HydrophobicContact CB-CZ3 3.77Å; K237-W293 HydrophobicContact CD-CH2 4.46Å; K237-W293 HydrophobicContact CG-CH2 3.94Å; K237-W293 HydrophobicContact CG-CZ3 4.03Å; K237-W293 WeakPolarHBondContact O-CH2 3.48Å; K237-W293 WeakPolarHBondContact O-CZ3 3.12Å; F240-W293 HydrophobicContact CB-CZ3 4.39Å; F240-W293 AromaticContact CD1-CE3 3.94Å; F240-W293 HydrophobicContact CD1-CE3 3.94Å; F240-W293 HydrophobicContact CD1-CZ3 4.26Å; L241-W293 HydrophobicContact CB-CD2 4.31Å; L241-W293 HydrophobicContact CB-CE3 3.79Å; L241-W293 HydrophobicContact CB-CH2 3.55Å; L241-W293 HydrophobicContact CB-CZ2 4.1Å; L241-W293 HydrophobicContact CB-CZ3 3.47Å; L241-W293 VanDerWaalsContact CB-CZ3 3.47Å; L241-W293 HydrophobicContact CD1-CD2 4.01Å; L241-W293 HydrophobicContact CD1-CE3 4.19Å; L241-W293 HydrophobicContact CD1-CG 4.35Å; L241-W293 HydrophobicContact CD2-CH2 4.22Å; L241-W293 HydrophobicContact CD2-CZ2 3.98Å; L241-W293 HydrophobicContact CG-CH2 4.38Å; L241-W293 HydrophobicContact CG-CZ2 4.46Å; L241-W293 HydrophobicContact CG-CZ3 4.49Å; L244-W293 HydrophobicContact CD1-CB 4.04Å; A289-W293 WeakPolarHBondContact O-CB 3.31Å; A289-W293 PolarHBondContact O-N 3.42Å; T290-W293 WeakPolarHBondContact O-CB 3.26Å; T290-W293 PolarHBondContact O-N 3.36Å; W293-N295 VanDerWaalsContact C-N 3.28Å; W293-N295 PolarHBondContact O-N 2.99Å; W293-C296 PolarHBondContact O-N 3.15Å
294F81.5Confident71.7Confident135 Ų13562.9 Ų62.959%0.59230%0.301SS*.Hα-helixtrans-63.8-34.8179.5-79.2-66.7000112.7T290 H297T290-F294 HydrophobicContact CG2-CD2 3.67Å; T290-F294 HydrophobicContact CG2-CE2 3.45Å; T290-F294 VanDerWaalsContact CG2-CE2 3.45Å; T290-F294 WeakPolarHBondContact O-CD2 3.34Å; T290-F294 PolarHBondContact O-N 3.22Å; F294-H297 PolarHBondContact O-ND1 3.32Å
295N74.2Confident69.9Low30 Ų3066.1 Ų66.116%0.1634%0.336CS..THydrogen-bonded Turntrans-98.815.8-176.1-65.7-75.4000114.4F124 V291 Y292 W293 H297 K298 L299F124-N295 HydrophobicContact CD1-CB 4.2Å; F124-N295 HydrophobicContact CE1-CB 3.28Å; F124-N295 VanDerWaalsContact CE1-OD1 3.28Å; F124-N295 WeakPolarHBondContact CE1-OD1 3.47Å; F124-N295 HydrophobicContact CE2-CB 4.07Å; F124-N295 HydrophobicContact CZ-CB 3.2Å; V291-N295 WeakPolarHBondContact O-CB 3.36Å; V291-N295 PolarHBondContact O-N 3.38Å; V291-N295 VanDerWaalsContact O-N 3.13Å; V291-N295 PolarHBondContact O-ND2 3.32Å; Y292-N295 CarbonylContact O-C 3.52Å; Y292-N295 PolarHBondContact O-N 3.09Å; W293-N295 VanDerWaalsContact C-N 3.28Å; W293-N295 PolarHBondContact O-N 2.99Å; N295-H297 PolarHBondContact O-N 2.86Å; N295-K298 PolarHBondContact O-N 2.96Å; N295-L299 WeakPolarHBondContact O-CG 3.38Å; N295-L299 PolarHBondContact O-N 3.38Å
296C71.7Confident68.6Low19 Ų1969.1 Ų69.113%0.12835%0.351CS..THydrogen-bonded Turntrans-51.4-28.4-175.771.30000114.3K237 F240 Y292 W293K237-C296 WeakPolarHBondContact CE-SG 3.41Å; K237-C296 WeakPolarHBondContact CG-SG 3.39Å; F240-C296 HydrophobicContact CD1-CB 3.76Å; F240-C296 HydrophobicContact CE1-CB 4.07Å; Y292-C296 PolarHBondContact O-N 2.82Å; W293-C296 PolarHBondContact O-N 3.15Å
297H66.4Low67.2Low117 Ų11769 Ų6954%0.54235%0.353SS..THydrogen-bonded Turntrans-72.4-28.6178.561.4-75.1000113.5F294 N295F294-H297 PolarHBondContact O-ND1 3.32Å; N295-H297 PolarHBondContact O-N 2.86Å
298K63.7Low66.3Low106 Ų10672 Ų7246%0.46137%0.368SS..THydrogen-bonded Turntrans-87.1-13.6178.3-68.8173.1-177.81750113F124 N295 N300 I304F124-K298 HydrophobicContact CE1-CD 4.28Å; N295-K298 PolarHBondContact O-N 2.96Å; K298-N300 VanDerWaalsContact C-N 3.3Å; K298-N300 PolarHBondContact O-N 3.46Å; K298-I304 VanDerWaalsContact O-CD1 3.31Å; K298-I304 WeakPolarHBondContact O-CD1 3.13Å
299L60.6Low65.8Low29 Ų2972.3 Ų72.315%0.15237%0.37CS..THydrogen-bonded Turntrans-80.5-5.5-174.2-64176.3000114F124 F240 Y292 N295 L301 L306 F318F124-L299 HydrophobicContact CE2-CD2 3.9Å; F124-L299 HydrophobicContact CZ-CD2 4.02Å; F240-L299 HydrophobicContact CE1-CD1 4.26Å; F240-L299 HydrophobicContact CZ-CD1 4.06Å; Y292-L299 HydrophobicContact CD1-CD1 4.1Å; Y292-L299 HydrophobicContact CD1-CD2 4.47Å; Y292-L299 HydrophobicContact CG-CD1 4.41Å; N295-L299 WeakPolarHBondContact O-CG 3.38Å; N295-L299 PolarHBondContact O-N 3.38Å; L299-L301 PolarHBondContact O-N 3.5Å; L299-L306 HydrophobicContact CD2-CD2 3.64Å; L299-F318 HydrophobicContact CB-CE1 4.28Å; L299-F318 HydrophobicContact CD1-CE1 3.55Å; L299-F318 HydrophobicContact CD1-CZ 3.87Å; L299-F318 HydrophobicContact CG-CE1 4.39Å
300N49.9Very low65.2Low151 Ų15172.1 Ų72.181%0.80737%0.368SS*.THydrogen-bonded Turntrans-72.7-2.1178.4-87.3-10.5000114.8K298K298-N300 VanDerWaalsContact C-N 3.3Å; K298-N300 PolarHBondContact O-N 3.46Å
301L42.2Very low64.8Low137 Ų13772 Ų7272%0.71736%0.364SS*.SBendtrans-110.3108.1179.3-78.1157000109.9L299 D303L299-L301 PolarHBondContact O-N 3.5Å; L301-D303 PolarHBondContact O-N 3.18Å
302R42Very low64.4Low238 Ų23871.5 Ų71.590%0.89836%0.361SS*.THydrogen-bonded Turntrans-30.1123.6159.1-136.3173-176.8-175.6-0.3108.8
303D43.9Very low64.1Low148 Ų14874.2 Ų74.279%0.79138%0.376SS*.THydrogen-bonded Turntrans90.232.7174.3-49.2-36.6000119.6L301L301-D303 PolarHBondContact O-N 3.18Å
304I48.4Very low63.5Low44 Ų4471.9 Ų71.923%0.22637%0.367CS..  trans-87.2125.9153.8-56.2176.5000107.9K298 L306K298-I304 VanDerWaalsContact O-CD1 3.31Å; K298-I304 WeakPolarHBondContact O-CD1 3.13Å; I304-L306 WeakPolarHBondContact O-CG 3.48Å; I304-L306 PolarHBondContact O-N 3.15Å
305G52.8Low62.7Low74 Ų7471.8 Ų71.876%0.76337%0.366SS*.  trans-62.477170.700000110.8
306L59.8Low62Low62 Ų6272.7 Ų72.733%0.32538%0.375SS..  trans-56.5133.8-179.1-76.4146.9000109.3Y292 L299 I304 L308 F318Y292-L306 HydrophobicContact CD1-CD2 3.92Å; Y292-L306 HydrophobicContact CE1-CB 4.35Å; Y292-L306 HydrophobicContact CE1-CD2 3.2Å; Y292-L306 HydrophobicContact CE1-CG 4.36Å; Y292-L306 WeakPolarHBondContact OH-CB 3.19Å; L299-L306 HydrophobicContact CD2-CD2 3.64Å; I304-L306 WeakPolarHBondContact O-CG 3.48Å; I304-L306 PolarHBondContact O-N 3.15Å; L306-L308 PolarHBondContact O-N 2.98Å; L306-F318 HydrophobicContact CD2-CE2 4.25Å; L306-F318 HydrophobicContact CD2-CZ 4.2Å
307P61.2Low61.5Low20 Ų2071.9 Ų71.913%0.1337%0.369CS..  trans-54.2113.9174.318.2-30.2000110.5Y120 I288 Y292 D309Y120-P307 HydrophobicContact CD1-CB 4.11Å; Y120-P307 HydrophobicContact CD1-CG 4.47Å; Y120-P307 HydrophobicContact CE1-CB 3.86Å; I288-P307 HydrophobicContact CG1-CB 4.38Å; I288-P307 HydrophobicContact CG2-CG 4.31Å; Y292-P307 HydrophobicContact CE1-CG 3.84Å; Y292-P307 WeakPolarHBondContact OH-CD 3.36Å; Y292-P307 WeakPolarHBondContact OH-CG 3.12Å; Y292-P307 PolarHBondContact OH-O 3.35Å; P307-D309 PolarHBondContact O-N 3.18Å
308L68.5Low61.1Low69 Ų6969 Ų6936%0.36136%0.355SS..  trans-75122.9179-70.1168.7000109.2N49 T50 L306N49-L308 VanDerWaalsContact O-CD1 3.25Å; N49-L308 WeakPolarHBondContact O-CD1 3.1Å; T50-L308 HydrophobicContact CG2-CB 4.14Å; L306-L308 PolarHBondContact O-N 2.98Å
309D73.9Confident60.4Low8 Ų868 Ų684%0.04335%0.354CS..  trans-89.5134.4175-173.3-49.6000110.3S285 I288 P307 F311 V312 W314S285-D309 WeakPolarHBondContact CA-OD2 3.45Å; S285-D309 WeakPolarHBondContact CB-OD2 3.44Å; S285-D309 PolarHBondContact OG-OD1 3.47Å; S285-D309 PolarHBondContact OG-OD2 2.92Å; I288-D309 HydrophobicContact CD1-CB 3.83Å; P307-D309 PolarHBondContact O-N 3.18Å; D309-F311 VanDerWaalsContact C-N 3.28Å; D309-F311 PolarHBondContact O-N 2.99Å; D309-F311 PolarHBondContact OD1-N 3.28Å; D309-V312 HydrophobicContact CB-CB 4.42Å; D309-V312 WeakPolarHBondContact CB-O 3.49Å; D309-V312 PolarHBondContact OD1-N 2.63Å; D309-W314 VanDerWaalsContact CB-CD1 3.4Å; D309-W314 PolarHBondContact OD2-NE1 3.25Å; D309-W314 VanDerWaalsContact OD2-NE1 3.15Å
310P75.2Confident59.5Low8 Ų870.9 Ų70.95%0.05237%0.374CS..SBendtrans-67.3-24.1-178.322.4-29.9000114.7R46 R47 T50 Y281R46-P310 HydrophobicContact CB-CB 4.22Å; R46-P310 HydrophobicContact CG-CB 3.53Å; R47-P310 WeakPolarHBondContact CG-O 3.43Å; R47-P310 PolarHBondContact N-O 3.43Å; T50-P310 HydrophobicContact CG2-CB 3.98Å; Y281-P310 HydrophobicContact CD1-CG 3.58Å; Y281-P310 HydrophobicContact CE1-CB 4.35Å; Y281-P310 HydrophobicContact CE1-CG 3.52Å
311F78.3Confident58.8Low39 Ų3968.2 Ų68.217%0.17136%0.36CS..SBendtrans-117.8-46.9-175.7-67.5-81.7000112.6T42 M45 T251 W252 Y281 D309T42-F311 HydrophobicContact CG2-CE1 4.48Å; T42-F311 HydrophobicContact CG2-CE2 4.2Å; T42-F311 HydrophobicContact CG2-CZ 3.65Å; T42-F311 WeakPolarHBondContact O-CZ 3.23Å; M45-F311 HydrophobicContact CB-CE1 4.24Å; T251-F311 HydrophobicContact CG2-CB 4.06Å; W252-F311 HydrophobicContact CZ2-CB 4.35Å; W252-F311 HydrophobicContact CZ2-CD2 4.32Å; W252-F311 HydrophobicContact CZ2-CG 4.42Å; Y281-F311 HydrophobicContact CD1-CD2 4.25Å; Y281-F311 AromaticContact CD1-CE2 3.96Å; Y281-F311 HydrophobicContact CD1-CE2 3.96Å; Y281-F311 HydrophobicContact CD2-CD2 4.33Å; Y281-F311 AromaticContact CD2-CE2 3.45Å; Y281-F311 HydrophobicContact CD2-CE2 3.45Å; Y281-F311 VanDerWaalsContact CD2-CE2 3.45Å; Y281-F311 HydrophobicContact CD2-CZ 4.18Å; Y281-F311 HydrophobicContact CE1-CE2 4.32Å; Y281-F311 AromaticContact CE2-CE2 3.79Å; Y281-F311 HydrophobicContact CE2-CE2 3.79Å; Y281-F311 HydrophobicContact CE2-CZ 4.37Å; Y281-F311 AromaticContact CG-CD2 3.97Å; Y281-F311 HydrophobicContact CG-CD2 3.97Å; Y281-F311 AromaticContact CG-CE2 3.52Å; Y281-F311 HydrophobicContact CG-CE2 3.52Å; D309-F311 VanDerWaalsContact C-N 3.28Å; D309-F311 PolarHBondContact O-N 2.99Å; D309-F311 PolarHBondContact OD1-N 3.28Å
312V73.9Confident58.2Low3 Ų367.6 Ų67.62%0.01836%0.361CS..  trans-85.5123.6-176-174.40000110.8C247 T251 D309 W314C247-V312 HydrophobicContact CB-CG1 4.25Å; T251-V312 HydrophobicContact CG2-CG2 4.19Å; D309-V312 HydrophobicContact CB-CB 4.42Å; D309-V312 WeakPolarHBondContact CB-O 3.49Å; D309-V312 PolarHBondContact OD1-N 2.63Å; V312-W314 HydrophobicContact CB-CD2 4.25Å; V312-W314 HydrophobicContact CB-CH2 4.35Å; V312-W314 HydrophobicContact CB-CZ2 3.73Å; V312-W314 HydrophobicContact CG1-CD2 3.66Å; V312-W314 HydrophobicContact CG1-CE3 3.83Å; V312-W314 HydrophobicContact CG1-CG 4.32Å; V312-W314 HydrophobicContact CG1-CH2 3.73Å; V312-W314 HydrophobicContact CG1-CZ2 3.57Å; V312-W314 HydrophobicContact CG1-CZ3 3.86Å; V312-W314 HydrophobicContact CG2-CZ2 4.06Å; V312-W314 PolarHBondContact O-N 2.97Å; V312-W314 VanDerWaalsContact O-N 3.08Å
313N73.9Confident57.7Low61 Ų6161.3 Ų61.333%0.32635%0.345SS..  trans-82.483.7173.6-164.10.5000111.6K315 C316N313-K315 PolarHBondContact O-N 3.15Å; N313-K315 VanDerWaalsContact O-N 3.1Å; N313-K315 WeakPolarHBondContact OD1-CB 3.4Å; N313-K315 WeakPolarHBondContact OD1-CG 3.37Å; N313-K315 PolarHBondContact OD1-N 3.5Å; N313-C316 PolarHBondContact O-N 2.85Å
314W71.4Confident57.1Low11 Ų1159.4 Ų59.44%0.04234%0.341CS..THydrogen-bonded Turntrans-63-17.5179.6-58.3110.8000114L244 C247 F248 S285 A289 Y292 D309 V312 C316 C317 F318L244-W314 HydrophobicContact CB-CZ3 4.38Å; L244-W314 HydrophobicContact CD2-CE3 3.61Å; L244-W314 HydrophobicContact CD2-CZ3 3.61Å; C247-W314 HydrophobicContact CB-CE3 4.09Å; C247-W314 HydrophobicContact CB-CZ3 3.89Å; F248-W314 HydrophobicContact CB-CH2 4.03Å; F248-W314 HydrophobicContact CD2-CH2 4.24Å; S285-W314 WeakPolarHBondContact O-CZ2 3.44Å; A289-W314 HydrophobicContact CB-CH2 3.6Å; A289-W314 HydrophobicContact CB-CZ2 4.11Å; A289-W314 HydrophobicContact CB-CZ3 4.16Å; Y292-W314 HydrophobicContact CD2-CD2 4.35Å; Y292-W314 HydrophobicContact CD2-CG 4.35Å; Y292-W314 HydrophobicContact CE2-CB 3.87Å; Y292-W314 AromaticContact CE2-CD1 3.87Å; Y292-W314 HydrophobicContact CE2-CD2 4.07Å; Y292-W314 AromaticContact CE2-CG 3.65Å; Y292-W314 HydrophobicContact CE2-CG 3.65Å; D309-W314 VanDerWaalsContact CB-CD1 3.4Å; D309-W314 PolarHBondContact OD2-NE1 3.25Å; D309-W314 VanDerWaalsContact OD2-NE1 3.15Å; V312-W314 HydrophobicContact CB-CD2 4.25Å; V312-W314 HydrophobicContact CB-CH2 4.35Å; V312-W314 HydrophobicContact CB-CZ2 3.73Å; V312-W314 HydrophobicContact CG1-CD2 3.66Å; V312-W314 HydrophobicContact CG1-CE3 3.83Å; V312-W314 HydrophobicContact CG1-CG 4.32Å; V312-W314 HydrophobicContact CG1-CH2 3.73Å; V312-W314 HydrophobicContact CG1-CZ2 3.57Å; V312-W314 HydrophobicContact CG1-CZ3 3.86Å; V312-W314 HydrophobicContact CG2-CZ2 4.06Å; V312-W314 PolarHBondContact O-N 2.97Å; V312-W314 VanDerWaalsContact O-N 3.08Å; W314-C316 PolarHBondContact O-N 3.3Å; W314-C317 WeakPolarHBondContact O-CB 3.32Å; W314-C317 PolarHBondContact O-N 3.33Å; W314-C317 PolarHBondContact O-SG 2.83Å; W314-C317 VanDerWaalsContact O-SG 3.39Å; W314-F318 HydrophobicContact CB-CE2 4.09Å; W314-F318 WeakPolarHBondContact O-CD2 3.42Å
315K64.7Low56.2Low133 Ų13363 Ų6358%0.57836%0.36SS*.Hα-helixtrans-56.1-35.8177.3-63.5-177177.3-177.40112.1N313 C317 F318 I319N313-K315 PolarHBondContact O-N 3.15Å; N313-K315 VanDerWaalsContact O-N 3.1Å; N313-K315 WeakPolarHBondContact OD1-CB 3.4Å; N313-K315 WeakPolarHBondContact OD1-CG 3.37Å; N313-K315 PolarHBondContact OD1-N 3.5Å; K315-C317 PolarHBondContact O-N 3.29Å; K315-F318 PolarHBondContact O-N 3.42Å; K315-F318 VanDerWaalsContact O-N 3.14Å; K315-I319 HydrophobicContact CB-CD1 4.14Å; K315-I319 WeakPolarHBondContact O-CG1 3.44Å; K315-I319 PolarHBondContact O-N 2.96Å
316C59.6Low55.1Low50 Ų5068 Ų6834%0.33837%0.368SS..Hα-helixtrans-62.5-24.2177.2-57.80000112.9N313 W314N313-C316 PolarHBondContact O-N 2.85Å; W314-C316 PolarHBondContact O-N 3.3Å
317C60.7Low53.7Low2 Ų272.2 Ų72.21%0.01439%0.387CS..Hα-helixtrans-86-15.1-178.9-25.30000112K243 C247 W314 K315K243-C317 HydrophobicContact CB-CB 4.05Å; K243-C317 WeakPolarHBondContact CD-O 3.33Å; C247-C317 WeakPolarHBondContact CB-SG 3.48Å; C247-C317 WeakPolarHBondContact SG-CB 3.27Å; C247-C317 CovalentContact SG-SG 2.07Å; C247-C317 PolarHBondContact SG-SG 3.27Å; W314-C317 WeakPolarHBondContact O-CB 3.32Å; W314-C317 PolarHBondContact O-N 3.33Å; W314-C317 PolarHBondContact O-SG 2.83Å; W314-C317 VanDerWaalsContact O-SG 3.39Å; K315-C317 PolarHBondContact O-N 3.29Å
318F58.2Low52.2Low55 Ų5580.1 Ų80.124%0.24142%0.422CS..Hα-helixtrans-110.5-22.2-174.8-66.5-70000115.7F240 Y292 L299 L306 W314 K315 P320F240-F318 HydrophobicContact CD2-CE1 4.48Å; F240-F318 HydrophobicContact CE1-CE1 4.47Å; F240-F318 AromaticContact CE2-CD1 3.8Å; F240-F318 HydrophobicContact CE2-CD1 3.8Å; F240-F318 AromaticContact CE2-CE1 3.26Å; F240-F318 HydrophobicContact CE2-CE1 3.26Å; F240-F318 AromaticContact CE2-CZ 3.8Å; F240-F318 HydrophobicContact CE2-CZ 3.8Å; F240-F318 HydrophobicContact CZ-CD1 4.25Å; F240-F318 AromaticContact CZ-CE1 3.26Å; F240-F318 HydrophobicContact CZ-CE1 3.26Å; F240-F318 AromaticContact CZ-CZ 3.51Å; F240-F318 HydrophobicContact CZ-CZ 3.51Å; Y292-F318 HydrophobicContact CD1-CZ 4.14Å; Y292-F318 HydrophobicContact CD2-CE2 4.1Å; Y292-F318 AromaticContact CD2-CZ 3.9Å; Y292-F318 HydrophobicContact CD2-CZ 3.9Å; Y292-F318 HydrophobicContact CE1-CZ 4.47Å; Y292-F318 HydrophobicContact CE2-CE2 4.03Å; Y292-F318 HydrophobicContact CE2-CZ 4.23Å; Y292-F318 HydrophobicContact CG-CE2 4.48Å; Y292-F318 AromaticContact CG-CZ 3.87Å; Y292-F318 HydrophobicContact CG-CZ 3.87Å; L299-F318 HydrophobicContact CB-CE1 4.28Å; L299-F318 HydrophobicContact CD1-CE1 3.55Å; L299-F318 HydrophobicContact CD1-CZ 3.87Å; L299-F318 HydrophobicContact CG-CE1 4.39Å; L306-F318 HydrophobicContact CD2-CE2 4.25Å; L306-F318 HydrophobicContact CD2-CZ 4.2Å; W314-F318 HydrophobicContact CB-CE2 4.09Å; W314-F318 WeakPolarHBondContact O-CD2 3.42Å; K315-F318 PolarHBondContact O-N 3.42Å; K315-F318 VanDerWaalsContact O-N 3.14Å; F318-P320 WeakPolarHBondContact O-CD 3.42Å
319I49.1Very low50.6Low87 Ų8783.4 Ų83.445%0.44644%0.438SS..  trans-83.2112.6-177.4-60.2162.3000108.9K315 L321K315-I319 HydrophobicContact CB-CD1 4.14Å; K315-I319 WeakPolarHBondContact O-CG1 3.44Å; K315-I319 PolarHBondContact O-N 2.96Å; I319-L321 VanDerWaalsContact C-N 3.33Å; I319-L321 HydrophobicContact CG2-CB 4.35Å; I319-L321 HydrophobicContact CG2-CD1 3.86Å; I319-L321 HydrophobicContact CG2-CG 3.67Å; I319-L321 PolarHBondContact O-N 3.16Å; I319-L321 VanDerWaalsContact O-N 3.12Å
320P42.2Very low48.4Very low88 Ų8891.4 Ų91.457%0.57148%0.475SS*.  trans-70.999.2153.230.3-28.3000105.8F318 T322F318-P320 WeakPolarHBondContact O-CD 3.42Å; P320-T322 PolarHBondContact O-N 3.47Å
321L33.9Very low46.2Very low96 Ų9699.9 Ų99.950%0.50351%0.511SS..  trans-73.180.9166-94133.2000106.3I319 I323I319-L321 VanDerWaalsContact C-N 3.33Å; I319-L321 HydrophobicContact CG2-CB 4.35Å; I319-L321 HydrophobicContact CG2-CD1 3.86Å; I319-L321 HydrophobicContact CG2-CG 3.67Å; I319-L321 PolarHBondContact O-N 3.16Å; I319-L321 VanDerWaalsContact O-N 3.12Å; L321-I323 PolarHBondContact O-N 2.89Å
322T30.1Very low44.1Very low123 Ų123104.4 Ų104.476%0.75554%0.544SS*.  trans-60.197.1152.730.80000105.6P320 P324P320-T322 PolarHBondContact O-N 3.47Å; T322-P324 WeakPolarHBondContact O-CD 3.34Å
323I31Very low41.9Very low107 Ų107111.8 Ų111.855%0.54958%0.582SS.*  trans-71.2108158.9-61.5167.7000104.3Y223 L321 N325Y223-I323 HydrophobicContact CE2-CD1 4.12Å; L321-I323 PolarHBondContact O-N 2.89Å; I323-N325 PolarHBondContact O-N 2.77Å
324P31.8Very low39.7Very low108 Ų108113.1 Ų113.170%0.70160%0.597SS**  trans-75.2106.7161.814.44.6000105.1T322T322-P324 WeakPolarHBondContact O-CD 3.34Å
325N29.2Very low37.5Very low119 Ų119119.9 Ų119.964%0.63663%0.632SS**  trans63.6107.4156.5-61-16.5000117.6I323 E327I323-N325 PolarHBondContact O-N 2.77Å; N325-E327 HydrophobicContact CB-CB 4.14Å; N325-E327 PolarHBondContact O-N 3.35Å
326L30.6Very low35.6Very low179 Ų179120.5 Ų120.594%0.93764%0.639SS**SBendtrans-6950.3140.3-16786.3000109.9
327E29.7Very low33.8Very low151 Ų151124.8 Ų124.871%0.70666%0.657SS**  trans-137.692.5167.2-75.5-175.9167.500106.2N325 I329N325-E327 HydrophobicContact CB-CB 4.14Å; N325-E327 PolarHBondContact O-N 3.35Å; E327-I329 PolarHBondContact O-N 3.21Å
328Q30.9Very low32.5Very low185 Ų185134 Ų13486%0.86472%0.719SS**  trans-35.5113.9134.6-109.2174-8.400106.8
329I34.1Very low31.2Very low138 Ų138138 Ų13871%0.70874%0.743SS**  -172.5115.766-81138.3000106.2E327E327-I329 PolarHBondContact O-N 3.21Å
330E27.9Very low30.3Very low176 Ų176140.6 Ų140.682%0.82276%0.758SS**  169.8112.6129.8-99.6168.1-175.200112.4
331K28.1Very low29.6Very low187 Ų187143.6 Ų143.681%0.81377%0.769SS**  trans41.5133.3150.6-67.2179.3-179.6172.50121.2
332P33.9Very low29.4Very low133 Ų133146.4 Ų146.486%0.86478%0.784SS**  trans-79.2133172.934.9-31000110.5
333I29.6Very low29.3Very low158 Ų158147.8 Ų147.881%0.8179%0.786SS**  trans-134.6122.7164.7-53.8172.8000102.9
334S26.8Very low29.2Very low90 Ų90150.5 Ų150.563%0.62980%0.802SS**  cis-171.6132.36.442.80000103.1
335I25.5Very low29Very low152 Ų152153.6 Ų153.678%0.77981%0.809SS**  46.3129.4106.3-58.4172.8000112.7
336M24Very low29Very low147 Ų147156.2 Ų156.272%0.72482%0.823SS**  cis175.2165.3-5.4-154.4-159.5-48.500105.3
337I22.9Very low28.9Very low140 Ų140154.3 Ų154.372%0.71881%0.813SS**  trans75128.7154.5-49.5146.7000114.9
338C33.3Very low28.8Very low195 Ų195154.6 Ų154.6100%1.31882%0.823SS**  cis-145.6031-131.30000109.3

Retrieved 338 of 338 residues in 63.3 ms (Link to these results)