A0A077YXG4_TRITR Loading...

Flp 18 GPCR receptor

AlphaFold DB , UniProt , Accession A0A077YXG4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 373 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
1M44.3Very low53.2Low239 Ų239163.5 Ų163.5100%1.17781%0.806SS**  096.60-81.8178.5-79.100106.9E3M1-E3 PolarHBondContact O-N 3.29Å
2Y45.6Very low56Low240 Ų240153.4 Ų153.494%0.94176%0.763SS**  trans-77.1106.8161.2-83.1-85000104.8E4Y2-E4 PolarHBondContact O-N 3Å
3E46.5Very low58.5Low178 Ų178144.2 Ų144.283%0.83272%0.72SS**  trans-60.6109.2171.8-141.5162.1-157.100105.5M1 Q5M1-E3 PolarHBondContact O-N 3.29Å; E3-Q5 PolarHBondContact O-N 3.38Å
4E49.7Very low60.8Low175 Ų175139.6 Ų139.682%0.81870%0.699SS**  trans-64.186.4174.7-156.3173.1-147.500105.3Y2 T6Y2-E4 PolarHBondContact O-N 3Å; E4-T6 PolarHBondContact O-N 3.15Å
5Q48.7Very low62.8Low167 Ų167132.8 Ų132.878%0.7866%0.662SS**  trans-60.292.9165.7-77.3-174.3-14.600104E3 V7E3-Q5 PolarHBondContact O-N 3.38Å; Q5-V7 PolarHBondContact O-N 2.96Å
6T48.3Very low64.6Low116 Ų116126.1 Ų126.171%0.71263%0.634SS**  trans-57.189.716032.70000104.3E4 K8E4-T6 PolarHBondContact O-N 3.15Å; T6-K8 PolarHBondContact O-N 3.16Å
7V51.3Low66Low116 Ų116124.2 Ų124.270%0.70362%0.623SS**  trans-55.1100.5165.5176.60000102.6Q5 V9Q5-V7 PolarHBondContact O-N 2.96Å; V7-V9 PolarHBondContact O-N 3.24Å
8K51.5Low67.4Low184 Ų184120.2 Ų120.280%0.860%0.601SS**  trans-57.2100.6168-81.9-178.4177.2176.20103.6T6 V10T6-K8 PolarHBondContact O-N 3.16Å; K8-V10 PolarHBondContact O-N 3.22Å
9V58.4Low68.6Low111 Ų111113.8 Ų113.867%0.67357%0.569SS**  trans-61.297.9169.4177.30000103.8V7 Q11V7-V9 PolarHBondContact O-N 3.24Å; V9-Q11 VanDerWaalsContact C-N 3.26Å; V9-Q11 HydrophobicContact CG1-CG 4.18Å; V9-Q11 PolarHBondContact O-N 3.19Å
10V62.4Low69.7Low112 Ų112113.3 Ų113.368%0.67956%0.56SS**  trans-66.694.6176178.40000105.5K8 C12K8-V10 PolarHBondContact O-N 3.22Å; V10-C12 WeakPolarHBondContact CG1-O 3.48Å; V10-C12 PolarHBondContact O-N 2.79Å
11Q78.3Confident70.7Confident160 Ų160114.5 Ų114.575%0.74857%0.565SS**  trans-71.9-20.2-176.9-76.6-177.6-14.300112.2V9V9-Q11 VanDerWaalsContact C-N 3.26Å; V9-Q11 HydrophobicContact CG1-CG 4.18Å; V9-Q11 PolarHBondContact O-N 3.19Å
12C87.2Confident72.9Confident43 Ų43107.7 Ų107.729%0.29153%0.532SS..EExtended strand (participates in β ladder)trans-153.3156.6-179.963.50000112.5V10 W186 C188V10-C12 WeakPolarHBondContact CG1-O 3.48Å; V10-C12 PolarHBondContact O-N 2.79Å; C12-W186 CarbonylContact C-O 3.53Å; C12-W186 WeakPolarHBondContact CA-O 3.46Å; C12-W186 VanDerWaalsContact CB-O 3.24Å; C12-W186 WeakPolarHBondContact CB-O 3.36Å; C12-C188 HydrophobicContact CB-CB 3.95Å; C12-C188 WeakPolarHBondContact CB-SG 2.82Å; C12-C188 PolarHBondContact O-SG 3.44Å; C12-C188 VanDerWaalsContact O-SG 3.38Å; C12-C188 WeakPolarHBondContact SG-CA 3.28Å; C12-C188 WeakPolarHBondContact SG-CB 3.37Å; C12-C188 CovalentContact SG-SG 2.04Å; C12-C188 PolarHBondContact SG-SG 3Å
13T88.1Confident75.1Confident33 Ų33100.4 Ų100.420%0.20250%0.504CS..EExtended strand (participates in β ladder)trans-95.9137.5176.8-54.70000110.6Y15 Y177 W186 Y187 C188T13-Y15 PolarHBondContact O-N 3.38Å; T13-Y177 HydrophobicContact CG2-CD2 4.45Å; T13-Y177 HydrophobicContact CG2-CG 4.48Å; T13-Y177 WeakPolarHBondContact OG1-CD1 3.49Å; T13-W186 PolarHBondContact N-O 2.9Å; T13-Y187 HydrophobicContact CG2-CD1 4.33Å; T13-Y187 HydrophobicContact CG2-CE1 4.3Å; T13-Y187 CarbonylContact O-C 3.47Å; T13-Y187 VanDerWaalsContact O-CA 3.24Å; T13-Y187 WeakPolarHBondContact O-CA 3.36Å; T13-C188 PolarHBondContact O-N 3.44Å
14D90.7Very high77.2Confident80 Ų8093.4 Ų93.443%0.42848%0.48SS..  trans-71.5117.4175.6-170.2-10000110.7A16 E17 F18D14-A16 VanDerWaalsContact C-N 3.28Å; D14-A16 PolarHBondContact O-N 3.13Å; D14-A16 WeakPolarHBondContact OD1-CB 3.21Å; D14-A16 PolarHBondContact OD1-N 2.98Å; D14-E17 HydrophobicContact CB-CB 4.14Å; D14-E17 PolarHBondContact O-N 3.26Å; D14-F18 PolarHBondContact O-N 3.21Å
15Y91.9Very high79.2Confident38 Ų3885.3 Ų85.315%0.14944%0.442CS..Hα-helixtrans-68.4-28.1178.6-173-86.4000112.5T13 E17 F18 A19 K97 Y187 F191 Y310T13-Y15 PolarHBondContact O-N 3.38Å; Y15-E17 VanDerWaalsContact C-N 3.3Å; Y15-E17 PolarHBondContact O-N 3.36Å; Y15-F18 HydrophobicContact CD2-CD1 4.29Å; Y15-F18 HydrophobicContact CE2-CD1 4.14Å; Y15-F18 HydrophobicContact CE2-CE1 4.41Å; Y15-F18 PolarHBondContact O-N 3.36Å; Y15-A19 HydrophobicContact CD1-CB 4.48Å; Y15-A19 HydrophobicContact CE1-CB 4.35Å; Y15-A19 VanDerWaalsContact O-CB 3.31Å; Y15-A19 WeakPolarHBondContact O-CB 3.25Å; Y15-A19 PolarHBondContact O-N 2.96Å; Y15-K97 HydrophobicContact CD1-CB 3.86Å; Y15-K97 HydrophobicContact CD1-CG 4.46Å; Y15-K97 HydrophobicContact CE1-CB 4.47Å; Y15-Y187 AromaticContact CD2-CD1 3.73Å; Y15-Y187 HydrophobicContact CD2-CD1 3.73Å; Y15-Y187 AromaticContact CD2-CD2 3.83Å; Y15-Y187 HydrophobicContact CD2-CD2 3.83Å; Y15-Y187 AromaticContact CD2-CE1 3.81Å; Y15-Y187 HydrophobicContact CD2-CE1 3.81Å; Y15-Y187 AromaticContact CD2-CE2 3.89Å; Y15-Y187 HydrophobicContact CD2-CE2 3.89Å; Y15-Y187 AromaticContact CD2-CG 3.72Å; Y15-Y187 HydrophobicContact CD2-CG 3.72Å; Y15-Y187 AromaticContact CD2-CZ 3.86Å; Y15-Y187 HydrophobicContact CE2-CD2 4.46Å; Y15-Y187 HydrophobicContact CE2-CE2 4.24Å; Y15-Y187 HydrophobicContact CG-CD1 4.24Å; Y15-Y187 HydrophobicContact CG-CG 4.41Å; Y15-F191 AromaticContact CD1-CE1 3.93Å; Y15-F191 HydrophobicContact CD1-CE1 3.93Å; Y15-F191 HydrophobicContact CD1-CZ 4.18Å; Y15-F191 AromaticContact CD2-CE1 3.97Å; Y15-F191 HydrophobicContact CD2-CE1 3.97Å; Y15-F191 AromaticContact CD2-CZ 3.65Å; Y15-F191 HydrophobicContact CD2-CZ 3.65Å; Y15-F191 HydrophobicContact CE1-CE1 4.1Å; Y15-F191 HydrophobicContact CE2-CE1 4.16Å; Y15-F191 HydrophobicContact CE2-CZ 4.22Å; Y15-F191 AromaticContact CG-CE1 3.84Å; Y15-F191 HydrophobicContact CG-CE1 3.84Å; Y15-F191 AromaticContact CG-CZ 3.62Å; Y15-F191 HydrophobicContact CG-CZ 3.62Å; Y15-Y310 WeakPolarHBondContact CE1-OH 3.45Å; Y15-Y310 PolarHBondContact OH-OH 3.36Å
16A90.9Very high81.4Confident26 Ų2680.7 Ų80.722%0.21542%0.422CS..Hα-helixtrans-68.4-32.4176.700000111.9D14 Y20 K97D14-A16 VanDerWaalsContact C-N 3.28Å; D14-A16 PolarHBondContact O-N 3.13Å; D14-A16 WeakPolarHBondContact OD1-CB 3.21Å; D14-A16 PolarHBondContact OD1-N 2.98Å; A16-Y20 PolarHBondContact O-N 3.33Å; A16-K97 HydrophobicContact CB-CB 4.36Å; A16-K97 HydrophobicContact CB-CG 4.13Å
17E89Confident83.6Confident94 Ų9475.3 Ų75.344%0.43939%0.389SS..Hα-helixtrans-68.9-48.7172.8-173.2164.5-14300110.8D14 Y15 A19 Y20 E21D14-E17 HydrophobicContact CB-CB 4.14Å; D14-E17 PolarHBondContact O-N 3.26Å; Y15-E17 VanDerWaalsContact C-N 3.3Å; Y15-E17 PolarHBondContact O-N 3.36Å; E17-A19 PolarHBondContact O-N 2.68Å; E17-Y20 WeakPolarHBondContact O-CB 3.42Å; E17-Y20 PolarHBondContact O-N 3.4Å; E17-Y20 VanDerWaalsContact O-N 3.11Å; E17-E21 PolarHBondContact O-N 2.76Å
18F90.3Very high85.4Confident51 Ų5174.8 Ų74.822%0.22437%0.374CS..Hα-helixtrans-55.3-47.4173.2171.4-96.3000112.8D14 Y15 Y20 E21 I22 Y177 Y187D14-F18 PolarHBondContact O-N 3.21Å; Y15-F18 HydrophobicContact CD2-CD1 4.29Å; Y15-F18 HydrophobicContact CE2-CD1 4.14Å; Y15-F18 HydrophobicContact CE2-CE1 4.41Å; Y15-F18 PolarHBondContact O-N 3.36Å; F18-Y20 PolarHBondContact O-N 3.31Å; F18-E21 PolarHBondContact O-N 2.96Å; F18-I22 HydrophobicContact CD1-CG1 4.44Å; F18-I22 HydrophobicContact CD2-CG1 3.92Å; F18-I22 HydrophobicContact CE1-CG1 4.06Å; F18-I22 HydrophobicContact CE2-CD1 4Å; F18-I22 HydrophobicContact CE2-CG1 3.51Å; F18-I22 HydrophobicContact CG-CG1 4.38Å; F18-I22 HydrophobicContact CZ-CD1 4.34Å; F18-I22 HydrophobicContact CZ-CG1 3.59Å; F18-I22 WeakPolarHBondContact O-CG1 3.27Å; F18-I22 PolarHBondContact O-N 2.86Å; F18-Y177 HydrophobicContact CD2-CE2 4.47Å; F18-Y187 HydrophobicContact CB-CE1 3.87Å; F18-Y187 HydrophobicContact CD1-CE1 4.24Å; F18-Y187 WeakPolarHBondContact CD1-OH 3.4Å; F18-Y187 HydrophobicContact CD2-CE1 4.39Å; F18-Y187 WeakPolarHBondContact CD2-OH 3.23Å; F18-Y187 WeakPolarHBondContact CE1-OH 3.39Å; F18-Y187 WeakPolarHBondContact CE2-OH 3.36Å; F18-Y187 AromaticContact CG-CE1 3.91Å; F18-Y187 HydrophobicContact CG-CE1 3.91Å; F18-Y187 WeakPolarHBondContact CG-OH 3.33Å; F18-Y187 WeakPolarHBondContact CZ-OH 3.45Å
19A89.8Confident87.4Confident0 Ų069.3 Ų69.30%035%0.352CS..Hα-helixtrans-61.4-34.517900000112.3Y15 E17 Y23 Y310Y15-A19 HydrophobicContact CD1-CB 4.48Å; Y15-A19 HydrophobicContact CE1-CB 4.35Å; Y15-A19 VanDerWaalsContact O-CB 3.31Å; Y15-A19 WeakPolarHBondContact O-CB 3.25Å; Y15-A19 PolarHBondContact O-N 2.96Å; E17-A19 PolarHBondContact O-N 2.68Å; A19-Y23 WeakPolarHBondContact O-CB 3.39Å; A19-Y23 WeakPolarHBondContact O-CD2 3.41Å; A19-Y23 PolarHBondContact O-N 2.91Å; A19-Y310 HydrophobicContact CB-CE2 3.84Å
20Y90.6Very high89.1Confident102 Ų10269.6 Ų69.640%0.435%0.354SS..Hα-helixtrans-70.2-42.4174.6177.6-98000112.1A16 E17 F18 G24 R28A16-Y20 PolarHBondContact O-N 3.33Å; E17-Y20 WeakPolarHBondContact O-CB 3.42Å; E17-Y20 PolarHBondContact O-N 3.4Å; E17-Y20 VanDerWaalsContact O-N 3.11Å; F18-Y20 PolarHBondContact O-N 3.31Å; Y20-G24 WeakPolarHBondContact O-CA 3.39Å; Y20-G24 PolarHBondContact O-N 2.86Å; Y20-R28 VanDerWaalsContact CB-NH1 3.35Å; Y20-R28 HydrophobicContact CD2-CB 4.35Å
21E91Very high90.7Very high139 Ų13971.7 Ų71.765%0.6535%0.35SS*.Hα-helixtrans-65.6-40.3178.6-70.5179.717000112.9E17 F18E17-E21 PolarHBondContact O-N 2.76Å; F18-E21 PolarHBondContact O-N 2.96Å
22I91.1Very high91.5Very high97 Ų9764.7 Ų64.750%0.49732%0.317SS..Hα-helixtrans-80.9-44.2-176.4-62.7-59.9000112.5F18F18-I22 HydrophobicContact CD1-CG1 4.44Å; F18-I22 HydrophobicContact CD2-CG1 3.92Å; F18-I22 HydrophobicContact CE1-CG1 4.06Å; F18-I22 HydrophobicContact CE2-CD1 4Å; F18-I22 HydrophobicContact CE2-CG1 3.51Å; F18-I22 HydrophobicContact CG-CG1 4.38Å; F18-I22 HydrophobicContact CZ-CD1 4.34Å; F18-I22 HydrophobicContact CZ-CG1 3.59Å; F18-I22 WeakPolarHBondContact O-CG1 3.27Å; F18-I22 PolarHBondContact O-N 2.86Å
23Y91.3Very high92Very high86 Ų8666.5 Ų66.534%0.33732%0.318SS..Hα-helixtrans-105.5-12.9-172.1-59.2-70.4000113.2A19 D25 D307 Q308 P309 Y310A19-Y23 WeakPolarHBondContact O-CB 3.39Å; A19-Y23 WeakPolarHBondContact O-CD2 3.41Å; A19-Y23 PolarHBondContact O-N 2.91Å; Y23-D25 VanDerWaalsContact C-N 3.3Å; Y23-D307 WeakPolarHBondContact CB-O 3.37Å; Y23-D307 VanDerWaalsContact O-O 3.13Å; Y23-Q308 PolarHBondContact O-NE2 3.48Å; Y23-P309 HydrophobicContact CD1-CG 4.1Å; Y23-P309 HydrophobicContact CD2-CG 4.39Å; Y23-P309 HydrophobicContact CE1-CG 4.21Å; Y23-P309 HydrophobicContact CE2-CG 4.49Å; Y23-P309 HydrophobicContact CG-CG 4.2Å; Y23-Y310 HydrophobicContact CD2-CE2 4.17Å; Y23-Y310 HydrophobicContact CE2-CE2 4.48Å
24G90.9Very high92.4Very high32 Ų3266.8 Ų66.833%0.3333%0.328SS..  trans60.243.5-16400000110.9Y20 L26 Q308Y20-G24 WeakPolarHBondContact O-CA 3.39Å; Y20-G24 PolarHBondContact O-N 2.86Å; G24-L26 PolarHBondContact O-N 2.93Å; G24-Q308 PolarHBondContact O-NE2 3.08Å
25D92.5Very high92.7Very high4 Ų467.1 Ų67.12%0.02133%0.329CS..  trans-54.3101.1-170.6177.417.6000113Y23 T27 R28 K97 Y310Y23-D25 VanDerWaalsContact C-N 3.3Å; D25-T27 PolarHBondContact O-N 3.3Å; D25-T27 VanDerWaalsContact O-N 3.12Å; D25-T27 VanDerWaalsContact OD1-CB 3.31Å; D25-T27 WeakPolarHBondContact OD1-CB 3.33Å; D25-T27 WeakPolarHBondContact OD1-CG2 3.38Å; D25-T27 PolarHBondContact OD1-N 3.13Å; D25-T27 PolarHBondContact OD1-OG1 2.94Å; D25-T27 PolarHBondContact OD2-OG1 2.78Å; D25-R28 VanDerWaalsContact O-CB 3.3Å; D25-R28 WeakPolarHBondContact O-CB 3.46Å; D25-R28 PolarHBondContact O-N 3.19Å; D25-R28 VanDerWaalsContact O-N 3.08Å; D25-K97 IonicContact OD1-NZ 2.96Å; D25-K97 WeakPolarHBondContact OD2-CE 3.38Å; D25-K97 IonicContact OD2-NZ 3.37Å; D25-K97 PolarHBondContact OD2-NZ 2.97Å; D25-Y310 HydrophobicContact CB-CD2 4.34Å
26L93.6Very high93Very high71 Ų7166.2 Ų66.237%0.37233%0.325SS..G310 helixtrans-64.3-18-179-69.6176000112.7G24 R28 E29 I32 L311G24-L26 PolarHBondContact O-N 2.93Å; L26-R28 PolarHBondContact O-N 3.45Å; L26-R28 VanDerWaalsContact O-N 3.17Å; L26-E29 VanDerWaalsContact O-CB 3.31Å; L26-E29 WeakPolarHBondContact O-CB 3.4Å; L26-E29 PolarHBondContact O-N 3.49Å; L26-E29 VanDerWaalsContact O-N 3.1Å; L26-I32 HydrophobicContact CB-CD1 3.73Å; L26-I32 VanDerWaalsContact O-CD1 3.23Å; L26-I32 WeakPolarHBondContact O-CD1 3.43Å; L26-L311 HydrophobicContact CB-CD2 4.11Å; L26-L311 HydrophobicContact CD1-CD2 3.8Å
27T93.6Very high93.4Very high2 Ų269.3 Ų69.31%0.01234%0.337CS..G310 helixtrans-70.1-8.6175.871.80000113.1D25 R33 K97 L311 L314D25-T27 PolarHBondContact O-N 3.3Å; D25-T27 VanDerWaalsContact O-N 3.12Å; D25-T27 VanDerWaalsContact OD1-CB 3.31Å; D25-T27 WeakPolarHBondContact OD1-CB 3.33Å; D25-T27 WeakPolarHBondContact OD1-CG2 3.38Å; D25-T27 PolarHBondContact OD1-N 3.13Å; D25-T27 PolarHBondContact OD1-OG1 2.94Å; D25-T27 PolarHBondContact OD2-OG1 2.78Å; T27-R33 VanDerWaalsContact O-CD 3.25Å; T27-R33 WeakPolarHBondContact O-CD 3.35Å; T27-R33 WeakPolarHBondContact O-CG 3.44Å; T27-K97 PolarHBondContact OG1-NZ 2.99Å; T27-L311 HydrophobicContact CG2-CB 3.89Å; T27-L311 HydrophobicContact CG2-CD1 4.23Å; T27-L314 HydrophobicContact CG2-CD1 3.77Å
28R90.7Very high93.8Very high105 Ų10571.4 Ų71.440%0.39635%0.345SS..G310 helixtrans-73-29.4170.2-168.8175.1-179.4171.72.3112.2Y20 D25 L26 T30Y20-R28 VanDerWaalsContact CB-NH1 3.35Å; Y20-R28 HydrophobicContact CD2-CB 4.35Å; D25-R28 VanDerWaalsContact O-CB 3.3Å; D25-R28 WeakPolarHBondContact O-CB 3.46Å; D25-R28 PolarHBondContact O-N 3.19Å; D25-R28 VanDerWaalsContact O-N 3.08Å; L26-R28 PolarHBondContact O-N 3.45Å; L26-R28 VanDerWaalsContact O-N 3.17Å; R28-T30 PolarHBondContact O-N 3.44Å
29E93.6Very high94.2Very high69 Ų6971.8 Ų71.832%0.32235%0.349SS..SBendtrans-60.5129.3-178.5-65.7-58.8139.800111.9L26 W31 I32 R33L26-E29 VanDerWaalsContact O-CB 3.31Å; L26-E29 WeakPolarHBondContact O-CB 3.4Å; L26-E29 PolarHBondContact O-N 3.49Å; L26-E29 VanDerWaalsContact O-N 3.1Å; E29-W31 VanDerWaalsContact C-N 3.31Å; E29-W31 PolarHBondContact O-N 3.01Å; E29-I32 HydrophobicContact CB-CB 4.18Å; E29-I32 HydrophobicContact CB-CD1 4.06Å; E29-I32 HydrophobicContact CB-CG1 4.09Å; E29-I32 HydrophobicContact CG-CD1 4.36Å; E29-I32 PolarHBondContact O-N 3.04Å; E29-R33 WeakPolarHBondContact O-CG 3.49Å; E29-R33 PolarHBondContact O-N 3.45Å
30T93.9Very high94.6Very high117 Ų11772.2 Ų72.272%0.71835%0.351SS*.Hα-helixtrans-62.2-38.5-172.953.20000112.6R28 R33 G34R28-T30 PolarHBondContact O-N 3.44Å; T30-R33 PolarHBondContact O-N 3.28Å; T30-G34 PolarHBondContact O-N 3.5Å
31W95.5Very high94.9Very high157 Ų15771.6 Ų71.660%0.59536%0.358SS*.Hα-helixtrans-69.6-39.217966.4-90.1000111.9E29 G34 I35E29-W31 VanDerWaalsContact C-N 3.31Å; E29-W31 PolarHBondContact O-N 3.01Å; W31-G34 PolarHBondContact O-N 3.01Å; W31-I35 HydrophobicContact CE3-CD1 3.69Å; W31-I35 HydrophobicContact CZ3-CD1 3.9Å; W31-I35 WeakPolarHBondContact O-CG1 3.35Å; W31-I35 PolarHBondContact O-N 3.34Å
32I95.7Very high95.3Very high13 Ų1368.8 Ų68.87%0.06735%0.346CS..Hα-helixtrans-62.8-46.2174.4-68.5179.4000110.1L26 E29 G34 I35 F36 L311L26-I32 HydrophobicContact CB-CD1 3.73Å; L26-I32 VanDerWaalsContact O-CD1 3.23Å; L26-I32 WeakPolarHBondContact O-CD1 3.43Å; E29-I32 HydrophobicContact CB-CB 4.18Å; E29-I32 HydrophobicContact CB-CD1 4.06Å; E29-I32 HydrophobicContact CB-CG1 4.09Å; E29-I32 HydrophobicContact CG-CD1 4.36Å; E29-I32 PolarHBondContact O-N 3.04Å; I32-G34 VanDerWaalsContact C-N 3.32Å; I32-G34 PolarHBondContact O-N 3.27Å; I32-I35 PolarHBondContact O-N 3.44Å; I32-F36 HydrophobicContact CG2-CD2 3.8Å; I32-F36 HydrophobicContact CG2-CE2 3.82Å; I32-F36 WeakPolarHBondContact O-CD2 3.44Å; I32-F36 PolarHBondContact O-N 2.96Å; I32-F36 VanDerWaalsContact O-N 3.07Å; I32-L311 HydrophobicContact CG2-CD1 4.24Å
33R96.2Very high95.6Very high80 Ų8064.3 Ų64.330%0.30232%0.323SS..Hα-helixtrans-58.9-45.3175.4-65.6173.495.5171.711.8111.1T27 E29 T30 I35 F36 I37 M95T27-R33 VanDerWaalsContact O-CD 3.25Å; T27-R33 WeakPolarHBondContact O-CD 3.35Å; T27-R33 WeakPolarHBondContact O-CG 3.44Å; E29-R33 WeakPolarHBondContact O-CG 3.49Å; E29-R33 PolarHBondContact O-N 3.45Å; T30-R33 PolarHBondContact O-N 3.28Å; R33-I35 PolarHBondContact O-N 3.48Å; R33-F36 PolarHBondContact O-N 3.1Å; R33-I37 HydrophobicContact CB-CD1 4.48Å; R33-I37 WeakPolarHBondContact O-CB 3.24Å; R33-I37 WeakPolarHBondContact O-CD1 3.43Å; R33-I37 WeakPolarHBondContact O-CG1 3.29Å; R33-I37 PolarHBondContact O-N 3.48Å; R33-M95 HydrophobicContact CB-SD 4.29Å; R33-M95 HydrophobicContact CG-SD 4.24Å; R33-M95 PolarHBondContact NH2-O 3.48Å
34G97.3Very high96Very high40 Ų4064 Ų6441%0.41232%0.324SS..Hα-helixtrans-56.5-45.5176.800000112.9T30 W31 I32 F38T30-G34 PolarHBondContact O-N 3.5Å; W31-G34 PolarHBondContact O-N 3.01Å; I32-G34 VanDerWaalsContact C-N 3.32Å; I32-G34 PolarHBondContact O-N 3.27Å; G34-F38 WeakPolarHBondContact O-CB 3.48Å; G34-F38 PolarHBondContact O-N 2.88Å
35I97.7Very high96.3Very high86 Ų8664.9 Ų64.944%0.44133%0.327SS..Hα-helixtrans-61.4-51.7177.2-69.1168.3000111W31 I32 R33 F38 I39W31-I35 HydrophobicContact CE3-CD1 3.69Å; W31-I35 HydrophobicContact CZ3-CD1 3.9Å; W31-I35 WeakPolarHBondContact O-CG1 3.35Å; W31-I35 PolarHBondContact O-N 3.34Å; I32-I35 PolarHBondContact O-N 3.44Å; R33-I35 PolarHBondContact O-N 3.48Å; I35-F38 PolarHBondContact O-N 3Å; I35-I39 HydrophobicContact CG2-CD1 3.79Å; I35-I39 WeakPolarHBondContact O-CG1 3.21Å; I35-I39 PolarHBondContact O-N 2.96Å
36F98Very high96.5Very high19 Ų1967 Ų678%0.08335%0.345CS..Hα-helixtrans-64-44-179.6-83.7-71.1000112.1I32 R33 F38 I39 Y40 M95 L311 L314 I315 C318I32-F36 HydrophobicContact CG2-CD2 3.8Å; I32-F36 HydrophobicContact CG2-CE2 3.82Å; I32-F36 WeakPolarHBondContact O-CD2 3.44Å; I32-F36 PolarHBondContact O-N 2.96Å; I32-F36 VanDerWaalsContact O-N 3.07Å; R33-F36 PolarHBondContact O-N 3.1Å; F36-F38 VanDerWaalsContact C-N 3.3Å; F36-F38 PolarHBondContact O-N 2.99Å; F36-I39 PolarHBondContact O-N 2.99Å; F36-Y40 HydrophobicContact CB-CD2 4.27Å; F36-Y40 HydrophobicContact CB-CE2 4.28Å; F36-Y40 AromaticContact CD1-CE2 3.86Å; F36-Y40 HydrophobicContact CD1-CE2 3.86Å; F36-Y40 HydrophobicContact CG-CE2 4.49Å; F36-Y40 WeakPolarHBondContact O-CD2 3.36Å; F36-Y40 PolarHBondContact O-N 3.19Å; F36-M95 HydrophobicContact CB-CE 3.41Å; F36-M95 VanDerWaalsContact CB-CE 3.41Å; F36-M95 HydrophobicContact CG-CE 4.32Å; F36-L311 HydrophobicContact CE2-CD1 3.83Å; F36-L311 HydrophobicContact CZ-CD1 4.22Å; F36-L314 HydrophobicContact CD1-CB 4.34Å; F36-L314 HydrophobicContact CD2-CD1 4.26Å; F36-L314 HydrophobicContact CE1-CB 3.87Å; F36-L314 HydrophobicContact CE2-CB 4.31Å; F36-L314 HydrophobicContact CE2-CD1 4.4Å; F36-L314 HydrophobicContact CG-CD1 4.47Å; F36-L314 HydrophobicContact CZ-CB 3.86Å; F36-I315 HydrophobicContact CE1-CG1 4.49Å; F36-I315 HydrophobicContact CZ-CG1 3.81Å; F36-C318 HydrophobicContact CD1-CB 4.49Å; F36-C318 HydrophobicContact CE1-CB 4.18Å
37I97.9Very high96.7Very high91 Ų9163.6 Ų63.647%0.46733%0.328SS..Hα-helixtrans-56.1-47.9176.4-71.8166.1000110R33 I39 Y40 V41 M95R33-I37 HydrophobicContact CB-CD1 4.48Å; R33-I37 WeakPolarHBondContact O-CB 3.24Å; R33-I37 WeakPolarHBondContact O-CD1 3.43Å; R33-I37 WeakPolarHBondContact O-CG1 3.29Å; R33-I37 PolarHBondContact O-N 3.48Å; I37-I39 PolarHBondContact O-N 2.97Å; I37-Y40 PolarHBondContact O-N 3.37Å; I37-V41 HydrophobicContact CG2-CG2 4.32Å; I37-V41 WeakPolarHBondContact O-CB 3.33Å; I37-V41 VanDerWaalsContact O-CG2 3.24Å; I37-V41 WeakPolarHBondContact O-CG2 3.32Å; I37-V41 PolarHBondContact O-N 3.47Å; I37-M95 HydrophobicContact CD1-SD 4.34Å; I37-M95 HydrophobicContact CG1-CE 4.18Å; I37-M95 HydrophobicContact CG1-SD 4.12Å
38F98.1Very high96.9Very high138 Ų13865.3 Ų65.361%0.60534%0.337SS*.Hα-helixtrans-57.8-46.5177.7178.5-104.5000112.1G34 I35 F36 V41 I42G34-F38 WeakPolarHBondContact O-CB 3.48Å; G34-F38 PolarHBondContact O-N 2.88Å; I35-F38 PolarHBondContact O-N 3Å; F36-F38 VanDerWaalsContact C-N 3.3Å; F36-F38 PolarHBondContact O-N 2.99Å; F38-V41 PolarHBondContact O-N 3.38Å; F38-I42 HydrophobicContact CD1-CD1 3.95Å; F38-I42 HydrophobicContact CE1-CD1 3.44Å; F38-I42 VanDerWaalsContact CE1-CD1 3.44Å; F38-I42 HydrophobicContact CE2-CD1 4.15Å; F38-I42 HydrophobicContact CZ-CD1 3.56Å; F38-I42 WeakPolarHBondContact O-CG1 3.43Å; F38-I42 PolarHBondContact O-N 2.94Å; F38-I42 VanDerWaalsContact O-N 3.12Å
39I98.3Very high97.2Very high59 Ų5963.6 Ų63.630%0.30334%0.338SS..Hα-helixtrans-64.3-48178.5-64.6165.8000111.4I35 F36 I37 V41 I42 I43 C318I35-I39 HydrophobicContact CG2-CD1 3.79Å; I35-I39 WeakPolarHBondContact O-CG1 3.21Å; I35-I39 PolarHBondContact O-N 2.96Å; F36-I39 PolarHBondContact O-N 2.99Å; I37-I39 PolarHBondContact O-N 2.97Å; I39-V41 VanDerWaalsContact C-N 3.31Å; I39-V41 PolarHBondContact O-N 3.08Å; I39-I42 WeakPolarHBondContact O-CB 3.47Å; I39-I42 PolarHBondContact O-N 3.3Å; I39-I42 VanDerWaalsContact O-N 3.16Å; I39-I43 HydrophobicContact CG2-CD1 3.78Å; I39-I43 HydrophobicContact CG2-CG1 4.31Å; I39-I43 WeakPolarHBondContact O-CG1 3.27Å; I39-I43 PolarHBondContact O-N 2.97Å; I39-C318 WeakPolarHBondContact CG2-SG 3.17Å
40Y98.5Very high97.3Very high10 Ų1060.8 Ų60.84%0.03933%0.328CS..Hα-helixtrans-64.4-34.3179.5-78.4-70.4000112.4F36 I37 I43 F44 V87 P91 L314 H317 C318 M321F36-Y40 HydrophobicContact CB-CD2 4.27Å; F36-Y40 HydrophobicContact CB-CE2 4.28Å; F36-Y40 AromaticContact CD1-CE2 3.86Å; F36-Y40 HydrophobicContact CD1-CE2 3.86Å; F36-Y40 HydrophobicContact CG-CE2 4.49Å; F36-Y40 WeakPolarHBondContact O-CD2 3.36Å; F36-Y40 PolarHBondContact O-N 3.19Å; I37-Y40 PolarHBondContact O-N 3.37Å; Y40-I43 HydrophobicContact CD1-CD1 4.48Å; Y40-I43 PolarHBondContact O-N 2.77Å; Y40-F44 VanDerWaalsContact O-CB 3.28Å; Y40-F44 WeakPolarHBondContact O-CB 3.43Å; Y40-F44 PolarHBondContact O-N 2.95Å; Y40-V87 HydrophobicContact CD1-CG1 4.07Å; Y40-V87 WeakPolarHBondContact CD1-O 3.42Å; Y40-V87 WeakPolarHBondContact O-CG1 3.26Å; Y40-P91 HydrophobicContact CD1-CG 4.03Å; Y40-P91 HydrophobicContact CD2-CB 3.68Å; Y40-P91 HydrophobicContact CD2-CG 3.78Å; Y40-P91 HydrophobicContact CE1-CG 4.16Å; Y40-P91 HydrophobicContact CE2-CB 3.59Å; Y40-P91 HydrophobicContact CE2-CG 3.95Å; Y40-P91 HydrophobicContact CG-CB 4.29Å; Y40-P91 HydrophobicContact CG-CG 3.86Å; Y40-L314 HydrophobicContact CE2-CD2 4.4Å; Y40-L314 PolarHBondContact OH-O 2.82Å; Y40-H317 AromaticContact CE1-CD2 3.88Å; Y40-H317 AromaticContact CZ-CD2 3.94Å; Y40-H317 PolarHBondContact OH-CD2 3.46Å; Y40-H317 VanDerWaalsContact OH-CD2 3.26Å; Y40-C318 HydrophobicContact CE1-CB 4.49Å; Y40-C318 HydrophobicContact CE2-CB 4.44Å; Y40-C318 WeakPolarHBondContact OH-CA 3.31Å; Y40-C318 WeakPolarHBondContact OH-CB 3.39Å; Y40-C318 PolarHBondContact OH-N 2.81Å; Y40-M321 HydrophobicContact CE1-CB 4.49Å; Y40-M321 HydrophobicContact CE1-CG 4.1Å
41V98.4Very high97.5Very high89 Ų8955.2 Ų55.254%0.53929%0.293SS..Hα-helixtrans-63.4-42.4173167.30000111.1I37 F38 I39 F44 A45I37-V41 HydrophobicContact CG2-CG2 4.32Å; I37-V41 WeakPolarHBondContact O-CB 3.33Å; I37-V41 VanDerWaalsContact O-CG2 3.24Å; I37-V41 WeakPolarHBondContact O-CG2 3.32Å; I37-V41 PolarHBondContact O-N 3.47Å; F38-V41 PolarHBondContact O-N 3.38Å; I39-V41 VanDerWaalsContact C-N 3.31Å; I39-V41 PolarHBondContact O-N 3.08Å; V41-F44 PolarHBondContact O-N 3.37Å; V41-A45 WeakPolarHBondContact O-CB 3.23Å; V41-A45 PolarHBondContact O-N 3.42Å
42I98.2Very high97.6Very high80 Ų8049.7 Ų49.741%0.4128%0.278SS..Hα-helixtrans-62.5-48.4174.4-69.8170.1000110.5F38 I39 F44 A45 A46F38-I42 HydrophobicContact CD1-CD1 3.95Å; F38-I42 HydrophobicContact CE1-CD1 3.44Å; F38-I42 VanDerWaalsContact CE1-CD1 3.44Å; F38-I42 HydrophobicContact CE2-CD1 4.15Å; F38-I42 HydrophobicContact CZ-CD1 3.56Å; F38-I42 WeakPolarHBondContact O-CG1 3.43Å; F38-I42 PolarHBondContact O-N 2.94Å; F38-I42 VanDerWaalsContact O-N 3.12Å; I39-I42 WeakPolarHBondContact O-CB 3.47Å; I39-I42 PolarHBondContact O-N 3.3Å; I39-I42 VanDerWaalsContact O-N 3.16Å; I42-F44 VanDerWaalsContact C-N 3.31Å; I42-F44 PolarHBondContact O-N 2.95Å; I42-A45 PolarHBondContact O-N 3.36Å; I42-A46 WeakPolarHBondContact O-CB 3.24Å; I42-A46 PolarHBondContact O-N 3.39Å
43I98.4Very high97.6Very high3 Ų349.3 Ų49.32%0.01528%0.277CS..Hα-helixtrans-58.4-46.2179.2-65.7168.5000110.1I39 Y40 G47 V87 M321 T322 L325I39-I43 HydrophobicContact CG2-CD1 3.78Å; I39-I43 HydrophobicContact CG2-CG1 4.31Å; I39-I43 WeakPolarHBondContact O-CG1 3.27Å; I39-I43 PolarHBondContact O-N 2.97Å; Y40-I43 HydrophobicContact CD1-CD1 4.48Å; Y40-I43 PolarHBondContact O-N 2.77Å; I43-G47 WeakPolarHBondContact O-CA 3.32Å; I43-G47 PolarHBondContact O-N 3.19Å; I43-V87 HydrophobicContact CB-CG1 4.32Å; I43-V87 HydrophobicContact CG2-CG1 4.11Å; I43-V87 HydrophobicContact CG2-CG2 3.88Å; I43-M321 HydrophobicContact CD1-CB 4.24Å; I43-M321 HydrophobicContact CG2-CB 4.21Å; I43-T322 HydrophobicContact CD1-CG2 4.02Å; I43-L325 HydrophobicContact CG1-CD1 4.09Å; I43-L325 HydrophobicContact CG2-CD2 4.42Å; I43-L325 HydrophobicContact CG2-CG 4.49Å; I43-L325 WeakPolarHBondContact O-CD2 3.45Å
44F98.6Very high97.5Very high80 Ų8045.5 Ų45.535%0.35126%0.263SS..Hα-helixtrans-59.3-55.9178.4-176-92.3000111.7Y40 V41 I42 G47 I48 C83 L84 V87Y40-F44 VanDerWaalsContact O-CB 3.28Å; Y40-F44 WeakPolarHBondContact O-CB 3.43Å; Y40-F44 PolarHBondContact O-N 2.95Å; V41-F44 PolarHBondContact O-N 3.37Å; I42-F44 VanDerWaalsContact C-N 3.31Å; I42-F44 PolarHBondContact O-N 2.95Å; F44-G47 PolarHBondContact O-N 3.47Å; F44-I48 HydrophobicContact CE1-CG1 4.33Å; F44-I48 HydrophobicContact CE2-CG1 4.33Å; F44-I48 HydrophobicContact CZ-CG1 4.21Å; F44-I48 WeakPolarHBondContact O-CB 3.42Å; F44-I48 VanDerWaalsContact O-CG1 3.28Å; F44-I48 WeakPolarHBondContact O-CG1 3.47Å; F44-I48 PolarHBondContact O-N 3.22Å; F44-C83 WeakPolarHBondContact CD2-O 3.38Å; F44-C83 VanDerWaalsContact CE2-O 3.24Å; F44-C83 WeakPolarHBondContact CE2-O 2.89Å; F44-L84 HydrophobicContact CE2-CD2 4.33Å; F44-L84 HydrophobicContact CZ-CD2 4.31Å; F44-V87 HydrophobicContact CB-CG1 3.78Å; F44-V87 HydrophobicContact CD2-CG1 4.28Å
45A97.9Very high97.5Very high49 Ų4945.8 Ų45.841%0.40525%0.254SS..Hα-helixtrans-64.5-46-17500000112V41 I42 T49V41-A45 WeakPolarHBondContact O-CB 3.23Å; V41-A45 PolarHBondContact O-N 3.42Å; I42-A45 PolarHBondContact O-N 3.36Å; A45-T49 WeakPolarHBondContact O-CB 3.28Å; A45-T49 PolarHBondContact O-N 2.97Å; A45-T49 VanDerWaalsContact O-N 3.09Å; A45-T49 PolarHBondContact O-OG1 3.34Å
46A96.9Very high97.4Very high48 Ų4844.5 Ų44.540%0.39725%0.248SC..Hα-helixtrans-71.4-37.9179.800000112.1I42 G50 L325I42-A46 WeakPolarHBondContact O-CB 3.24Å; I42-A46 PolarHBondContact O-N 3.39Å; A46-G50 WeakPolarHBondContact O-CA 3.11Å; A46-G50 PolarHBondContact O-N 2.96Å; A46-L325 HydrophobicContact CB-CD2 3.7Å
47G97.9Very high97.3Very high0 Ų043.7 Ų43.70%024%0.244CC..Hα-helixtrans-66-49.7178.600000112.1I43 F44 N51 L325I43-G47 WeakPolarHBondContact O-CA 3.32Å; I43-G47 PolarHBondContact O-N 3.19Å; F44-G47 PolarHBondContact O-N 3.47Å; G47-N51 WeakPolarHBondContact O-CB 3.41Å; G47-N51 PolarHBondContact O-N 3.29Å; G47-N51 PolarHBondContact O-ND2 3Å; G47-L325 VanDerWaalsContact N-CD2 3.26Å
48I98Very high97.1Very high39 Ų3939.6 Ų39.620%0.222%0.224CC..Hα-helixtrans-61.8-48.5176.2-67-64.5000110.6F44 S52 I80 C83 L84F44-I48 HydrophobicContact CE1-CG1 4.33Å; F44-I48 HydrophobicContact CE2-CG1 4.33Å; F44-I48 HydrophobicContact CZ-CG1 4.21Å; F44-I48 WeakPolarHBondContact O-CB 3.42Å; F44-I48 VanDerWaalsContact O-CG1 3.28Å; F44-I48 WeakPolarHBondContact O-CG1 3.47Å; F44-I48 PolarHBondContact O-N 3.22Å; I48-S52 WeakPolarHBondContact O-CB 3.44Å; I48-S52 PolarHBondContact O-N 3.07Å; I48-S52 PolarHBondContact O-OG 2.86Å; I48-I80 HydrophobicContact CD1-CG2 4.11Å; I48-C83 HydrophobicContact CD1-CB 3.47Å; I48-C83 VanDerWaalsContact CD1-CB 3.47Å; I48-C83 HydrophobicContact CG1-CB 3.84Å; I48-L84 HydrophobicContact CD1-CD2 3.75Å; I48-L84 HydrophobicContact CD1-CG 3.81Å
49T96.2Very high97Very high68 Ų6836.2 Ų36.242%0.41722%0.221SC..Hα-helixtrans-65.4-48.9-176.6-60.50000111.2A45 C53 L346A45-T49 WeakPolarHBondContact O-CB 3.28Å; A45-T49 PolarHBondContact O-N 2.97Å; A45-T49 VanDerWaalsContact O-N 3.09Å; A45-T49 PolarHBondContact O-OG1 3.34Å; T49-C53 WeakPolarHBondContact O-CB 3.48Å; T49-C53 PolarHBondContact O-N 2.94Å; T49-C53 PolarHBondContact O-SG 3.47Å; T49-L346 HydrophobicContact CG2-CD1 4.17Å
50G96Very high96.8Very high11 Ų1142.3 Ų42.311%0.11324%0.24CC..Hα-helixtrans-61.9-50.7-177.800000112.2A46 C53 V54A46-G50 WeakPolarHBondContact O-CA 3.11Å; A46-G50 PolarHBondContact O-N 2.96Å; G50-C53 WeakPolarHBondContact O-CB 3.39Å; G50-C53 PolarHBondContact O-N 3.32Å; G50-V54 WeakPolarHBondContact O-CG2 3.48Å; G50-V54 PolarHBondContact O-N 3.43Å
51N97.8Very high96.5Very high0 Ų043.8 Ų43.80%025%0.247CC..Hα-helixtrans-68.8-37.3-179.1-71.9-64.2000112.1G47 C53 V54 I55 I80 T324 P328G47-N51 WeakPolarHBondContact O-CB 3.41Å; G47-N51 PolarHBondContact O-N 3.29Å; G47-N51 PolarHBondContact O-ND2 3Å; N51-C53 VanDerWaalsContact C-N 3.32Å; N51-C53 PolarHBondContact O-N 3.45Å; N51-V54 WeakPolarHBondContact O-CB 3.33Å; N51-V54 PolarHBondContact O-N 3.33Å; N51-I55 WeakPolarHBondContact O-CG1 3.46Å; N51-I55 PolarHBondContact O-N 2.77Å; N51-I55 VanDerWaalsContact O-N 3.08Å; N51-I80 HydrophobicContact CB-CD1 4.02Å; N51-I80 HydrophobicContact CB-CG1 3.67Å; N51-T324 PolarHBondContact ND2-O 2.89Å; N51-P328 WeakPolarHBondContact OD1-CG 3.48Å
52S96.9Very high96.2Very high40 Ų4043.3 Ų43.328%0.2825%0.253SS..Hα-helixtrans-60.9-41.3171.3-60.40000111.7I48 V54 I55 I56I48-S52 WeakPolarHBondContact O-CB 3.44Å; I48-S52 PolarHBondContact O-N 3.07Å; I48-S52 PolarHBondContact O-OG 2.86Å; S52-V54 VanDerWaalsContact C-N 3.33Å; S52-V54 PolarHBondContact O-N 3.23Å; S52-I55 PolarHBondContact O-N 2.77Å; S52-I56 WeakPolarHBondContact O-CB 3.47Å; S52-I56 VanDerWaalsContact O-CG1 3.23Å; S52-I56 WeakPolarHBondContact O-CG1 3.43Å; S52-I56 PolarHBondContact O-N 3.36Å
53C95.6Very high95.9Very high6 Ų644.6 Ų44.64%0.04127%0.268CS..Hα-helixtrans-61.9-38.9175.4-72.50000112.4T49 G50 N51 S57 F342T49-C53 WeakPolarHBondContact O-CB 3.48Å; T49-C53 PolarHBondContact O-N 2.94Å; T49-C53 PolarHBondContact O-SG 3.47Å; G50-C53 WeakPolarHBondContact O-CB 3.39Å; G50-C53 PolarHBondContact O-N 3.32Å; N51-C53 VanDerWaalsContact C-N 3.32Å; N51-C53 PolarHBondContact O-N 3.45Å; C53-S57 WeakPolarHBondContact O-CB 3.25Å; C53-S57 PolarHBondContact O-N 3.05Å; C53-S57 PolarHBondContact O-OG 2.99Å; C53-F342 HydrophobicContact CB-CD2 4.17Å; C53-F342 HydrophobicContact CB-CE1 4.25Å; C53-F342 HydrophobicContact CB-CE2 3.88Å; C53-F342 HydrophobicContact CB-CG 4.47Å; C53-F342 HydrophobicContact CB-CZ 3.92Å
54V95.5Very high95.6Very high0 Ų044.7 Ų44.70%027%0.269CS..Hα-helixtrans-59.1-51.9174.1176.60000110.5G50 N51 S52 S57 V58 I72 S76 P328 Y331 F338 F342G50-V54 WeakPolarHBondContact O-CG2 3.48Å; G50-V54 PolarHBondContact O-N 3.43Å; N51-V54 WeakPolarHBondContact O-CB 3.33Å; N51-V54 PolarHBondContact O-N 3.33Å; S52-V54 VanDerWaalsContact C-N 3.33Å; S52-V54 PolarHBondContact O-N 3.23Å; V54-S57 PolarHBondContact O-N 3.11Å; V54-V58 WeakPolarHBondContact O-CG2 3.31Å; V54-V58 PolarHBondContact O-N 3.29Å; V54-V58 VanDerWaalsContact O-N 3.13Å; V54-I72 HydrophobicContact CG1-CG2 3.48Å; V54-I72 VanDerWaalsContact CG1-CG2 3.48Å; V54-S76 VanDerWaalsContact CG1-OG 3.24Å; V54-S76 WeakPolarHBondContact CG1-OG 3.38Å; V54-P328 HydrophobicContact CG2-CB 4.27Å; V54-P328 HydrophobicContact CG2-CG 4.17Å; V54-Y331 HydrophobicContact CG2-CD2 4.01Å; V54-F338 HydrophobicContact CG1-CE1 4.15Å; V54-F342 HydrophobicContact CB-CZ 4.48Å; V54-F342 HydrophobicContact CG2-CE2 4.22Å; V54-F342 HydrophobicContact CG2-CZ 3.63Å
55I97.2Very high95.4Very high45 Ų4544.4 Ų44.423%0.23127%0.269CS..Hα-helixtrans-60.2-51.4-178.3-63.9171.7000110.4N51 S52 S57 V58 A59 V73 I80N51-I55 WeakPolarHBondContact O-CG1 3.46Å; N51-I55 PolarHBondContact O-N 2.77Å; N51-I55 VanDerWaalsContact O-N 3.08Å; S52-I55 PolarHBondContact O-N 2.77Å; I55-S57 VanDerWaalsContact C-N 3.31Å; I55-S57 PolarHBondContact O-N 3.12Å; I55-V58 PolarHBondContact O-N 3.33Å; I55-A59 WeakPolarHBondContact O-CB 3.29Å; I55-A59 PolarHBondContact O-N 3.45Å; I55-V73 HydrophobicContact CG1-CG1 4.33Å; I55-I80 HydrophobicContact CD1-CD1 3.63Å
56I95.9Very high95.1Very high60 Ų6044.2 Ų44.231%0.30826%0.264SS..Hα-helixtrans-60.8-40.6-180-66.1166.5000111S52 V58 A59 R60 I345S52-I56 WeakPolarHBondContact O-CB 3.47Å; S52-I56 VanDerWaalsContact O-CG1 3.23Å; S52-I56 WeakPolarHBondContact O-CG1 3.43Å; S52-I56 PolarHBondContact O-N 3.36Å; I56-V58 PolarHBondContact O-N 2.85Å; I56-A59 PolarHBondContact O-N 2.96Å; I56-R60 HydrophobicContact CG2-CG 4.16Å; I56-R60 WeakPolarHBondContact O-CB 3.24Å; I56-R60 WeakPolarHBondContact O-CG 3.39Å; I56-R60 PolarHBondContact O-N 3.14Å; I56-I345 HydrophobicContact CB-CD1 3.99Å; I56-I345 HydrophobicContact CG2-CD1 3.62Å; I56-I345 HydrophobicContact CG2-CG1 4.12Å
57S94.6Very high94.9Very high1 Ų142.8 Ų42.81%0.00725%0.251CS..Hα-helixtrans-60.9-45178.9-66.70000112.3C53 V54 I55 K61 A341 F342 I345C53-S57 WeakPolarHBondContact O-CB 3.25Å; C53-S57 PolarHBondContact O-N 3.05Å; C53-S57 PolarHBondContact O-OG 2.99Å; V54-S57 PolarHBondContact O-N 3.11Å; I55-S57 VanDerWaalsContact C-N 3.31Å; I55-S57 PolarHBondContact O-N 3.12Å; S57-K61 WeakPolarHBondContact O-CB 3.27Å; S57-K61 PolarHBondContact O-N 2.82Å; S57-A341 WeakPolarHBondContact OG-CB 3.46Å; S57-F342 VanDerWaalsContact OG-CD2 3.31Å; S57-F342 WeakPolarHBondContact OG-CD2 3.24Å; S57-F342 WeakPolarHBondContact OG-CE2 3.24Å; S57-I345 VanDerWaalsContact OG-CD1 3.29Å; S57-I345 WeakPolarHBondContact OG-CD1 3.38Å
58V94.9Very high94.6Very high6 Ų643.9 Ų43.94%0.03626%0.255CS..Hα-helixtrans-70.1-40.4178.6177.70000110.9V54 I55 I56 L64 Q65 N69 V73 F338V54-V58 WeakPolarHBondContact O-CG2 3.31Å; V54-V58 PolarHBondContact O-N 3.29Å; V54-V58 VanDerWaalsContact O-N 3.13Å; I55-V58 PolarHBondContact O-N 3.33Å; I56-V58 PolarHBondContact O-N 2.85Å; V58-L64 HydrophobicContact CG2-CB 4.47Å; V58-Q65 HydrophobicContact CG1-CG 4.34Å; V58-Q65 WeakPolarHBondContact O-CG 3.2Å; V58-Q65 PolarHBondContact O-NE2 2.94Å; V58-N69 HydrophobicContact CG1-CB 4.22Å; V58-N69 HydrophobicContact CG2-CB 4.02Å; V58-V73 HydrophobicContact CB-CG2 3.75Å; V58-V73 HydrophobicContact CG1-CG2 3.83Å; V58-V73 HydrophobicContact CG2-CG2 3.93Å; V58-F338 HydrophobicContact CG2-CE1 3.69Å; V58-F338 HydrophobicContact CG2-CZ 3.72Å
59A95Very high94.4Very high67 Ų6742 Ų4255%0.55425%0.246SC*.Hα-helixtrans-61.8-46.3178.300000112I55 I56 Q65I55-A59 WeakPolarHBondContact O-CB 3.29Å; I55-A59 PolarHBondContact O-N 3.45Å; I56-A59 PolarHBondContact O-N 2.96Å; A59-Q65 PolarHBondContact O-NE2 3.11Å; A59-Q65 VanDerWaalsContact O-NE2 3.11Å
60R93.9Very high94.4Very high186 Ų18640.8 Ų40.870%0.70224%0.236SC*.Hα-helixtrans-77.1-27.6-175.3-69.8-175.9179.1-179.21.4114.5I56I56-R60 HydrophobicContact CG2-CG 4.16Å; I56-R60 WeakPolarHBondContact O-CB 3.24Å; I56-R60 WeakPolarHBondContact O-CG 3.39Å; I56-R60 PolarHBondContact O-N 3.14Å
61K92.7Very high94.4Very high41 Ų4140.2 Ų40.218%0.17823%0.231CC..  trans-112.2108.8-173.4-62.5-165.3179.2-167.10112.2S57 S63 L64 Q65 A341 E344S57-K61 WeakPolarHBondContact O-CB 3.27Å; S57-K61 PolarHBondContact O-N 2.82Å; K61-S63 PolarHBondContact O-N 3.33Å; K61-S63 VanDerWaalsContact O-N 3.13Å; K61-L64 HydrophobicContact CB-CB 4.17Å; K61-L64 HydrophobicContact CB-CD1 4.08Å; K61-L64 HydrophobicContact CB-CG 4.02Å; K61-L64 HydrophobicContact CD-CD1 4.15Å; K61-L64 WeakPolarHBondContact O-CA 3.32Å; K61-L64 WeakPolarHBondContact O-CB 3.42Å; K61-L64 PolarHBondContact O-N 3.42Å; K61-Q65 PolarHBondContact O-N 3.09Å; K61-A341 HydrophobicContact CD-CB 3.85Å; K61-E344 WeakPolarHBondContact CE-OE2 3.08Å; K61-E344 IonicContact NZ-OE1 3.48Å; K61-E344 PolarHBondContact NZ-OE1 2.04Å; K61-E344 IonicContact NZ-OE2 2.7Å; K61-E344 PolarHBondContact NZ-OE2 2.88Å
62A91.9Very high94.3Very high80 Ų8040.2 Ų40.266%0.66123%0.231SC*.G310 helixtrans-53.5-35.5174.100000112.9L64 Q65A62-L64 PolarHBondContact O-N 3.04Å; A62-Q65 PolarHBondContact O-N 3.01Å
63S91.6Very high94.3Very high106 Ų10639.9 Ų39.974%0.74123%0.227SC*.G310 helixtrans-64.8-19.5175.861.80000114.2K61K61-S63 PolarHBondContact O-N 3.33Å; K61-S63 VanDerWaalsContact O-N 3.13Å
64L91.7Very high94.4Very high6 Ų639.9 Ų39.93%0.03123%0.227CC..G310 helixtrans-96.2-6.7173.2-65.2-178.7000112.8V58 K61 A62 S66 N69 F338 A341V58-L64 HydrophobicContact CG2-CB 4.47Å; K61-L64 HydrophobicContact CB-CB 4.17Å; K61-L64 HydrophobicContact CB-CD1 4.08Å; K61-L64 HydrophobicContact CB-CG 4.02Å; K61-L64 HydrophobicContact CD-CD1 4.15Å; K61-L64 WeakPolarHBondContact O-CA 3.32Å; K61-L64 WeakPolarHBondContact O-CB 3.42Å; K61-L64 PolarHBondContact O-N 3.42Å; A62-L64 PolarHBondContact O-N 3.04Å; L64-S66 PolarHBondContact O-N 3.39Å; L64-N69 WeakPolarHBondContact O-CB 3.39Å; L64-N69 VanDerWaalsContact O-CG 3.28Å; L64-N69 PolarHBondContact O-ND2 3.42Å; L64-F338 HydrophobicContact CD1-CD1 4.25Å; L64-F338 HydrophobicContact CD1-CE1 4.33Å; L64-A341 HydrophobicContact CD1-CB 3.9Å
65Q94.3Very high94.5Very high74 Ų7440 Ų4035%0.34623%0.227SC..  trans-81.555.6-179.7-65.1176.8-1.600112.3V58 A59 K61 A62 K145V58-Q65 HydrophobicContact CG1-CG 4.34Å; V58-Q65 WeakPolarHBondContact O-CG 3.2Å; V58-Q65 PolarHBondContact O-NE2 2.94Å; A59-Q65 PolarHBondContact O-NE2 3.11Å; A59-Q65 VanDerWaalsContact O-NE2 3.11Å; K61-Q65 PolarHBondContact O-N 3.09Å; A62-Q65 PolarHBondContact O-N 3.01Å; Q65-K145 WeakPolarHBondContact O-CE 3.5Å; Q65-K145 PolarHBondContact O-NZ 3.25Å
66S92.4Very high94.5Very high44 Ų4437.8 Ų37.831%0.30822%0.216SC..  trans-90.8158.4173.765.90000111.3L64 R68 N69 L70L64-S66 PolarHBondContact O-N 3.39Å; S66-R68 VanDerWaalsContact C-N 3.34Å; S66-R68 PolarHBondContact O-N 3.3Å; S66-N69 WeakPolarHBondContact O-CA 3.17Å; S66-N69 WeakPolarHBondContact O-CB 3.36Å; S66-N69 PolarHBondContact O-N 3.33Å; S66-N69 PolarHBondContact OG-N 3.14Å; S66-L70 PolarHBondContact O-N 3.06Å; S66-L70 VanDerWaalsContact O-N 3.1Å
67V93.1Very high94.6Very high19 Ų1937 Ų3712%0.11522%0.215CC..Hα-helixtrans-52.7-48.2177.71640000112.8N69 L70 F71 L143 K145 A148V67-N69 PolarHBondContact O-N 2.97Å; V67-L70 WeakPolarHBondContact O-CB 3.38Å; V67-L70 PolarHBondContact O-N 2.96Å; V67-F71 HydrophobicContact CG1-CD2 4.4Å; V67-F71 HydrophobicContact CG1-CE2 3.88Å; V67-F71 WeakPolarHBondContact O-CD2 3.44Å; V67-F71 PolarHBondContact O-N 3.34Å; V67-L143 HydrophobicContact CG1-CB 4.29Å; V67-L143 HydrophobicContact CG1-CD2 3.76Å; V67-L143 HydrophobicContact CG1-CG 4.15Å; V67-L143 WeakPolarHBondContact CG2-O 3.34Å; V67-K145 HydrophobicContact CG2-CG 3.96Å; V67-A148 HydrophobicContact CB-CB 4.4Å; V67-A148 HydrophobicContact CG1-CB 3.64Å; V67-A148 HydrophobicContact CG2-CB 4.23Å
68R91.3Very high94.8Very high22 Ų2237 Ų378%0.08322%0.215CC..Hα-helixtrans-53.3-42.5173.8-178.9-174.260.377.913.6112.2S66 L70 F71 I72S66-R68 VanDerWaalsContact C-N 3.34Å; S66-R68 PolarHBondContact O-N 3.3Å; R68-L70 VanDerWaalsContact C-N 3.3Å; R68-L70 PolarHBondContact O-N 3.43Å; R68-F71 PolarHBondContact O-N 2.95Å; R68-I72 HydrophobicContact CG-CD1 4.06Å; R68-I72 WeakPolarHBondContact O-CG1 3.48Å; R68-I72 PolarHBondContact O-N 3.06Å; R68-I72 VanDerWaalsContact O-N 3.11Å
69N93.4Very high95Very high1 Ų136.8 Ų36.81%0.00521%0.214CC..Hα-helixtrans-73.7-21.3-178-77.6-1.8000112.9V58 L64 S66 V67 I72 V73 F338V58-N69 HydrophobicContact CG1-CB 4.22Å; V58-N69 HydrophobicContact CG2-CB 4.02Å; L64-N69 WeakPolarHBondContact O-CB 3.39Å; L64-N69 VanDerWaalsContact O-CG 3.28Å; L64-N69 PolarHBondContact O-ND2 3.42Å; S66-N69 WeakPolarHBondContact O-CA 3.17Å; S66-N69 WeakPolarHBondContact O-CB 3.36Å; S66-N69 PolarHBondContact O-N 3.33Å; S66-N69 PolarHBondContact OG-N 3.14Å; V67-N69 PolarHBondContact O-N 2.97Å; N69-I72 PolarHBondContact O-N 3.4Å; N69-I72 WeakPolarHBondContact OD1-CD1 3.46Å; N69-V73 WeakPolarHBondContact O-CG2 3.43Å; N69-V73 PolarHBondContact O-N 3.14Å; N69-F338 VanDerWaalsContact OD1-CE2 3.29Å; N69-F338 WeakPolarHBondContact OD1-CE2 3.43Å
70L96.8Very high95.1Very high41 Ų4135.1 Ų35.122%0.21520%0.195CC..Hα-helixtrans-65.8-43.3169.6-58.7180000111S66 V67 R68 I72 V73 S74 K145 A148 V149 I152S66-L70 PolarHBondContact O-N 3.06Å; S66-L70 VanDerWaalsContact O-N 3.1Å; V67-L70 WeakPolarHBondContact O-CB 3.38Å; V67-L70 PolarHBondContact O-N 2.96Å; R68-L70 VanDerWaalsContact C-N 3.3Å; R68-L70 PolarHBondContact O-N 3.43Å; L70-I72 VanDerWaalsContact C-N 3.31Å; L70-I72 PolarHBondContact O-N 2.89Å; L70-V73 WeakPolarHBondContact O-CB 3.4Å; L70-V73 PolarHBondContact O-N 3.4Å; L70-S74 PolarHBondContact O-N 2.93Å; L70-K145 HydrophobicContact CD1-CB 4.33Å; L70-K145 HydrophobicContact CD1-CG 4.38Å; L70-A148 HydrophobicContact CD1-CB 4.37Å; L70-V149 HydrophobicContact CD1-CG2 4.24Å; L70-I152 HydrophobicContact CB-CD1 3.99Å
71F96.7Very high95.3Very high0 Ų027.8 Ų27.80%017%0.171CC..Hα-helixtrans-61.9-40.7172.4-67.3-60.6000111.6V67 R68 V73 S74 L75 T123 A126 I127 L143 A148 M151 I152V67-F71 HydrophobicContact CG1-CD2 4.4Å; V67-F71 HydrophobicContact CG1-CE2 3.88Å; V67-F71 WeakPolarHBondContact O-CD2 3.44Å; V67-F71 PolarHBondContact O-N 3.34Å; R68-F71 PolarHBondContact O-N 2.95Å; F71-V73 VanDerWaalsContact C-N 3.29Å; F71-V73 PolarHBondContact O-N 3.19Å; F71-S74 WeakPolarHBondContact O-CA 3.41Å; F71-S74 WeakPolarHBondContact O-CB 3.33Å; F71-S74 PolarHBondContact O-N 2.88Å; F71-S74 VanDerWaalsContact O-N 3.1Å; F71-L75 PolarHBondContact O-N 3.43Å; F71-T123 HydrophobicContact CB-CG2 3.82Å; F71-T123 HydrophobicContact CD1-CG2 4.43Å; F71-T123 WeakPolarHBondContact O-CG2 3.47Å; F71-A126 HydrophobicContact CD1-CB 4.07Å; F71-A126 HydrophobicContact CE1-CB 3.79Å; F71-A126 HydrophobicContact CZ-CB 4.07Å; F71-I127 HydrophobicContact CB-CD1 3.88Å; F71-I127 HydrophobicContact CB-CG1 3.53Å; F71-I127 HydrophobicContact CD2-CG1 4.32Å; F71-I127 HydrophobicContact CG-CG1 4.14Å; F71-L143 HydrophobicContact CE2-CD2 4.11Å; F71-L143 HydrophobicContact CZ-CD2 4.2Å; F71-A148 HydrophobicContact CE2-CB 4.23Å; F71-A148 HydrophobicContact CZ-CB 4.07Å; F71-M151 HydrophobicContact CE1-CB 4.15Å; F71-M151 HydrophobicContact CE1-CE 4.45Å; F71-M151 HydrophobicContact CZ-CB 4.3Å; F71-M151 HydrophobicContact CZ-CE 4Å; F71-M151 HydrophobicContact CZ-SD 4.06Å; F71-I152 HydrophobicContact CD1-CD1 4.08Å; F71-I152 HydrophobicContact CD1-CG1 3.69Å; F71-I152 HydrophobicContact CE1-CD1 4.37Å; F71-I152 HydrophobicContact CE1-CG1 3.78Å
72I95.1Very high95.6Very high0 Ų026 Ų260%016%0.164CC..Hα-helixtrans-62.8-36.8177-67.4170.8000112.1V54 R68 N69 L70 L75 S76 I127 Y331 F338V54-I72 HydrophobicContact CG1-CG2 3.48Å; V54-I72 VanDerWaalsContact CG1-CG2 3.48Å; R68-I72 HydrophobicContact CG-CD1 4.06Å; R68-I72 WeakPolarHBondContact O-CG1 3.48Å; R68-I72 PolarHBondContact O-N 3.06Å; R68-I72 VanDerWaalsContact O-N 3.11Å; N69-I72 PolarHBondContact O-N 3.4Å; N69-I72 WeakPolarHBondContact OD1-CD1 3.46Å; L70-I72 VanDerWaalsContact C-N 3.31Å; L70-I72 PolarHBondContact O-N 2.89Å; I72-L75 PolarHBondContact O-N 3.15Å; I72-S76 WeakPolarHBondContact O-CB 3.3Å; I72-S76 PolarHBondContact O-N 3.4Å; I72-S76 PolarHBondContact O-OG 3.3Å; I72-I127 HydrophobicContact CG1-CD1 4.14Å; I72-Y331 HydrophobicContact CD1-CD1 4.16Å; I72-Y331 HydrophobicContact CD1-CE1 3.32Å; I72-Y331 HydrophobicContact CG1-CE1 3.88Å; I72-Y331 WeakPolarHBondContact CG1-OH 3.43Å; I72-Y331 HydrophobicContact CG2-CD2 4.11Å; I72-Y331 HydrophobicContact CG2-CE1 4.05Å; I72-Y331 HydrophobicContact CG2-CE2 3.47Å; I72-Y331 VanDerWaalsContact CG2-CE2 3.47Å; I72-Y331 VanDerWaalsContact CG2-CZ 3.47Å; I72-F338 HydrophobicContact CG2-CZ 4.47Å
73V97.2Very high95.9Very high33 Ų3322.2 Ų22.220%0.213%0.132CC..Hα-helixtrans-63.6-45.9171.9167.70000110.5I55 V58 N69 L70 F71 L75 S76 C77I55-V73 HydrophobicContact CG1-CG1 4.33Å; V58-V73 HydrophobicContact CB-CG2 3.75Å; V58-V73 HydrophobicContact CG1-CG2 3.83Å; V58-V73 HydrophobicContact CG2-CG2 3.93Å; N69-V73 WeakPolarHBondContact O-CG2 3.43Å; N69-V73 PolarHBondContact O-N 3.14Å; L70-V73 WeakPolarHBondContact O-CB 3.4Å; L70-V73 PolarHBondContact O-N 3.4Å; F71-V73 VanDerWaalsContact C-N 3.29Å; F71-V73 PolarHBondContact O-N 3.19Å; V73-L75 VanDerWaalsContact C-N 3.32Å; V73-L75 PolarHBondContact O-N 3.23Å; V73-S76 WeakPolarHBondContact O-CB 3.38Å; V73-S76 PolarHBondContact O-N 3.1Å; V73-S76 VanDerWaalsContact O-N 3.11Å; V73-C77 PolarHBondContact O-N 3.49Å; V73-C77 PolarHBondContact O-SG 3.07Å
74S97.9Very high96.2Very high6 Ų621.9 Ų21.94%0.04212%0.122CC..Hα-helixtrans-55.4-45.4174.8-1780000112.3L70 F71 S76 C77 S78 W156L70-S74 PolarHBondContact O-N 2.93Å; F71-S74 WeakPolarHBondContact O-CA 3.41Å; F71-S74 WeakPolarHBondContact O-CB 3.33Å; F71-S74 PolarHBondContact O-N 2.88Å; F71-S74 VanDerWaalsContact O-N 3.1Å; S74-S76 PolarHBondContact O-N 3.47Å; S74-C77 WeakPolarHBondContact O-CB 3.47Å; S74-C77 PolarHBondContact O-N 3.39Å; S74-S78 PolarHBondContact O-N 2.86Å; S74-S78 VanDerWaalsContact O-N 3.15Å; S74-W156 PolarHBondContact OG-NE1 2.9Å
75L97Very high96.5Very high1 Ų122.3 Ų22.31%0.00513%0.125CC..Hα-helixtrans-62.1-41.2175.9-174.863.4000112.2F71 I72 V73 C77 S78 D79 S120 T123 L124 N327F71-L75 PolarHBondContact O-N 3.43Å; I72-L75 PolarHBondContact O-N 3.15Å; V73-L75 VanDerWaalsContact C-N 3.32Å; V73-L75 PolarHBondContact O-N 3.23Å; L75-C77 VanDerWaalsContact C-N 3.32Å; L75-C77 PolarHBondContact O-N 3.3Å; L75-S78 PolarHBondContact O-N 3.04Å; L75-S78 PolarHBondContact O-OG 3.46Å; L75-D79 PolarHBondContact O-N 3.1Å; L75-S120 VanDerWaalsContact CD1-CA 3.47Å; L75-T123 HydrophobicContact CB-CG2 3.94Å; L75-L124 HydrophobicContact CD2-CD2 4.13Å; L75-N327 WeakPolarHBondContact CD2-ND2 3.29Å; L75-N327 WeakPolarHBondContact CG-ND2 3.2Å
76S97.8Very high96.6Very high0 Ų018.8 Ų18.80%011%0.108CC..Hα-helixtrans-67-34.7178.1-54.10000111.7V54 I72 V73 S74 D79 I80V54-S76 VanDerWaalsContact CG1-OG 3.24Å; V54-S76 WeakPolarHBondContact CG1-OG 3.38Å; I72-S76 WeakPolarHBondContact O-CB 3.3Å; I72-S76 PolarHBondContact O-N 3.4Å; I72-S76 PolarHBondContact O-OG 3.3Å; V73-S76 WeakPolarHBondContact O-CB 3.38Å; V73-S76 PolarHBondContact O-N 3.1Å; V73-S76 VanDerWaalsContact O-N 3.11Å; S74-S76 PolarHBondContact O-N 3.47Å; S76-D79 PolarHBondContact O-N 3.23Å; S76-I80 WeakPolarHBondContact O-CG1 3.22Å; S76-I80 PolarHBondContact O-N 3.47Å
77C98.2Very high96.9Very high43 Ų4316.8 Ų16.829%0.2919%0.094SC..Hα-helixtrans-65.1-45174.5-67.80000111.6V73 S74 L75 I80 V81 W156V73-C77 PolarHBondContact O-N 3.49Å; V73-C77 PolarHBondContact O-SG 3.07Å; S74-C77 WeakPolarHBondContact O-CB 3.47Å; S74-C77 PolarHBondContact O-N 3.39Å; L75-C77 VanDerWaalsContact C-N 3.32Å; L75-C77 PolarHBondContact O-N 3.3Å; C77-I80 PolarHBondContact O-N 3.25Å; C77-V81 WeakPolarHBondContact O-CG2 3.33Å; C77-V81 PolarHBondContact O-N 3.28Å; C77-V81 VanDerWaalsContact O-N 3.13Å; C77-W156 HydrophobicContact CB-CH2 4.27Å; C77-W156 HydrophobicContact CB-CZ2 3.98Å
78S98Very high97.1Very high0 Ų017.9 Ų17.90%010%0.101CC..Hα-helixtrans-64.4-39.8175.953.30000112.1S74 L75 I80 V81 V82 S120S74-S78 PolarHBondContact O-N 2.86Å; S74-S78 VanDerWaalsContact O-N 3.15Å; L75-S78 PolarHBondContact O-N 3.04Å; L75-S78 PolarHBondContact O-OG 3.46Å; S78-I80 VanDerWaalsContact C-N 3.33Å; S78-I80 PolarHBondContact O-N 2.7Å; S78-V81 WeakPolarHBondContact O-CB 3.34Å; S78-V81 PolarHBondContact O-N 2.73Å; S78-V82 WeakPolarHBondContact O-CG2 3.17Å; S78-V82 PolarHBondContact O-N 2.91Å; S78-S120 PolarHBondContact OG-OG 2.88Å; S78-S120 VanDerWaalsContact OG-OG 3.07Å
79D98Very high97.4Very high2 Ų217.4 Ų17.41%0.01110%0.101CC..Hα-helixtrans-63.9-36.4176.2-73.9-21.2000112.3L75 S76 V82 C83 T324 N327L75-D79 PolarHBondContact O-N 3.1Å; S76-D79 PolarHBondContact O-N 3.23Å; D79-V82 PolarHBondContact O-N 3.4Å; D79-C83 WeakPolarHBondContact O-CB 3.24Å; D79-C83 PolarHBondContact O-N 3.16Å; D79-C83 PolarHBondContact O-SG 2.68Å; D79-T324 HydrophobicContact CB-CG2 4.21Å; D79-N327 PolarHBondContact OD2-ND2 3.43Å
80I98.5Very high97.6Very high32 Ų3218.3 Ų18.316%0.16411%0.106CC..Hα-helixtrans-64.1-42.2173.3-73.3169.5000110.9I48 N51 I55 S76 C77 S78 V82 C83 L84I48-I80 HydrophobicContact CD1-CG2 4.11Å; N51-I80 HydrophobicContact CB-CD1 4.02Å; N51-I80 HydrophobicContact CB-CG1 3.67Å; I55-I80 HydrophobicContact CD1-CD1 3.63Å; S76-I80 WeakPolarHBondContact O-CG1 3.22Å; S76-I80 PolarHBondContact O-N 3.47Å; C77-I80 PolarHBondContact O-N 3.25Å; S78-I80 VanDerWaalsContact C-N 3.33Å; S78-I80 PolarHBondContact O-N 2.7Å; I80-V82 VanDerWaalsContact C-N 3.31Å; I80-V82 PolarHBondContact O-N 3.48Å; I80-C83 PolarHBondContact O-N 2.91Å; I80-L84 HydrophobicContact CG2-CD1 3.81Å; I80-L84 HydrophobicContact CG2-CG 4.22Å; I80-L84 WeakPolarHBondContact O-CG 3.41Å; I80-L84 PolarHBondContact O-N 2.89Å
81V98.3Very high97.6Very high33 Ų3316.7 Ų16.720%0.210%0.098CC..Hα-helixtrans-58.8-45.2175.4174.40000110.3C77 S78 C83 L84 T85 L112 M115 S116C77-V81 WeakPolarHBondContact O-CG2 3.33Å; C77-V81 PolarHBondContact O-N 3.28Å; C77-V81 VanDerWaalsContact O-N 3.13Å; S78-V81 WeakPolarHBondContact O-CB 3.34Å; S78-V81 PolarHBondContact O-N 2.73Å; V81-C83 PolarHBondContact O-N 3.26Å; V81-L84 PolarHBondContact O-N 3.14Å; V81-T85 WeakPolarHBondContact O-CB 3.29Å; V81-T85 WeakPolarHBondContact O-CG2 3.5Å; V81-T85 PolarHBondContact O-N 3.42Å; V81-T85 PolarHBondContact O-OG1 3.13Å; V81-L112 HydrophobicContact CG1-CB 4.11Å; V81-L112 HydrophobicContact CG1-CD2 4.18Å; V81-M115 HydrophobicContact CG1-CE 4.23Å; V81-S116 VanDerWaalsContact CG1-OG 3.29Å; V81-S116 WeakPolarHBondContact CG1-OG 3.33Å
82V98.2Very high97.6Very high4 Ų419.9 Ų19.92%0.02412%0.115CC..Hα-helixtrans-59.9-45.4175.2174.40000111.3S78 D79 I80 L84 T85 S86 V87 M321 T324S78-V82 WeakPolarHBondContact O-CG2 3.17Å; S78-V82 PolarHBondContact O-N 2.91Å; D79-V82 PolarHBondContact O-N 3.4Å; I80-V82 VanDerWaalsContact C-N 3.31Å; I80-V82 PolarHBondContact O-N 3.48Å; V82-L84 PolarHBondContact O-N 2.95Å; V82-T85 CarbonylContact O-C 3.37Å; V82-T85 PolarHBondContact O-N 3.49Å; V82-S86 PolarHBondContact O-N 3.4Å; V82-V87 PolarHBondContact O-N 2.86Å; V82-M321 HydrophobicContact CG1-CE 4.3Å; V82-M321 HydrophobicContact CG1-SD 3.55Å; V82-M321 VanDerWaalsContact CG1-SD 3.55Å; V82-T324 HydrophobicContact CB-CG2 4Å; V82-T324 HydrophobicContact CG1-CG2 3.67Å
83C98.5Very high97.7Very high0 Ų021.4 Ų21.40%012%0.124CC..Hα-helixtrans-62.9-40.2178.5-67.30000112.6F44 I48 D79 I80 V81 T85 P88F44-C83 WeakPolarHBondContact CD2-O 3.38Å; F44-C83 VanDerWaalsContact CE2-O 3.24Å; F44-C83 WeakPolarHBondContact CE2-O 2.89Å; I48-C83 HydrophobicContact CD1-CB 3.47Å; I48-C83 VanDerWaalsContact CD1-CB 3.47Å; I48-C83 HydrophobicContact CG1-CB 3.84Å; D79-C83 WeakPolarHBondContact O-CB 3.24Å; D79-C83 PolarHBondContact O-N 3.16Å; D79-C83 PolarHBondContact O-SG 2.68Å; I80-C83 PolarHBondContact O-N 2.91Å; V81-C83 PolarHBondContact O-N 3.26Å; C83-T85 VanDerWaalsContact C-N 3.29Å; C83-T85 PolarHBondContact O-N 2.94Å; C83-P88 WeakPolarHBondContact O-CD 3.48Å
84L98Very high97.6Very high98 Ų9820.8 Ų20.851%0.51312%0.12SC..Hα-helixtrans-74.7-19.5178.9-68.8175.3000113.2F44 I48 I80 V81 V82F44-L84 HydrophobicContact CE2-CD2 4.33Å; F44-L84 HydrophobicContact CZ-CD2 4.31Å; I48-L84 HydrophobicContact CD1-CD2 3.75Å; I48-L84 HydrophobicContact CD1-CG 3.81Å; I80-L84 HydrophobicContact CG2-CD1 3.81Å; I80-L84 HydrophobicContact CG2-CG 4.22Å; I80-L84 WeakPolarHBondContact O-CG 3.41Å; I80-L84 PolarHBondContact O-N 2.89Å; V81-L84 PolarHBondContact O-N 3.14Å; V82-L84 PolarHBondContact O-N 2.95Å
85T97Very high97.4Very high16 Ų1621.4 Ų21.410%0.09812%0.123CC..THydrogen-bonded Turntrans-116.7-75.8-173.560.70000112.7V81 V82 C83 V87 P88 I89 L112V81-T85 WeakPolarHBondContact O-CB 3.29Å; V81-T85 WeakPolarHBondContact O-CG2 3.5Å; V81-T85 PolarHBondContact O-N 3.42Å; V81-T85 PolarHBondContact O-OG1 3.13Å; V82-T85 CarbonylContact O-C 3.37Å; V82-T85 PolarHBondContact O-N 3.49Å; C83-T85 VanDerWaalsContact C-N 3.29Å; C83-T85 PolarHBondContact O-N 2.94Å; T85-V87 VanDerWaalsContact C-N 3.32Å; T85-V87 PolarHBondContact O-N 3.34Å; T85-P88 WeakPolarHBondContact O-CD 3.41Å; T85-P88 WeakPolarHBondContact O-CG 3.04Å; T85-I89 WeakPolarHBondContact O-CB 3.31Å; T85-I89 VanDerWaalsContact O-CG1 3.24Å; T85-I89 WeakPolarHBondContact O-CG1 3.41Å; T85-I89 PolarHBondContact O-N 3.33Å; T85-L112 HydrophobicContact CG2-CD1 3.68Å
86S97.6Very high97.2Very high0 Ų028.3 Ų28.30%015%0.148CC..Hα-helixtrans-64.7-31.9-171.6-59.30000113.8V82 T90 H317 M321V82-S86 PolarHBondContact O-N 3.4Å; S86-T90 WeakPolarHBondContact O-CB 3.45Å; S86-T90 PolarHBondContact O-OG1 3.43Å; S86-H317 PolarHBondContact O-NE2 3.35Å; S86-M321 VanDerWaalsContact CB-SD 3.54Å
87V98.3Very high97.1Very high1 Ų128.9 Ų28.91%0.00615%0.151CC..Hα-helixtrans-68.6-45.6-179.7174.10000112.2Y40 I43 F44 V82 T85 P91 M321Y40-V87 HydrophobicContact CD1-CG1 4.07Å; Y40-V87 WeakPolarHBondContact CD1-O 3.42Å; Y40-V87 WeakPolarHBondContact O-CG1 3.26Å; I43-V87 HydrophobicContact CB-CG1 4.32Å; I43-V87 HydrophobicContact CG2-CG1 4.11Å; I43-V87 HydrophobicContact CG2-CG2 3.88Å; F44-V87 HydrophobicContact CB-CG1 3.78Å; F44-V87 HydrophobicContact CD2-CG1 4.28Å; V82-V87 PolarHBondContact O-N 2.86Å; T85-V87 VanDerWaalsContact C-N 3.32Å; T85-V87 PolarHBondContact O-N 3.34Å; V87-P91 WeakPolarHBondContact O-CD 3.49Å; V87-P91 WeakPolarHBondContact O-CG 3.29Å; V87-M321 HydrophobicContact CG2-CB 4.16Å; V87-M321 HydrophobicContact CG2-CG 4.08Å; V87-M321 HydrophobicContact CG2-SD 4.01Å
88P97.4Very high96.9Very high42 Ų4228.7 Ų28.727%0.27315%0.147SC..Hα-helixtrans-85.6-43.1173.428.1-34.6000114.4C83 T85 P91 I92C83-P88 WeakPolarHBondContact O-CD 3.48Å; T85-P88 WeakPolarHBondContact O-CD 3.41Å; T85-P88 WeakPolarHBondContact O-CG 3.04Å; P88-P91 WeakPolarHBondContact O-CD 3.42Å; P88-P91 WeakPolarHBondContact O-CG 3.19Å; P88-I92 WeakPolarHBondContact O-CB 2.91Å; P88-I92 VanDerWaalsContact O-CD1 3.29Å; P88-I92 WeakPolarHBondContact O-CD1 3.09Å; P88-I92 WeakPolarHBondContact O-CG1 3.48Å; P88-I92 PolarHBondContact O-N 2.95Å
89I97.8Very high96.9Very high13 Ų1329.3 Ų29.37%0.06715%0.149CC..Hα-helixtrans-68.3-49.5-167.8-66.9173.4000111.3T85 I92 T93 W99 F101 F109T85-I89 WeakPolarHBondContact O-CB 3.31Å; T85-I89 VanDerWaalsContact O-CG1 3.24Å; T85-I89 WeakPolarHBondContact O-CG1 3.41Å; T85-I89 PolarHBondContact O-N 3.33Å; I89-I92 PolarHBondContact O-N 3.04Å; I89-T93 WeakPolarHBondContact O-CB 3.46Å; I89-T93 PolarHBondContact O-N 3.42Å; I89-T93 PolarHBondContact O-OG1 2.98Å; I89-T93 VanDerWaalsContact O-OG1 3.06Å; I89-W99 HydrophobicContact CG2-CH2 3.75Å; I89-W99 HydrophobicContact CG2-CZ3 3.79Å; I89-F101 HydrophobicContact CB-CE2 4.23Å; I89-F101 HydrophobicContact CB-CZ 4.33Å; I89-F101 HydrophobicContact CG1-CE1 4.22Å; I89-F101 HydrophobicContact CG1-CE2 4.32Å; I89-F101 HydrophobicContact CG1-CZ 4.08Å; I89-F101 HydrophobicContact CG2-CD2 3.89Å; I89-F101 HydrophobicContact CG2-CE2 3.71Å; I89-F101 HydrophobicContact CG2-CZ 4.3Å; I89-F109 HydrophobicContact CB-CD2 4.18Å; I89-F109 HydrophobicContact CB-CE2 3.94Å; I89-F109 HydrophobicContact CB-CZ 4.35Å; I89-F109 HydrophobicContact CD1-CD2 3.79Å; I89-F109 HydrophobicContact CD1-CE2 4.3Å; I89-F109 HydrophobicContact CD1-CG 4.44Å; I89-F109 HydrophobicContact CG2-CD1 4.18Å; I89-F109 HydrophobicContact CG2-CD2 3.94Å; I89-F109 HydrophobicContact CG2-CE1 4.16Å; I89-F109 HydrophobicContact CG2-CE2 3.93Å; I89-F109 HydrophobicContact CG2-CG 4.08Å; I89-F109 HydrophobicContact CG2-CZ 4.05Å
90T97.4Very high96.8Very high19 Ų1933.3 Ų33.312%0.11717%0.17CC..Hα-helixtrans-59.5-53-177.1-54.10000113S86 I92 T93 V94 F109 H317S86-T90 WeakPolarHBondContact O-CB 3.45Å; S86-T90 PolarHBondContact O-OG1 3.43Å; T90-I92 VanDerWaalsContact C-N 3.32Å; T90-I92 PolarHBondContact O-N 3.47Å; T90-T93 PolarHBondContact O-N 2.92Å; T90-V94 HydrophobicContact CG2-CG2 4.25Å; T90-V94 WeakPolarHBondContact O-CG2 3.42Å; T90-V94 PolarHBondContact O-N 3.19Å; T90-F109 WeakPolarHBondContact OG1-CZ 3.49Å; T90-H317 WeakPolarHBondContact CB-NE2 3.42Å; T90-H317 PolarHBondContact OG1-CE1 2.77Å; T90-H317 VanDerWaalsContact OG1-CE1 3.3Å; T90-H317 PolarHBondContact OG1-NE2 3.33Å
91P97.6Very high96.8Very high8 Ų834.5 Ų34.55%0.05217%0.174CC..Hα-helixtrans-65.4-35-179.925.1-34.1000112.8Y40 V87 P88 V94 M95 L314Y40-P91 HydrophobicContact CD1-CG 4.03Å; Y40-P91 HydrophobicContact CD2-CB 3.68Å; Y40-P91 HydrophobicContact CD2-CG 3.78Å; Y40-P91 HydrophobicContact CE1-CG 4.16Å; Y40-P91 HydrophobicContact CE2-CB 3.59Å; Y40-P91 HydrophobicContact CE2-CG 3.95Å; Y40-P91 HydrophobicContact CG-CB 4.29Å; Y40-P91 HydrophobicContact CG-CG 3.86Å; V87-P91 WeakPolarHBondContact O-CD 3.49Å; V87-P91 WeakPolarHBondContact O-CG 3.29Å; P88-P91 WeakPolarHBondContact O-CD 3.42Å; P88-P91 WeakPolarHBondContact O-CG 3.19Å; P91-V94 PolarHBondContact O-N 3.32Å; P91-M95 HydrophobicContact CB-CE 4.46Å; P91-M95 VanDerWaalsContact O-CB 3.22Å; P91-M95 WeakPolarHBondContact O-CB 3.14Å; P91-M95 WeakPolarHBondContact O-CG 3.37Å; P91-M95 PolarHBondContact O-N 3.48Å; P91-L314 HydrophobicContact CB-CD2 4.08Å
92I96.8Very high96.7Very high67 Ų6734.5 Ų34.534%0.34418%0.181SC..Hα-helixtrans-60.8-49.8174.1-69.6169.1000110.1P88 I89 T90 V94 M95 R96 I100 F101P88-I92 WeakPolarHBondContact O-CB 2.91Å; P88-I92 VanDerWaalsContact O-CD1 3.29Å; P88-I92 WeakPolarHBondContact O-CD1 3.09Å; P88-I92 WeakPolarHBondContact O-CG1 3.48Å; P88-I92 PolarHBondContact O-N 2.95Å; I89-I92 PolarHBondContact O-N 3.04Å; T90-I92 VanDerWaalsContact C-N 3.32Å; T90-I92 PolarHBondContact O-N 3.47Å; I92-V94 PolarHBondContact O-N 3.2Å; I92-M95 PolarHBondContact O-N 3.24Å; I92-R96 HydrophobicContact CG2-CG 4.19Å; I92-R96 VanDerWaalsContact O-CB 3.22Å; I92-R96 WeakPolarHBondContact O-CB 3.32Å; I92-R96 VanDerWaalsContact O-CG 3.23Å; I92-R96 WeakPolarHBondContact O-CG 3.42Å; I92-R96 PolarHBondContact O-N 3.29Å; I92-I100 HydrophobicContact CG2-CD1 3.97Å; I92-I100 HydrophobicContact CG2-CG1 4.43Å; I92-F101 HydrophobicContact CB-CE2 4.37Å; I92-F101 HydrophobicContact CB-CZ 4.02Å; I92-F101 HydrophobicContact CD1-CZ 4.11Å; I92-F101 HydrophobicContact CG2-CE2 4.05Å; I92-F101 HydrophobicContact CG2-CZ 3.74Å
93T96.1Very high96.5Very high31 Ų3138.1 Ų38.119%0.1920%0.199CC..Hα-helixtrans-61-45.1179.4-62.50000111.5I89 T90 K97 W99I89-T93 WeakPolarHBondContact O-CB 3.46Å; I89-T93 PolarHBondContact O-N 3.42Å; I89-T93 PolarHBondContact O-OG1 2.98Å; I89-T93 VanDerWaalsContact O-OG1 3.06Å; T90-T93 PolarHBondContact O-N 2.92Å; T93-K97 WeakPolarHBondContact O-CA 3.19Å; T93-K97 PolarHBondContact O-N 2.99Å; T93-W99 HydrophobicContact CG2-CE3 3.9Å; T93-W99 HydrophobicContact CG2-CZ3 4.47Å
94V95.1Very high96.5Very high20 Ų2042.3 Ų42.312%0.12123%0.226CC..Hα-helixtrans-68.4-40.7179.71770000111.7T90 P91 I92 K97 Y310 L314T90-V94 HydrophobicContact CG2-CG2 4.25Å; T90-V94 WeakPolarHBondContact O-CG2 3.42Å; T90-V94 PolarHBondContact O-N 3.19Å; P91-V94 PolarHBondContact O-N 3.32Å; I92-V94 PolarHBondContact O-N 3.2Å; V94-K97 VanDerWaalsContact O-CD 3.26Å; V94-K97 WeakPolarHBondContact O-CD 3.23Å; V94-K97 PolarHBondContact O-NZ 2.95Å; V94-Y310 HydrophobicContact CG1-CD1 4.11Å; V94-Y310 HydrophobicContact CG1-CG 4.49Å; V94-L314 HydrophobicContact CB-CD2 3.9Å; V94-L314 HydrophobicContact CB-CG 4.18Å; V94-L314 HydrophobicContact CG1-CD1 3.94Å; V94-L314 HydrophobicContact CG1-CD2 3.97Å; V94-L314 HydrophobicContact CG1-CG 3.66Å; V94-L314 HydrophobicContact CG2-CD2 4.28Å
95M94.2Very high96.4Very high20 Ų2040.7 Ų40.710%0.09922%0.218CC..Hα-helixtrans-74.8-29.3179.5-70.9-179.7-173.400113.3R33 F36 I37 P91 I92 L314R33-M95 HydrophobicContact CB-SD 4.29Å; R33-M95 HydrophobicContact CG-SD 4.24Å; R33-M95 PolarHBondContact NH2-O 3.48Å; F36-M95 HydrophobicContact CB-CE 3.41Å; F36-M95 VanDerWaalsContact CB-CE 3.41Å; F36-M95 HydrophobicContact CG-CE 4.32Å; I37-M95 HydrophobicContact CD1-SD 4.34Å; I37-M95 HydrophobicContact CG1-CE 4.18Å; I37-M95 HydrophobicContact CG1-SD 4.12Å; P91-M95 HydrophobicContact CB-CE 4.46Å; P91-M95 VanDerWaalsContact O-CB 3.22Å; P91-M95 WeakPolarHBondContact O-CB 3.14Å; P91-M95 WeakPolarHBondContact O-CG 3.37Å; P91-M95 PolarHBondContact O-N 3.48Å; I92-M95 PolarHBondContact O-N 3.24Å; M95-L314 HydrophobicContact CE-CD1 4.34Å; M95-L314 HydrophobicContact CG-CD1 4.45Å
96R93.4Very high96.5Very high145 Ų14540 Ų4055%0.54721%0.214SC..Hα-helixtrans-86.9-18.3177-67.9-68.5-67.5-125.6-2112.6I92 N98I92-R96 HydrophobicContact CG2-CG 4.19Å; I92-R96 VanDerWaalsContact O-CB 3.22Å; I92-R96 WeakPolarHBondContact O-CB 3.32Å; I92-R96 VanDerWaalsContact O-CG 3.23Å; I92-R96 WeakPolarHBondContact O-CG 3.42Å; I92-R96 PolarHBondContact O-N 3.29Å; R96-N98 HydrophobicContact CB-CB 4.48Å; R96-N98 PolarHBondContact O-N 3.34Å; R96-N98 VanDerWaalsContact O-N 3.11Å
97K94.3Very high96.5Very high13 Ų1343.5 Ų43.56%0.05723%0.227CC..THydrogen-bonded Turntrans53.127.9-172.8-54.5-70.3-167.3-970112.9Y15 A16 D25 T27 T93 V94 F191 Y310Y15-K97 HydrophobicContact CD1-CB 3.86Å; Y15-K97 HydrophobicContact CD1-CG 4.46Å; Y15-K97 HydrophobicContact CE1-CB 4.47Å; A16-K97 HydrophobicContact CB-CB 4.36Å; A16-K97 HydrophobicContact CB-CG 4.13Å; D25-K97 IonicContact OD1-NZ 2.96Å; D25-K97 WeakPolarHBondContact OD2-CE 3.38Å; D25-K97 IonicContact OD2-NZ 3.37Å; D25-K97 PolarHBondContact OD2-NZ 2.97Å; T27-K97 PolarHBondContact OG1-NZ 2.99Å; T93-K97 WeakPolarHBondContact O-CA 3.19Å; T93-K97 PolarHBondContact O-N 2.99Å; V94-K97 VanDerWaalsContact O-CD 3.26Å; V94-K97 WeakPolarHBondContact O-CD 3.23Å; V94-K97 PolarHBondContact O-NZ 2.95Å; K97-F191 WeakPolarHBondContact O-CE1 3.17Å; K97-Y310 HydrophobicContact CD-CD1 3.7Å; K97-Y310 HydrophobicContact CD-CD2 4.42Å; K97-Y310 HydrophobicContact CD-CE1 3.5Å; K97-Y310 HydrophobicContact CD-CE2 4.26Å; K97-Y310 HydrophobicContact CD-CG 4.16Å
98N94.9Very high96.4Very high39 Ų3946.9 Ų46.921%0.20925%0.245CC..SBendtrans-153.6133.3-172.9-179.811.6000108.5R96 I100 G189 Y190R96-N98 HydrophobicContact CB-CB 4.48Å; R96-N98 PolarHBondContact O-N 3.34Å; R96-N98 VanDerWaalsContact O-N 3.11Å; N98-I100 PolarHBondContact O-N 3.34Å; N98-G189 WeakPolarHBondContact OD1-CA 3.37Å; N98-Y190 PolarHBondContact OD1-N 3.47Å; N98-Y190 PolarHBondContact OD1-O 3.28Å
99W97.2Very high96.4Very high13 Ų1345.7 Ų45.75%0.04924%0.236CC..  trans-82.8108.3174.5-176.1-91000110.8I89 T93 F101 G102 L105 C106 F109 L172 Y190 C192I89-W99 HydrophobicContact CG2-CH2 3.75Å; I89-W99 HydrophobicContact CG2-CZ3 3.79Å; T93-W99 HydrophobicContact CG2-CE3 3.9Å; T93-W99 HydrophobicContact CG2-CZ3 4.47Å; W99-F101 HydrophobicContact CD2-CD2 4.25Å; W99-F101 HydrophobicContact CE3-CD2 4.26Å; W99-F101 HydrophobicContact CH2-CB 4.45Å; W99-F101 HydrophobicContact CH2-CD2 4.17Å; W99-F101 HydrophobicContact CZ2-CB 3.69Å; W99-F101 HydrophobicContact CZ2-CD2 4.14Å; W99-F101 HydrophobicContact CZ2-CG 4.34Å; W99-F101 HydrophobicContact CZ3-CD2 4.23Å; W99-G102 PolarHBondContact NE1-O 2.84Å; W99-L105 VanDerWaalsContact CZ2-C 3.48Å; W99-L105 HydrophobicContact CZ2-CB 3.94Å; W99-C106 HydrophobicContact CZ2-CB 4.12Å; W99-F109 HydrophobicContact CH2-CB 3.95Å; W99-F109 AromaticContact CH2-CD1 3.75Å; W99-F109 HydrophobicContact CH2-CD1 3.75Å; W99-F109 AromaticContact CH2-CG 3.98Å; W99-F109 HydrophobicContact CH2-CG 3.98Å; W99-F109 HydrophobicContact CZ3-CD1 4.03Å; W99-L172 HydrophobicContact CB-CD1 4.02Å; W99-L172 HydrophobicContact CG-CD1 3.8Å; W99-Y190 WeakPolarHBondContact CB-O 3.28Å; W99-Y190 PolarHBondContact N-O 3.15Å; W99-C192 HydrophobicContact CB-CB 3.94Å; W99-C192 HydrophobicContact CD2-CB 3.39Å; W99-C192 HydrophobicContact CE3-CB 3.56Å; W99-C192 HydrophobicContact CG-CB 3.57Å; W99-C192 HydrophobicContact CZ3-CB 4.25Å
100I96.7Very high96.4Very high86 Ų8645.4 Ų45.444%0.44123%0.234SC..  trans-102.7-0-176.265.6169.6000114.1I92 N98I92-I100 HydrophobicContact CG2-CD1 3.97Å; I92-I100 HydrophobicContact CG2-CG1 4.43Å; N98-I100 PolarHBondContact O-N 3.34Å
101F97.1Very high96.3Very high57 Ų5745.6 Ų45.625%0.2523%0.234CC..SBendtrans-92.45.1-170.8-58.5-77.3000113.8I89 I92 W99 L105I89-F101 HydrophobicContact CB-CE2 4.23Å; I89-F101 HydrophobicContact CB-CZ 4.33Å; I89-F101 HydrophobicContact CG1-CE1 4.22Å; I89-F101 HydrophobicContact CG1-CE2 4.32Å; I89-F101 HydrophobicContact CG1-CZ 4.08Å; I89-F101 HydrophobicContact CG2-CD2 3.89Å; I89-F101 HydrophobicContact CG2-CE2 3.71Å; I89-F101 HydrophobicContact CG2-CZ 4.3Å; I92-F101 HydrophobicContact CB-CE2 4.37Å; I92-F101 HydrophobicContact CB-CZ 4.02Å; I92-F101 HydrophobicContact CD1-CZ 4.11Å; I92-F101 HydrophobicContact CG2-CE2 4.05Å; I92-F101 HydrophobicContact CG2-CZ 3.74Å; W99-F101 HydrophobicContact CD2-CD2 4.25Å; W99-F101 HydrophobicContact CE3-CD2 4.26Å; W99-F101 HydrophobicContact CH2-CB 4.45Å; W99-F101 HydrophobicContact CH2-CD2 4.17Å; W99-F101 HydrophobicContact CZ2-CB 3.69Å; W99-F101 HydrophobicContact CZ2-CD2 4.14Å; W99-F101 HydrophobicContact CZ2-CG 4.34Å; W99-F101 HydrophobicContact CZ3-CD2 4.23Å; F101-L105 HydrophobicContact CB-CB 3.98Å; F101-L105 HydrophobicContact CB-CD1 3.82Å; F101-L105 HydrophobicContact CD1-CD1 4.49Å
102G96.1Very high96.4Very high33 Ų3346.9 Ų46.934%0.3424%0.241SC..Hα-helixtrans74.8174.4178.700000114.3W99 C106W99-G102 PolarHBondContact NE1-O 2.84Å; G102-C106 PolarHBondContact O-N 3.29Å
103L96Very high96.3Very high79 Ų7945.9 Ų45.941%0.41424%0.235SC..Hα-helixtrans-64.1-45.7-173.5-177.368.5000114L105 C106 Y107 L172L103-L105 VanDerWaalsContact C-N 3.33Å; L103-L105 PolarHBondContact O-N 2.86Å; L103-C106 WeakPolarHBondContact O-CB 3.45Å; L103-C106 PolarHBondContact O-N 3.46Å; L103-Y107 HydrophobicContact CD1-CD2 4.2Å; L103-Y107 HydrophobicContact CD1-CE2 3.43Å; L103-Y107 VanDerWaalsContact CD1-CE2 3.43Å; L103-Y107 HydrophobicContact CD2-CE2 4.19Å; L103-Y107 HydrophobicContact CG-CD2 4.16Å; L103-Y107 HydrophobicContact CG-CE2 3.6Å; L103-Y107 WeakPolarHBondContact O-CD2 3.28Å; L103-Y107 PolarHBondContact O-N 3.32Å; L103-L172 HydrophobicContact CB-CD2 4.11Å; L103-L172 HydrophobicContact CD1-CB 3.52Å; L103-L172 HydrophobicContact CD1-CD2 4.22Å
104P96.9Very high96.4Very high88 Ų8844.9 Ų44.957%0.57123%0.229SC*.Hα-helixtrans-60.9-41.9-176.2-24.435.2000112.9C106 Y107 I108P104-C106 VanDerWaalsContact C-N 3.3Å; P104-C106 PolarHBondContact O-N 3Å; P104-Y107 PolarHBondContact O-N 3.32Å; P104-I108 WeakPolarHBondContact O-CB 3.48Å; P104-I108 WeakPolarHBondContact O-CG1 3.39Å; P104-I108 PolarHBondContact O-N 3.03Å; P104-I108 VanDerWaalsContact O-N 3.08Å
105L97.2Very high96.5Very high65 Ų6544.7 Ų44.734%0.3423%0.227SC..Hα-helixtrans-70.6-26.7177.3-78174.5000112.2W99 F101 L103 Y107 I108 F109W99-L105 VanDerWaalsContact CZ2-C 3.48Å; W99-L105 HydrophobicContact CZ2-CB 3.94Å; F101-L105 HydrophobicContact CB-CB 3.98Å; F101-L105 HydrophobicContact CB-CD1 3.82Å; F101-L105 HydrophobicContact CD1-CD1 4.49Å; L103-L105 VanDerWaalsContact C-N 3.33Å; L103-L105 PolarHBondContact O-N 2.86Å; L105-Y107 VanDerWaalsContact C-N 3.26Å; L105-Y107 PolarHBondContact O-N 2.68Å; L105-I108 PolarHBondContact O-N 3.49Å; L105-F109 WeakPolarHBondContact O-CB 3.22Å; L105-F109 PolarHBondContact O-N 3.36Å
106C98.1Very high96.7Very high0 Ų043.7 Ų43.70%022%0.222CC..Hα-helixtrans-62-36.2175.8178.60000112W99 G102 L103 P104 P110 N171 L172 C192W99-C106 HydrophobicContact CZ2-CB 4.12Å; G102-C106 PolarHBondContact O-N 3.29Å; L103-C106 WeakPolarHBondContact O-CB 3.45Å; L103-C106 PolarHBondContact O-N 3.46Å; P104-C106 VanDerWaalsContact C-N 3.3Å; P104-C106 PolarHBondContact O-N 3Å; C106-P110 WeakPolarHBondContact O-CD 3.49Å; C106-P110 WeakPolarHBondContact O-CG 3.42Å; C106-N171 PolarHBondContact SG-O 2.99Å; C106-L172 HydrophobicContact CB-CB 4.32Å; C106-L172 HydrophobicContact CB-CD1 4.44Å; C106-C192 WeakPolarHBondContact CA-SG 3.33Å; C106-C192 HydrophobicContact CB-CB 3.9Å; C106-C192 WeakPolarHBondContact CB-SG 3.24Å; C106-C192 PolarHBondContact O-SG 3.02Å; C106-C192 VanDerWaalsContact O-SG 3.4Å; C106-C192 VanDerWaalsContact SG-CA 3.59Å; C106-C192 WeakPolarHBondContact SG-CB 3.23Å; C106-C192 CovalentContact SG-SG 2.03Å; C106-C192 PolarHBondContact SG-SG 3.37Å
107Y97.1Very high96.8Very high74 Ų7437 Ų3729%0.2920%0.197SC..Hα-helixtrans-79.6-42.7175.3-65.8-63000113.2L103 P104 L105 L167 Y170 N171L103-Y107 HydrophobicContact CD1-CD2 4.2Å; L103-Y107 HydrophobicContact CD1-CE2 3.43Å; L103-Y107 VanDerWaalsContact CD1-CE2 3.43Å; L103-Y107 HydrophobicContact CD2-CE2 4.19Å; L103-Y107 HydrophobicContact CG-CD2 4.16Å; L103-Y107 HydrophobicContact CG-CE2 3.6Å; L103-Y107 WeakPolarHBondContact O-CD2 3.28Å; L103-Y107 PolarHBondContact O-N 3.32Å; P104-Y107 PolarHBondContact O-N 3.32Å; L105-Y107 VanDerWaalsContact C-N 3.26Å; L105-Y107 PolarHBondContact O-N 2.68Å; Y107-L167 VanDerWaalsContact CD1-O 3.3Å; Y107-L167 WeakPolarHBondContact CD1-O 3.39Å; Y107-Y170 VanDerWaalsContact CD1-O 3.23Å; Y107-Y170 WeakPolarHBondContact CD1-O 3.48Å; Y107-Y170 WeakPolarHBondContact CE1-O 3.49Å; Y107-N171 PolarHBondContact OH-OD1 3.37Å
108I97.2Very high97Very high73 Ų7336.4 Ų36.437%0.37419%0.194SC..Hα-helixtrans-78.8-35.5-172.4-66.4168.3000111.7P104 L105 L111 L112P104-I108 WeakPolarHBondContact O-CB 3.48Å; P104-I108 WeakPolarHBondContact O-CG1 3.39Å; P104-I108 PolarHBondContact O-N 3.03Å; P104-I108 VanDerWaalsContact O-N 3.08Å; L105-I108 PolarHBondContact O-N 3.49Å; I108-L111 WeakPolarHBondContact O-CB 3.48Å; I108-L111 PolarHBondContact O-N 2.84Å; I108-L112 HydrophobicContact CG2-CD1 3.67Å; I108-L112 HydrophobicContact CG2-CD2 4.43Å; I108-L112 HydrophobicContact CG2-CG 3.78Å; I108-L112 WeakPolarHBondContact O-CG 3.36Å; I108-L112 PolarHBondContact O-N 3.24Å
109F97.4Very high97.2Very high17 Ų1734.5 Ų34.58%0.07519%0.185CC..Hα-helixtrans-59.6-49.9-175.2167-106.7000113.4I89 T90 W99 L105 L111 L112 Q113I89-F109 HydrophobicContact CB-CD2 4.18Å; I89-F109 HydrophobicContact CB-CE2 3.94Å; I89-F109 HydrophobicContact CB-CZ 4.35Å; I89-F109 HydrophobicContact CD1-CD2 3.79Å; I89-F109 HydrophobicContact CD1-CE2 4.3Å; I89-F109 HydrophobicContact CD1-CG 4.44Å; I89-F109 HydrophobicContact CG2-CD1 4.18Å; I89-F109 HydrophobicContact CG2-CD2 3.94Å; I89-F109 HydrophobicContact CG2-CE1 4.16Å; I89-F109 HydrophobicContact CG2-CE2 3.93Å; I89-F109 HydrophobicContact CG2-CG 4.08Å; I89-F109 HydrophobicContact CG2-CZ 4.05Å; T90-F109 WeakPolarHBondContact OG1-CZ 3.49Å; W99-F109 HydrophobicContact CH2-CB 3.95Å; W99-F109 AromaticContact CH2-CD1 3.75Å; W99-F109 HydrophobicContact CH2-CD1 3.75Å; W99-F109 AromaticContact CH2-CG 3.98Å; W99-F109 HydrophobicContact CH2-CG 3.98Å; W99-F109 HydrophobicContact CZ3-CD1 4.03Å; L105-F109 WeakPolarHBondContact O-CB 3.22Å; L105-F109 PolarHBondContact O-N 3.36Å; F109-L111 VanDerWaalsContact C-N 3.3Å; F109-L111 PolarHBondContact O-N 3.13Å; F109-L112 PolarHBondContact O-N 2.84Å; F109-Q113 PolarHBondContact O-N 3.02Å
110P96.8Very high97.1Very high6 Ų634.1 Ų34.14%0.03918%0.184CC..Hα-helixtrans-61.7-37.2177.1-23.335.2000112.8C106 Q113 C114 M166 Y170C106-P110 WeakPolarHBondContact O-CD 3.49Å; C106-P110 WeakPolarHBondContact O-CG 3.42Å; P110-Q113 PolarHBondContact O-N 3.22Å; P110-C114 WeakPolarHBondContact O-CB 3.47Å; P110-C114 PolarHBondContact O-N 2.84Å; P110-M166 HydrophobicContact CB-CB 4.08Å; P110-Y170 HydrophobicContact CB-CD1 4.34Å; P110-Y170 HydrophobicContact CB-CD2 3.75Å; P110-Y170 HydrophobicContact CB-CE1 4.31Å; P110-Y170 HydrophobicContact CB-CE2 3.67Å; P110-Y170 HydrophobicContact CB-CG 4.06Å; P110-Y170 HydrophobicContact CG-CD1 3.5Å; P110-Y170 VanDerWaalsContact CG-CD1 3.5Å; P110-Y170 HydrophobicContact CG-CD2 3.77Å; P110-Y170 HydrophobicContact CG-CE1 3.7Å; P110-Y170 HydrophobicContact CG-CE2 3.92Å; P110-Y170 HydrophobicContact CG-CG 3.52Å
111L97.2Very high97.2Very high23 Ų2330 Ų3012%0.1216%0.163CC..Hα-helixtrans-58.6-51.8172.6174.676.7000111.1I108 F109 Q113 C114 M115 S163 L167I108-L111 WeakPolarHBondContact O-CB 3.48Å; I108-L111 PolarHBondContact O-N 2.84Å; F109-L111 VanDerWaalsContact C-N 3.3Å; F109-L111 PolarHBondContact O-N 3.13Å; L111-Q113 VanDerWaalsContact C-N 3.3Å; L111-Q113 PolarHBondContact O-N 2.69Å; L111-C114 PolarHBondContact O-N 3.12Å; L111-M115 WeakPolarHBondContact O-CB 3.34Å; L111-M115 VanDerWaalsContact O-CG 3.29Å; L111-M115 WeakPolarHBondContact O-CG 3.46Å; L111-M115 PolarHBondContact O-N 3.26Å; L111-S163 WeakPolarHBondContact CD1-O 3.37Å; L111-L167 HydrophobicContact CB-CB 4.26Å; L111-L167 HydrophobicContact CD1-CB 4.49Å; L111-L167 HydrophobicContact CD2-CD1 3.82Å
112L98Very high97.2Very high36 Ų3628.4 Ų28.419%0.18816%0.156CC..Hα-helixtrans-61.1-39.7-178.6-68.3178.5000111.7V81 T85 I108 F109 M115 S116V81-L112 HydrophobicContact CG1-CB 4.11Å; V81-L112 HydrophobicContact CG1-CD2 4.18Å; T85-L112 HydrophobicContact CG2-CD1 3.68Å; I108-L112 HydrophobicContact CG2-CD1 3.67Å; I108-L112 HydrophobicContact CG2-CD2 4.43Å; I108-L112 HydrophobicContact CG2-CG 3.78Å; I108-L112 WeakPolarHBondContact O-CG 3.36Å; I108-L112 PolarHBondContact O-N 3.24Å; F109-L112 PolarHBondContact O-N 2.84Å; L112-M115 HydrophobicContact CB-CE 4.49Å; L112-M115 HydrophobicContact CD2-CE 3.21Å; L112-M115 HydrophobicContact CD2-SD 3.98Å; L112-M115 HydrophobicContact CG-CE 4.4Å; L112-M115 WeakPolarHBondContact O-CG 3.49Å; L112-S116 WeakPolarHBondContact O-CB 3Å; L112-S116 PolarHBondContact O-N 3.09Å; L112-S116 VanDerWaalsContact O-N 3.1Å; L112-S116 PolarHBondContact O-OG 3.31Å
113Q96.4Very high97.3Very high45 Ų4526.9 Ų26.921%0.2114%0.139CC..Hα-helixtrans-65.7-50.7177.8-176.1178.35.600111.6F109 P110 L111 T117F109-Q113 PolarHBondContact O-N 3.02Å; P110-Q113 PolarHBondContact O-N 3.22Å; L111-Q113 VanDerWaalsContact C-N 3.3Å; L111-Q113 PolarHBondContact O-N 2.69Å; Q113-T117 PolarHBondContact O-N 3.15Å; Q113-T117 PolarHBondContact O-OG1 3.09Å
114C97Very high97.3Very high11 Ų1123.4 Ų23.47%0.07412%0.121CC..Hα-helixtrans-62.9-50.4-179.4-170.70000110.9P110 L111 S116 T117 I118 S163 M166P110-C114 WeakPolarHBondContact O-CB 3.47Å; P110-C114 PolarHBondContact O-N 2.84Å; L111-C114 PolarHBondContact O-N 3.12Å; C114-S116 VanDerWaalsContact C-N 3.35Å; C114-S116 PolarHBondContact O-N 3.34Å; C114-T117 PolarHBondContact O-N 3.22Å; C114-I118 WeakPolarHBondContact O-CG1 3.2Å; C114-I118 PolarHBondContact O-N 3.32Å; C114-S163 PolarHBondContact SG-OG 3.28Å; C114-S163 VanDerWaalsContact SG-OG 3.38Å; C114-M166 HydrophobicContact CB-CG 4.17Å
115M97.7Very high97.2Very high15 Ų1520.9 Ų20.97%0.07410%0.102CC..Hα-helixtrans-63.6-40.6-176.780.4179.9-163.500111.6V81 L111 L112 T117 I118 I119 A159 I160 S163V81-M115 HydrophobicContact CG1-CE 4.23Å; L111-M115 WeakPolarHBondContact O-CB 3.34Å; L111-M115 VanDerWaalsContact O-CG 3.29Å; L111-M115 WeakPolarHBondContact O-CG 3.46Å; L111-M115 PolarHBondContact O-N 3.26Å; L112-M115 HydrophobicContact CB-CE 4.49Å; L112-M115 HydrophobicContact CD2-CE 3.21Å; L112-M115 HydrophobicContact CD2-SD 3.98Å; L112-M115 HydrophobicContact CG-CE 4.4Å; L112-M115 WeakPolarHBondContact O-CG 3.49Å; M115-T117 VanDerWaalsContact C-N 3.26Å; M115-T117 PolarHBondContact O-N 3.32Å; M115-I118 PolarHBondContact O-N 3.26Å; M115-I119 WeakPolarHBondContact O-CB 3.37Å; M115-I119 VanDerWaalsContact O-CG1 3.23Å; M115-I119 WeakPolarHBondContact O-CG1 3.35Å; M115-I119 PolarHBondContact O-N 2.83Å; M115-A159 HydrophobicContact CB-CB 4.43Å; M115-I160 HydrophobicContact SD-CG1 4.02Å; M115-S163 WeakPolarHBondContact CA-OG 3.4Å; M115-S163 PolarHBondContact N-OG 3.15Å
116S98Very high97.2Very high0 Ų018 Ų180%09%0.088CC..Hα-helixtrans-66.6-34.2-177.2-59.70000111.3V81 L112 C114 S120V81-S116 VanDerWaalsContact CG1-OG 3.29Å; V81-S116 WeakPolarHBondContact CG1-OG 3.33Å; L112-S116 WeakPolarHBondContact O-CB 3Å; L112-S116 PolarHBondContact O-N 3.09Å; L112-S116 VanDerWaalsContact O-N 3.1Å; L112-S116 PolarHBondContact O-OG 3.31Å; C114-S116 VanDerWaalsContact C-N 3.35Å; C114-S116 PolarHBondContact O-N 3.34Å; S116-S120 WeakPolarHBondContact O-CB 3.41Å; S116-S120 PolarHBondContact O-N 2.88Å; S116-S120 PolarHBondContact O-OG 3.3Å
117T96.2Very high97Very high3 Ų318.1 Ų18.12%0.0189%0.089CC..Hα-helixtrans-73.7-38177.5-45.60000111.5Q113 C114 M115 S120 T121 F214 F282 W286Q113-T117 PolarHBondContact O-N 3.15Å; Q113-T117 PolarHBondContact O-OG1 3.09Å; C114-T117 PolarHBondContact O-N 3.22Å; M115-T117 VanDerWaalsContact C-N 3.26Å; M115-T117 PolarHBondContact O-N 3.32Å; T117-S120 PolarHBondContact O-N 3.02Å; T117-T121 PolarHBondContact O-N 3.42Å; T117-T121 PolarHBondContact O-OG1 3.46Å; T117-F214 HydrophobicContact CG2-CZ 4.01Å; T117-F282 HydrophobicContact CG2-CZ 4.17Å; T117-W286 HydrophobicContact CG2-CD2 3.79Å; T117-W286 HydrophobicContact CG2-CE3 3.87Å; T117-W286 HydrophobicContact CG2-CH2 3.46Å; T117-W286 VanDerWaalsContact CG2-CH2 3.46Å; T117-W286 HydrophobicContact CG2-CZ2 3.38Å; T117-W286 HydrophobicContact CG2-CZ3 3.71Å; T117-W286 WeakPolarHBondContact OG1-CH2 3.44Å; T117-W286 WeakPolarHBondContact OG1-CZ2 3.3Å
118I97.8Very high96.9Very high1 Ų114.6 Ų14.61%0.0058%0.075CC..Hα-helixtrans-65.1-46.8172.5-63.2167.7000110.6C114 M115 S120 T121 F122 A159 I162 Q213C114-I118 WeakPolarHBondContact O-CG1 3.2Å; C114-I118 PolarHBondContact O-N 3.32Å; M115-I118 PolarHBondContact O-N 3.26Å; I118-S120 VanDerWaalsContact C-N 3.25Å; I118-S120 PolarHBondContact O-N 3.31Å; I118-T121 PolarHBondContact O-N 2.84Å; I118-F122 HydrophobicContact CG2-CD1 4.33Å; I118-F122 HydrophobicContact CG2-CD2 3.96Å; I118-F122 HydrophobicContact CG2-CE1 4.29Å; I118-F122 HydrophobicContact CG2-CE2 3.91Å; I118-F122 HydrophobicContact CG2-CG 4.18Å; I118-F122 HydrophobicContact CG2-CZ 4.09Å; I118-F122 WeakPolarHBondContact O-CB 3.47Å; I118-F122 PolarHBondContact O-N 3.4Å; I118-A159 HydrophobicContact CB-CB 3.85Å; I118-A159 HydrophobicContact CG2-CB 3.65Å; I118-I162 HydrophobicContact CD1-CB 3.93Å; I118-I162 HydrophobicContact CD1-CG2 3.58Å; I118-Q213 HydrophobicContact CG1-CB 4.1Å; I118-Q213 HydrophobicContact CG1-CG 3.77Å
119I98.4Very high96.8Very high0 Ų013.8 Ų13.80%07%0.071CC..Hα-helixtrans-54.2-46.7175.4-70.5163.3000109.8M115 T121 T123 I155 W156 A159M115-I119 WeakPolarHBondContact O-CB 3.37Å; M115-I119 VanDerWaalsContact O-CG1 3.23Å; M115-I119 WeakPolarHBondContact O-CG1 3.35Å; M115-I119 PolarHBondContact O-N 2.83Å; I119-T121 PolarHBondContact O-N 3.35Å; I119-T123 WeakPolarHBondContact O-CB 3.49Å; I119-T123 PolarHBondContact O-N 3.49Å; I119-T123 PolarHBondContact O-OG1 3.31Å; I119-I155 HydrophobicContact CG1-CG2 4.44Å; I119-I155 HydrophobicContact CG2-CG2 4.43Å; I119-W156 HydrophobicContact CD1-CD2 3.65Å; I119-W156 HydrophobicContact CD1-CE3 3.76Å; I119-W156 HydrophobicContact CD1-CG 4.11Å; I119-W156 HydrophobicContact CD1-CH2 4.26Å; I119-W156 HydrophobicContact CD1-CZ2 4.16Å; I119-W156 HydrophobicContact CD1-CZ3 4.06Å; I119-W156 HydrophobicContact CG1-CD2 4.38Å; I119-W156 HydrophobicContact CG1-CG 4.37Å; I119-W156 HydrophobicContact CG2-CZ2 4.45Å; I119-A159 HydrophobicContact CD1-CB 4.29Å; I119-A159 HydrophobicContact CG1-CB 3.52Å
120S97Very high96.6Very high4 Ų413.2 Ų13.23%0.0287%0.069CC..Hα-helixtrans-59.9-48.7-179.4-60.80000111.6L75 S78 S116 T117 I118 T123 L124L75-S120 VanDerWaalsContact CD1-CA 3.47Å; S78-S120 PolarHBondContact OG-OG 2.88Å; S78-S120 VanDerWaalsContact OG-OG 3.07Å; S116-S120 WeakPolarHBondContact O-CB 3.41Å; S116-S120 PolarHBondContact O-N 2.88Å; S116-S120 PolarHBondContact O-OG 3.3Å; T117-S120 PolarHBondContact O-N 3.02Å; I118-S120 VanDerWaalsContact C-N 3.25Å; I118-S120 PolarHBondContact O-N 3.31Å; S120-T123 PolarHBondContact O-N 3.37Å; S120-L124 WeakPolarHBondContact O-CG 3.45Å; S120-L124 PolarHBondContact O-N 2.97Å
121T97Very high96.3Very high1 Ų115.1 Ų15.11%0.0068%0.075CC..Hα-helixtrans-70.1-42.5-176.6-42.30000112.4T117 I118 I119 T123 L124 M125 Q213 P217 F282T117-T121 PolarHBondContact O-N 3.42Å; T117-T121 PolarHBondContact O-OG1 3.46Å; I118-T121 PolarHBondContact O-N 2.84Å; I119-T121 PolarHBondContact O-N 3.35Å; T121-T123 VanDerWaalsContact C-N 3.32Å; T121-T123 PolarHBondContact O-N 2.94Å; T121-L124 PolarHBondContact O-N 2.94Å; T121-M125 PolarHBondContact O-N 3.24Å; T121-Q213 WeakPolarHBondContact CB-O 3.21Å; T121-Q213 WeakPolarHBondContact CG2-O 3.23Å; T121-P217 HydrophobicContact CG2-CB 3.57Å; T121-P217 HydrophobicContact CG2-CG 4.04Å; T121-F282 HydrophobicContact CG2-CE1 3.97Å; T121-F282 WeakPolarHBondContact OG1-CE1 3.26Å; T121-F282 WeakPolarHBondContact OG1-CZ 3.24Å
122F98.1Very high96.1Very high23 Ų2315.3 Ų15.310%0.1018%0.075CC..Hα-helixtrans-66.4-35.1175.8-79.110.2000112.2I118 M125 A126 I155 L158 I162 L212 P217I118-F122 HydrophobicContact CG2-CD1 4.33Å; I118-F122 HydrophobicContact CG2-CD2 3.96Å; I118-F122 HydrophobicContact CG2-CE1 4.29Å; I118-F122 HydrophobicContact CG2-CE2 3.91Å; I118-F122 HydrophobicContact CG2-CG 4.18Å; I118-F122 HydrophobicContact CG2-CZ 4.09Å; I118-F122 WeakPolarHBondContact O-CB 3.47Å; I118-F122 PolarHBondContact O-N 3.4Å; F122-M125 HydrophobicContact CD1-CE 4.16Å; F122-M125 HydrophobicContact CG-CE 4.44Å; F122-M125 PolarHBondContact O-N 3.05Å; F122-A126 WeakPolarHBondContact O-CB 3.41Å; F122-A126 PolarHBondContact O-N 2.88Å; F122-I155 HydrophobicContact CB-CB 4.46Å; F122-I155 HydrophobicContact CB-CD1 4.29Å; F122-I155 HydrophobicContact CB-CG1 4.05Å; F122-I155 HydrophobicContact CB-CG2 3.67Å; F122-I155 HydrophobicContact CD2-CG2 4.34Å; F122-L158 HydrophobicContact CE2-CB 4.37Å; F122-I162 HydrophobicContact CE2-CD1 4.47Å; F122-I162 HydrophobicContact CZ-CD1 4.43Å; F122-L212 VanDerWaalsContact CE1-O 3.25Å; F122-L212 WeakPolarHBondContact CE1-O 3.43Å; F122-P217 HydrophobicContact CD1-CG 3.87Å; F122-P217 HydrophobicContact CE1-CG 3.71Å
123T97.5Very high95.9Very high0 Ų016.5 Ų16.50%08%0.081CC..Hα-helixtrans-67-42174.7-60.70000111.3F71 L75 I119 S120 T121 M125 A126 I127F71-T123 HydrophobicContact CB-CG2 3.82Å; F71-T123 HydrophobicContact CD1-CG2 4.43Å; F71-T123 WeakPolarHBondContact O-CG2 3.47Å; L75-T123 HydrophobicContact CB-CG2 3.94Å; I119-T123 WeakPolarHBondContact O-CB 3.49Å; I119-T123 PolarHBondContact O-N 3.49Å; I119-T123 PolarHBondContact O-OG1 3.31Å; S120-T123 PolarHBondContact O-N 3.37Å; T121-T123 VanDerWaalsContact C-N 3.32Å; T121-T123 PolarHBondContact O-N 2.94Å; T123-M125 VanDerWaalsContact C-N 3.33Å; T123-M125 PolarHBondContact O-N 3.33Å; T123-A126 PolarHBondContact O-N 3.24Å; T123-I127 HydrophobicContact CG2-CD1 4.2Å; T123-I127 VanDerWaalsContact O-CG1 3.28Å; T123-I127 WeakPolarHBondContact O-CG1 3.17Å; T123-I127 PolarHBondContact O-N 3.34Å
124L95.7Very high95.6Very high6 Ų616.9 Ų16.93%0.0318%0.084CC..Hα-helixtrans-61.1-41.9172.9-73.3171.4000111.9L75 S120 T121 I127 A128 I221 M278 V279 F282L75-L124 HydrophobicContact CD2-CD2 4.13Å; S120-L124 WeakPolarHBondContact O-CG 3.45Å; S120-L124 PolarHBondContact O-N 2.97Å; T121-L124 PolarHBondContact O-N 2.94Å; L124-I127 PolarHBondContact O-N 3.06Å; L124-A128 PolarHBondContact O-N 3.25Å; L124-I221 HydrophobicContact CB-CD1 4.27Å; L124-M278 HydrophobicContact CD2-CB 4.31Å; L124-V279 HydrophobicContact CB-CG2 4.5Å; L124-V279 HydrophobicContact CD2-CG2 4.37Å; L124-F282 HydrophobicContact CD1-CB 3.85Å; L124-F282 HydrophobicContact CD1-CD1 3.96Å; L124-F282 HydrophobicContact CD1-CD2 3.98Å; L124-F282 HydrophobicContact CD1-CG 3.65Å
125M96.6Very high95.2Very high35 Ų3518.1 Ų18.117%0.1729%0.09CC..Hα-helixtrans-61-46.2174-177.2179.563.700111.9T121 F122 T123 I127 A128 I129 P217 V220 I221T121-M125 PolarHBondContact O-N 3.24Å; F122-M125 HydrophobicContact CD1-CE 4.16Å; F122-M125 HydrophobicContact CG-CE 4.44Å; F122-M125 PolarHBondContact O-N 3.05Å; T123-M125 VanDerWaalsContact C-N 3.33Å; T123-M125 PolarHBondContact O-N 3.33Å; M125-I127 VanDerWaalsContact C-N 3.33Å; M125-I127 PolarHBondContact O-N 3.44Å; M125-A128 WeakPolarHBondContact O-CB 3.46Å; M125-A128 PolarHBondContact O-N 3.11Å; M125-A128 VanDerWaalsContact O-N 3.14Å; M125-I129 HydrophobicContact CG-CD1 4.01Å; M125-I129 WeakPolarHBondContact O-CG1 3.5Å; M125-I129 PolarHBondContact O-N 3.46Å; M125-P217 HydrophobicContact CB-CB 4.42Å; M125-P217 HydrophobicContact SD-CB 4.16Å; M125-P217 HydrophobicContact SD-CG 4.39Å; M125-V220 HydrophobicContact CG-CB 4.04Å; M125-V220 HydrophobicContact CG-CG1 3.67Å; M125-V220 HydrophobicContact SD-CB 3.87Å; M125-V220 HydrophobicContact SD-CG1 3.92Å; M125-V220 HydrophobicContact SD-CG2 4.08Å; M125-I221 HydrophobicContact CB-CD1 4.17Å; M125-I221 HydrophobicContact CB-CG1 4.06Å; M125-I221 HydrophobicContact CG-CG1 4.39Å
126A96.6Very high94.9Very high5 Ų518.8 Ų18.84%0.0419%0.094CC..Hα-helixtrans-61.1-40.6176.700000112.2F71 F122 T123 I129 D130 M151 I155F71-A126 HydrophobicContact CD1-CB 4.07Å; F71-A126 HydrophobicContact CE1-CB 3.79Å; F71-A126 HydrophobicContact CZ-CB 4.07Å; F122-A126 WeakPolarHBondContact O-CB 3.41Å; F122-A126 PolarHBondContact O-N 2.88Å; T123-A126 PolarHBondContact O-N 3.24Å; A126-I129 PolarHBondContact O-N 3.37Å; A126-D130 WeakPolarHBondContact O-CB 3.44Å; A126-D130 PolarHBondContact O-N 3.32Å; A126-M151 HydrophobicContact CB-CE 3.97Å; A126-I155 HydrophobicContact CB-CD1 4.12Å
127I94.4Very high94.6Very high2 Ų223.7 Ų23.71%0.0111%0.114CC..Hα-helixtrans-61.5-44.4173.6-68.3165.2000110.6F71 I72 T123 L124 M125 D130 R131 L275F71-I127 HydrophobicContact CB-CD1 3.88Å; F71-I127 HydrophobicContact CB-CG1 3.53Å; F71-I127 HydrophobicContact CD2-CG1 4.32Å; F71-I127 HydrophobicContact CG-CG1 4.14Å; I72-I127 HydrophobicContact CG1-CD1 4.14Å; T123-I127 HydrophobicContact CG2-CD1 4.2Å; T123-I127 VanDerWaalsContact O-CG1 3.28Å; T123-I127 WeakPolarHBondContact O-CG1 3.17Å; T123-I127 PolarHBondContact O-N 3.34Å; L124-I127 PolarHBondContact O-N 3.06Å; M125-I127 VanDerWaalsContact C-N 3.33Å; M125-I127 PolarHBondContact O-N 3.44Å; I127-D130 PolarHBondContact O-N 3.47Å; I127-R131 VanDerWaalsContact O-CG 3.29Å; I127-R131 WeakPolarHBondContact O-CG 3.39Å; I127-R131 PolarHBondContact O-N 3.4Å; I127-L275 HydrophobicContact CG2-CD1 3.96Å; I127-L275 HydrophobicContact CG2-CD2 3.78Å; I127-L275 HydrophobicContact CG2-CG 4.41Å
128A94.2Very high94.1Very high0 Ų027.7 Ų27.70%014%0.139CC..Hα-helixtrans-62.6-43.6178.900000112.1L124 M125 R131 F132 I221 C224 Y225L124-A128 PolarHBondContact O-N 3.25Å; M125-A128 WeakPolarHBondContact O-CB 3.46Å; M125-A128 PolarHBondContact O-N 3.11Å; M125-A128 VanDerWaalsContact O-N 3.14Å; A128-R131 PolarHBondContact O-N 3.04Å; A128-F132 WeakPolarHBondContact O-CB 3.41Å; A128-F132 PolarHBondContact O-N 2.93Å; A128-I221 HydrophobicContact CB-CB 4.49Å; A128-I221 HydrophobicContact CB-CG1 4.09Å; A128-I221 HydrophobicContact CB-CG2 4.36Å; A128-C224 HydrophobicContact CB-CB 3.98Å; A128-Y225 HydrophobicContact CB-CE2 3.91Å
129I94.7Very high93.6Very high56 Ų5634 Ų3429%0.28718%0.178SC..Hα-helixtrans-63-47.9177.2-67.3165.9000111.2M125 A126 R131 F132 I133 V220M125-I129 HydrophobicContact CG-CD1 4.01Å; M125-I129 WeakPolarHBondContact O-CG1 3.5Å; M125-I129 PolarHBondContact O-N 3.46Å; A126-I129 PolarHBondContact O-N 3.37Å; I129-R131 VanDerWaalsContact C-N 3.28Å; I129-R131 PolarHBondContact O-N 3.1Å; I129-F132 WeakPolarHBondContact O-CB 3.41Å; I129-F132 PolarHBondContact O-N 2.9Å; I129-F132 VanDerWaalsContact O-N 3.13Å; I129-I133 HydrophobicContact CG2-CD1 3.91Å; I129-I133 HydrophobicContact CG2-CG1 4.47Å; I129-I133 WeakPolarHBondContact O-CG1 3.33Å; I129-I133 PolarHBondContact O-N 3.32Å; I129-V220 HydrophobicContact CD1-CG1 3.99Å; I129-V220 HydrophobicContact CG1-CG1 4.01Å
130D92.8Very high93.2Very high6 Ų640 Ų403%0.03220%0.204CC..Hα-helixtrans-57-42.9176.9163.376.2000111.2A126 I127 L134A126-D130 WeakPolarHBondContact O-CB 3.44Å; A126-D130 PolarHBondContact O-N 3.32Å; I127-D130 PolarHBondContact O-N 3.47Å; D130-L134 WeakPolarHBondContact O-CB 3.19Å; D130-L134 WeakPolarHBondContact O-CD1 3.43Å; D130-L134 VanDerWaalsContact O-CG 3.28Å; D130-L134 WeakPolarHBondContact O-CG 3.48Å; D130-L134 PolarHBondContact O-N 2.96Å; D130-L134 VanDerWaalsContact O-N 3.14Å
131R91.5Very high92.8Very high45 Ų4547.9 Ų47.917%0.1724%0.241CC..Hα-helixtrans-66.6-41.2175.2-67.9-55.395.3-171.68.2112.8I127 A128 I129 L134 I135 I228 L275I127-R131 VanDerWaalsContact O-CG 3.29Å; I127-R131 WeakPolarHBondContact O-CG 3.39Å; I127-R131 PolarHBondContact O-N 3.4Å; A128-R131 PolarHBondContact O-N 3.04Å; I129-R131 VanDerWaalsContact C-N 3.28Å; I129-R131 PolarHBondContact O-N 3.1Å; R131-L134 PolarHBondContact O-N 2.97Å; R131-I135 HydrophobicContact CB-CD1 4.47Å; R131-I135 WeakPolarHBondContact O-CB 3.42Å; R131-I135 WeakPolarHBondContact O-CD1 3.42Å; R131-I135 WeakPolarHBondContact O-CG1 3.16Å; R131-I135 PolarHBondContact O-N 3.24Å; R131-I135 VanDerWaalsContact O-N 3.11Å; R131-I228 HydrophobicContact CB-CD1 4Å; R131-L275 HydrophobicContact CG-CD1 3.5Å
132F92.8Very high92.4Very high28 Ų2851.3 Ų51.312%0.12326%0.263CS..Hα-helixtrans-58.2-50.5177.7166.4-98.1000110.6A128 I129 L134 I135 V136 Y137 F223 C224 S227 I228A128-F132 WeakPolarHBondContact O-CB 3.41Å; A128-F132 PolarHBondContact O-N 2.93Å; I129-F132 WeakPolarHBondContact O-CB 3.41Å; I129-F132 PolarHBondContact O-N 2.9Å; I129-F132 VanDerWaalsContact O-N 3.13Å; F132-L134 PolarHBondContact O-N 2.66Å; F132-I135 PolarHBondContact O-N 3.28Å; F132-V136 HydrophobicContact CD2-CB 4.26Å; F132-V136 HydrophobicContact CD2-CG2 3.64Å; F132-V136 HydrophobicContact CE2-CB 4.13Å; F132-V136 HydrophobicContact CE2-CG1 4.2Å; F132-V136 HydrophobicContact CE2-CG2 3.76Å; F132-V136 HydrophobicContact CG-CG2 4.42Å; F132-V136 HydrophobicContact CZ-CG1 4.44Å; F132-V136 VanDerWaalsContact O-CB 3.27Å; F132-V136 WeakPolarHBondContact O-CB 3.23Å; F132-V136 WeakPolarHBondContact O-CG2 3.44Å; F132-V136 PolarHBondContact O-N 2.99Å; F132-Y137 HydrophobicContact CE1-CD2 4.27Å; F132-Y137 AromaticContact CE1-CE2 3.69Å; F132-Y137 HydrophobicContact CE1-CE2 3.69Å; F132-Y137 AromaticContact CZ-CE2 3.71Å; F132-Y137 HydrophobicContact CZ-CE2 3.71Å; F132-F223 HydrophobicContact CE2-CE1 4.06Å; F132-F223 HydrophobicContact CE2-CZ 4.47Å; F132-F223 AromaticContact CZ-CE1 3.96Å; F132-F223 HydrophobicContact CZ-CE1 3.96Å; F132-F223 HydrophobicContact CZ-CZ 4.36Å; F132-C224 HydrophobicContact CB-CB 3.97Å; F132-C224 HydrophobicContact CG-CB 4.5Å; F132-S227 VanDerWaalsContact CE2-CB 3.41Å; F132-I228 HydrophobicContact CB-CD1 4.38Å
133I93Very high92.1Very high60 Ų6052.7 Ų52.731%0.30827%0.271SS..Hα-helixtrans-57.9-50.2178.4-65.6168.5000110.6I129 I135 Y137I129-I133 HydrophobicContact CG2-CD1 3.91Å; I129-I133 HydrophobicContact CG2-CG1 4.47Å; I129-I133 WeakPolarHBondContact O-CG1 3.33Å; I129-I133 PolarHBondContact O-N 3.32Å; I133-I135 VanDerWaalsContact C-N 3.27Å; I133-I135 PolarHBondContact O-N 3.13Å; I133-Y137 CarbonylContact O-C 3.46Å; I133-Y137 WeakPolarHBondContact O-CA 3.16Å; I133-Y137 PolarHBondContact O-N 3.1Å
134L90.9Very high92Very high54 Ų5458.3 Ų58.328%0.28330%0.297SS..Hα-helixtrans-66.3-23.7-175.4-73.1169.9000114.9D130 R131 F132 P142D130-L134 WeakPolarHBondContact O-CB 3.19Å; D130-L134 WeakPolarHBondContact O-CD1 3.43Å; D130-L134 VanDerWaalsContact O-CG 3.28Å; D130-L134 WeakPolarHBondContact O-CG 3.48Å; D130-L134 PolarHBondContact O-N 2.96Å; D130-L134 VanDerWaalsContact O-N 3.14Å; R131-L134 PolarHBondContact O-N 2.97Å; F132-L134 PolarHBondContact O-N 2.66Å; L134-P142 HydrophobicContact CD2-CB 3.76Å
135I88.9Confident91.9Very high37 Ų3763.1 Ų63.119%0.1932%0.318CS..Hα-helixtrans-102.7-43.4-175.7-64.7164.8000111.5R131 F132 I133 I228 R231 N272R131-I135 HydrophobicContact CB-CD1 4.47Å; R131-I135 WeakPolarHBondContact O-CB 3.42Å; R131-I135 WeakPolarHBondContact O-CD1 3.42Å; R131-I135 WeakPolarHBondContact O-CG1 3.16Å; R131-I135 PolarHBondContact O-N 3.24Å; R131-I135 VanDerWaalsContact O-N 3.11Å; F132-I135 PolarHBondContact O-N 3.28Å; I133-I135 VanDerWaalsContact C-N 3.27Å; I133-I135 PolarHBondContact O-N 3.13Å; I135-I228 HydrophobicContact CB-CG1 4.47Å; I135-I228 HydrophobicContact CD1-CD1 4.24Å; I135-I228 HydrophobicContact CD1-CG1 4.24Å; I135-I228 HydrophobicContact CD1-CG2 4.05Å; I135-I228 HydrophobicContact CG2-CG2 4.39Å; I135-R231 HydrophobicContact CG2-CG 4.4Å; I135-N272 WeakPolarHBondContact CD1-ND2 3.37Å; I135-N272 WeakPolarHBondContact CD1-OD1 3.44Å
136V90.7Very high92Very high29 Ų2971.5 Ų71.518%0.17635%0.348CS..Hα-helixtrans-79.2-37.1-176.9-179.10000110.6F132 P138 I228 R231F132-V136 HydrophobicContact CD2-CB 4.26Å; F132-V136 HydrophobicContact CD2-CG2 3.64Å; F132-V136 HydrophobicContact CE2-CB 4.13Å; F132-V136 HydrophobicContact CE2-CG1 4.2Å; F132-V136 HydrophobicContact CE2-CG2 3.76Å; F132-V136 HydrophobicContact CG-CG2 4.42Å; F132-V136 HydrophobicContact CZ-CG1 4.44Å; F132-V136 VanDerWaalsContact O-CB 3.27Å; F132-V136 WeakPolarHBondContact O-CB 3.23Å; F132-V136 WeakPolarHBondContact O-CG2 3.44Å; F132-V136 PolarHBondContact O-N 2.99Å; V136-P138 VanDerWaalsContact C-CD 3.46Å; V136-P138 VanDerWaalsContact O-CD 3.24Å; V136-P138 WeakPolarHBondContact O-CD 3.47Å; V136-I228 HydrophobicContact CG2-CG1 4.49Å; V136-R231 HydrophobicContact CG2-CB 4.36Å
137Y91.1Very high92Very high103 Ų10376.3 Ų76.340%0.40437%0.369SS..  trans-119.968.5-177.7-58.4-73.5000112.3F132 I133 T139 K140F132-Y137 HydrophobicContact CE1-CD2 4.27Å; F132-Y137 AromaticContact CE1-CE2 3.69Å; F132-Y137 HydrophobicContact CE1-CE2 3.69Å; F132-Y137 AromaticContact CZ-CE2 3.71Å; F132-Y137 HydrophobicContact CZ-CE2 3.71Å; I133-Y137 CarbonylContact O-C 3.46Å; I133-Y137 WeakPolarHBondContact O-CA 3.16Å; I133-Y137 PolarHBondContact O-N 3.1Å; Y137-T139 PolarHBondContact O-N 2.78Å; Y137-T139 VanDerWaalsContact O-N 3.09Å; Y137-K140 HydrophobicContact CG-CD 4.15Å; Y137-K140 PolarHBondContact O-N 3.37Å
138P86.2Confident92.1Very high86 Ų8676.2 Ų76.256%0.55837%0.369SS*.THydrogen-bonded Turntrans-65.3-16.2-173.328.3-36.9000114.7V136V136-P138 VanDerWaalsContact C-CD 3.46Å; V136-P138 VanDerWaalsContact O-CD 3.24Å; V136-P138 WeakPolarHBondContact O-CD 3.47Å
139T88.7Confident92.2Very high133 Ų13380 Ų8082%0.81639%0.391SS*.THydrogen-bonded Turntrans-86.4-13.317753.20000113.1Y137Y137-T139 PolarHBondContact O-N 2.78Å; Y137-T139 VanDerWaalsContact O-N 3.09Å
140K88.5Confident92.4Very high126 Ų12679.8 Ų79.855%0.54840%0.398SS..SBendtrans-76.5145.4175.7-71.3-170.4179.3-168.20110.1Y137Y137-K140 HydrophobicContact CG-CD 4.15Å; Y137-K140 PolarHBondContact O-N 3.37Å
141Q88.9Confident92.7Very high171 Ų17182.5 Ų82.580%0.79941%0.411SS*.PPolyproline II helixtrans-59.2134.9175.2-67.3-67-15.700110.1
142P89.4Confident93Very high73 Ų7381.7 Ų81.747%0.47441%0.41SS..PPolyproline II helixtrans-66.3151.4177.429.3-35.3000110.8L134 Q144L134-P142 HydrophobicContact CD2-CB 3.76Å; P142-Q144 PolarHBondContact O-N 3.46Å
143L92Very high93.3Very high52 Ų5284.5 Ų84.527%0.27243%0.429SS..PPolyproline II helixtrans-56.4128.7173.6-174.965.4000109.6V67 F71 H147 A148 M151V67-L143 HydrophobicContact CG1-CB 4.29Å; V67-L143 HydrophobicContact CG1-CD2 3.76Å; V67-L143 HydrophobicContact CG1-CG 4.15Å; V67-L143 WeakPolarHBondContact CG2-O 3.34Å; F71-L143 HydrophobicContact CE2-CD2 4.11Å; F71-L143 HydrophobicContact CZ-CD2 4.2Å; L143-H147 HydrophobicContact CD1-CB 3.53Å; L143-H147 HydrophobicContact CG-CB 4.41Å; L143-A148 HydrophobicContact CD2-CB 4.16Å; L143-M151 HydrophobicContact CD1-SD 4.3Å; L143-M151 HydrophobicContact CD2-SD 3.79Å
144Q94.1Very high93.5Very high118 Ų11884.7 Ų84.755%0.55144%0.436SS*.PPolyproline II helixtrans-84.1155.9177.6-56.2-176.114.100111.2P142 R146 H147 A148P142-Q144 PolarHBondContact O-N 3.46Å; Q144-R146 VanDerWaalsContact C-N 3.27Å; Q144-R146 PolarHBondContact O-N 3.24Å; Q144-H147 PolarHBondContact O-N 2.94Å; Q144-A148 PolarHBondContact O-N 3.28Å
145K95Very high93.9Very high107 Ų10782.9 Ų82.947%0.46543%0.426SS..Hα-helixtrans-55.4-39.6179.4-66.1-175.2179.5-173.10113.2Q65 V67 L70 H147 A148 V149Q65-K145 WeakPolarHBondContact O-CE 3.5Å; Q65-K145 PolarHBondContact O-NZ 3.25Å; V67-K145 HydrophobicContact CG2-CG 3.96Å; L70-K145 HydrophobicContact CD1-CB 4.33Å; L70-K145 HydrophobicContact CD1-CG 4.38Å; K145-H147 PolarHBondContact O-N 3.11Å; K145-A148 WeakPolarHBondContact O-CB 3.4Å; K145-A148 PolarHBondContact O-N 3.23Å; K145-V149 WeakPolarHBondContact O-CG2 3.14Å; K145-V149 PolarHBondContact O-N 3.08Å
146R96.8Very high94.4Very high211 Ų21184.5 Ų84.580%0.79643%0.43SS*.Hα-helixtrans-60.1-46.6179.3-66.8-179178.2175.6-1.1111.8Q144 V149 A150Q144-R146 VanDerWaalsContact C-N 3.27Å; Q144-R146 PolarHBondContact O-N 3.24Å; R146-V149 PolarHBondContact O-N 3.28Å; R146-A150 PolarHBondContact O-N 2.76Å
147H96.5Very high94.7Very high106 Ų10687.5 Ų87.549%0.49145%0.449SS..Hα-helixtrans-67.3-37.1176.9-61.1-58.6000112.1L143 Q144 K145 V149 A150 M151L143-H147 HydrophobicContact CD1-CB 3.53Å; L143-H147 HydrophobicContact CG-CB 4.41Å; Q144-H147 PolarHBondContact O-N 2.94Å; K145-H147 PolarHBondContact O-N 3.11Å; H147-V149 PolarHBondContact O-N 3.46Å; H147-A150 PolarHBondContact O-N 2.98Å; H147-M151 VanDerWaalsContact O-CG 3.29Å; H147-M151 WeakPolarHBondContact O-CG 3.29Å; H147-M151 PolarHBondContact O-N 3.06Å
148A96.9Very high95.1Very high0 Ų087.2 Ų87.20%045%0.454CS..Hα-helixtrans-62.6-41.7174.800000112.5V67 L70 F71 L143 Q144 K145 M151 I152V67-A148 HydrophobicContact CB-CB 4.4Å; V67-A148 HydrophobicContact CG1-CB 3.64Å; V67-A148 HydrophobicContact CG2-CB 4.23Å; L70-A148 HydrophobicContact CD1-CB 4.37Å; F71-A148 HydrophobicContact CE2-CB 4.23Å; F71-A148 HydrophobicContact CZ-CB 4.07Å; L143-A148 HydrophobicContact CD2-CB 4.16Å; Q144-A148 PolarHBondContact O-N 3.28Å; K145-A148 WeakPolarHBondContact O-CB 3.4Å; K145-A148 PolarHBondContact O-N 3.23Å; A148-M151 PolarHBondContact O-N 3.43Å; A148-I152 WeakPolarHBondContact O-CG1 3.3Å; A148-I152 PolarHBondContact O-N 3.04Å
149V98Very high95.7Very high78 Ų7883.1 Ų83.147%0.47343%0.427SS..Hα-helixtrans-64.6-44174.8172.50000110.9L70 K145 R146 H147 M151 I152 V153L70-V149 HydrophobicContact CD1-CG2 4.24Å; K145-V149 WeakPolarHBondContact O-CG2 3.14Å; K145-V149 PolarHBondContact O-N 3.08Å; R146-V149 PolarHBondContact O-N 3.28Å; H147-V149 PolarHBondContact O-N 3.46Å; V149-M151 VanDerWaalsContact C-N 3.31Å; V149-M151 PolarHBondContact O-N 2.91Å; V149-I152 PolarHBondContact O-N 2.94Å; V149-I152 VanDerWaalsContact O-N 3.17Å; V149-V153 WeakPolarHBondContact O-CG2 3.32Å; V149-V153 PolarHBondContact O-N 3.27Å
150A98.2Very high96.1Very high52 Ų5280.1 Ų80.143%0.4341%0.405SS..Hα-helixtrans-58.1-4417500000111.8R146 H147 I152 V153 S154R146-A150 PolarHBondContact O-N 2.76Å; H147-A150 PolarHBondContact O-N 2.98Å; A150-I152 PolarHBondContact O-N 3.13Å; A150-V153 PolarHBondContact O-N 3.31Å; A150-S154 PolarHBondContact O-N 3.2Å; A150-S154 PolarHBondContact O-OG 2.91Å; A150-S154 VanDerWaalsContact O-OG 3.05Å
151M98.1Very high96.6Very high63 Ų6375.9 Ų75.931%0.3140%0.397SS..Hα-helixtrans-60.6-42.9174.8-71.4173.168.500112.4F71 A126 L143 H147 A148 V149 S154 I155F71-M151 HydrophobicContact CE1-CB 4.15Å; F71-M151 HydrophobicContact CE1-CE 4.45Å; F71-M151 HydrophobicContact CZ-CB 4.3Å; F71-M151 HydrophobicContact CZ-CE 4Å; F71-M151 HydrophobicContact CZ-SD 4.06Å; A126-M151 HydrophobicContact CB-CE 3.97Å; L143-M151 HydrophobicContact CD1-SD 4.3Å; L143-M151 HydrophobicContact CD2-SD 3.79Å; H147-M151 VanDerWaalsContact O-CG 3.29Å; H147-M151 WeakPolarHBondContact O-CG 3.29Å; H147-M151 PolarHBondContact O-N 3.06Å; A148-M151 PolarHBondContact O-N 3.43Å; V149-M151 VanDerWaalsContact C-N 3.31Å; V149-M151 PolarHBondContact O-N 2.91Å; M151-S154 PolarHBondContact O-N 3.36Å; M151-I155 VanDerWaalsContact O-CG1 3.24Å; M151-I155 WeakPolarHBondContact O-CG1 3.38Å; M151-I155 PolarHBondContact O-N 3.41Å
152I98.6Very high97Very high28 Ų2869.4 Ų69.414%0.14437%0.368CS..Hα-helixtrans-60.8-48.4176.7-70165.3000110L70 F71 A148 V149 A150 S154 I155 W156L70-I152 HydrophobicContact CB-CD1 3.99Å; F71-I152 HydrophobicContact CD1-CD1 4.08Å; F71-I152 HydrophobicContact CD1-CG1 3.69Å; F71-I152 HydrophobicContact CE1-CD1 4.37Å; F71-I152 HydrophobicContact CE1-CG1 3.78Å; A148-I152 WeakPolarHBondContact O-CG1 3.3Å; A148-I152 PolarHBondContact O-N 3.04Å; V149-I152 PolarHBondContact O-N 2.94Å; V149-I152 VanDerWaalsContact O-N 3.17Å; A150-I152 PolarHBondContact O-N 3.13Å; I152-S154 VanDerWaalsContact C-N 3.31Å; I152-S154 PolarHBondContact O-N 3.47Å; I152-I155 PolarHBondContact O-N 3.41Å; I152-I155 VanDerWaalsContact O-N 3.17Å; I152-W156 PolarHBondContact O-N 3.13Å
153V98.5Very high97.4Very high87 Ų8765.9 Ų65.953%0.52735%0.345SS..Hα-helixtrans-57.4-46.4177.1174.20000110.7V149 A150 I155 W156 T157V149-V153 WeakPolarHBondContact O-CG2 3.32Å; V149-V153 PolarHBondContact O-N 3.27Å; A150-V153 PolarHBondContact O-N 3.31Å; V153-I155 PolarHBondContact O-N 2.91Å; V153-W156 PolarHBondContact O-N 2.93Å; V153-T157 PolarHBondContact O-N 2.9Å; V153-T157 PolarHBondContact O-OG1 3.31Å; V153-T157 VanDerWaalsContact O-OG1 3.06Å
154S98.4Very high97.7Very high65 Ų6567.1 Ų67.146%0.45535%0.351SS..Hα-helixtrans-60.3-42.6176.6-57.70000112.9A150 M151 I152 W156 T157 L158A150-S154 PolarHBondContact O-N 3.2Å; A150-S154 PolarHBondContact O-OG 2.91Å; A150-S154 VanDerWaalsContact O-OG 3.05Å; M151-S154 PolarHBondContact O-N 3.36Å; I152-S154 VanDerWaalsContact C-N 3.31Å; I152-S154 PolarHBondContact O-N 3.47Å; S154-W156 VanDerWaalsContact C-N 3.33Å; S154-W156 PolarHBondContact O-N 3.21Å; S154-T157 PolarHBondContact O-N 3.36Å; S154-L158 WeakPolarHBondContact O-CB 3.18Å; S154-L158 VanDerWaalsContact O-CG 3.23Å; S154-L158 WeakPolarHBondContact O-CG 3.1Å; S154-L158 PolarHBondContact O-N 2.93Å
155I98.6Very high97.9Very high15 Ų1563.1 Ų63.18%0.07734%0.336CS..Hα-helixtrans-59.3-45.8177-73.1167.3000110.5I119 F122 A126 M151 I152 V153 L158 A159I119-I155 HydrophobicContact CG1-CG2 4.44Å; I119-I155 HydrophobicContact CG2-CG2 4.43Å; F122-I155 HydrophobicContact CB-CB 4.46Å; F122-I155 HydrophobicContact CB-CD1 4.29Å; F122-I155 HydrophobicContact CB-CG1 4.05Å; F122-I155 HydrophobicContact CB-CG2 3.67Å; F122-I155 HydrophobicContact CD2-CG2 4.34Å; A126-I155 HydrophobicContact CB-CD1 4.12Å; M151-I155 VanDerWaalsContact O-CG1 3.24Å; M151-I155 WeakPolarHBondContact O-CG1 3.38Å; M151-I155 PolarHBondContact O-N 3.41Å; I152-I155 PolarHBondContact O-N 3.41Å; I152-I155 VanDerWaalsContact O-N 3.17Å; V153-I155 PolarHBondContact O-N 2.91Å; I155-L158 PolarHBondContact O-N 3.14Å; I155-A159 WeakPolarHBondContact O-CB 3.12Å; I155-A159 PolarHBondContact O-N 2.81Å
156W98.6Very high97.9Very high72 Ų7259.7 Ų59.727%0.27332%0.322SS..Hα-helixtrans-65.2-46179.2-80.464.4000111.8S74 C77 I119 I152 V153 S154 L158 A159 I160S74-W156 PolarHBondContact OG-NE1 2.9Å; C77-W156 HydrophobicContact CB-CH2 4.27Å; C77-W156 HydrophobicContact CB-CZ2 3.98Å; I119-W156 HydrophobicContact CD1-CD2 3.65Å; I119-W156 HydrophobicContact CD1-CE3 3.76Å; I119-W156 HydrophobicContact CD1-CG 4.11Å; I119-W156 HydrophobicContact CD1-CH2 4.26Å; I119-W156 HydrophobicContact CD1-CZ2 4.16Å; I119-W156 HydrophobicContact CD1-CZ3 4.06Å; I119-W156 HydrophobicContact CG1-CD2 4.38Å; I119-W156 HydrophobicContact CG1-CG 4.37Å; I119-W156 HydrophobicContact CG2-CZ2 4.45Å; I152-W156 PolarHBondContact O-N 3.13Å; V153-W156 PolarHBondContact O-N 2.93Å; S154-W156 VanDerWaalsContact C-N 3.33Å; S154-W156 PolarHBondContact O-N 3.21Å; W156-L158 PolarHBondContact O-N 3.02Å; W156-A159 PolarHBondContact O-N 3.5Å; W156-I160 WeakPolarHBondContact O-CB 3.34Å; W156-I160 VanDerWaalsContact O-CG1 3.28Å; W156-I160 WeakPolarHBondContact O-CG1 3.5Å; W156-I160 PolarHBondContact O-N 3.49Å
157T98.5Very high97.9Very high92 Ų9252.2 Ų52.256%0.56430%0.297SS*.Hα-helixtrans-60.2-45.3177.1-56.20000111.7V153 S154 G161V153-T157 PolarHBondContact O-N 2.9Å; V153-T157 PolarHBondContact O-OG1 3.31Å; V153-T157 VanDerWaalsContact O-OG1 3.06Å; S154-T157 PolarHBondContact O-N 3.36Å; T157-G161 PolarHBondContact O-N 3.5Å
158L98.2Very high97.9Very high96 Ų9652.6 Ų52.650%0.50330%0.302SS..Hα-helixtrans-65.3-43.8177.9-71.2170.8000111.8F122 S154 I155 W156 I160 G161 I162F122-L158 HydrophobicContact CE2-CB 4.37Å; S154-L158 WeakPolarHBondContact O-CB 3.18Å; S154-L158 VanDerWaalsContact O-CG 3.23Å; S154-L158 WeakPolarHBondContact O-CG 3.1Å; S154-L158 PolarHBondContact O-N 2.93Å; I155-L158 PolarHBondContact O-N 3.14Å; W156-L158 PolarHBondContact O-N 3.02Å; L158-I160 PolarHBondContact O-N 2.91Å; L158-G161 PolarHBondContact O-N 3.32Å; L158-I162 WeakPolarHBondContact O-CB 3.41Å; L158-I162 VanDerWaalsContact O-CG1 3.26Å; L158-I162 WeakPolarHBondContact O-CG1 3.18Å; L158-I162 PolarHBondContact O-N 2.98Å
159A98.6Very high97.9Very high0 Ų055.1 Ų55.10%031%0.314CS..Hα-helixtrans-62.4-43.517900000112.2M115 I118 I119 I155 W156 S163M115-A159 HydrophobicContact CB-CB 4.43Å; I118-A159 HydrophobicContact CB-CB 3.85Å; I118-A159 HydrophobicContact CG2-CB 3.65Å; I119-A159 HydrophobicContact CD1-CB 4.29Å; I119-A159 HydrophobicContact CG1-CB 3.52Å; I155-A159 WeakPolarHBondContact O-CB 3.12Å; I155-A159 PolarHBondContact O-N 2.81Å; W156-A159 PolarHBondContact O-N 3.5Å; A159-S163 VanDerWaalsContact O-CB 3.27Å; A159-S163 WeakPolarHBondContact O-CB 3.43Å; A159-S163 PolarHBondContact O-N 3.34Å; A159-S163 VanDerWaalsContact O-N 3.14Å; A159-S163 PolarHBondContact O-OG 3.27Å
160I98.2Very high97.8Very high70 Ų7053.2 Ų53.236%0.35930%0.299SS..Hα-helixtrans-61.3-51173.6-67.9165.5000109.2M115 W156 L158 I162 S163 I164M115-I160 HydrophobicContact SD-CG1 4.02Å; W156-I160 WeakPolarHBondContact O-CB 3.34Å; W156-I160 VanDerWaalsContact O-CG1 3.28Å; W156-I160 WeakPolarHBondContact O-CG1 3.5Å; W156-I160 PolarHBondContact O-N 3.49Å; L158-I160 PolarHBondContact O-N 2.91Å; I160-I162 PolarHBondContact O-N 2.85Å; I160-S163 CarbonylContact O-C 3.58Å; I160-S163 WeakPolarHBondContact O-CA 3.45Å; I160-S163 PolarHBondContact O-N 2.94Å; I160-I164 WeakPolarHBondContact O-CG1 3.34Å; I160-I164 PolarHBondContact O-N 2.86Å
161G98.1Very high97.8Very high37 Ų3753.6 Ų53.638%0.38129%0.293SS..Hα-helixtrans-55.9-47.2-179.100000113.8T157 L158 S163 I164T157-G161 PolarHBondContact O-N 3.5Å; L158-G161 PolarHBondContact O-N 3.32Å; G161-S163 PolarHBondContact O-N 3.18Å; G161-I164 PolarHBondContact O-N 3.44Å
162I98Very high97.8Very high35 Ų3552.3 Ų52.318%0.17929%0.287CS..Hα-helixtrans-65.1-28.2177.1-65.6164.7000111.4I118 F122 L158 I160 P165 Y205 V209 L212I118-I162 HydrophobicContact CD1-CB 3.93Å; I118-I162 HydrophobicContact CD1-CG2 3.58Å; F122-I162 HydrophobicContact CE2-CD1 4.47Å; F122-I162 HydrophobicContact CZ-CD1 4.43Å; L158-I162 WeakPolarHBondContact O-CB 3.41Å; L158-I162 VanDerWaalsContact O-CG1 3.26Å; L158-I162 WeakPolarHBondContact O-CG1 3.18Å; L158-I162 PolarHBondContact O-N 2.98Å; I160-I162 PolarHBondContact O-N 2.85Å; I162-P165 WeakPolarHBondContact O-CD 3.5Å; I162-Y205 WeakPolarHBondContact O-CE2 3.23Å; I162-Y205 PolarHBondContact O-OH 3.45Å; I162-V209 HydrophobicContact CG2-CG2 4.28Å; I162-L212 HydrophobicContact CD1-CD1 4.19Å; I162-L212 HydrophobicContact CG1-CD1 4.38Å; I162-L212 HydrophobicContact CG2-CD1 4.43Å
163S98.1Very high97.7Very high0 Ų054.8 Ų54.80%030%0.295CS..Hα-helixtrans-88.9-11.4-178.1-53.70000113.9L111 C114 M115 A159 I160 G161 P165 M166L111-S163 WeakPolarHBondContact CD1-O 3.37Å; C114-S163 PolarHBondContact SG-OG 3.28Å; C114-S163 VanDerWaalsContact SG-OG 3.38Å; M115-S163 WeakPolarHBondContact CA-OG 3.4Å; M115-S163 PolarHBondContact N-OG 3.15Å; A159-S163 VanDerWaalsContact O-CB 3.27Å; A159-S163 WeakPolarHBondContact O-CB 3.43Å; A159-S163 PolarHBondContact O-N 3.34Å; A159-S163 VanDerWaalsContact O-N 3.14Å; A159-S163 PolarHBondContact O-OG 3.27Å; I160-S163 CarbonylContact O-C 3.58Å; I160-S163 WeakPolarHBondContact O-CA 3.45Å; I160-S163 PolarHBondContact O-N 2.94Å; G161-S163 PolarHBondContact O-N 3.18Å; S163-P165 VanDerWaalsContact C-CD 3.49Å; S163-P165 VanDerWaalsContact C-N 3.34Å; S163-M166 WeakPolarHBondContact O-CB 3.49Å; S163-M166 PolarHBondContact O-N 3.05Å
164I98.1Very high97.4Very high77 Ų7755.2 Ų55.240%0.39529%0.29SS..Hα-helixtrans-53.6-41.9179.7-74.8169.9000112.9I160 G161 M166 L167 L168I160-I164 WeakPolarHBondContact O-CG1 3.34Å; I160-I164 PolarHBondContact O-N 2.86Å; G161-I164 PolarHBondContact O-N 3.44Å; I164-M166 PolarHBondContact O-N 3.21Å; I164-L167 WeakPolarHBondContact O-CA 3.07Å; I164-L167 VanDerWaalsContact O-CB 3.29Å; I164-L167 WeakPolarHBondContact O-CB 3.48Å; I164-L167 PolarHBondContact O-N 3.48Å; I164-L168 HydrophobicContact CG2-CD1 3.77Å; I164-L168 HydrophobicContact CG2-CG 4.04Å; I164-L168 PolarHBondContact O-N 2.65Å; I164-L168 VanDerWaalsContact O-N 3.11Å
165P97.5Very high97.1Very high35 Ų3554.1 Ų54.123%0.22728%0.279CS..Hα-helixtrans-59.2-30.8178.3-27.237.3000113.9I162 S163 L167 L168 H169 W196 Y205I162-P165 WeakPolarHBondContact O-CD 3.5Å; S163-P165 VanDerWaalsContact C-CD 3.49Å; S163-P165 VanDerWaalsContact C-N 3.34Å; P165-L167 VanDerWaalsContact C-N 3.27Å; P165-L167 PolarHBondContact O-N 3.41Å; P165-L168 PolarHBondContact O-N 3.46Å; P165-H169 WeakPolarHBondContact O-CB 3.33Å; P165-H169 PolarHBondContact O-CD2 2.87Å; P165-H169 PolarHBondContact O-N 3.38Å; P165-W196 HydrophobicContact CB-CH2 3.94Å; P165-Y205 HydrophobicContact CB-CD2 3.88Å; P165-Y205 HydrophobicContact CB-CE1 4.37Å; P165-Y205 HydrophobicContact CB-CE2 3.53Å; P165-Y205 HydrophobicContact CB-CG 4.45Å; P165-Y205 HydrophobicContact CG-CD2 4.02Å; P165-Y205 HydrophobicContact CG-CE2 3.53Å
166M95.4Very high96.8Very high35 Ų3556.5 Ų56.517%0.17230%0.296CS..Hα-helixtrans-62.8-34.7171.2-70.2-59.6-162.700112.1P110 C114 S163 I164 Y170 Y205P110-M166 HydrophobicContact CB-CB 4.08Å; C114-M166 HydrophobicContact CB-CG 4.17Å; S163-M166 WeakPolarHBondContact O-CB 3.49Å; S163-M166 PolarHBondContact O-N 3.05Å; I164-M166 PolarHBondContact O-N 3.21Å; M166-Y170 WeakPolarHBondContact O-CB 3.49Å; M166-Y170 WeakPolarHBondContact O-CD2 3.42Å; M166-Y170 PolarHBondContact O-N 2.88Å; M166-Y170 HydrophobicContact SD-CD2 4.33Å; M166-Y170 HydrophobicContact SD-CE2 3.74Å; M166-Y205 HydrophobicContact CE-CD1 4.44Å; M166-Y205 HydrophobicContact CE-CE1 3.68Å; M166-Y205 HydrophobicContact CG-CE1 3.84Å; M166-Y205 HydrophobicContact SD-CE1 3.71Å
167L96.2Very high96.2Very high54 Ų5458.5 Ų58.528%0.28330%0.304SS..Hα-helixtrans-69-38.7174.2179.9150.1000111.5Y107 L111 I164 P165Y107-L167 VanDerWaalsContact CD1-O 3.3Å; Y107-L167 WeakPolarHBondContact CD1-O 3.39Å; L111-L167 HydrophobicContact CB-CB 4.26Å; L111-L167 HydrophobicContact CD1-CB 4.49Å; L111-L167 HydrophobicContact CD2-CD1 3.82Å; I164-L167 WeakPolarHBondContact O-CA 3.07Å; I164-L167 VanDerWaalsContact O-CB 3.29Å; I164-L167 WeakPolarHBondContact O-CB 3.48Å; I164-L167 PolarHBondContact O-N 3.48Å; P165-L167 VanDerWaalsContact C-N 3.27Å; P165-L167 PolarHBondContact O-N 3.41Å
168L96.8Very high95.5Very high113 Ų11358 Ų5859%0.59230%0.295SS*.Hα-helixtrans-79.6-29.6-174.8-61.8176.6000113.4I164 P165I164-L168 HydrophobicContact CG2-CD1 3.77Å; I164-L168 HydrophobicContact CG2-CG 4.04Å; I164-L168 PolarHBondContact O-N 2.65Å; I164-L168 VanDerWaalsContact O-N 3.11Å; P165-L168 PolarHBondContact O-N 3.46Å
169H96.9Very high94.6Very high54 Ų5463.7 Ų63.725%0.2531%0.31CS..SBendtrans-109.614.4-173.6-66.3-67000114.1P165 E194 T195 W196P165-H169 WeakPolarHBondContact O-CB 3.33Å; P165-H169 PolarHBondContact O-CD2 2.87Å; P165-H169 PolarHBondContact O-N 3.38Å; H169-E194 CarbonylContact O-C 3.48Å; H169-E194 VanDerWaalsContact O-CA 3.31Å; H169-E194 WeakPolarHBondContact O-CA 3.35Å; H169-T195 PolarHBondContact O-N 3.25Å; H169-W196 HydrophobicContact CB-CD2 3.88Å; H169-W196 HydrophobicContact CB-CE3 4.01Å; H169-W196 HydrophobicContact CB-CG 4.44Å; H169-W196 HydrophobicContact CB-CH2 4.13Å; H169-W196 HydrophobicContact CB-CZ2 4.02Å; H169-W196 HydrophobicContact CB-CZ3 4.16Å; H169-W196 AromaticContact CD2-CE3 3.59Å; H169-W196 AromaticContact CD2-CH2 3.58Å; H169-W196 AromaticContact CD2-CZ3 3.17Å; H169-W196 WeakPolarHBondContact CD2-CZ3 3.32Å; H169-W196 AromaticContact CG-CD2 3.99Å; H169-W196 AromaticContact CG-CE3 3.61Å; H169-W196 AromaticContact CG-CZ3 3.67Å; H169-W196 AromaticContact NE2-CZ3 3.7Å
170Y97.3Very high93.7Very high38 Ų3870.5 Ų70.515%0.14934%0.336CS..EExtended strand (participates in β ladder)trans-100.4146.8162.6-94.4-103.6000110Y107 P110 M166 D193 E194Y107-Y170 VanDerWaalsContact CD1-O 3.23Å; Y107-Y170 WeakPolarHBondContact CD1-O 3.48Å; Y107-Y170 WeakPolarHBondContact CE1-O 3.49Å; P110-Y170 HydrophobicContact CB-CD1 4.34Å; P110-Y170 HydrophobicContact CB-CD2 3.75Å; P110-Y170 HydrophobicContact CB-CE1 4.31Å; P110-Y170 HydrophobicContact CB-CE2 3.67Å; P110-Y170 HydrophobicContact CB-CG 4.06Å; P110-Y170 HydrophobicContact CG-CD1 3.5Å; P110-Y170 VanDerWaalsContact CG-CD1 3.5Å; P110-Y170 HydrophobicContact CG-CD2 3.77Å; P110-Y170 HydrophobicContact CG-CE1 3.7Å; P110-Y170 HydrophobicContact CG-CE2 3.92Å; P110-Y170 HydrophobicContact CG-CG 3.52Å; M166-Y170 WeakPolarHBondContact O-CB 3.49Å; M166-Y170 WeakPolarHBondContact O-CD2 3.42Å; M166-Y170 PolarHBondContact O-N 2.88Å; M166-Y170 HydrophobicContact SD-CD2 4.33Å; M166-Y170 HydrophobicContact SD-CE2 3.74Å; Y170-D193 WeakPolarHBondContact CA-O 3.48Å; Y170-E194 HydrophobicContact CD2-CG 3.96Å; Y170-E194 HydrophobicContact CE1-CG 4.17Å; Y170-E194 HydrophobicContact CE2-CB 4.45Å; Y170-E194 HydrophobicContact CE2-CG 3.31Å; Y170-E194 VanDerWaalsContact CZ-CG 3.42Å; Y170-E194 PolarHBondContact OH-OE1 2.98Å
171N97.2Very high92.8Very high60 Ų6072.3 Ų72.332%0.32136%0.361SS..EExtended strand (participates in β ladder)trans-146.2156.3175.5-154.3-29.8000111.9C106 Y107 Y173 C192 D193 T195C106-N171 PolarHBondContact SG-O 2.99Å; Y107-N171 PolarHBondContact OH-OD1 3.37Å; N171-Y173 WeakPolarHBondContact O-CD1 3.28Å; N171-C192 WeakPolarHBondContact O-CA 3.48Å; N171-D193 PolarHBondContact N-O 3.44Å; N171-D193 PolarHBondContact O-N 3.25Å; N171-T195 HydrophobicContact CB-CG2 3.76Å
172L97.8Very high92.1Very high35 Ų3578.4 Ų78.418%0.18339%0.385CS..EExtended strand (participates in β ladder)trans-96.9115.8172.9-171.274.7000109.8W99 L103 C106 Y190 F191 C192W99-L172 HydrophobicContact CB-CD1 4.02Å; W99-L172 HydrophobicContact CG-CD1 3.8Å; L103-L172 HydrophobicContact CB-CD2 4.11Å; L103-L172 HydrophobicContact CD1-CB 3.52Å; L103-L172 HydrophobicContact CD1-CD2 4.22Å; C106-L172 HydrophobicContact CB-CB 4.32Å; C106-L172 HydrophobicContact CB-CD1 4.44Å; L172-Y190 HydrophobicContact CD1-CG 4.42Å; L172-Y190 HydrophobicContact CD2-CD1 4.27Å; L172-Y190 HydrophobicContact CD2-CG 4.34Å; L172-Y190 HydrophobicContact CG-CD1 4.17Å; L172-Y190 HydrophobicContact CG-CG 4.3Å; L172-F191 CarbonylContact C-O 3.57Å; L172-F191 WeakPolarHBondContact CA-O 3.4Å; L172-C192 HydrophobicContact CD1-CB 4.28Å
173Y95.9Very high91.4Very high80 Ų8082.6 Ų82.631%0.31440%0.403SS..EExtended strand (participates in β ladder)trans-141.1169.8-176.662.9-83.7000112.6N171 I175 F191 D193 T195N171-Y173 WeakPolarHBondContact O-CD1 3.28Å; Y173-I175 HydrophobicContact CD2-CG1 4.08Å; Y173-I175 HydrophobicContact CE2-CD1 4.2Å; Y173-I175 HydrophobicContact CE2-CG1 3.59Å; Y173-F191 HydrophobicContact CE2-CB 4.37Å; Y173-F191 PolarHBondContact N-O 3.1Å; Y173-F191 PolarHBondContact O-N 3.5Å; Y173-D193 HydrophobicContact CE1-CB 3.91Å; Y173-D193 WeakPolarHBondContact OH-CB 3.42Å; Y173-T195 HydrophobicContact CD1-CG2 4.27Å; Y173-T195 HydrophobicContact CE1-CG2 4.16Å
174K94Very high90.8Very high97 Ų9784.5 Ų84.542%0.42242%0.415SS..  trans-104.9143.5170.8-65.1-171.9176.41790109.4W186 Y190K174-W186 HydrophobicContact CB-CD2 4.45Å; K174-W186 HydrophobicContact CB-CE3 3.7Å; K174-W186 HydrophobicContact CB-CZ3 4.14Å; K174-W186 WeakPolarHBondContact O-CZ3 3.32Å; K174-Y190 HydrophobicContact CD-CE1 4.28Å; K174-Y190 HydrophobicContact CG-CD1 3.89Å; K174-Y190 HydrophobicContact CG-CE1 3.95Å
175I91.9Very high90.3Very high41 Ų4181.7 Ų81.721%0.2140%0.401CS..  trans-98.3128.3177.9-62172.4000109Y173 Y187 F191Y173-I175 HydrophobicContact CD2-CG1 4.08Å; Y173-I175 HydrophobicContact CE2-CD1 4.2Å; Y173-I175 HydrophobicContact CE2-CG1 3.59Å; I175-Y187 HydrophobicContact CB-CD2 3.79Å; I175-Y187 HydrophobicContact CB-CE2 4.44Å; I175-Y187 HydrophobicContact CG2-CD2 3.63Å; I175-Y187 HydrophobicContact CG2-CE2 3.78Å; I175-Y187 WeakPolarHBondContact O-CD2 3.34Å; I175-Y187 PolarHBondContact O-N 2.96Å; I175-F191 HydrophobicContact CB-CD2 4.19Å; I175-F191 HydrophobicContact CB-CE2 4.1Å; I175-F191 HydrophobicContact CD1-CB 4.15Å; I175-F191 HydrophobicContact CD1-CD1 3.67Å; I175-F191 HydrophobicContact CD1-CD2 3.58Å; I175-F191 HydrophobicContact CD1-CE1 3.91Å; I175-F191 HydrophobicContact CD1-CE2 3.84Å; I175-F191 HydrophobicContact CD1-CG 3.5Å; I175-F191 VanDerWaalsContact CD1-CG 3.5Å; I175-F191 HydrophobicContact CD1-CZ 3.99Å; I175-F191 HydrophobicContact CG1-CB 4.45Å; I175-F191 HydrophobicContact CG1-CD2 3.61Å; I175-F191 HydrophobicContact CG1-CE2 3.97Å; I175-F191 HydrophobicContact CG1-CG 3.96Å
176P90.7Very high90Very high66 Ų6684.7 Ų84.743%0.42941%0.408SS..EExtended strand (participates in β ladder)trans-72.3133.9173.130.4-32.8000110.1T184 W186P176-T184 HydrophobicContact CB-CG2 3.69Å; P176-W186 HydrophobicContact CB-CE3 4.05Å; P176-W186 HydrophobicContact CB-CH2 4.42Å; P176-W186 HydrophobicContact CB-CZ3 3.94Å; P176-W186 HydrophobicContact CG-CZ3 4.28Å
177Y86.8Confident89.9Confident114 Ų11483.8 Ų83.845%0.44740%0.403SS..EExtended strand (participates in β ladder)trans-86.9-56.7174.2169.4-112.5000110.8T13 F18 V185 Y187T13-Y177 HydrophobicContact CG2-CD2 4.45Å; T13-Y177 HydrophobicContact CG2-CG 4.48Å; T13-Y177 WeakPolarHBondContact OG1-CD1 3.49Å; F18-Y177 HydrophobicContact CD2-CE2 4.47Å; Y177-V185 HydrophobicContact CD1-CB 4.38Å; Y177-V185 HydrophobicContact CD1-CG1 4.07Å; Y177-V185 PolarHBondContact N-O 3.25Å; Y177-Y187 AromaticContact CD2-CE1 3.68Å; Y177-Y187 HydrophobicContact CD2-CE1 3.68Å; Y177-Y187 HydrophobicContact CD2-CE2 4.3Å; Y177-Y187 AromaticContact CD2-CZ 3.56Å; Y177-Y187 WeakPolarHBondContact CD2-OH 3.14Å; Y177-Y187 HydrophobicContact CE2-CE1 4.49Å; Y177-Y187 HydrophobicContact CG-CE1 4.3Å
178E83.8Confident89.7Confident80 Ų8083 Ų8337%0.37440%0.402SS..EExtended strand (participates in β ladder)trans-139.2129.8-176.4-172.6-173.3-169.700109.5R180 V185E178-R180 HydrophobicContact CG-CG 4.17Å; E178-R180 IonicContact OE1-NE 2.88Å; E178-R180 IonicContact OE2-CZ 3.92Å; E178-R180 IonicContact OE2-NE 3.96Å; E178-R180 PolarHBondContact OE2-NE 2.75Å; E178-R180 IonicContact OE2-NH2 2.72Å; E178-R180 PolarHBondContact OE2-NH2 3.07Å; E178-V185 HydrophobicContact CB-CB 4.35Å; E178-V185 PolarHBondContact N-O 3.03Å; E178-V185 PolarHBondContact O-N 3.11Å
179R79.3Confident89.6Confident216 Ų21678.8 Ų78.882%0.81539%0.385SS*.EExtended strand (participates in β ladder)trans-95.298.9172.3-169.8-177.6-72.8-166.2-0.7108.8
180R78.8Confident89.5Confident144 Ų14481.3 Ų81.354%0.54339%0.393SS..EExtended strand (participates in β ladder)trans-84.4159.6171.1-59.4-178.7-178.9173.70.7110.1E178 N182 H183E178-R180 HydrophobicContact CG-CG 4.17Å; E178-R180 IonicContact OE1-NE 2.88Å; E178-R180 IonicContact OE2-CZ 3.92Å; E178-R180 IonicContact OE2-NE 3.96Å; E178-R180 PolarHBondContact OE2-NE 2.75Å; E178-R180 IonicContact OE2-NH2 2.72Å; E178-R180 PolarHBondContact OE2-NH2 3.07Å; R180-N182 PolarHBondContact O-N 3.21Å; R180-N182 VanDerWaalsContact O-N 3.08Å; R180-H183 WeakPolarHBondContact CA-O 3.08Å; R180-H183 VanDerWaalsContact CB-O 3.29Å; R180-H183 WeakPolarHBondContact CB-O 3.42Å; R180-H183 PolarHBondContact N-O 2.84Å; R180-H183 PolarHBondContact O-N 2.98Å
181A80.1Confident89.5Confident107 Ų10780.6 Ų80.688%0.88439%0.391SS*.THydrogen-bonded Turntrans-49.4-39.5-175.300000114.3
182N83.1Confident89.5Confident166 Ų16678.9 Ų78.989%0.88838%0.383SS*.THydrogen-bonded Turntrans-115.7-0.9-178.7-72.1-4.7000114.6R180R180-N182 PolarHBondContact O-N 3.21Å; R180-N182 VanDerWaalsContact O-N 3.08Å
183H83.8Confident89.3Confident123 Ų12380.7 Ų80.757%0.56939%0.393SS*.EExtended strand (participates in β ladder)trans-155.8138.7-175.9-161.8-83.3000111.8R180R180-H183 WeakPolarHBondContact CA-O 3.08Å; R180-H183 VanDerWaalsContact CB-O 3.29Å; R180-H183 WeakPolarHBondContact CB-O 3.42Å; R180-H183 PolarHBondContact N-O 2.84Å; R180-H183 PolarHBondContact O-N 2.98Å
184T85.1Confident89.3Confident39 Ų3978.7 Ų78.724%0.23939%0.387CS..EExtended strand (participates in β ladder)trans-95.5120.3170.1-57.50000108.9P176 W186P176-T184 HydrophobicContact CB-CG2 3.69Å; T184-W186 HydrophobicContact CG2-CD2 4.22Å; T184-W186 HydrophobicContact CG2-CH2 4.39Å; T184-W186 HydrophobicContact CG2-CZ2 3.81Å; T184-W186 PolarHBondContact O-NE1 3.37Å
185V87.1Confident89.4Confident18 Ų1877 Ų7711%0.10938%0.384CS..EExtended strand (participates in β ladder)trans-83.6130.8171.4-175.70000107.6Y177 E178Y177-V185 HydrophobicContact CD1-CB 4.38Å; Y177-V185 HydrophobicContact CD1-CG1 4.07Å; Y177-V185 PolarHBondContact N-O 3.25Å; E178-V185 HydrophobicContact CB-CB 4.35Å; E178-V185 PolarHBondContact N-O 3.03Å; E178-V185 PolarHBondContact O-N 3.11Å
186W91.4Very high89.6Confident98 Ų9877 Ų7737%0.37138%0.381SS..EExtended strand (participates in β ladder)trans-109156.2-176.7-59.987000110.7C12 T13 K174 P176 T184C12-W186 CarbonylContact C-O 3.53Å; C12-W186 WeakPolarHBondContact CA-O 3.46Å; C12-W186 VanDerWaalsContact CB-O 3.24Å; C12-W186 WeakPolarHBondContact CB-O 3.36Å; T13-W186 PolarHBondContact N-O 2.9Å; K174-W186 HydrophobicContact CB-CD2 4.45Å; K174-W186 HydrophobicContact CB-CE3 3.7Å; K174-W186 HydrophobicContact CB-CZ3 4.14Å; K174-W186 WeakPolarHBondContact O-CZ3 3.32Å; P176-W186 HydrophobicContact CB-CE3 4.05Å; P176-W186 HydrophobicContact CB-CH2 4.42Å; P176-W186 HydrophobicContact CB-CZ3 3.94Å; P176-W186 HydrophobicContact CG-CZ3 4.28Å; T184-W186 HydrophobicContact CG2-CD2 4.22Å; T184-W186 HydrophobicContact CG2-CH2 4.39Å; T184-W186 HydrophobicContact CG2-CZ2 3.81Å; T184-W186 PolarHBondContact O-NE1 3.37Å
187Y93.6Very high89.8Confident16 Ų1678.6 Ų78.66%0.06339%0.392CS..EExtended strand (participates in β ladder)trans-68.1151.5162-69.3-72.2000111.2T13 Y15 F18 I175 Y177T13-Y187 HydrophobicContact CG2-CD1 4.33Å; T13-Y187 HydrophobicContact CG2-CE1 4.3Å; T13-Y187 CarbonylContact O-C 3.47Å; T13-Y187 VanDerWaalsContact O-CA 3.24Å; T13-Y187 WeakPolarHBondContact O-CA 3.36Å; Y15-Y187 AromaticContact CD2-CD1 3.73Å; Y15-Y187 HydrophobicContact CD2-CD1 3.73Å; Y15-Y187 AromaticContact CD2-CD2 3.83Å; Y15-Y187 HydrophobicContact CD2-CD2 3.83Å; Y15-Y187 AromaticContact CD2-CE1 3.81Å; Y15-Y187 HydrophobicContact CD2-CE1 3.81Å; Y15-Y187 AromaticContact CD2-CE2 3.89Å; Y15-Y187 HydrophobicContact CD2-CE2 3.89Å; Y15-Y187 AromaticContact CD2-CG 3.72Å; Y15-Y187 HydrophobicContact CD2-CG 3.72Å; Y15-Y187 AromaticContact CD2-CZ 3.86Å; Y15-Y187 HydrophobicContact CE2-CD2 4.46Å; Y15-Y187 HydrophobicContact CE2-CE2 4.24Å; Y15-Y187 HydrophobicContact CG-CD1 4.24Å; Y15-Y187 HydrophobicContact CG-CG 4.41Å; F18-Y187 HydrophobicContact CB-CE1 3.87Å; F18-Y187 HydrophobicContact CD1-CE1 4.24Å; F18-Y187 WeakPolarHBondContact CD1-OH 3.4Å; F18-Y187 HydrophobicContact CD2-CE1 4.39Å; F18-Y187 WeakPolarHBondContact CD2-OH 3.23Å; F18-Y187 WeakPolarHBondContact CE1-OH 3.39Å; F18-Y187 WeakPolarHBondContact CE2-OH 3.36Å; F18-Y187 AromaticContact CG-CE1 3.91Å; F18-Y187 HydrophobicContact CG-CE1 3.91Å; F18-Y187 WeakPolarHBondContact CG-OH 3.33Å; F18-Y187 WeakPolarHBondContact CZ-OH 3.45Å; I175-Y187 HydrophobicContact CB-CD2 3.79Å; I175-Y187 HydrophobicContact CB-CE2 4.44Å; I175-Y187 HydrophobicContact CG2-CD2 3.63Å; I175-Y187 HydrophobicContact CG2-CE2 3.78Å; I175-Y187 WeakPolarHBondContact O-CD2 3.34Å; I175-Y187 PolarHBondContact O-N 2.96Å; Y177-Y187 AromaticContact CD2-CE1 3.68Å; Y177-Y187 HydrophobicContact CD2-CE1 3.68Å; Y177-Y187 HydrophobicContact CD2-CE2 4.3Å; Y177-Y187 AromaticContact CD2-CZ 3.56Å; Y177-Y187 WeakPolarHBondContact CD2-OH 3.14Å; Y177-Y187 HydrophobicContact CE2-CE1 4.49Å; Y177-Y187 HydrophobicContact CG-CE1 4.3Å
188C92.7Very high90.2Very high39 Ų3977.3 Ų77.326%0.26439%0.393SS..SBendtrans-70.6140.7176.5-61.70000111.2C12 T13C12-C188 HydrophobicContact CB-CB 3.95Å; C12-C188 WeakPolarHBondContact CB-SG 2.82Å; C12-C188 PolarHBondContact O-SG 3.44Å; C12-C188 VanDerWaalsContact O-SG 3.38Å; C12-C188 WeakPolarHBondContact SG-CA 3.28Å; C12-C188 WeakPolarHBondContact SG-CB 3.37Å; C12-C188 CovalentContact SG-SG 2.04Å; C12-C188 PolarHBondContact SG-SG 3Å; T13-C188 PolarHBondContact O-N 3.44Å
189G93.4Very high90.7Very high23 Ų2378.2 Ų78.224%0.23740%0.404CS..SBendtrans87.2-157176.500000114.5N98N98-G189 WeakPolarHBondContact OD1-CA 3.37Å
190Y96Very high91.5Very high108 Ų10874 Ų7442%0.42439%0.393SS..  trans-132.7153.1-178.6-64.3-87.1000110.4N98 W99 L172 K174N98-Y190 PolarHBondContact OD1-N 3.47Å; N98-Y190 PolarHBondContact OD1-O 3.28Å; W99-Y190 WeakPolarHBondContact CB-O 3.28Å; W99-Y190 PolarHBondContact N-O 3.15Å; L172-Y190 HydrophobicContact CD1-CG 4.42Å; L172-Y190 HydrophobicContact CD2-CD1 4.27Å; L172-Y190 HydrophobicContact CD2-CG 4.34Å; L172-Y190 HydrophobicContact CG-CD1 4.17Å; L172-Y190 HydrophobicContact CG-CG 4.3Å; K174-Y190 HydrophobicContact CD-CE1 4.28Å; K174-Y190 HydrophobicContact CG-CD1 3.89Å; K174-Y190 HydrophobicContact CG-CE1 3.95Å
191F96Very high92.4Very high23 Ų2368.4 Ų68.410%0.10138%0.378CS..EExtended strand (participates in β ladder)trans-119.3137.5177.6-61.3-94000108.5Y15 K97 L172 Y173 I175Y15-F191 AromaticContact CD1-CE1 3.93Å; Y15-F191 HydrophobicContact CD1-CE1 3.93Å; Y15-F191 HydrophobicContact CD1-CZ 4.18Å; Y15-F191 AromaticContact CD2-CE1 3.97Å; Y15-F191 HydrophobicContact CD2-CE1 3.97Å; Y15-F191 AromaticContact CD2-CZ 3.65Å; Y15-F191 HydrophobicContact CD2-CZ 3.65Å; Y15-F191 HydrophobicContact CE1-CE1 4.1Å; Y15-F191 HydrophobicContact CE2-CE1 4.16Å; Y15-F191 HydrophobicContact CE2-CZ 4.22Å; Y15-F191 AromaticContact CG-CE1 3.84Å; Y15-F191 HydrophobicContact CG-CE1 3.84Å; Y15-F191 AromaticContact CG-CZ 3.62Å; Y15-F191 HydrophobicContact CG-CZ 3.62Å; K97-F191 WeakPolarHBondContact O-CE1 3.17Å; L172-F191 CarbonylContact C-O 3.57Å; L172-F191 WeakPolarHBondContact CA-O 3.4Å; Y173-F191 HydrophobicContact CE2-CB 4.37Å; Y173-F191 PolarHBondContact N-O 3.1Å; Y173-F191 PolarHBondContact O-N 3.5Å; I175-F191 HydrophobicContact CB-CD2 4.19Å; I175-F191 HydrophobicContact CB-CE2 4.1Å; I175-F191 HydrophobicContact CD1-CB 4.15Å; I175-F191 HydrophobicContact CD1-CD1 3.67Å; I175-F191 HydrophobicContact CD1-CD2 3.58Å; I175-F191 HydrophobicContact CD1-CE1 3.91Å; I175-F191 HydrophobicContact CD1-CE2 3.84Å; I175-F191 HydrophobicContact CD1-CG 3.5Å; I175-F191 VanDerWaalsContact CD1-CG 3.5Å; I175-F191 HydrophobicContact CD1-CZ 3.99Å; I175-F191 HydrophobicContact CG1-CB 4.45Å; I175-F191 HydrophobicContact CG1-CD2 3.61Å; I175-F191 HydrophobicContact CG1-CE2 3.97Å; I175-F191 HydrophobicContact CG1-CG 3.96Å
192C97.3Very high93.1Very high23 Ų2366 Ų6616%0.15535%0.346CS..EExtended strand (participates in β ladder)trans-115.6108.6174.1-179.70000107.7W99 C106 N171 L172W99-C192 HydrophobicContact CB-CB 3.94Å; W99-C192 HydrophobicContact CD2-CB 3.39Å; W99-C192 HydrophobicContact CE3-CB 3.56Å; W99-C192 HydrophobicContact CG-CB 3.57Å; W99-C192 HydrophobicContact CZ3-CB 4.25Å; C106-C192 WeakPolarHBondContact CA-SG 3.33Å; C106-C192 HydrophobicContact CB-CB 3.9Å; C106-C192 WeakPolarHBondContact CB-SG 3.24Å; C106-C192 PolarHBondContact O-SG 3.02Å; C106-C192 VanDerWaalsContact O-SG 3.4Å; C106-C192 VanDerWaalsContact SG-CA 3.59Å; C106-C192 WeakPolarHBondContact SG-CB 3.23Å; C106-C192 CovalentContact SG-SG 2.03Å; C106-C192 PolarHBondContact SG-SG 3.37Å; N171-C192 WeakPolarHBondContact O-CA 3.48Å; L172-C192 HydrophobicContact CD1-CB 4.28Å
193D95.5Very high93.8Very high73 Ų7360.7 Ų60.739%0.3932%0.316SS..EExtended strand (participates in β ladder)trans-149.7170.4-175.3-153.2-6000111Y170 N171 Y173 T195Y170-D193 WeakPolarHBondContact CA-O 3.48Å; N171-D193 PolarHBondContact N-O 3.44Å; N171-D193 PolarHBondContact O-N 3.25Å; Y173-D193 HydrophobicContact CE1-CB 3.91Å; Y173-D193 WeakPolarHBondContact OH-CB 3.42Å; D193-T195 PolarHBondContact O-N 3.47Å
194E95.1Very high94.4Very high39 Ų3960 Ų6018%0.18232%0.315CS..EExtended strand (participates in β ladder)trans-66.1122.7177.6-65.1175.9-145.900111.8H169 Y170 W196 R202H169-E194 CarbonylContact O-C 3.48Å; H169-E194 VanDerWaalsContact O-CA 3.31Å; H169-E194 WeakPolarHBondContact O-CA 3.35Å; Y170-E194 HydrophobicContact CD2-CG 3.96Å; Y170-E194 HydrophobicContact CE1-CG 4.17Å; Y170-E194 HydrophobicContact CE2-CB 4.45Å; Y170-E194 HydrophobicContact CE2-CG 3.31Å; Y170-E194 VanDerWaalsContact CZ-CG 3.42Å; Y170-E194 PolarHBondContact OH-OE1 2.98Å; E194-W196 VanDerWaalsContact OE2-CD1 3.29Å; E194-W196 PolarHBondContact OE2-NE1 3.06Å; E194-R202 IonicContact OE2-CZ 2.8Å; E194-R202 IonicContact OE2-NE 2.78Å; E194-R202 IonicContact OE2-NH1 3.23Å; E194-R202 IonicContact OE2-NH2 2.73Å
195T95.6Very high94.9Very high61 Ų6159.4 Ų59.437%0.37431%0.309SS..  trans-114.862174.161.70000110.6H169 N171 Y173 D193H169-T195 PolarHBondContact O-N 3.25Å; N171-T195 HydrophobicContact CB-CG2 3.76Å; Y173-T195 HydrophobicContact CD1-CG2 4.27Å; Y173-T195 HydrophobicContact CE1-CG2 4.16Å; D193-T195 PolarHBondContact O-N 3.47Å
196W96.1Very high95.4Very high40 Ų4059.5 Ų59.515%0.15231%0.313CS..  trans-67.1147.3173.5-65.996.4000111.3P165 H169 E194 N198 A201 R202 Y205P165-W196 HydrophobicContact CB-CH2 3.94Å; H169-W196 HydrophobicContact CB-CD2 3.88Å; H169-W196 HydrophobicContact CB-CE3 4.01Å; H169-W196 HydrophobicContact CB-CG 4.44Å; H169-W196 HydrophobicContact CB-CH2 4.13Å; H169-W196 HydrophobicContact CB-CZ2 4.02Å; H169-W196 HydrophobicContact CB-CZ3 4.16Å; H169-W196 AromaticContact CD2-CE3 3.59Å; H169-W196 AromaticContact CD2-CH2 3.58Å; H169-W196 AromaticContact CD2-CZ3 3.17Å; H169-W196 WeakPolarHBondContact CD2-CZ3 3.32Å; H169-W196 AromaticContact CG-CD2 3.99Å; H169-W196 AromaticContact CG-CE3 3.61Å; H169-W196 AromaticContact CG-CZ3 3.67Å; H169-W196 AromaticContact NE2-CZ3 3.7Å; E194-W196 VanDerWaalsContact OE2-CD1 3.29Å; E194-W196 PolarHBondContact OE2-NE1 3.06Å; W196-N198 PolarHBondContact O-N 3.02Å; W196-A201 HydrophobicContact CE3-CB 4.14Å; W196-R202 HydrophobicContact CB-CB 4.03Å; W196-R202 HydrophobicContact CD2-CB 4.05Å; W196-R202 HydrophobicContact CG-CB 3.6Å; W196-R202 HydrophobicContact CG-CG 4.21Å; W196-Y205 AromaticContact CH2-CD1 3.28Å; W196-Y205 HydrophobicContact CH2-CD1 3.28Å; W196-Y205 HydrophobicContact CH2-CD2 4.12Å; W196-Y205 AromaticContact CH2-CE1 3.97Å; W196-Y205 HydrophobicContact CH2-CE1 3.97Å; W196-Y205 AromaticContact CH2-CG 3.34Å; W196-Y205 HydrophobicContact CH2-CG 3.34Å; W196-Y205 AromaticContact CZ2-CD1 3.3Å; W196-Y205 HydrophobicContact CZ2-CD1 3.3Å; W196-Y205 AromaticContact CZ2-CE1 3.92Å; W196-Y205 HydrophobicContact CZ2-CE1 3.92Å; W196-Y205 AromaticContact CZ2-CG 3.86Å; W196-Y205 HydrophobicContact CZ2-CG 3.86Å; W196-Y205 HydrophobicContact CZ3-CD1 4.45Å; W196-Y205 HydrophobicContact CZ3-CG 4.2Å
197P95Very high95.7Very high100 Ų10056.1 Ų56.165%0.64931%0.309SS*.SBendtrans-63.9-29.6-179.925.4-34.6000113.1A201P197-A201 HydrophobicContact CG-CB 4.03Å
198N95.2Very high95.9Very high87 Ų8757.4 Ų57.447%0.46532%0.323SS..SBendtrans-156.9166.7174.854.445.7000110.2W196 E200 A201 R202W196-N198 PolarHBondContact O-N 3.02Å; N198-E200 VanDerWaalsContact C-N 3.29Å; N198-E200 PolarHBondContact O-N 2.91Å; N198-A201 PolarHBondContact O-N 3.17Å; N198-A201 WeakPolarHBondContact OD1-CB 3.28Å; N198-A201 PolarHBondContact OD1-N 2.99Å; N198-R202 PolarHBondContact O-N 3.43Å
199V94.4Very high96.1Very high99 Ų9956.2 Ų56.260%0.631%0.314SS*.Hα-helixtrans-63.4-36.4-179.3178.50000111.5R202 Q203V199-R202 WeakPolarHBondContact O-CB 3.39Å; V199-R202 PolarHBondContact O-N 3.3Å; V199-Q203 HydrophobicContact CG1-CG 4.3Å; V199-Q203 WeakPolarHBondContact O-CG 3.36Å; V199-Q203 PolarHBondContact O-N 3.46Å
200E96.3Very high96.2Very high128 Ų12857.3 Ų57.360%0.59831%0.314SS*.Hα-helixtrans-63-44.4-180-173.6-178.1-178.900112N198 R202 Q203 I204N198-E200 VanDerWaalsContact C-N 3.29Å; N198-E200 PolarHBondContact O-N 2.91Å; E200-R202 VanDerWaalsContact C-N 3.31Å; E200-R202 PolarHBondContact O-N 3.17Å; E200-Q203 PolarHBondContact O-N 2.84Å; E200-Q203 VanDerWaalsContact O-N 3.15Å; E200-I204 HydrophobicContact CG-CD1 3.8Å; E200-I204 HydrophobicContact CG-CG1 4.3Å; E200-I204 WeakPolarHBondContact O-CB 3.45Å; E200-I204 VanDerWaalsContact O-CG1 3.3Å; E200-I204 WeakPolarHBondContact O-CG1 3.27Å; E200-I204 PolarHBondContact O-N 3.42Å
201A96.6Very high96.3Very high27 Ų2755.2 Ų55.222%0.22331%0.313CS..Hα-helixtrans-60.3-41.9177.200000111.8W196 P197 N198 Y205W196-A201 HydrophobicContact CE3-CB 4.14Å; P197-A201 HydrophobicContact CG-CB 4.03Å; N198-A201 PolarHBondContact O-N 3.17Å; N198-A201 WeakPolarHBondContact OD1-CB 3.28Å; N198-A201 PolarHBondContact OD1-N 2.99Å; A201-Y205 WeakPolarHBondContact O-CB 3.25Å; A201-Y205 PolarHBondContact O-N 3.02Å
202R95.9Very high96.4Very high55 Ų5557.3 Ų57.321%0.20833%0.325CS..Hα-helixtrans-59.4-48.4173.1178.4180161.8142.114.7111.2E194 W196 N198 V199 E200 Y205 G206 D297E194-R202 IonicContact OE2-CZ 2.8Å; E194-R202 IonicContact OE2-NE 2.78Å; E194-R202 IonicContact OE2-NH1 3.23Å; E194-R202 IonicContact OE2-NH2 2.73Å; W196-R202 HydrophobicContact CB-CB 4.03Å; W196-R202 HydrophobicContact CD2-CB 4.05Å; W196-R202 HydrophobicContact CG-CB 3.6Å; W196-R202 HydrophobicContact CG-CG 4.21Å; N198-R202 PolarHBondContact O-N 3.43Å; V199-R202 WeakPolarHBondContact O-CB 3.39Å; V199-R202 PolarHBondContact O-N 3.3Å; E200-R202 VanDerWaalsContact C-N 3.31Å; E200-R202 PolarHBondContact O-N 3.17Å; R202-Y205 PolarHBondContact O-N 3.2Å; R202-G206 PolarHBondContact O-N 2.77Å; R202-D297 IonicContact CZ-OD1 3.5Å; R202-D297 VanDerWaalsContact CZ-OD1 3.23Å; R202-D297 IonicContact NE-OD1 3.86Å; R202-D297 PolarHBondContact NE-OD1 2.65Å; R202-D297 IonicContact NH2-OD1 3.67Å; R202-D297 PolarHBondContact NH2-OD1 2.84Å
203Q97.1Very high96.3Very high56 Ų5657 Ų5726%0.26232%0.321SS..Hα-helixtrans-65.1-42.6-179.6-73173.1-17.500112.7V199 E200 G207 D297V199-Q203 HydrophobicContact CG1-CG 4.3Å; V199-Q203 WeakPolarHBondContact O-CG 3.36Å; V199-Q203 PolarHBondContact O-N 3.46Å; E200-Q203 PolarHBondContact O-N 2.84Å; E200-Q203 VanDerWaalsContact O-N 3.15Å; Q203-G207 PolarHBondContact O-N 3.15Å; Q203-D297 HydrophobicContact CG-CB 4.47Å; Q203-D297 WeakPolarHBondContact CG-O 2.94Å; Q203-D297 PolarHBondContact NE2-O 3.2Å
204I96.7Very high96.3Very high108 Ų10854.2 Ų54.255%0.55431%0.305SS*.Hα-helixtrans-61.2-47.9176.4-70.3169.8000109.8E200 A208E200-I204 HydrophobicContact CG-CD1 3.8Å; E200-I204 HydrophobicContact CG-CG1 4.3Å; E200-I204 WeakPolarHBondContact O-CB 3.45Å; E200-I204 VanDerWaalsContact O-CG1 3.3Å; E200-I204 WeakPolarHBondContact O-CG1 3.27Å; E200-I204 PolarHBondContact O-N 3.42Å; I204-A208 VanDerWaalsContact O-CB 3.32Å; I204-A208 WeakPolarHBondContact O-CB 3.42Å; I204-A208 PolarHBondContact O-N 2.87Å
205Y97Very high96.3Very high27 Ų2756.1 Ų56.111%0.10632%0.316CS..Hα-helixtrans-66-48.4179178.5-106.7000112.1I162 P165 M166 W196 A201 R202 G207 A208 V209I162-Y205 WeakPolarHBondContact O-CE2 3.23Å; I162-Y205 PolarHBondContact O-OH 3.45Å; P165-Y205 HydrophobicContact CB-CD2 3.88Å; P165-Y205 HydrophobicContact CB-CE1 4.37Å; P165-Y205 HydrophobicContact CB-CE2 3.53Å; P165-Y205 HydrophobicContact CB-CG 4.45Å; P165-Y205 HydrophobicContact CG-CD2 4.02Å; P165-Y205 HydrophobicContact CG-CE2 3.53Å; M166-Y205 HydrophobicContact CE-CD1 4.44Å; M166-Y205 HydrophobicContact CE-CE1 3.68Å; M166-Y205 HydrophobicContact CG-CE1 3.84Å; M166-Y205 HydrophobicContact SD-CE1 3.71Å; W196-Y205 AromaticContact CH2-CD1 3.28Å; W196-Y205 HydrophobicContact CH2-CD1 3.28Å; W196-Y205 HydrophobicContact CH2-CD2 4.12Å; W196-Y205 AromaticContact CH2-CE1 3.97Å; W196-Y205 HydrophobicContact CH2-CE1 3.97Å; W196-Y205 AromaticContact CH2-CG 3.34Å; W196-Y205 HydrophobicContact CH2-CG 3.34Å; W196-Y205 AromaticContact CZ2-CD1 3.3Å; W196-Y205 HydrophobicContact CZ2-CD1 3.3Å; W196-Y205 AromaticContact CZ2-CE1 3.92Å; W196-Y205 HydrophobicContact CZ2-CE1 3.92Å; W196-Y205 AromaticContact CZ2-CG 3.86Å; W196-Y205 HydrophobicContact CZ2-CG 3.86Å; W196-Y205 HydrophobicContact CZ3-CD1 4.45Å; W196-Y205 HydrophobicContact CZ3-CG 4.2Å; A201-Y205 WeakPolarHBondContact O-CB 3.25Å; A201-Y205 PolarHBondContact O-N 3.02Å; R202-Y205 PolarHBondContact O-N 3.2Å; Y205-G207 VanDerWaalsContact C-N 3.3Å; Y205-G207 PolarHBondContact O-N 3Å; Y205-A208 PolarHBondContact O-N 3.35Å; Y205-A208 VanDerWaalsContact O-N 3.16Å; Y205-V209 HydrophobicContact CD1-CG2 4.2Å; Y205-V209 HydrophobicContact CD2-CG2 4.12Å; Y205-V209 HydrophobicContact CE1-CG2 3.72Å; Y205-V209 HydrophobicContact CE2-CG2 3.58Å; Y205-V209 HydrophobicContact CG-CG2 4.4Å; Y205-V209 WeakPolarHBondContact O-CB 3.44Å; Y205-V209 WeakPolarHBondContact O-CG2 3.24Å; Y205-V209 PolarHBondContact O-N 3.46Å
206G96.3Very high96.4Very high19 Ų1956.9 Ų56.920%0.19632%0.317CS..Hα-helixtrans-57.1-43.2176.700000112.1R202 V209 L210R202-G206 PolarHBondContact O-N 2.77Å; G206-V209 PolarHBondContact O-N 3.49Å; G206-L210 WeakPolarHBondContact O-CB 3.46Å; G206-L210 PolarHBondContact O-N 3.31Å
207G97.3Very high96.4Very high28 Ų2855 Ų5529%0.28931%0.31SS..Hα-helixtrans-64.1-43.7173.800000113.3Q203 Y205 L210 V211Q203-G207 PolarHBondContact O-N 3.15Å; Y205-G207 VanDerWaalsContact C-N 3.3Å; Y205-G207 PolarHBondContact O-N 3Å; G207-L210 WeakPolarHBondContact O-CB 3.36Å; G207-L210 PolarHBondContact O-N 3.01Å; G207-V211 WeakPolarHBondContact O-CG2 3.29Å; G207-V211 PolarHBondContact O-N 3.11Å
208A97.6Very high96.5Very high43 Ų4352.3 Ų52.336%0.35529%0.29SS..Hα-helixtrans-63.3-44.2176.500000111.7I204 Y205 V211 L212I204-A208 VanDerWaalsContact O-CB 3.32Å; I204-A208 WeakPolarHBondContact O-CB 3.42Å; I204-A208 PolarHBondContact O-N 2.87Å; Y205-A208 PolarHBondContact O-N 3.35Å; Y205-A208 VanDerWaalsContact O-N 3.16Å; A208-V211 PolarHBondContact O-N 3.26Å; A208-L212 WeakPolarHBondContact O-CB 3.45Å; A208-L212 VanDerWaalsContact O-CG 3.28Å; A208-L212 WeakPolarHBondContact O-CG 3.35Å; A208-L212 PolarHBondContact O-N 2.86Å
209V97.1Very high96.5Very high13 Ų1353.3 Ų53.38%0.07929%0.294CS..Hα-helixtrans-61.9-47.1174.8170.50000110.1I162 Y205 G206 V211 L212 Q213I162-V209 HydrophobicContact CG2-CG2 4.28Å; Y205-V209 HydrophobicContact CD1-CG2 4.2Å; Y205-V209 HydrophobicContact CD2-CG2 4.12Å; Y205-V209 HydrophobicContact CE1-CG2 3.72Å; Y205-V209 HydrophobicContact CE2-CG2 3.58Å; Y205-V209 HydrophobicContact CG-CG2 4.4Å; Y205-V209 WeakPolarHBondContact O-CB 3.44Å; Y205-V209 WeakPolarHBondContact O-CG2 3.24Å; Y205-V209 PolarHBondContact O-N 3.46Å; G206-V209 PolarHBondContact O-N 3.49Å; V209-V211 VanDerWaalsContact C-N 3.32Å; V209-V211 PolarHBondContact O-N 3.12Å; V209-L212 PolarHBondContact O-N 3.43Å; V209-Q213 HydrophobicContact CG1-CB 4.29Å; V209-Q213 WeakPolarHBondContact O-CA 3.22Å; V209-Q213 WeakPolarHBondContact O-CB 3.05Å; V209-Q213 PolarHBondContact O-N 2.93Å
210L96.9Very high96.7Very high46 Ų4650.6 Ų50.624%0.24128%0.278CS..Hα-helixtrans-53.2-48.5175.2172.566.1000112.1G206 G207 F214 I215 V290 V294G206-L210 WeakPolarHBondContact O-CB 3.46Å; G206-L210 PolarHBondContact O-N 3.31Å; G207-L210 WeakPolarHBondContact O-CB 3.36Å; G207-L210 PolarHBondContact O-N 3.01Å; L210-F214 PolarHBondContact O-N 3.44Å; L210-I215 HydrophobicContact CG-CG1 4.24Å; L210-I215 PolarHBondContact O-N 3.28Å; L210-I215 VanDerWaalsContact O-N 3.14Å; L210-V290 HydrophobicContact CD1-CG1 3.39Å; L210-V294 HydrophobicContact CD1-CG2 4.49Å; L210-V294 HydrophobicContact CD2-CG2 3.85Å
211V97.8Very high96.7Very high65 Ų6544.7 Ų44.739%0.39425%0.25SS..Iπ-helixtrans-66.3-49.8-178.2170.60000111.5G207 A208 V209 I215 I216G207-V211 WeakPolarHBondContact O-CG2 3.29Å; G207-V211 PolarHBondContact O-N 3.11Å; A208-V211 PolarHBondContact O-N 3.26Å; V209-V211 VanDerWaalsContact C-N 3.32Å; V209-V211 PolarHBondContact O-N 3.12Å; V211-I215 PolarHBondContact O-N 3.01Å; V211-I216 HydrophobicContact CG1-CD1 3.76Å; V211-I216 HydrophobicContact CG1-CG1 4Å; V211-I216 PolarHBondContact O-N 3.34Å
212L97.1Very high96.6Very high67 Ų6748 Ų4835%0.35127%0.268SS..Iπ-helixtrans-70.6-43-176.9-69.5170.4000111.9F122 I162 A208 V209 I216 P217F122-L212 VanDerWaalsContact CE1-O 3.25Å; F122-L212 WeakPolarHBondContact CE1-O 3.43Å; I162-L212 HydrophobicContact CD1-CD1 4.19Å; I162-L212 HydrophobicContact CG1-CD1 4.38Å; I162-L212 HydrophobicContact CG2-CD1 4.43Å; A208-L212 WeakPolarHBondContact O-CB 3.45Å; A208-L212 VanDerWaalsContact O-CG 3.28Å; A208-L212 WeakPolarHBondContact O-CG 3.35Å; A208-L212 PolarHBondContact O-N 2.86Å; V209-L212 PolarHBondContact O-N 3.43Å; L212-I216 HydrophobicContact CD2-CD1 4.19Å; L212-P217 WeakPolarHBondContact O-CD 3.12Å; L212-P217 WeakPolarHBondContact O-CG 3.49Å
213Q96.2Very high96.6Very high16 Ų1651.2 Ų51.28%0.07528%0.284CS..Iπ-helixtrans-77.8-38.8-174.4-175.9-178.52.100112.4I118 T121 V209 P217I118-Q213 HydrophobicContact CG1-CB 4.1Å; I118-Q213 HydrophobicContact CG1-CG 3.77Å; T121-Q213 WeakPolarHBondContact CB-O 3.21Å; T121-Q213 WeakPolarHBondContact CG2-O 3.23Å; V209-Q213 HydrophobicContact CG1-CB 4.29Å; V209-Q213 WeakPolarHBondContact O-CA 3.22Å; V209-Q213 WeakPolarHBondContact O-CB 3.05Å; V209-Q213 PolarHBondContact O-N 2.93Å; Q213-P217 WeakPolarHBondContact O-CG 3.46Å
214F94.3Very high96.6Very high14 Ų1448.8 Ų48.86%0.06127%0.273CS..Iπ-helixtrans-120.1-56.6-172.6-67.7-74.3000113.2T117 L210 I216 P217 L218 F282 W286 V290T117-F214 HydrophobicContact CG2-CZ 4.01Å; L210-F214 PolarHBondContact O-N 3.44Å; F214-I216 PolarHBondContact O-N 3.32Å; F214-P217 WeakPolarHBondContact O-CD 3.47Å; F214-L218 HydrophobicContact CB-CD1 4.32Å; F214-L218 VanDerWaalsContact O-CB 3.23Å; F214-L218 WeakPolarHBondContact O-CB 3.17Å; F214-L218 WeakPolarHBondContact O-CD1 3.45Å; F214-L218 WeakPolarHBondContact O-CG 3.23Å; F214-L218 PolarHBondContact O-N 3.4Å; F214-F282 HydrophobicContact CD1-CE1 4.37Å; F214-F282 AromaticContact CE1-CE1 3.8Å; F214-F282 HydrophobicContact CE1-CE1 3.8Å; F214-F282 HydrophobicContact CE1-CZ 4.23Å; F214-W286 HydrophobicContact CE1-CB 3.78Å; F214-W286 HydrophobicContact CE1-CG 4.09Å; F214-W286 HydrophobicContact CZ-CB 3.98Å; F214-W286 HydrophobicContact CZ-CD2 4.09Å; F214-W286 AromaticContact CZ-CE3 3.93Å; F214-W286 HydrophobicContact CZ-CE3 3.93Å; F214-W286 HydrophobicContact CZ-CG 4.12Å; F214-V290 HydrophobicContact CD2-CG1 4.41Å; F214-V290 HydrophobicContact CD2-CG2 3.71Å; F214-V290 HydrophobicContact CE1-CG2 4.21Å; F214-V290 HydrophobicContact CE2-CG2 3.22Å; F214-V290 HydrophobicContact CG-CG2 4.38Å; F214-V290 HydrophobicContact CZ-CG2 3.52Å
215I96.2Very high96.4Very high79 Ų7944.6 Ų44.641%0.40525%0.25SS..Iπ-helixtrans-62.7-52.9-168.8-55.1-59.5000112.2L210 V211 L218 I219L210-I215 HydrophobicContact CG-CG1 4.24Å; L210-I215 PolarHBondContact O-N 3.28Å; L210-I215 VanDerWaalsContact O-N 3.14Å; V211-I215 PolarHBondContact O-N 3.01Å; I215-L218 PolarHBondContact O-N 3.07Å; I215-I219 HydrophobicContact CG2-CD1 3.9Å; I215-I219 WeakPolarHBondContact O-CG1 3.29Å; I215-I219 PolarHBondContact O-N 2.86Å
216I97.2Very high96.2Very high77 Ų7744.9 Ų44.940%0.39526%0.261SS..Hα-helixtrans-60.6-52.4179.3-71.5168.5000110.9V211 L212 F214 L218 I219 V220V211-I216 HydrophobicContact CG1-CD1 3.76Å; V211-I216 HydrophobicContact CG1-CG1 4Å; V211-I216 PolarHBondContact O-N 3.34Å; L212-I216 HydrophobicContact CD2-CD1 4.19Å; F214-I216 PolarHBondContact O-N 3.32Å; I216-L218 VanDerWaalsContact C-N 3.29Å; I216-L218 PolarHBondContact O-N 3.02Å; I216-I219 PolarHBondContact O-N 3.44Å; I216-V220 WeakPolarHBondContact O-CG2 3.46Å; I216-V220 PolarHBondContact O-N 2.85Å; I216-V220 VanDerWaalsContact O-N 3.09Å
217P97.1Very high96.1Very high0 Ų045.3 Ų45.30%026%0.261CS..Hα-helixtrans-57.4-39.6177-30.638.8000113.9T121 F122 M125 L212 Q213 F214 V220 I221T121-P217 HydrophobicContact CG2-CB 3.57Å; T121-P217 HydrophobicContact CG2-CG 4.04Å; F122-P217 HydrophobicContact CD1-CG 3.87Å; F122-P217 HydrophobicContact CE1-CG 3.71Å; M125-P217 HydrophobicContact CB-CB 4.42Å; M125-P217 HydrophobicContact SD-CB 4.16Å; M125-P217 HydrophobicContact SD-CG 4.39Å; L212-P217 WeakPolarHBondContact O-CD 3.12Å; L212-P217 WeakPolarHBondContact O-CG 3.49Å; Q213-P217 WeakPolarHBondContact O-CG 3.46Å; F214-P217 WeakPolarHBondContact O-CD 3.47Å; P217-V220 PolarHBondContact O-N 3.37Å; P217-I221 HydrophobicContact CB-CD1 4.5Å; P217-I221 VanDerWaalsContact O-CB 3.3Å; P217-I221 WeakPolarHBondContact O-CB 3.48Å; P217-I221 WeakPolarHBondContact O-CD1 3.42Å; P217-I221 WeakPolarHBondContact O-CG1 3.48Å; P217-I221 PolarHBondContact O-N 2.9Å
218L95.5Very high95.8Very high44 Ų4444.1 Ų44.123%0.2325%0.248CC..Hα-helixtrans-67.8-38.3179.9-71.1173000112.8F214 I215 I216 T222 V283F214-L218 HydrophobicContact CB-CD1 4.32Å; F214-L218 VanDerWaalsContact O-CB 3.23Å; F214-L218 WeakPolarHBondContact O-CB 3.17Å; F214-L218 WeakPolarHBondContact O-CD1 3.45Å; F214-L218 WeakPolarHBondContact O-CG 3.23Å; F214-L218 PolarHBondContact O-N 3.4Å; I215-L218 PolarHBondContact O-N 3.07Å; I216-L218 VanDerWaalsContact C-N 3.29Å; I216-L218 PolarHBondContact O-N 3.02Å; L218-T222 WeakPolarHBondContact O-CB 3.31Å; L218-T222 PolarHBondContact O-N 3.16Å; L218-T222 PolarHBondContact O-OG1 3.39Å; L218-V283 HydrophobicContact CD1-CG2 4.32Å; L218-V283 HydrophobicContact CD2-CG2 3.24Å; L218-V283 HydrophobicContact CG-CG2 4.4Å
219I96.9Very high95.5Very high108 Ų10848.2 Ų48.255%0.55426%0.258SS*.Hα-helixtrans-60.1-49.1172.6-69.2166.6000109.9I215 I216 T222 F223I215-I219 HydrophobicContact CG2-CD1 3.9Å; I215-I219 WeakPolarHBondContact O-CG1 3.29Å; I215-I219 PolarHBondContact O-N 2.86Å; I216-I219 PolarHBondContact O-N 3.44Å; I219-T222 PolarHBondContact O-N 2.91Å; I219-F223 WeakPolarHBondContact O-CB 3.18Å; I219-F223 PolarHBondContact O-N 3.44Å
220V98Very high95.2Very high43 Ų4353.3 Ų53.326%0.26128%0.284SS..Hα-helixtrans-63.7-45.4-179175.50000111.6M125 I129 I216 P217 F223 C224M125-V220 HydrophobicContact CG-CB 4.04Å; M125-V220 HydrophobicContact CG-CG1 3.67Å; M125-V220 HydrophobicContact SD-CB 3.87Å; M125-V220 HydrophobicContact SD-CG1 3.92Å; M125-V220 HydrophobicContact SD-CG2 4.08Å; I129-V220 HydrophobicContact CD1-CG1 3.99Å; I129-V220 HydrophobicContact CG1-CG1 4.01Å; I216-V220 WeakPolarHBondContact O-CG2 3.46Å; I216-V220 PolarHBondContact O-N 2.85Å; I216-V220 VanDerWaalsContact O-N 3.09Å; P217-V220 PolarHBondContact O-N 3.37Å; V220-F223 PolarHBondContact O-N 2.83Å; V220-C224 WeakPolarHBondContact O-CB 3.46Å; V220-C224 PolarHBondContact O-N 2.81Å; V220-C224 PolarHBondContact O-SG 3.12Å
221I96.1Very high94.9Very high3 Ų355.9 Ų55.92%0.01529%0.291CS..Hα-helixtrans-63.5-45179-71.2165.7000110.8L124 M125 A128 P217 C224 Y225 V279L124-I221 HydrophobicContact CB-CD1 4.27Å; M125-I221 HydrophobicContact CB-CD1 4.17Å; M125-I221 HydrophobicContact CB-CG1 4.06Å; M125-I221 HydrophobicContact CG-CG1 4.39Å; A128-I221 HydrophobicContact CB-CB 4.49Å; A128-I221 HydrophobicContact CB-CG1 4.09Å; A128-I221 HydrophobicContact CB-CG2 4.36Å; P217-I221 HydrophobicContact CB-CD1 4.5Å; P217-I221 VanDerWaalsContact O-CB 3.3Å; P217-I221 WeakPolarHBondContact O-CB 3.48Å; P217-I221 WeakPolarHBondContact O-CD1 3.42Å; P217-I221 WeakPolarHBondContact O-CG1 3.48Å; P217-I221 PolarHBondContact O-N 2.9Å; I221-C224 PolarHBondContact O-N 3.37Å; I221-Y225 HydrophobicContact CG2-CD2 3.59Å; I221-Y225 HydrophobicContact CG2-CE2 3.68Å; I221-Y225 WeakPolarHBondContact O-CD2 3.47Å; I221-Y225 PolarHBondContact O-N 2.95Å; I221-V279 HydrophobicContact CD1-CG1 4.49Å; I221-V279 HydrophobicContact CD1-CG2 4.49Å; I221-V279 HydrophobicContact CG2-CB 4.24Å; I221-V279 HydrophobicContact CG2-CG1 3.58Å; I221-V279 HydrophobicContact CG2-CG2 3.85Å
222T94.7Very high94.3Very high98 Ų9855.1 Ų55.160%0.60129%0.286SS*.Hα-helixtrans-61.9-45178.3-59.70000110.6L218 I219 C224 Y225 G226L218-T222 WeakPolarHBondContact O-CB 3.31Å; L218-T222 PolarHBondContact O-N 3.16Å; L218-T222 PolarHBondContact O-OG1 3.39Å; I219-T222 PolarHBondContact O-N 2.91Å; T222-C224 PolarHBondContact O-N 3.19Å; T222-Y225 PolarHBondContact O-N 3.42Å; T222-G226 PolarHBondContact O-N 2.96Å
223F96.3Very high93.7Very high122 Ų12256.2 Ų56.254%0.53529%0.291SS..Hα-helixtrans-59.3-46.6174.2171.1-96.4000112.3F132 I219 V220 S227F132-F223 HydrophobicContact CE2-CE1 4.06Å; F132-F223 HydrophobicContact CE2-CZ 4.47Å; F132-F223 AromaticContact CZ-CE1 3.96Å; F132-F223 HydrophobicContact CZ-CE1 3.96Å; F132-F223 HydrophobicContact CZ-CZ 4.36Å; I219-F223 WeakPolarHBondContact O-CB 3.18Å; I219-F223 PolarHBondContact O-N 3.44Å; V220-F223 PolarHBondContact O-N 2.83Å; F223-S227 WeakPolarHBondContact O-CB 3.2Å; F223-S227 PolarHBondContact O-N 3.09Å; F223-S227 PolarHBondContact O-OG 3.22Å
224C96.1Very high93.2Very high4 Ų461.8 Ų61.83%0.02732%0.315CS..Hα-helixtrans-59.9-50.8179.4-72.90000111.4A128 F132 V220 I221 T222 S227 I228A128-C224 HydrophobicContact CB-CB 3.98Å; F132-C224 HydrophobicContact CB-CB 3.97Å; F132-C224 HydrophobicContact CG-CB 4.5Å; V220-C224 WeakPolarHBondContact O-CB 3.46Å; V220-C224 PolarHBondContact O-N 2.81Å; V220-C224 PolarHBondContact O-SG 3.12Å; I221-C224 PolarHBondContact O-N 3.37Å; T222-C224 PolarHBondContact O-N 3.19Å; C224-S227 PolarHBondContact O-N 2.72Å; C224-I228 WeakPolarHBondContact O-CD1 3.01Å; C224-I228 VanDerWaalsContact O-CG1 3.24Å; C224-I228 WeakPolarHBondContact O-CG1 3.42Å; C224-I228 PolarHBondContact O-N 3.28Å
225Y93.2Very high92.5Very high21 Ų2162.1 Ų62.18%0.08232%0.323CS..Hα-helixtrans-73.8-34.3-178.6-74.3-54.3000113.7A128 I221 T222 S227 I228 F229 L275 I276 V279A128-Y225 HydrophobicContact CB-CE2 3.91Å; I221-Y225 HydrophobicContact CG2-CD2 3.59Å; I221-Y225 HydrophobicContact CG2-CE2 3.68Å; I221-Y225 WeakPolarHBondContact O-CD2 3.47Å; I221-Y225 PolarHBondContact O-N 2.95Å; T222-Y225 PolarHBondContact O-N 3.42Å; Y225-S227 VanDerWaalsContact C-N 3.34Å; Y225-I228 HydrophobicContact CD1-CD1 3.8Å; Y225-I228 HydrophobicContact CE1-CD1 4.09Å; Y225-I228 PolarHBondContact O-N 2.99Å; Y225-F229 WeakPolarHBondContact O-CB 3.39Å; Y225-F229 PolarHBondContact O-N 3.31Å; Y225-L275 HydrophobicContact CE1-CB 4.38Å; Y225-L275 WeakPolarHBondContact OH-CB 3.42Å; Y225-I276 HydrophobicContact CD1-CD1 4.02Å; Y225-I276 HydrophobicContact CD1-CG1 3.49Å; Y225-I276 VanDerWaalsContact CD1-CG1 3.49Å; Y225-I276 HydrophobicContact CD2-CG1 4.13Å; Y225-I276 HydrophobicContact CE1-CG1 3.79Å; Y225-I276 HydrophobicContact CE2-CG1 4.37Å; Y225-I276 HydrophobicContact CG-CD1 4.38Å; Y225-I276 HydrophobicContact CG-CG1 3.71Å; Y225-V279 HydrophobicContact CE2-CG2 3.97Å
226G93Very high91.4Very high33 Ų3361.4 Ų61.434%0.3432%0.322SS..Hα-helixtrans-59-46.5170.900000111.2T222 I228 F229 L230T222-G226 PolarHBondContact O-N 2.96Å; G226-I228 PolarHBondContact O-N 3.46Å; G226-F229 WeakPolarHBondContact O-CB 3.35Å; G226-F229 PolarHBondContact O-N 2.73Å; G226-L230 WeakPolarHBondContact O-CG 3.24Å; G226-L230 PolarHBondContact O-N 3.43Å
227S93.8Very high90.1Very high27 Ų2760.9 Ų60.919%0.18933%0.325CS..Hα-helixtrans-64.4-40.5176.5-60.90000113F132 F223 C224 Y225 F229 R231F132-S227 VanDerWaalsContact CE2-CB 3.41Å; F223-S227 WeakPolarHBondContact O-CB 3.2Å; F223-S227 PolarHBondContact O-N 3.09Å; F223-S227 PolarHBondContact O-OG 3.22Å; C224-S227 PolarHBondContact O-N 2.72Å; Y225-S227 VanDerWaalsContact C-N 3.34Å; S227-F229 VanDerWaalsContact C-N 3.33Å; S227-R231 WeakPolarHBondContact O-CB 3.16Å; S227-R231 PolarHBondContact O-N 2.98Å
228I91.5Very high88.4Confident4 Ų465.7 Ų65.72%0.02135%0.349CS..Hα-helixtrans-60.5-45.3173.9-72.1163.9000110.3R131 F132 I135 V136 C224 Y225 G226 R231 V232R131-I228 HydrophobicContact CB-CD1 4Å; F132-I228 HydrophobicContact CB-CD1 4.38Å; I135-I228 HydrophobicContact CB-CG1 4.47Å; I135-I228 HydrophobicContact CD1-CD1 4.24Å; I135-I228 HydrophobicContact CD1-CG1 4.24Å; I135-I228 HydrophobicContact CD1-CG2 4.05Å; I135-I228 HydrophobicContact CG2-CG2 4.39Å; V136-I228 HydrophobicContact CG2-CG1 4.49Å; C224-I228 WeakPolarHBondContact O-CD1 3.01Å; C224-I228 VanDerWaalsContact O-CG1 3.24Å; C224-I228 WeakPolarHBondContact O-CG1 3.42Å; C224-I228 PolarHBondContact O-N 3.28Å; Y225-I228 HydrophobicContact CD1-CD1 3.8Å; Y225-I228 HydrophobicContact CE1-CD1 4.09Å; Y225-I228 PolarHBondContact O-N 2.99Å; G226-I228 PolarHBondContact O-N 3.46Å; I228-R231 PolarHBondContact O-N 3.36Å; I228-V232 HydrophobicContact CG2-CG2 4.41Å; I228-V232 VanDerWaalsContact O-CG2 3.29Å; I228-V232 WeakPolarHBondContact O-CG2 3.45Å; I228-V232 PolarHBondContact O-N 2.89Å
229F90.5Very high86.8Confident129 Ų12969.3 Ų69.357%0.56636%0.359SS*.Hα-helixtrans-60.5-50.2179.3176.4-103.3000111.5Y225 G226 S227 R231 V232 I233Y225-F229 WeakPolarHBondContact O-CB 3.39Å; Y225-F229 PolarHBondContact O-N 3.31Å; G226-F229 WeakPolarHBondContact O-CB 3.35Å; G226-F229 PolarHBondContact O-N 2.73Å; S227-F229 VanDerWaalsContact C-N 3.33Å; F229-R231 VanDerWaalsContact C-N 3.32Å; F229-R231 PolarHBondContact O-N 2.98Å; F229-V232 PolarHBondContact O-N 3.37Å; F229-I233 HydrophobicContact CD1-CD1 3.93Å; F229-I233 HydrophobicContact CD2-CD1 4.26Å; F229-I233 HydrophobicContact CE1-CD1 3.35Å; F229-I233 HydrophobicContact CE2-CD1 3.72Å; F229-I233 HydrophobicContact CE2-CG1 4.43Å; F229-I233 HydrophobicContact CG-CD1 4.37Å; F229-I233 HydrophobicContact CZ-CD1 3.24Å; F229-I233 HydrophobicContact CZ-CG1 4.37Å; F229-I233 PolarHBondContact O-N 3.35Å
230L91.4Very high84.9Confident120 Ų12070.7 Ų70.763%0.62836%0.364SS*.Hα-helixtrans-58.6-42.4176.4-67.6175.1000112G226 I233 K234G226-L230 WeakPolarHBondContact O-CG 3.24Å; G226-L230 PolarHBondContact O-N 3.43Å; L230-I233 PolarHBondContact O-N 3.32Å; L230-K234 WeakPolarHBondContact O-CB 3.12Å; L230-K234 PolarHBondContact O-N 3.07Å
231R89.3Confident83Confident100 Ų10073.2 Ų73.238%0.37738%0.379SS..Hα-helixtrans-64.4-40.9177.6-178.159.1171.8160.1-2.4112.3I135 V136 S227 I228 F229 G235I135-R231 HydrophobicContact CG2-CG 4.4Å; V136-R231 HydrophobicContact CG2-CB 4.36Å; S227-R231 WeakPolarHBondContact O-CB 3.16Å; S227-R231 PolarHBondContact O-N 2.98Å; I228-R231 PolarHBondContact O-N 3.36Å; F229-R231 VanDerWaalsContact C-N 3.32Å; F229-R231 PolarHBondContact O-N 2.98Å; R231-G235 PolarHBondContact O-N 3.48Å
232V85.7Confident81.1Confident49 Ų4976 Ų7630%0.29740%0.396SS..Hα-helixtrans-66.3-45.7178.61700000110.8I228 F229 G235 V236I228-V232 HydrophobicContact CG2-CG2 4.41Å; I228-V232 VanDerWaalsContact O-CG2 3.29Å; I228-V232 WeakPolarHBondContact O-CG2 3.45Å; I228-V232 PolarHBondContact O-N 2.89Å; F229-V232 PolarHBondContact O-N 3.37Å; V232-G235 PolarHBondContact O-N 2.9Å; V232-V236 WeakPolarHBondContact O-CG2 3.44Å; V232-V236 PolarHBondContact O-N 3.2Å
233I85Confident79.2Confident89 Ų8977.1 Ų77.146%0.45640%0.398SS..Hα-helixtrans-61.5-50.2177.9-71.6179000110.9F229 L230 G235 V236 S237F229-I233 HydrophobicContact CD1-CD1 3.93Å; F229-I233 HydrophobicContact CD2-CD1 4.26Å; F229-I233 HydrophobicContact CE1-CD1 3.35Å; F229-I233 HydrophobicContact CE2-CD1 3.72Å; F229-I233 HydrophobicContact CE2-CG1 4.43Å; F229-I233 HydrophobicContact CG-CD1 4.37Å; F229-I233 HydrophobicContact CZ-CD1 3.24Å; F229-I233 HydrophobicContact CZ-CG1 4.37Å; F229-I233 PolarHBondContact O-N 3.35Å; L230-I233 PolarHBondContact O-N 3.32Å; I233-G235 VanDerWaalsContact C-N 3.26Å; I233-G235 PolarHBondContact O-N 3.25Å; I233-V236 PolarHBondContact O-N 2.81Å; I233-V236 VanDerWaalsContact O-N 3.13Å; I233-S237 PolarHBondContact O-N 3.08Å
234K86Confident77.1Confident133 Ų13379.4 Ų79.458%0.57841%0.411SS*.Hα-helixtrans-58.7-40177.8-170.9173.8-176.5173.60111.7L230 S237 M238L230-K234 WeakPolarHBondContact O-CB 3.12Å; L230-K234 PolarHBondContact O-N 3.07Å; K234-S237 PolarHBondContact O-N 3.3Å; K234-M238 WeakPolarHBondContact O-CG 3.41Å; K234-M238 PolarHBondContact O-N 2.75Å
235G79.6Confident74.9Confident21 Ų2183.3 Ų83.322%0.21644%0.438CS..Hα-helixtrans-67.9-30.9177.700000114.5R231 V232 I233 R239R231-G235 PolarHBondContact O-N 3.48Å; V232-G235 PolarHBondContact O-N 2.9Å; I233-G235 VanDerWaalsContact C-N 3.26Å; I233-G235 PolarHBondContact O-N 3.25Å; G235-R239 WeakPolarHBondContact O-CG 3.5Å; G235-R239 PolarHBondContact O-N 3.05Å
236V72.6Confident73Confident64 Ų6487.9 Ų87.939%0.38846%0.463SS..Hα-helixtrans-73.4-45.6173.1172.10000110.5V232 I233 M238 R239 Q240V232-V236 WeakPolarHBondContact O-CG2 3.44Å; V232-V236 PolarHBondContact O-N 3.2Å; I233-V236 PolarHBondContact O-N 2.81Å; I233-V236 VanDerWaalsContact O-N 3.13Å; V236-M238 PolarHBondContact O-N 2.91Å; V236-R239 PolarHBondContact O-N 3.41Å; V236-Q240 PolarHBondContact O-N 3.31Å; V236-Q240 VanDerWaalsContact O-N 3.13Å
237S69.3Low71.1Confident66 Ų6693.6 Ų93.646%0.46249%0.485SS..Hα-helixtrans-58.2-45.5177.8172.90000112.2I233 K234 R239 Q240 T241I233-S237 PolarHBondContact O-N 3.08Å; K234-S237 PolarHBondContact O-N 3.3Å; S237-R239 VanDerWaalsContact C-N 3.31Å; S237-R239 PolarHBondContact O-N 2.88Å; S237-Q240 PolarHBondContact O-N 3.47Å; S237-T241 PolarHBondContact O-N 2.94Å; S237-T241 PolarHBondContact O-OG1 2.93Å
238M62Low69.1Low101 Ų10196.3 Ų96.350%0.49850%0.502SS..Hα-helixtrans-65.7-31.3178.1-68.1-155.9-46.800113.6K234 V236 T241 T242K234-M238 WeakPolarHBondContact O-CG 3.41Å; K234-M238 PolarHBondContact O-N 2.75Å; V236-M238 PolarHBondContact O-N 2.91Å; M238-T241 PolarHBondContact O-OG1 3.29Å; M238-T242 PolarHBondContact O-N 3.39Å; M238-T242 PolarHBondContact O-OG1 3.45Å
239R61.5Low67.3Low120 Ų120104.8 Ų104.845%0.45354%0.544SS..Hα-helixtrans-73-37.9178-78.3177.9176.8163-1112.4G235 V236 S237 T241 T242 D243G235-R239 WeakPolarHBondContact O-CG 3.5Å; G235-R239 PolarHBondContact O-N 3.05Å; V236-R239 PolarHBondContact O-N 3.41Å; S237-R239 VanDerWaalsContact C-N 3.31Å; S237-R239 PolarHBondContact O-N 2.88Å; R239-T241 VanDerWaalsContact C-N 3.25Å; R239-T241 PolarHBondContact O-N 2.94Å; R239-T242 PolarHBondContact O-N 3.36Å; R239-D243 PolarHBondContact O-N 2.94Å
240Q58Low65.6Low138 Ų138106.4 Ų106.465%0.64556%0.558SS**Hα-helixtrans-61-36.5175.1-76.7177.6-39.500111.8V236 S237V236-Q240 PolarHBondContact O-N 3.31Å; V236-Q240 VanDerWaalsContact O-N 3.13Å; S237-Q240 PolarHBondContact O-N 3.47Å
241T56.6Low64.1Low95 Ų95102.9 Ų102.958%0.58355%0.551SS**Hα-helixtrans-73.5-35176.348.90000113.2S237 M238 R239 S245S237-T241 PolarHBondContact O-N 2.94Å; S237-T241 PolarHBondContact O-OG1 2.93Å; M238-T241 PolarHBondContact O-OG1 3.29Å; R239-T241 VanDerWaalsContact C-N 3.25Å; R239-T241 PolarHBondContact O-N 2.94Å; T241-S245 PolarHBondContact O-OG 3.23Å
242T57.1Low62.9Low61 Ų61105.9 Ų105.937%0.37457%0.571SS.*Hα-helixtrans-80-36.7-178.77.40000113.7M238 R239 H244 S245 L246M238-T242 PolarHBondContact O-N 3.39Å; M238-T242 PolarHBondContact O-OG1 3.45Å; R239-T242 PolarHBondContact O-N 3.36Å; T242-H244 PolarHBondContact O-N 2.97Å; T242-S245 PolarHBondContact O-N 3.41Å; T242-S245 VanDerWaalsContact O-N 3.16Å; T242-S245 PolarHBondContact O-OG 3.21Å; T242-L246 HydrophobicContact CG2-CD1 3.78Å; T242-L246 HydrophobicContact CG2-CG 4.4Å; T242-L246 WeakPolarHBondContact O-CB 3.37Å; T242-L246 PolarHBondContact O-N 3.08Å
243D54.7Low61.9Low122 Ų122106.8 Ų106.865%0.65258%0.578SS**Hα-helixtrans-61.8-27.1177.6-86.7-10.2000111.5R239R239-D243 PolarHBondContact O-N 2.94Å
244H51.7Low61.5Low171 Ų171106.5 Ų106.579%0.79258%0.584SS**Hα-helixtrans-83.3-22.4178.2-145.2-56.9000113.7T242T242-H244 PolarHBondContact O-N 2.97Å
245S51.1Low61.3Low85 Ų85107.6 Ų107.659%0.59459%0.591SS**Hα-helixtrans-99.5-20.1-17961.40000113.8T241 T242T241-S245 PolarHBondContact O-OG 3.23Å; T242-S245 PolarHBondContact O-N 3.41Å; T242-S245 VanDerWaalsContact O-N 3.16Å; T242-S245 PolarHBondContact O-OG 3.21Å
246L52.8Low61.5Low117 Ų117109.8 Ų109.861%0.61361%0.607SS**  trans-118.861.1-176.8-60.7177.1000110.6T242 P248T242-L246 HydrophobicContact CG2-CD1 3.78Å; T242-L246 HydrophobicContact CG2-CG 4.4Å; T242-L246 WeakPolarHBondContact O-CB 3.37Å; T242-L246 PolarHBondContact O-N 3.08Å; L246-P248 WeakPolarHBondContact O-CD 3.31Å
247L52.8Low62.1Low153 Ų153112.5 Ų112.580%0.80162%0.617SS**  trans-82.388.9152-69.9176.6000107.4M249L247-M249 PolarHBondContact O-N 3.48Å
248P51.2Low62.7Low84 Ų84111.8 Ų111.855%0.54561%0.61SS.*  trans-66.2125.2174.127.4-34.7000109.1L246 N250L246-P248 WeakPolarHBondContact O-CD 3.31Å; P248-N250 PolarHBondContact O-N 3.06Å
249M53.5Low63.8Low182 Ų182109.7 Ų109.790%0.89761%0.609SS**THydrogen-bonded Turntrans-57.1-18.5-175.6-144-175.7-65.400114L247L247-M249 PolarHBondContact O-N 3.48Å
250N56.8Low64.9Low164 Ų164113.7 Ų113.788%0.87762%0.624SS**THydrogen-bonded Turntrans-141.226.8-170.1-79.4-24.9000116.3P248P248-N250 PolarHBondContact O-N 3.06Å
251G59.5Low66.1Low46 Ų46111.9 Ų111.947%0.47462%0.615SS.*  trans-158.668.4179.700000112.7P253G251-P253 WeakPolarHBondContact O-CD 3Å; G251-P253 VanDerWaalsContact O-N 3.16Å
252M63.1Low67.4Low163 Ų163113.2 Ų113.280%0.80361%0.613SS**  trans-63.9116.1175.2-154.1-175.5-61.500107.8S254M252-S254 PolarHBondContact O-N 3.23Å
253P64.6Low68.6Low68 Ų68113 Ų11344%0.44262%0.617SS.*  trans-55.9131.4169.821.6-29.7000107.4G251 E255 V258G251-P253 WeakPolarHBondContact O-CD 3Å; G251-P253 VanDerWaalsContact O-N 3.16Å; P253-E255 PolarHBondContact O-N 3.27Å; P253-V258 HydrophobicContact CB-CG2 4Å; P253-V258 HydrophobicContact CG-CG2 3.74Å
254S76.8Confident69.7Low82 Ų82109.3 Ų109.357%0.57360%0.604SS**  trans-44.6129.7179.1172.60000109.4M252 A256 M257 V258M252-S254 PolarHBondContact O-N 3.23Å; S254-A256 PolarHBondContact O-N 3.34Å; S254-M257 WeakPolarHBondContact O-CA 3.38Å; S254-M257 WeakPolarHBondContact O-CB 3.47Å; S254-M257 PolarHBondContact O-N 2.89Å; S254-V258 PolarHBondContact O-N 3.17Å
255E82.2Confident71Confident156 Ų156103.1 Ų103.173%0.72958%0.578SS**Hα-helixtrans-49.1-33.6-179-63.1-177.6157.500111.7P253 M257 V258 A259P253-E255 PolarHBondContact O-N 3.27Å; E255-M257 PolarHBondContact O-N 2.82Å; E255-V258 PolarHBondContact O-N 2.87Å; E255-A259 VanDerWaalsContact O-CB 3.25Å; E255-A259 WeakPolarHBondContact O-CB 3.19Å; E255-A259 PolarHBondContact O-N 3.32Å
256A84.6Confident72.4Confident67 Ų67107.3 Ų107.355%0.55458%0.581SS**Hα-helixtrans-61.1-39.9174.400000113.6S254 R260S254-A256 PolarHBondContact O-N 3.34Å; A256-R260 VanDerWaalsContact O-CB 3.27Å; A256-R260 WeakPolarHBondContact O-CB 3.25Å; A256-R260 PolarHBondContact O-N 3.31Å
257M84Confident73.6Confident122 Ų122109.7 Ų109.760%0.60158%0.581SS**Hα-helixtrans-67.2-46.1176.8-176.7177177.200111S254 E255 A259 R260 Q261S254-M257 WeakPolarHBondContact O-CA 3.38Å; S254-M257 WeakPolarHBondContact O-CB 3.47Å; S254-M257 PolarHBondContact O-N 2.89Å; E255-M257 PolarHBondContact O-N 2.82Å; M257-A259 VanDerWaalsContact C-N 3.35Å; M257-A259 PolarHBondContact O-N 3.01Å; M257-R260 PolarHBondContact O-N 3.25Å; M257-Q261 PolarHBondContact O-N 3.17Å
258V82.9Confident74.8Confident51 Ų51110.6 Ų110.631%0.30957%0.574SS.*Hα-helixtrans-62.5-44177.1178.80000110.5P253 S254 E255 Q261 K262P253-V258 HydrophobicContact CB-CG2 4Å; P253-V258 HydrophobicContact CG-CG2 3.74Å; S254-V258 PolarHBondContact O-N 3.17Å; E255-V258 PolarHBondContact O-N 2.87Å; V258-Q261 PolarHBondContact O-N 3.43Å; V258-K262 HydrophobicContact CG1-CD 4.19Å; V258-K262 WeakPolarHBondContact O-CG 3.36Å; V258-K262 PolarHBondContact O-N 3.38Å
259A84.7Confident76.2Confident57 Ų57109.4 Ų109.447%0.47156%0.561SS.*Hα-helixtrans-60.3-45.2175.400000111.8E255 M257 Q261 K262 A263E255-A259 VanDerWaalsContact O-CB 3.25Å; E255-A259 WeakPolarHBondContact O-CB 3.19Å; E255-A259 PolarHBondContact O-N 3.32Å; M257-A259 VanDerWaalsContact C-N 3.35Å; M257-A259 PolarHBondContact O-N 3.01Å; A259-Q261 PolarHBondContact O-N 3.21Å; A259-K262 PolarHBondContact O-N 3.25Å; A259-A263 WeakPolarHBondContact O-CB 3.44Å; A259-A263 PolarHBondContact O-N 2.84Å
260R84.7Confident77.4Confident204 Ų204104.2 Ų104.277%0.7753%0.532SS*.Hα-helixtrans-62.4-40.2177.5-170175.5-177.2-1770.8112.1A256 M257 A263 A264A256-R260 VanDerWaalsContact O-CB 3.27Å; A256-R260 WeakPolarHBondContact O-CB 3.25Å; A256-R260 PolarHBondContact O-N 3.31Å; M257-R260 PolarHBondContact O-N 3.25Å; R260-A263 PolarHBondContact O-N 2.83Å; R260-A264 WeakPolarHBondContact O-CB 3.4Å; R260-A264 PolarHBondContact O-N 2.97Å
261Q82.5Confident78.3Confident100 Ų10097.8 Ų97.847%0.46750%0.499SS..Hα-helixtrans-66.2-46.6175.8-179.3168.2-36.600111.9M257 V258 A259 A263 A264 V265M257-Q261 PolarHBondContact O-N 3.17Å; V258-Q261 PolarHBondContact O-N 3.43Å; A259-Q261 PolarHBondContact O-N 3.21Å; Q261-A263 VanDerWaalsContact C-N 3.32Å; Q261-A263 PolarHBondContact O-N 2.9Å; Q261-A264 PolarHBondContact O-N 3.43Å; Q261-V265 WeakPolarHBondContact O-CG2 3.35Å; Q261-V265 PolarHBondContact O-N 3.13Å
262K83.5Confident79.3Confident123 Ų12396.4 Ų96.454%0.53548%0.48SS..Hα-helixtrans-59.4-43.2175.2-73.5177.4-179.9175.70111.1V258 A259 V265 R266V258-K262 HydrophobicContact CG1-CD 4.19Å; V258-K262 WeakPolarHBondContact O-CG 3.36Å; V258-K262 PolarHBondContact O-N 3.38Å; A259-K262 PolarHBondContact O-N 3.25Å; K262-V265 PolarHBondContact O-N 3.1Å; K262-R266 WeakPolarHBondContact O-CG 3.47Å; K262-R266 PolarHBondContact O-N 3.02Å
263A82.5Confident80.4Confident55 Ų5595.3 Ų95.346%0.45547%0.467SS..Hα-helixtrans-62.7-42.9176.400000112.6A259 R260 Q261 V265 R266 R267A259-A263 WeakPolarHBondContact O-CB 3.44Å; A259-A263 PolarHBondContact O-N 2.84Å; R260-A263 PolarHBondContact O-N 2.83Å; Q261-A263 VanDerWaalsContact C-N 3.32Å; Q261-A263 PolarHBondContact O-N 2.9Å; A263-V265 PolarHBondContact O-N 3.24Å; A263-R266 PolarHBondContact O-N 3.03Å; A263-R267 WeakPolarHBondContact O-CB 3.32Å; A263-R267 PolarHBondContact O-N 2.95Å
264A78.2Confident81.3Confident46 Ų4692 Ų9238%0.3845%0.446SS..Hα-helixtrans-62.7-40.7176.900000112.5R260 Q261 R267 R268R260-A264 WeakPolarHBondContact O-CB 3.4Å; R260-A264 PolarHBondContact O-N 2.97Å; Q261-A264 PolarHBondContact O-N 3.43Å; A264-R267 PolarHBondContact O-N 3.36Å; A264-R268 WeakPolarHBondContact O-CG 3.5Å; A264-R268 PolarHBondContact O-N 3.3Å; A264-R268 VanDerWaalsContact O-N 3.08Å
265V79.2Confident81.6Confident40 Ų4088.2 Ų88.224%0.24242%0.419CS..Hα-helixtrans-64.3-47.1175.4173.40000111Q261 K262 A263 R267 R268 Q269Q261-V265 WeakPolarHBondContact O-CG2 3.35Å; Q261-V265 PolarHBondContact O-N 3.13Å; K262-V265 PolarHBondContact O-N 3.1Å; A263-V265 PolarHBondContact O-N 3.24Å; V265-R267 VanDerWaalsContact C-N 3.29Å; V265-R267 PolarHBondContact O-N 3.07Å; V265-R268 PolarHBondContact O-N 3.26Å; V265-Q269 WeakPolarHBondContact O-CG 3.36Å; V265-Q269 PolarHBondContact O-N 3.41Å
266R80.2Confident81.9Confident174 Ų17484.4 Ų84.466%0.65740%0.403SS*.Hα-helixtrans-58.2-41.4176.5-72.9174.4-179.6179.2-0.1111.8K262 A263 Q269 R270K262-R266 WeakPolarHBondContact O-CG 3.47Å; K262-R266 PolarHBondContact O-N 3.02Å; A263-R266 PolarHBondContact O-N 3.03Å; R266-Q269 PolarHBondContact O-N 3.04Å; R266-R270 WeakPolarHBondContact O-CB 3.26Å; R266-R270 PolarHBondContact O-N 3.11Å
267R77.4Confident82.1Confident166 Ų16683.5 Ų83.563%0.62639%0.392SS*.Hα-helixtrans-61.8-46176.1-172.5178.3-179.9-1721.2111.7A263 A264 V265 R270 T271A263-R267 WeakPolarHBondContact O-CB 3.32Å; A263-R267 PolarHBondContact O-N 2.95Å; A264-R267 PolarHBondContact O-N 3.36Å; V265-R267 VanDerWaalsContact C-N 3.29Å; V265-R267 PolarHBondContact O-N 3.07Å; R267-R270 PolarHBondContact O-N 3.34Å; R267-T271 PolarHBondContact O-N 2.88Å; R267-T271 PolarHBondContact O-OG1 3.27Å
268R78.5Confident82.2Confident173 Ų17377.8 Ų77.865%0.65336%0.364SS*.Hα-helixtrans-61-46.2176.9-70.8176.4-174.5-159.92.1111.7A264 V265 R270 T271 N272A264-R268 WeakPolarHBondContact O-CG 3.5Å; A264-R268 PolarHBondContact O-N 3.3Å; A264-R268 VanDerWaalsContact O-N 3.08Å; V265-R268 PolarHBondContact O-N 3.26Å; R268-R270 VanDerWaalsContact C-N 3.34Å; R268-R270 PolarHBondContact O-N 2.98Å; R268-T271 PolarHBondContact O-N 3.3Å; R268-N272 PolarHBondContact O-N 3.26Å
269Q80.8Confident82.6Confident58 Ų5876.1 Ų76.127%0.27135%0.354SS..Hα-helixtrans-62.1-40.7177.3-71177.4-2100112.2V265 R266 N272 R273V265-Q269 WeakPolarHBondContact O-CG 3.36Å; V265-Q269 PolarHBondContact O-N 3.41Å; R266-Q269 PolarHBondContact O-N 3.04Å; Q269-N272 PolarHBondContact O-N 3.43Å; Q269-R273 WeakPolarHBondContact O-CG 3.27Å; Q269-R273 PolarHBondContact O-N 3.12Å
270R78.9Confident82.9Confident74 Ų7476.1 Ų76.128%0.27935%0.354SS..Hα-helixtrans-61.1-45175.9-175.4177.6179.1-166-5.3111.7R266 R267 R268 R273 M274 W333 L334R266-R270 WeakPolarHBondContact O-CB 3.26Å; R266-R270 PolarHBondContact O-N 3.11Å; R267-R270 PolarHBondContact O-N 3.34Å; R268-R270 VanDerWaalsContact C-N 3.34Å; R268-R270 PolarHBondContact O-N 2.98Å; R270-R273 PolarHBondContact O-N 3.32Å; R270-M274 PolarHBondContact O-N 3.44Å; R270-M274 VanDerWaalsContact O-N 3.07Å; R270-W333 PolarHBondContact NH2-O 3.13Å; R270-W333 VanDerWaalsContact NH2-O 3.11Å; R270-L334 WeakPolarHBondContact CD-O 3.01Å; R270-L334 PolarHBondContact NE-O 3.19Å; R270-L334 PolarHBondContact NH2-O 3.33Å
271T75.9Confident83.3Confident29 Ų2968.1 Ų68.118%0.17833%0.328CS..Hα-helixtrans-63-41.9176.1-58.20000111.8R267 R268 M274 L275R267-T271 PolarHBondContact O-N 2.88Å; R267-T271 PolarHBondContact O-OG1 3.27Å; R268-T271 PolarHBondContact O-N 3.3Å; T271-M274 HydrophobicContact CG2-CE 4.37Å; T271-M274 WeakPolarHBondContact O-CB 3.28Å; T271-M274 PolarHBondContact O-N 3.46Å; T271-L275 HydrophobicContact CG2-CD1 4.32Å; T271-L275 WeakPolarHBondContact O-CG 3.22Å; T271-L275 PolarHBondContact O-N 2.87Å
272N80.8Confident83.7Confident17 Ų1763.8 Ų63.89%0.09131%0.308CS..Hα-helixtrans-66.7-42.2178-71-4.8000112.8I135 R268 Q269 M274 L275 I276I135-N272 WeakPolarHBondContact CD1-ND2 3.37Å; I135-N272 WeakPolarHBondContact CD1-OD1 3.44Å; R268-N272 PolarHBondContact O-N 3.26Å; Q269-N272 PolarHBondContact O-N 3.43Å; N272-M274 VanDerWaalsContact C-N 3.3Å; N272-M274 PolarHBondContact O-N 2.88Å; N272-L275 PolarHBondContact O-N 2.94Å; N272-L275 VanDerWaalsContact O-N 3.14Å; N272-I276 WeakPolarHBondContact O-CG1 3.32Å; N272-I276 PolarHBondContact O-N 3.2Å
273R85.3Confident84.2Confident139 Ų13960.1 Ų60.153%0.52530%0.296SS..Hα-helixtrans-58.1-44.5175.1-75.4-167.9-59.6-91.62111.5Q269 R270 L275 I276 S277Q269-R273 WeakPolarHBondContact O-CG 3.27Å; Q269-R273 PolarHBondContact O-N 3.12Å; R270-R273 PolarHBondContact O-N 3.32Å; R273-L275 VanDerWaalsContact C-N 3.29Å; R273-L275 PolarHBondContact O-N 3.19Å; R273-I276 PolarHBondContact O-N 2.89Å; R273-S277 PolarHBondContact O-N 3.1Å; R273-S277 PolarHBondContact O-OG 3.47Å; R273-S277 VanDerWaalsContact O-OG 3.06Å
274M83Confident84.8Confident0 Ų060.5 Ų60.50%030%0.299CS..Hα-helixtrans-54.7-44.6174.8177.8-169.980.800112.4R270 T271 N272 S277 M278 L330 Y331 L334 N335R270-M274 PolarHBondContact O-N 3.44Å; R270-M274 VanDerWaalsContact O-N 3.07Å; T271-M274 HydrophobicContact CG2-CE 4.37Å; T271-M274 WeakPolarHBondContact O-CB 3.28Å; T271-M274 PolarHBondContact O-N 3.46Å; N272-M274 VanDerWaalsContact C-N 3.3Å; N272-M274 PolarHBondContact O-N 2.88Å; M274-S277 PolarHBondContact O-N 3.17Å; M274-M278 HydrophobicContact CE-CE 4.13Å; M274-M278 HydrophobicContact CG-CE 3.57Å; M274-M278 HydrophobicContact CG-SD 4.37Å; M274-M278 WeakPolarHBondContact O-CG 3.49Å; M274-M278 PolarHBondContact O-N 3.33Å; M274-M278 HydrophobicContact SD-CE 4Å; M274-L330 HydrophobicContact CG-CB 4.47Å; M274-Y331 HydrophobicContact CE-CD1 3.91Å; M274-Y331 HydrophobicContact CE-CE1 3.94Å; M274-Y331 HydrophobicContact SD-CD1 3.92Å; M274-Y331 HydrophobicContact SD-CE1 4.46Å; M274-L334 HydrophobicContact CB-CB 3.73Å; M274-L334 HydrophobicContact CB-CD1 3.63Å; M274-L334 HydrophobicContact CB-CG 4.34Å; M274-L334 HydrophobicContact CG-CB 3.73Å; M274-L334 HydrophobicContact CG-CD1 3.88Å; M274-L334 HydrophobicContact CG-CG 4.41Å; M274-L334 HydrophobicContact SD-CB 4.04Å; M274-N335 HydrophobicContact SD-CB 3.9Å
275L84.1Confident85.7Confident2 Ų258.7 Ų58.71%0.0128%0.283CS..Hα-helixtrans-73.2-36.9-177.4-62.1171.7000112.7I127 R131 Y225 T271 N272 R273 S277 M278 V279I127-L275 HydrophobicContact CG2-CD1 3.96Å; I127-L275 HydrophobicContact CG2-CD2 3.78Å; I127-L275 HydrophobicContact CG2-CG 4.41Å; R131-L275 HydrophobicContact CG-CD1 3.5Å; Y225-L275 HydrophobicContact CE1-CB 4.38Å; Y225-L275 WeakPolarHBondContact OH-CB 3.42Å; T271-L275 HydrophobicContact CG2-CD1 4.32Å; T271-L275 WeakPolarHBondContact O-CG 3.22Å; T271-L275 PolarHBondContact O-N 2.87Å; N272-L275 PolarHBondContact O-N 2.94Å; N272-L275 VanDerWaalsContact O-N 3.14Å; R273-L275 VanDerWaalsContact C-N 3.29Å; R273-L275 PolarHBondContact O-N 3.19Å; L275-S277 VanDerWaalsContact C-N 3.3Å; L275-S277 PolarHBondContact O-N 3.47Å; L275-M278 HydrophobicContact CD2-SD 3.85Å; L275-M278 WeakPolarHBondContact O-CB 3.48Å; L275-M278 PolarHBondContact O-N 3.48Å; L275-V279 PolarHBondContact O-N 3.44Å
276I88Confident86.5Confident76 Ų7657.5 Ų57.539%0.3927%0.274SS..Hα-helixtrans-61.3-43.1172.3-66.7166000109.9Y225 N272 R273 M278 V279 A280Y225-I276 HydrophobicContact CD1-CD1 4.02Å; Y225-I276 HydrophobicContact CD1-CG1 3.49Å; Y225-I276 VanDerWaalsContact CD1-CG1 3.49Å; Y225-I276 HydrophobicContact CD2-CG1 4.13Å; Y225-I276 HydrophobicContact CE1-CG1 3.79Å; Y225-I276 HydrophobicContact CE2-CG1 4.37Å; Y225-I276 HydrophobicContact CG-CD1 4.38Å; Y225-I276 HydrophobicContact CG-CG1 3.71Å; N272-I276 WeakPolarHBondContact O-CG1 3.32Å; N272-I276 PolarHBondContact O-N 3.2Å; R273-I276 PolarHBondContact O-N 2.89Å; I276-M278 VanDerWaalsContact C-N 3.33Å; I276-M278 PolarHBondContact O-N 3.24Å; I276-V279 PolarHBondContact O-N 2.89Å; I276-A280 WeakPolarHBondContact O-CB 3.29Å; I276-A280 PolarHBondContact O-N 3.06Å
277S88.8Confident87.3Confident47 Ų4754.9 Ų54.933%0.32927%0.268SS..Hα-helixtrans-61.1-39175.5-60.60000112.6R273 M274 L275 V279 A280 V281R273-S277 PolarHBondContact O-N 3.1Å; R273-S277 PolarHBondContact O-OG 3.47Å; R273-S277 VanDerWaalsContact O-OG 3.06Å; M274-S277 PolarHBondContact O-N 3.17Å; L275-S277 VanDerWaalsContact C-N 3.3Å; L275-S277 PolarHBondContact O-N 3.47Å; S277-V279 PolarHBondContact O-N 2.9Å; S277-A280 PolarHBondContact O-N 3.16Å; S277-V281 WeakPolarHBondContact O-CB 3.37Å; S277-V281 VanDerWaalsContact O-CG2 3.22Å; S277-V281 WeakPolarHBondContact O-CG2 3.11Å; S277-V281 PolarHBondContact O-N 3.33Å
278M87.3Confident88.2Confident2 Ų250.1 Ų50.11%0.0125%0.254CS..Hα-helixtrans-60.1-45.2176.4-73.3164.418000112L124 M274 L275 I276 F282 L330 Y331L124-M278 HydrophobicContact CD2-CB 4.31Å; M274-M278 HydrophobicContact CE-CE 4.13Å; M274-M278 HydrophobicContact CG-CE 3.57Å; M274-M278 HydrophobicContact CG-SD 4.37Å; M274-M278 WeakPolarHBondContact O-CG 3.49Å; M274-M278 PolarHBondContact O-N 3.33Å; M274-M278 HydrophobicContact SD-CE 4Å; L275-M278 HydrophobicContact CD2-SD 3.85Å; L275-M278 WeakPolarHBondContact O-CB 3.48Å; L275-M278 PolarHBondContact O-N 3.48Å; I276-M278 VanDerWaalsContact C-N 3.33Å; I276-M278 PolarHBondContact O-N 3.24Å; M278-F282 WeakPolarHBondContact O-CB 3.36Å; M278-F282 PolarHBondContact O-N 3.02Å; M278-L330 HydrophobicContact CB-CD1 4.3Å; M278-L330 HydrophobicContact CE-CB 3.52Å; M278-L330 HydrophobicContact CE-CD1 4.47Å; M278-L330 HydrophobicContact CG-CB 4.27Å; M278-L330 HydrophobicContact CG-CD1 3.55Å; M278-Y331 HydrophobicContact CE-CD1 3.31Å; M278-Y331 HydrophobicContact CE-CD2 4.18Å; M278-Y331 HydrophobicContact CE-CE1 3.01Å; M278-Y331 HydrophobicContact CE-CE2 3.93Å; M278-Y331 HydrophobicContact CE-CG 3.86Å; M278-Y331 HydrophobicContact SD-CD1 4.44Å; M278-Y331 HydrophobicContact SD-CE1 3.59Å; M278-Y331 VanDerWaalsContact SD-CE1 3.59Å; M278-Y331 PolarHBondContact SD-OH 3.11Å; M278-Y331 VanDerWaalsContact SD-OH 3.34Å
279V90.1Very high89.1Confident16 Ų1642.5 Ų42.510%0.09723%0.226CC..Hα-helixtrans-66.1-48.2177.9172.70000111.2L124 I221 Y225 L275 I276 S277 V281 F282 V283L124-V279 HydrophobicContact CB-CG2 4.5Å; L124-V279 HydrophobicContact CD2-CG2 4.37Å; I221-V279 HydrophobicContact CD1-CG1 4.49Å; I221-V279 HydrophobicContact CD1-CG2 4.49Å; I221-V279 HydrophobicContact CG2-CB 4.24Å; I221-V279 HydrophobicContact CG2-CG1 3.58Å; I221-V279 HydrophobicContact CG2-CG2 3.85Å; Y225-V279 HydrophobicContact CE2-CG2 3.97Å; L275-V279 PolarHBondContact O-N 3.44Å; I276-V279 PolarHBondContact O-N 2.89Å; S277-V279 PolarHBondContact O-N 2.9Å; V279-V281 VanDerWaalsContact C-N 3.26Å; V279-V281 PolarHBondContact O-N 2.86Å; V279-F282 PolarHBondContact O-N 2.88Å; V279-V283 HydrophobicContact CG1-CG2 4.35Å; V279-V283 WeakPolarHBondContact O-CG2 3.49Å; V279-V283 PolarHBondContact O-N 2.84Å
280A92Very high89.8Confident58 Ų5841 Ų4148%0.47922%0.221SC..Hα-helixtrans-58.4-42.4-178.600000111.6I276 S277 A284I276-A280 WeakPolarHBondContact O-CB 3.29Å; I276-A280 PolarHBondContact O-N 3.06Å; S277-A280 PolarHBondContact O-N 3.16Å; A280-A284 WeakPolarHBondContact O-CB 3.33Å; A280-A284 PolarHBondContact O-N 3.18Å
281V93.3Very high90.6Very high35 Ų3540.8 Ų40.821%0.21223%0.225CC..Hα-helixtrans-69.1-42.9177.4173.80000111.6S277 V279 V283 A284 C285 W326S277-V281 WeakPolarHBondContact O-CB 3.37Å; S277-V281 VanDerWaalsContact O-CG2 3.22Å; S277-V281 WeakPolarHBondContact O-CG2 3.11Å; S277-V281 PolarHBondContact O-N 3.33Å; V279-V281 VanDerWaalsContact C-N 3.26Å; V279-V281 PolarHBondContact O-N 2.86Å; V281-V283 VanDerWaalsContact C-N 3.32Å; V281-V283 PolarHBondContact O-N 3.37Å; V281-A284 PolarHBondContact O-N 2.84Å; V281-C285 WeakPolarHBondContact O-CB 3.45Å; V281-C285 PolarHBondContact O-N 3.39Å; V281-C285 PolarHBondContact O-SG 2.93Å; V281-W326 HydrophobicContact CB-CB 4.5Å; V281-W326 HydrophobicContact CB-CG 4.45Å; V281-W326 HydrophobicContact CG1-CB 3.59Å; V281-W326 HydrophobicContact CG1-CD2 3.75Å; V281-W326 HydrophobicContact CG1-CG 3.22Å
282F90.8Very high91.6Very high10 Ų1040 Ų404%0.04422%0.22CC..Hα-helixtrans-57-47175.5-178.6-94.1000111.5T117 T121 L124 F214 M278 V279 C285 W286T117-F282 HydrophobicContact CG2-CZ 4.17Å; T121-F282 HydrophobicContact CG2-CE1 3.97Å; T121-F282 WeakPolarHBondContact OG1-CE1 3.26Å; T121-F282 WeakPolarHBondContact OG1-CZ 3.24Å; L124-F282 HydrophobicContact CD1-CB 3.85Å; L124-F282 HydrophobicContact CD1-CD1 3.96Å; L124-F282 HydrophobicContact CD1-CD2 3.98Å; L124-F282 HydrophobicContact CD1-CG 3.65Å; F214-F282 HydrophobicContact CD1-CE1 4.37Å; F214-F282 AromaticContact CE1-CE1 3.8Å; F214-F282 HydrophobicContact CE1-CE1 3.8Å; F214-F282 HydrophobicContact CE1-CZ 4.23Å; M278-F282 WeakPolarHBondContact O-CB 3.36Å; M278-F282 PolarHBondContact O-N 3.02Å; V279-F282 PolarHBondContact O-N 2.88Å; F282-C285 PolarHBondContact O-N 2.88Å; F282-W286 AromaticContact CD2-CD1 3.68Å; F282-W286 AromaticContact CD2-NE1 3.89Å; F282-W286 HydrophobicContact CE1-CG 4.47Å; F282-W286 AromaticContact CE2-CD1 3.41Å; F282-W286 VanDerWaalsContact CE2-CD1 3.41Å; F282-W286 HydrophobicContact CE2-CG 4.4Å; F282-W286 AromaticContact CE2-NE1 3.34Å; F282-W286 VanDerWaalsContact CE2-NE1 3.34Å; F282-W286 AromaticContact CZ-CD1 3.58Å; F282-W286 HydrophobicContact CZ-CG 4.19Å; F282-W286 AromaticContact CZ-NE1 3.77Å; F282-W286 WeakPolarHBondContact O-CB 2.84Å; F282-W286 VanDerWaalsContact O-CD1 3.31Å; F282-W286 PolarHBondContact O-N 3.49Å
283V93.3Very high92.3Very high46 Ų4642 Ų4228%0.27923%0.23SC..Hα-helixtrans-60.5-48.1176.5174.70000111.2L218 V279 V281 C285 W286 F287L218-V283 HydrophobicContact CD1-CG2 4.32Å; L218-V283 HydrophobicContact CD2-CG2 3.24Å; L218-V283 HydrophobicContact CG-CG2 4.4Å; V279-V283 HydrophobicContact CG1-CG2 4.35Å; V279-V283 WeakPolarHBondContact O-CG2 3.49Å; V279-V283 PolarHBondContact O-N 2.84Å; V281-V283 VanDerWaalsContact C-N 3.32Å; V281-V283 PolarHBondContact O-N 3.37Å; V283-C285 PolarHBondContact O-N 3.49Å; V283-W286 PolarHBondContact O-N 2.82Å; V283-F287 WeakPolarHBondContact O-CB 3.2Å; V283-F287 PolarHBondContact O-N 2.78Å
284A95.8Very high92.8Very high63 Ų6337.4 Ų37.452%0.52122%0.217SC..Hα-helixtrans-62-43.1-179.200000112.5A280 V281A280-A284 WeakPolarHBondContact O-CB 3.33Å; A280-A284 PolarHBondContact O-N 3.18Å; V281-A284 PolarHBondContact O-N 2.84Å
285C96.2Very high93.5Very high7 Ų739.4 Ų39.45%0.04723%0.228CC..Hα-helixtrans-63.7-43.3177.8-69.50000111.8V281 F282 V283 I319 A320 T322V281-C285 WeakPolarHBondContact O-CB 3.45Å; V281-C285 PolarHBondContact O-N 3.39Å; V281-C285 PolarHBondContact O-SG 2.93Å; F282-C285 PolarHBondContact O-N 2.88Å; V283-C285 PolarHBondContact O-N 3.49Å; C285-I319 WeakPolarHBondContact CB-O 3.24Å; C285-A320 WeakPolarHBondContact O-CA 3.15Å; C285-A320 PolarHBondContact O-N 3.26Å; C285-T322 PolarHBondContact SG-OG1 3.11Å
286W96.4Very high94Very high16 Ų1643.4 Ų43.46%0.06124%0.243CC..Hα-helixtrans-84.5-23.3-175.6-79.991.9000114.3T117 F214 F282 V283 L288 Q289 V290 A320 M321 S323T117-W286 HydrophobicContact CG2-CD2 3.79Å; T117-W286 HydrophobicContact CG2-CE3 3.87Å; T117-W286 HydrophobicContact CG2-CH2 3.46Å; T117-W286 VanDerWaalsContact CG2-CH2 3.46Å; T117-W286 HydrophobicContact CG2-CZ2 3.38Å; T117-W286 HydrophobicContact CG2-CZ3 3.71Å; T117-W286 WeakPolarHBondContact OG1-CH2 3.44Å; T117-W286 WeakPolarHBondContact OG1-CZ2 3.3Å; F214-W286 HydrophobicContact CE1-CB 3.78Å; F214-W286 HydrophobicContact CE1-CG 4.09Å; F214-W286 HydrophobicContact CZ-CB 3.98Å; F214-W286 HydrophobicContact CZ-CD2 4.09Å; F214-W286 AromaticContact CZ-CE3 3.93Å; F214-W286 HydrophobicContact CZ-CE3 3.93Å; F214-W286 HydrophobicContact CZ-CG 4.12Å; F282-W286 AromaticContact CD2-CD1 3.68Å; F282-W286 AromaticContact CD2-NE1 3.89Å; F282-W286 HydrophobicContact CE1-CG 4.47Å; F282-W286 AromaticContact CE2-CD1 3.41Å; F282-W286 VanDerWaalsContact CE2-CD1 3.41Å; F282-W286 HydrophobicContact CE2-CG 4.4Å; F282-W286 AromaticContact CE2-NE1 3.34Å; F282-W286 VanDerWaalsContact CE2-NE1 3.34Å; F282-W286 AromaticContact CZ-CD1 3.58Å; F282-W286 HydrophobicContact CZ-CG 4.19Å; F282-W286 AromaticContact CZ-NE1 3.77Å; F282-W286 WeakPolarHBondContact O-CB 2.84Å; F282-W286 VanDerWaalsContact O-CD1 3.31Å; F282-W286 PolarHBondContact O-N 3.49Å; V283-W286 PolarHBondContact O-N 2.82Å; W286-L288 PolarHBondContact O-N 3.46Å; W286-Q289 HydrophobicContact CE3-CB 4.45Å; W286-Q289 HydrophobicContact CE3-CG 4.36Å; W286-Q289 HydrophobicContact CZ3-CG 4.27Å; W286-Q289 PolarHBondContact O-N 3.49Å; W286-Q289 VanDerWaalsContact O-N 3.15Å; W286-V290 WeakPolarHBondContact O-CG2 3.23Å; W286-V290 PolarHBondContact O-N 3.14Å; W286-A320 HydrophobicContact CD2-CB 4.26Å; W286-A320 HydrophobicContact CE3-CB 4.27Å; W286-A320 HydrophobicContact CZ3-CB 4.46Å; W286-M321 HydrophobicContact CH2-CE 4.29Å; W286-M321 HydrophobicContact CZ2-CE 4.43Å; W286-S323 PolarHBondContact NE1-OG 2.8Å
287F96.2Very high94.2Very high119 Ų11941 Ų4152%0.52223%0.23SC..Hα-helixtrans-52.4-49.9-173.5174-106000113V283 Q289 V290 L291V283-F287 WeakPolarHBondContact O-CB 3.2Å; V283-F287 PolarHBondContact O-N 2.78Å; F287-Q289 PolarHBondContact O-N 3.38Å; F287-V290 PolarHBondContact O-N 2.66Å; F287-L291 HydrophobicContact CE1-CD2 4.15Å; F287-L291 HydrophobicContact CZ-CD2 4.14Å; F287-L291 VanDerWaalsContact O-CB 3.3Å; F287-L291 WeakPolarHBondContact O-CB 3.22Å; F287-L291 PolarHBondContact O-N 2.99Å
288L96.4Very high94.5Very high65 Ų6544.9 Ų44.934%0.3424%0.242SC..Hα-helixtrans-66.9-37.1-177.2-67.1176.4000112.6W286 L292 V316 I319W286-L288 PolarHBondContact O-N 3.46Å; L288-L292 WeakPolarHBondContact O-CB 3.22Å; L288-L292 PolarHBondContact O-N 2.95Å; L288-V316 HydrophobicContact CB-CB 4.11Å; L288-V316 HydrophobicContact CB-CG1 3.85Å; L288-I319 HydrophobicContact CD1-CD1 3.6Å; L288-I319 HydrophobicContact CD1-CG2 4.47Å
289Q96.9Very high94.7Very high13 Ų1348.1 Ų48.16%0.06128%0.276CS..Hα-helixtrans-67-42.8176.7179.761.773.800111.4W286 F287 N293 A320W286-Q289 HydrophobicContact CE3-CB 4.45Å; W286-Q289 HydrophobicContact CE3-CG 4.36Å; W286-Q289 HydrophobicContact CZ3-CG 4.27Å; W286-Q289 PolarHBondContact O-N 3.49Å; W286-Q289 VanDerWaalsContact O-N 3.15Å; F287-Q289 PolarHBondContact O-N 3.38Å; Q289-N293 PolarHBondContact NE2-OD1 3.47Å; Q289-N293 VanDerWaalsContact O-CG 3.24Å; Q289-N293 PolarHBondContact O-N 2.93Å; Q289-N293 VanDerWaalsContact O-N 3.08Å; Q289-N293 PolarHBondContact O-OD1 3.05Å; Q289-A320 HydrophobicContact CB-CB 3.97Å; Q289-A320 HydrophobicContact CG-CB 4.38Å
290V96.2Very high95Very high27 Ų2749.9 Ų49.916%0.16429%0.292CS..Hα-helixtrans-65.1-46.4177.2173.80000110.5L210 F214 W286 F287 L292 N293 V294L210-V290 HydrophobicContact CD1-CG1 3.39Å; F214-V290 HydrophobicContact CD2-CG1 4.41Å; F214-V290 HydrophobicContact CD2-CG2 3.71Å; F214-V290 HydrophobicContact CE1-CG2 4.21Å; F214-V290 HydrophobicContact CE2-CG2 3.22Å; F214-V290 HydrophobicContact CG-CG2 4.38Å; F214-V290 HydrophobicContact CZ-CG2 3.52Å; W286-V290 WeakPolarHBondContact O-CG2 3.23Å; W286-V290 PolarHBondContact O-N 3.14Å; F287-V290 PolarHBondContact O-N 2.66Å; V290-L292 PolarHBondContact O-N 3.35Å; V290-N293 PolarHBondContact O-N 3.06Å; V290-V294 WeakPolarHBondContact O-CG2 3.43Å; V290-V294 PolarHBondContact O-N 3.38Å
291L96.5Very high95.1Very high70 Ų7049.9 Ų49.937%0.36628%0.283SS..Hα-helixtrans-58.5-47177.5179.461.1000111.2F287 N293 V294 L295F287-L291 HydrophobicContact CE1-CD2 4.15Å; F287-L291 HydrophobicContact CZ-CD2 4.14Å; F287-L291 VanDerWaalsContact O-CB 3.3Å; F287-L291 WeakPolarHBondContact O-CB 3.22Å; F287-L291 PolarHBondContact O-N 2.99Å; L291-N293 VanDerWaalsContact C-N 3.31Å; L291-N293 PolarHBondContact O-N 2.95Å; L291-V294 PolarHBondContact O-N 3.45Å; L291-L295 HydrophobicContact CD1-CD1 4.22Å; L291-L295 HydrophobicContact CD1-CG 4.18Å; L291-L295 HydrophobicContact CG-CD1 4.07Å; L291-L295 HydrophobicContact CG-CG 4.42Å; L291-L295 VanDerWaalsContact O-CG 3.29Å; L291-L295 WeakPolarHBondContact O-CG 3.3Å; L291-L295 PolarHBondContact O-N 2.65Å
292L96.4Very high95.2Very high13 Ų1351.1 Ų51.17%0.06829%0.292CS..Hα-helixtrans-62.4-39.1178.4-17463.9000112.1L288 V290 L295 R296 I305 V316L288-L292 WeakPolarHBondContact O-CB 3.22Å; L288-L292 PolarHBondContact O-N 2.95Å; V290-L292 PolarHBondContact O-N 3.35Å; L292-L295 PolarHBondContact O-N 2.94Å; L292-R296 WeakPolarHBondContact O-CB 3.29Å; L292-R296 PolarHBondContact O-N 2.75Å; L292-I305 HydrophobicContact CD1-CG2 3.87Å; L292-V316 HydrophobicContact CB-CG2 4.27Å; L292-V316 HydrophobicContact CD2-CG1 4.43Å; L292-V316 HydrophobicContact CD2-CG2 3.46Å; L292-V316 VanDerWaalsContact CD2-CG2 3.46Å
293N95.4Very high95.1Very high59 Ų5954.3 Ų54.332%0.31632%0.316SS..Hα-helixtrans-64.3-44.9176.8-71.4-8.6000111.6Q289 V290 L291 R296 D297Q289-N293 PolarHBondContact NE2-OD1 3.47Å; Q289-N293 VanDerWaalsContact O-CG 3.24Å; Q289-N293 PolarHBondContact O-N 2.93Å; Q289-N293 VanDerWaalsContact O-N 3.08Å; Q289-N293 PolarHBondContact O-OD1 3.05Å; V290-N293 PolarHBondContact O-N 3.06Å; L291-N293 VanDerWaalsContact C-N 3.31Å; L291-N293 PolarHBondContact O-N 2.95Å; N293-R296 WeakPolarHBondContact O-CB 3.17Å; N293-R296 PolarHBondContact O-N 3.06Å; N293-R296 PolarHBondContact OD1-NH1 2.98Å; N293-D297 VanDerWaalsContact O-CG 3.28Å; N293-D297 PolarHBondContact O-N 3.22Å
294V96.3Very high94.9Very high41 Ų4156.3 Ų56.325%0.24833%0.33CS..Hα-helixtrans-61.3-48175.7173.50000110.9L210 V290 L291 R296 D297 F298L210-V294 HydrophobicContact CD1-CG2 4.49Å; L210-V294 HydrophobicContact CD2-CG2 3.85Å; V290-V294 WeakPolarHBondContact O-CG2 3.43Å; V290-V294 PolarHBondContact O-N 3.38Å; L291-V294 PolarHBondContact O-N 3.45Å; V294-R296 PolarHBondContact O-N 2.88Å; V294-D297 PolarHBondContact O-N 3.39Å; V294-F298 HydrophobicContact CG1-CD2 3.85Å; V294-F298 HydrophobicContact CG1-CE2 4.09Å; V294-F298 VanDerWaalsContact O-CD2 3.27Å; V294-F298 WeakPolarHBondContact O-CD2 3.49Å; V294-F298 PolarHBondContact O-N 3.02Å; V294-F298 VanDerWaalsContact O-N 3.08Å
295L96.5Very high94.8Very high42 Ų4255.4 Ų55.422%0.2232%0.316CS..Hα-helixtrans-60.4-36.4177.6-67.2175.5000111.9L291 L292 G299 A300 I301L291-L295 HydrophobicContact CD1-CD1 4.22Å; L291-L295 HydrophobicContact CD1-CG 4.18Å; L291-L295 HydrophobicContact CG-CD1 4.07Å; L291-L295 HydrophobicContact CG-CG 4.42Å; L291-L295 VanDerWaalsContact O-CG 3.29Å; L291-L295 WeakPolarHBondContact O-CG 3.3Å; L291-L295 PolarHBondContact O-N 2.65Å; L292-L295 PolarHBondContact O-N 2.94Å; L295-G299 PolarHBondContact O-N 3.18Å; L295-G299 VanDerWaalsContact O-N 3.07Å; L295-A300 HydrophobicContact CD2-CB 3.98Å; L295-A300 PolarHBondContact O-N 2.62Å; L295-I301 HydrophobicContact CB-CG1 4.14Å
296R94.5Very high94.7Very high87 Ų8756.9 Ų56.933%0.32833%0.328SS..Hα-helixtrans-65.6-47.1174.9-171.3-173.6-61.7117.90.7111.8L292 N293 V294 F298 G299 I301L292-R296 WeakPolarHBondContact O-CB 3.29Å; L292-R296 PolarHBondContact O-N 2.75Å; N293-R296 WeakPolarHBondContact O-CB 3.17Å; N293-R296 PolarHBondContact O-N 3.06Å; N293-R296 PolarHBondContact OD1-NH1 2.98Å; V294-R296 PolarHBondContact O-N 2.88Å; R296-F298 VanDerWaalsContact C-N 3.25Å; R296-F298 PolarHBondContact O-N 2.72Å; R296-G299 PolarHBondContact O-N 2.9Å; R296-I301 HydrophobicContact CB-CD1 4.02Å; R296-I301 HydrophobicContact CG-CD1 4.24Å
297D93.2Very high94.6Very high24 Ų2460.2 Ų60.213%0.12835%0.347CS..Hα-helixtrans-64.9-30.3-177.7-68.3-17.5000112.6R202 Q203 N293 V294R202-D297 IonicContact CZ-OD1 3.5Å; R202-D297 VanDerWaalsContact CZ-OD1 3.23Å; R202-D297 IonicContact NE-OD1 3.86Å; R202-D297 PolarHBondContact NE-OD1 2.65Å; R202-D297 IonicContact NH2-OD1 3.67Å; R202-D297 PolarHBondContact NH2-OD1 2.84Å; Q203-D297 HydrophobicContact CG-CB 4.47Å; Q203-D297 WeakPolarHBondContact CG-O 2.94Å; Q203-D297 PolarHBondContact NE2-O 3.2Å; N293-D297 VanDerWaalsContact O-CG 3.28Å; N293-D297 PolarHBondContact O-N 3.22Å; V294-D297 PolarHBondContact O-N 3.39Å
298F94.2Very high94.5Very high129 Ų12956 Ų5657%0.56633%0.329SS*.THydrogen-bonded Turntrans-98.97.3176.8-68.3-75.9000114.3V294 R296 A300V294-F298 HydrophobicContact CG1-CD2 3.85Å; V294-F298 HydrophobicContact CG1-CE2 4.09Å; V294-F298 VanDerWaalsContact O-CD2 3.27Å; V294-F298 WeakPolarHBondContact O-CD2 3.49Å; V294-F298 PolarHBondContact O-N 3.02Å; V294-F298 VanDerWaalsContact O-N 3.08Å; R296-F298 VanDerWaalsContact C-N 3.25Å; R296-F298 PolarHBondContact O-N 2.72Å; F298-A300 PolarHBondContact O-N 2.74Å
299G92.3Very high94.4Very high70 Ų7055 Ų5572%0.72233%0.327SS*.THydrogen-bonded Turntrans62.127.5178.100000114.5L295 R296L295-G299 PolarHBondContact O-N 3.18Å; L295-G299 VanDerWaalsContact O-N 3.07Å; R296-G299 PolarHBondContact O-N 2.9Å
300A95.3Very high94.3Very high54 Ų5456.3 Ų56.345%0.44633%0.331SS..  trans-108.625.4-172.500000113.2L295 F298 P302L295-A300 HydrophobicContact CD2-CB 3.98Å; L295-A300 PolarHBondContact O-N 2.62Å; F298-A300 PolarHBondContact O-N 2.74Å; A300-P302 WeakPolarHBondContact O-CD 3.42Å
301I95.6Very high94.3Very high57 Ų5756.1 Ų56.129%0.29233%0.329SS..  trans-70122.4178.4-57.7178.8000109.1L295 R296 I305 A306L295-I301 HydrophobicContact CB-CG1 4.14Å; R296-I301 HydrophobicContact CB-CD1 4.02Å; R296-I301 HydrophobicContact CG-CD1 4.24Å; I301-I305 HydrophobicContact CG2-CB 3.77Å; I301-I305 HydrophobicContact CG2-CG2 3.59Å; I301-A306 HydrophobicContact CB-CB 4.5Å; I301-A306 HydrophobicContact CG2-CB 3.95Å
302P94.5Very high94.3Very high61 Ų6155.8 Ų55.840%0.39633%0.325SS..  trans-71.9152.2-179.429.9-35.3000112.1A300 I305 A306A300-P302 WeakPolarHBondContact O-CD 3.42Å; P302-I305 HydrophobicContact CG-CB 4.33Å; P302-I305 HydrophobicContact CG-CD1 3.8Å; P302-I305 HydrophobicContact CG-CG1 4.12Å; P302-I305 PolarHBondContact O-N 2.93Å; P302-A306 PolarHBondContact O-N 3.39Å
303S88.4Confident94.3Very high77 Ų7756.4 Ų56.454%0.53833%0.331SS..Hα-helixtrans-47.7-48.5-171.3159.60000115.2I305 A306 D307S303-I305 PolarHBondContact O-N 3.47Å; S303-I305 VanDerWaalsContact O-N 3.11Å; S303-A306 PolarHBondContact O-N 2.85Å; S303-A306 VanDerWaalsContact O-N 3.13Å; S303-D307 WeakPolarHBondContact O-CB 3.41Å; S303-D307 PolarHBondContact O-N 3.26Å; S303-D307 PolarHBondContact OG-OD2 3.4Å
304P89.9Confident94.3Very high88 Ų8853.7 Ų53.757%0.57132%0.316SS*.Hα-helixtrans-62.1-29.7-179.5-23.533.5000113.8F312P304-F312 WeakPolarHBondContact O-CE2 3.45Å
305I94Very high94.4Very high44 Ų4454.6 Ų54.623%0.22632%0.319CS..Hα-helixtrans-82.7-39.7178.4-58.8-178.9000110.4L292 I301 P302 S303 D307 Q308 F312L292-I305 HydrophobicContact CD1-CG2 3.87Å; I301-I305 HydrophobicContact CG2-CB 3.77Å; I301-I305 HydrophobicContact CG2-CG2 3.59Å; P302-I305 HydrophobicContact CG-CB 4.33Å; P302-I305 HydrophobicContact CG-CD1 3.8Å; P302-I305 HydrophobicContact CG-CG1 4.12Å; P302-I305 PolarHBondContact O-N 2.93Å; S303-I305 PolarHBondContact O-N 3.47Å; S303-I305 VanDerWaalsContact O-N 3.11Å; I305-D307 VanDerWaalsContact C-N 3.26Å; I305-D307 PolarHBondContact O-N 2.92Å; I305-Q308 CarbonylContact O-C 3.58Å; I305-Q308 PolarHBondContact O-N 3.47Å; I305-F312 HydrophobicContact CB-CD2 4.23Å; I305-F312 HydrophobicContact CB-CG 4.33Å; I305-F312 HydrophobicContact CG1-CD1 4.18Å; I305-F312 HydrophobicContact CG1-CD2 4.31Å; I305-F312 HydrophobicContact CG1-CE1 4.23Å; I305-F312 HydrophobicContact CG1-CE2 4.37Å; I305-F312 HydrophobicContact CG1-CG 4.22Å; I305-F312 HydrophobicContact CG1-CZ 4.32Å; I305-F312 HydrophobicContact CG2-CB 3.82Å; I305-F312 HydrophobicContact CG2-CD2 4.18Å; I305-F312 HydrophobicContact CG2-CG 3.93Å
306A93.8Very high94.5Very high38 Ų3853.2 Ų53.231%0.31431%0.312SS..Hα-helixtrans-64.6-31.9177.700000112.3I301 P302 S303 Q308 P309I301-A306 HydrophobicContact CB-CB 4.5Å; I301-A306 HydrophobicContact CG2-CB 3.95Å; P302-A306 PolarHBondContact O-N 3.39Å; S303-A306 PolarHBondContact O-N 2.85Å; S303-A306 VanDerWaalsContact O-N 3.13Å; A306-Q308 VanDerWaalsContact C-N 3.29Å; A306-Q308 PolarHBondContact O-N 2.9Å; A306-P309 WeakPolarHBondContact O-CD 3.43Å
307D93.7Very high94.6Very high86 Ų8649.3 Ų49.346%0.4630%0.298SS..THydrogen-bonded Turntrans-73.8-20.1178.5-60.9-22.1000112.4Y23 S303 I305Y23-D307 WeakPolarHBondContact CB-O 3.37Å; Y23-D307 VanDerWaalsContact O-O 3.13Å; S303-D307 WeakPolarHBondContact O-CB 3.41Å; S303-D307 PolarHBondContact O-N 3.26Å; S303-D307 PolarHBondContact OG-OD2 3.4Å; I305-D307 VanDerWaalsContact C-N 3.26Å; I305-D307 PolarHBondContact O-N 2.92Å
308Q95.2Very high94.9Very high30 Ų3048.8 Ų48.814%0.1430%0.296CS..SBendtrans-132.657.9-178.3-71.7-68.7-39.600111.9Y23 G24 I305 A306 Y310 L311 F312Y23-Q308 PolarHBondContact O-NE2 3.48Å; G24-Q308 PolarHBondContact O-NE2 3.08Å; I305-Q308 CarbonylContact O-C 3.58Å; I305-Q308 PolarHBondContact O-N 3.47Å; A306-Q308 VanDerWaalsContact C-N 3.29Å; A306-Q308 PolarHBondContact O-N 2.9Å; Q308-Y310 VanDerWaalsContact C-N 3.32Å; Q308-Y310 PolarHBondContact O-N 3.06Å; Q308-L311 HydrophobicContact CB-CB 4.26Å; Q308-L311 PolarHBondContact O-N 3.36Å; Q308-F312 HydrophobicContact CB-CD2 3.76Å; Q308-F312 HydrophobicContact CB-CE2 3.89Å; Q308-F312 WeakPolarHBondContact O-CD2 3.38Å; Q308-F312 PolarHBondContact O-N 2.88Å
309P93.9Very high95.1Very high44 Ų4445.4 Ų45.429%0.28628%0.283SS..Hα-helixtrans-63.6-37.2-166.425.1-33.1000112.5Y23 A306 S313Y23-P309 HydrophobicContact CD1-CG 4.1Å; Y23-P309 HydrophobicContact CD2-CG 4.39Å; Y23-P309 HydrophobicContact CE1-CG 4.21Å; Y23-P309 HydrophobicContact CE2-CG 4.49Å; Y23-P309 HydrophobicContact CG-CG 4.2Å; A306-P309 WeakPolarHBondContact O-CD 3.43Å; P309-S313 WeakPolarHBondContact O-CB 3.42Å; P309-S313 PolarHBondContact O-N 3.15Å
310Y95Very high95.3Very high41 Ų4142.1 Ų42.116%0.16125%0.249CC..Hα-helixtrans-73.3-41180-56.1-73.5000112.9Y15 A19 Y23 D25 V94 K97 Q308 L314Y15-Y310 WeakPolarHBondContact CE1-OH 3.45Å; Y15-Y310 PolarHBondContact OH-OH 3.36Å; A19-Y310 HydrophobicContact CB-CE2 3.84Å; Y23-Y310 HydrophobicContact CD2-CE2 4.17Å; Y23-Y310 HydrophobicContact CE2-CE2 4.48Å; D25-Y310 HydrophobicContact CB-CD2 4.34Å; V94-Y310 HydrophobicContact CG1-CD1 4.11Å; V94-Y310 HydrophobicContact CG1-CG 4.49Å; K97-Y310 HydrophobicContact CD-CD1 3.7Å; K97-Y310 HydrophobicContact CD-CD2 4.42Å; K97-Y310 HydrophobicContact CD-CE1 3.5Å; K97-Y310 HydrophobicContact CD-CE2 4.26Å; K97-Y310 HydrophobicContact CD-CG 4.16Å; Q308-Y310 VanDerWaalsContact C-N 3.32Å; Q308-Y310 PolarHBondContact O-N 3.06Å; Y310-L314 WeakPolarHBondContact O-CG 3.47Å; Y310-L314 PolarHBondContact O-N 2.87Å
311L96Very high95.5Very high24 Ų2439.5 Ų39.513%0.12623%0.228CC..Hα-helixtrans-65.2-51.8179.5177.662.7000110.2L26 T27 I32 F36 Q308 S313 L314 I315L26-L311 HydrophobicContact CB-CD2 4.11Å; L26-L311 HydrophobicContact CD1-CD2 3.8Å; T27-L311 HydrophobicContact CG2-CB 3.89Å; T27-L311 HydrophobicContact CG2-CD1 4.23Å; I32-L311 HydrophobicContact CG2-CD1 4.24Å; F36-L311 HydrophobicContact CE2-CD1 3.83Å; F36-L311 HydrophobicContact CZ-CD1 4.22Å; Q308-L311 HydrophobicContact CB-CB 4.26Å; Q308-L311 PolarHBondContact O-N 3.36Å; L311-S313 VanDerWaalsContact C-N 3.31Å; L311-S313 PolarHBondContact O-N 3.39Å; L311-L314 WeakPolarHBondContact O-CB 3.19Å; L311-L314 PolarHBondContact O-N 2.87Å; L311-L314 VanDerWaalsContact O-N 3.11Å; L311-I315 HydrophobicContact CD1-CD1 4.2Å; L311-I315 HydrophobicContact CD1-CG1 4.41Å; L311-I315 HydrophobicContact CG-CD1 3.96Å; L311-I315 WeakPolarHBondContact O-CG1 3.2Å; L311-I315 PolarHBondContact O-N 3.43Å
312F96.1Very high95.5Very high62 Ų6238.5 Ų38.527%0.27222%0.224SC..Hα-helixtrans-65-36.7179.2-78.6-77000112.1P304 I305 Q308 L314 I315 V316P304-F312 WeakPolarHBondContact O-CE2 3.45Å; I305-F312 HydrophobicContact CB-CD2 4.23Å; I305-F312 HydrophobicContact CB-CG 4.33Å; I305-F312 HydrophobicContact CG1-CD1 4.18Å; I305-F312 HydrophobicContact CG1-CD2 4.31Å; I305-F312 HydrophobicContact CG1-CE1 4.23Å; I305-F312 HydrophobicContact CG1-CE2 4.37Å; I305-F312 HydrophobicContact CG1-CG 4.22Å; I305-F312 HydrophobicContact CG1-CZ 4.32Å; I305-F312 HydrophobicContact CG2-CB 3.82Å; I305-F312 HydrophobicContact CG2-CD2 4.18Å; I305-F312 HydrophobicContact CG2-CG 3.93Å; Q308-F312 HydrophobicContact CB-CD2 3.76Å; Q308-F312 HydrophobicContact CB-CE2 3.89Å; Q308-F312 WeakPolarHBondContact O-CD2 3.38Å; Q308-F312 PolarHBondContact O-N 2.88Å; F312-L314 VanDerWaalsContact C-N 3.32Å; F312-L314 PolarHBondContact O-N 3.28Å; F312-I315 HydrophobicContact CD1-CD1 4.36Å; F312-I315 PolarHBondContact O-N 2.8Å; F312-V316 WeakPolarHBondContact O-CG2 3.06Å; F312-V316 PolarHBondContact O-N 3.45Å
313S95.6Very high95.6Very high27 Ų2735.9 Ų35.919%0.18921%0.207CC..Hα-helixtrans-60.3-40.9172.1-170.40000112.1P309 L311 H317P309-S313 WeakPolarHBondContact O-CB 3.42Å; P309-S313 PolarHBondContact O-N 3.15Å; L311-S313 VanDerWaalsContact C-N 3.31Å; L311-S313 PolarHBondContact O-N 3.39Å; S313-H317 WeakPolarHBondContact O-CB 3.37Å; S313-H317 PolarHBondContact O-N 2.98Å
314L97Very high96Very high1 Ų132.2 Ų32.21%0.00518%0.182CC..Hα-helixtrans-67.4-39.4175.1-79.6179.1000112.6T27 F36 Y40 P91 V94 M95 Y310 L311 F312 C318T27-L314 HydrophobicContact CG2-CD1 3.77Å; F36-L314 HydrophobicContact CD1-CB 4.34Å; F36-L314 HydrophobicContact CD2-CD1 4.26Å; F36-L314 HydrophobicContact CE1-CB 3.87Å; F36-L314 HydrophobicContact CE2-CB 4.31Å; F36-L314 HydrophobicContact CE2-CD1 4.4Å; F36-L314 HydrophobicContact CG-CD1 4.47Å; F36-L314 HydrophobicContact CZ-CB 3.86Å; Y40-L314 HydrophobicContact CE2-CD2 4.4Å; Y40-L314 PolarHBondContact OH-O 2.82Å; P91-L314 HydrophobicContact CB-CD2 4.08Å; V94-L314 HydrophobicContact CB-CD2 3.9Å; V94-L314 HydrophobicContact CB-CG 4.18Å; V94-L314 HydrophobicContact CG1-CD1 3.94Å; V94-L314 HydrophobicContact CG1-CD2 3.97Å; V94-L314 HydrophobicContact CG1-CG 3.66Å; V94-L314 HydrophobicContact CG2-CD2 4.28Å; M95-L314 HydrophobicContact CE-CD1 4.34Å; M95-L314 HydrophobicContact CG-CD1 4.45Å; Y310-L314 WeakPolarHBondContact O-CG 3.47Å; Y310-L314 PolarHBondContact O-N 2.87Å; L311-L314 WeakPolarHBondContact O-CB 3.19Å; L311-L314 PolarHBondContact O-N 2.87Å; L311-L314 VanDerWaalsContact O-N 3.11Å; F312-L314 VanDerWaalsContact C-N 3.32Å; F312-L314 PolarHBondContact O-N 3.28Å; L314-C318 WeakPolarHBondContact O-CB 3.4Å; L314-C318 PolarHBondContact O-N 3.49Å
315I97.8Very high96.4Very high60 Ų6029.6 Ų29.631%0.30816%0.162SC..Hα-helixtrans-62-54178.9-68.8169.1000110F36 L311 F312 H317 C318 I319F36-I315 HydrophobicContact CE1-CG1 4.49Å; F36-I315 HydrophobicContact CZ-CG1 3.81Å; L311-I315 HydrophobicContact CD1-CD1 4.2Å; L311-I315 HydrophobicContact CD1-CG1 4.41Å; L311-I315 HydrophobicContact CG-CD1 3.96Å; L311-I315 WeakPolarHBondContact O-CG1 3.2Å; L311-I315 PolarHBondContact O-N 3.43Å; F312-I315 HydrophobicContact CD1-CD1 4.36Å; F312-I315 PolarHBondContact O-N 2.8Å; I315-H317 VanDerWaalsContact C-N 3.35Å; I315-H317 PolarHBondContact O-N 3.32Å; I315-C318 WeakPolarHBondContact O-CB 3.4Å; I315-C318 PolarHBondContact O-N 3.42Å; I315-I319 HydrophobicContact CG2-CD1 3.94Å; I315-I319 WeakPolarHBondContact O-CG1 3.31Å; I315-I319 PolarHBondContact O-N 3.01Å
316V97.7Very high96.4Very high14 Ų1432.6 Ų32.69%0.08517%0.171CC..Hα-helixtrans-68.1-36-177.2-55.50000112L288 L292 F312 I319 A320L288-V316 HydrophobicContact CB-CB 4.11Å; L288-V316 HydrophobicContact CB-CG1 3.85Å; L292-V316 HydrophobicContact CB-CG2 4.27Å; L292-V316 HydrophobicContact CD2-CG1 4.43Å; L292-V316 HydrophobicContact CD2-CG2 3.46Å; L292-V316 VanDerWaalsContact CD2-CG2 3.46Å; F312-V316 WeakPolarHBondContact O-CG2 3.06Å; F312-V316 PolarHBondContact O-N 3.45Å; V316-I319 PolarHBondContact O-N 2.88Å; V316-A320 WeakPolarHBondContact O-CB 3.39Å; V316-A320 PolarHBondContact O-N 3.02Å
317H98.1Very high96.2Very high4 Ų431 Ų312%0.01916%0.157CC..Hα-helixtrans-64.1-45.2174.2-174.875.8000110.9Y40 S86 T90 S313 I315 I319 A320 M321Y40-H317 AromaticContact CE1-CD2 3.88Å; Y40-H317 AromaticContact CZ-CD2 3.94Å; Y40-H317 PolarHBondContact OH-CD2 3.46Å; Y40-H317 VanDerWaalsContact OH-CD2 3.26Å; S86-H317 PolarHBondContact O-NE2 3.35Å; T90-H317 WeakPolarHBondContact CB-NE2 3.42Å; T90-H317 PolarHBondContact OG1-CE1 2.77Å; T90-H317 VanDerWaalsContact OG1-CE1 3.3Å; T90-H317 PolarHBondContact OG1-NE2 3.33Å; S313-H317 WeakPolarHBondContact O-CB 3.37Å; S313-H317 PolarHBondContact O-N 2.98Å; I315-H317 VanDerWaalsContact C-N 3.35Å; I315-H317 PolarHBondContact O-N 3.32Å; H317-I319 PolarHBondContact O-N 3.21Å; H317-A320 WeakPolarHBondContact O-CB 3.29Å; H317-A320 PolarHBondContact O-N 3.38Å; H317-M321 VanDerWaalsContact CE1-CE 3.45Å; H317-M321 WeakPolarHBondContact CE1-CE 3.34Å; H317-M321 WeakPolarHBondContact NE2-CG 3.41Å; H317-M321 VanDerWaalsContact O-CG 3.28Å; H317-M321 WeakPolarHBondContact O-CG 2.98Å; H317-M321 PolarHBondContact O-N 2.94Å
318C98.2Very high96.1Very high13 Ų1327.3 Ų27.39%0.08814%0.138CC..Hα-helixtrans-58-48.2178-176.20000111.2F36 I39 Y40 L314 I315 A320 M321 T322F36-C318 HydrophobicContact CD1-CB 4.49Å; F36-C318 HydrophobicContact CE1-CB 4.18Å; I39-C318 WeakPolarHBondContact CG2-SG 3.17Å; Y40-C318 HydrophobicContact CE1-CB 4.49Å; Y40-C318 HydrophobicContact CE2-CB 4.44Å; Y40-C318 WeakPolarHBondContact OH-CA 3.31Å; Y40-C318 WeakPolarHBondContact OH-CB 3.39Å; Y40-C318 PolarHBondContact OH-N 2.81Å; L314-C318 WeakPolarHBondContact O-CB 3.4Å; L314-C318 PolarHBondContact O-N 3.49Å; I315-C318 WeakPolarHBondContact O-CB 3.4Å; I315-C318 PolarHBondContact O-N 3.42Å; C318-A320 VanDerWaalsContact C-N 3.33Å; C318-A320 PolarHBondContact O-N 3.28Å; C318-M321 PolarHBondContact O-N 2.85Å; C318-T322 WeakPolarHBondContact O-CG2 3.18Å; C318-T322 PolarHBondContact O-N 3.41Å; C318-T322 VanDerWaalsContact O-N 3.15Å
319I98.2Very high96Very high59 Ų5929.1 Ų29.130%0.30315%0.151SC..Hα-helixtrans-58.8-44.7176.7-67.2168.7000110.6C285 L288 I315 V316 H317 T322C285-I319 WeakPolarHBondContact CB-O 3.24Å; L288-I319 HydrophobicContact CD1-CD1 3.6Å; L288-I319 HydrophobicContact CD1-CG2 4.47Å; I315-I319 HydrophobicContact CG2-CD1 3.94Å; I315-I319 WeakPolarHBondContact O-CG1 3.31Å; I315-I319 PolarHBondContact O-N 3.01Å; V316-I319 PolarHBondContact O-N 2.88Å; H317-I319 PolarHBondContact O-N 3.21Å; I319-T322 PolarHBondContact O-N 3.07Å; I319-T322 PolarHBondContact O-OG1 3.19Å
320A98Very high95.7Very high0 Ų027.6 Ų27.60%014%0.14CC..Hα-helixtrans-61-44.9175.400000112C285 W286 Q289 V316 H317 C318 T322 S323C285-A320 WeakPolarHBondContact O-CA 3.15Å; C285-A320 PolarHBondContact O-N 3.26Å; W286-A320 HydrophobicContact CD2-CB 4.26Å; W286-A320 HydrophobicContact CE3-CB 4.27Å; W286-A320 HydrophobicContact CZ3-CB 4.46Å; Q289-A320 HydrophobicContact CB-CB 3.97Å; Q289-A320 HydrophobicContact CG-CB 4.38Å; V316-A320 WeakPolarHBondContact O-CB 3.39Å; V316-A320 PolarHBondContact O-N 3.02Å; H317-A320 WeakPolarHBondContact O-CB 3.29Å; H317-A320 PolarHBondContact O-N 3.38Å; C318-A320 VanDerWaalsContact C-N 3.33Å; C318-A320 PolarHBondContact O-N 3.28Å; A320-T322 PolarHBondContact O-N 3.18Å; A320-S323 WeakPolarHBondContact O-CB 3.45Å; A320-S323 PolarHBondContact O-N 3.21Å; A320-S323 PolarHBondContact O-OG 2.84Å
321M98Very high95.3Very high0 Ų025.7 Ų25.70%013%0.133CC..Hα-helixtrans-63.2-26.4-179-67.4-49.495.800113.2Y40 I43 V82 S86 V87 W286 H317 C318 S323 T324Y40-M321 HydrophobicContact CE1-CB 4.49Å; Y40-M321 HydrophobicContact CE1-CG 4.1Å; I43-M321 HydrophobicContact CD1-CB 4.24Å; I43-M321 HydrophobicContact CG2-CB 4.21Å; V82-M321 HydrophobicContact CG1-CE 4.3Å; V82-M321 HydrophobicContact CG1-SD 3.55Å; V82-M321 VanDerWaalsContact CG1-SD 3.55Å; S86-M321 VanDerWaalsContact CB-SD 3.54Å; V87-M321 HydrophobicContact CG2-CB 4.16Å; V87-M321 HydrophobicContact CG2-CG 4.08Å; V87-M321 HydrophobicContact CG2-SD 4.01Å; W286-M321 HydrophobicContact CH2-CE 4.29Å; W286-M321 HydrophobicContact CZ2-CE 4.43Å; H317-M321 VanDerWaalsContact CE1-CE 3.45Å; H317-M321 WeakPolarHBondContact CE1-CE 3.34Å; H317-M321 WeakPolarHBondContact NE2-CG 3.41Å; H317-M321 VanDerWaalsContact O-CG 3.28Å; H317-M321 WeakPolarHBondContact O-CG 2.98Å; H317-M321 PolarHBondContact O-N 2.94Å; C318-M321 PolarHBondContact O-N 2.85Å; M321-S323 PolarHBondContact O-N 3.43Å; M321-S323 VanDerWaalsContact O-N 3.13Å; M321-T324 PolarHBondContact O-N 3.5Å; M321-T324 PolarHBondContact O-OG1 2.97Å
322T97.3Very high94.8Very high35 Ų3525.7 Ų25.722%0.21514%0.137CC..THydrogen-bonded Turntrans-60.7-19.3172.970.50000113.2I43 C285 C318 I319 A320 T324 L325I43-T322 HydrophobicContact CD1-CG2 4.02Å; C285-T322 PolarHBondContact SG-OG1 3.11Å; C318-T322 WeakPolarHBondContact O-CG2 3.18Å; C318-T322 PolarHBondContact O-N 3.41Å; C318-T322 VanDerWaalsContact O-N 3.15Å; I319-T322 PolarHBondContact O-N 3.07Å; I319-T322 PolarHBondContact O-OG1 3.19Å; A320-T322 PolarHBondContact O-N 3.18Å; T322-T324 PolarHBondContact O-N 2.97Å; T322-T324 VanDerWaalsContact O-N 3.1Å; T322-L325 WeakPolarHBondContact O-CB 3.35Å; T322-L325 PolarHBondContact O-N 3.3Å
323S96.5Very high94.1Very high7 Ų731.2 Ų31.25%0.04916%0.156CC..Hα-helixtrans-53.7-33.2176.176.30000112.6W286 A320 M321 L325 W326W286-S323 PolarHBondContact NE1-OG 2.8Å; A320-S323 WeakPolarHBondContact O-CB 3.45Å; A320-S323 PolarHBondContact O-N 3.21Å; A320-S323 PolarHBondContact O-OG 2.84Å; M321-S323 PolarHBondContact O-N 3.43Å; M321-S323 VanDerWaalsContact O-N 3.13Å; S323-L325 PolarHBondContact O-N 3.39Å; S323-W326 PolarHBondContact O-N 3.45Å
324T96.8Very high93.4Very high0 Ų031.9 Ų31.90%016%0.157CC..Hα-helixtrans-66.3-20.8-179.963.70000113.8N51 D79 V82 M321 T322N51-T324 PolarHBondContact ND2-O 2.89Å; D79-T324 HydrophobicContact CB-CG2 4.21Å; V82-T324 HydrophobicContact CB-CG2 4Å; V82-T324 HydrophobicContact CG1-CG2 3.67Å; M321-T324 PolarHBondContact O-N 3.5Å; M321-T324 PolarHBondContact O-OG1 2.97Å; T322-T324 PolarHBondContact O-N 2.97Å; T322-T324 VanDerWaalsContact O-N 3.1Å
325L96.6Very high92.7Very high32 Ų3232.6 Ų32.617%0.16816%0.161CC..Hα-helixtrans-87.4-35.6-177.9-56.5-172.7000112.3I43 A46 G47 T322 S323 N327 P328 V329I43-L325 HydrophobicContact CG1-CD1 4.09Å; I43-L325 HydrophobicContact CG2-CD2 4.42Å; I43-L325 HydrophobicContact CG2-CG 4.49Å; I43-L325 WeakPolarHBondContact O-CD2 3.45Å; A46-L325 HydrophobicContact CB-CD2 3.7Å; G47-L325 VanDerWaalsContact N-CD2 3.26Å; T322-L325 WeakPolarHBondContact O-CB 3.35Å; T322-L325 PolarHBondContact O-N 3.3Å; S323-L325 PolarHBondContact O-N 3.39Å; L325-N327 VanDerWaalsContact C-N 3.32Å; L325-N327 PolarHBondContact O-N 3.32Å; L325-P328 WeakPolarHBondContact O-CD 3.41Å; L325-V329 VanDerWaalsContact O-CG2 3.26Å; L325-V329 WeakPolarHBondContact O-CG2 3.23Å; L325-V329 PolarHBondContact O-N 3.3Å
326W94.4Very high92.1Very high108 Ų10833.7 Ų33.741%0.40917%0.165SC..Hα-helixtrans-69.5-31-168-68.3115.2000113.1V281 S323 V329 L330V281-W326 HydrophobicContact CB-CB 4.5Å; V281-W326 HydrophobicContact CB-CG 4.45Å; V281-W326 HydrophobicContact CG1-CB 3.59Å; V281-W326 HydrophobicContact CG1-CD2 3.75Å; V281-W326 HydrophobicContact CG1-CG 3.22Å; S323-W326 PolarHBondContact O-N 3.45Å; W326-V329 HydrophobicContact CE3-CG1 4.41Å; W326-V329 PolarHBondContact O-N 3.11Å; W326-L330 HydrophobicContact CB-CD1 4.48Å; W326-L330 VanDerWaalsContact O-CB 3.24Å; W326-L330 WeakPolarHBondContact O-CB 2.94Å; W326-L330 WeakPolarHBondContact O-CD1 3.42Å; W326-L330 WeakPolarHBondContact O-CG 3.3Å; W326-L330 PolarHBondContact O-N 3.38Å
327N90.2Very high91.6Very high5 Ų535.1 Ų35.13%0.02718%0.175CC..Hα-helixtrans-57.6-64.6176.4-73.7-28.1000111.1L75 D79 L325 V329 L330 Y331L75-N327 WeakPolarHBondContact CD2-ND2 3.29Å; L75-N327 WeakPolarHBondContact CG-ND2 3.2Å; D79-N327 PolarHBondContact OD2-ND2 3.43Å; L325-N327 VanDerWaalsContact C-N 3.32Å; L325-N327 PolarHBondContact O-N 3.32Å; N327-V329 VanDerWaalsContact C-N 3.33Å; N327-V329 PolarHBondContact O-N 2.87Å; N327-L330 PolarHBondContact O-N 2.72Å; N327-Y331 VanDerWaalsContact C-CD2 3.41Å; N327-Y331 HydrophobicContact CB-CE2 3.96Å; N327-Y331 WeakPolarHBondContact O-CD2 3.35Å; N327-Y331 WeakPolarHBondContact O-CE2 3.47Å; N327-Y331 PolarHBondContact O-N 2.9Å
328P92.3Very high91Very high8 Ų835 Ų355%0.05217%0.174CC..Hα-helixtrans-53.2-43.6174.2-27.933000114.5N51 V54 L325 L330 Y331 A332 F342N51-P328 WeakPolarHBondContact OD1-CG 3.48Å; V54-P328 HydrophobicContact CG2-CB 4.27Å; V54-P328 HydrophobicContact CG2-CG 4.17Å; L325-P328 WeakPolarHBondContact O-CD 3.41Å; P328-L330 PolarHBondContact O-N 3.46Å; P328-Y331 PolarHBondContact O-N 3.19Å; P328-A332 WeakPolarHBondContact O-CB 3.42Å; P328-A332 PolarHBondContact O-N 3.02Å; P328-F342 HydrophobicContact CB-CE1 4.43Å
329V91.6Very high90.6Very high68 Ų6838.5 Ų38.541%0.41219%0.186SC..Hα-helixtrans-60.3-48.2-179.3168.90000110.9L325 W326 N327 A332 W333L325-V329 VanDerWaalsContact O-CG2 3.26Å; L325-V329 WeakPolarHBondContact O-CG2 3.23Å; L325-V329 PolarHBondContact O-N 3.3Å; W326-V329 HydrophobicContact CE3-CG1 4.41Å; W326-V329 PolarHBondContact O-N 3.11Å; N327-V329 VanDerWaalsContact C-N 3.33Å; N327-V329 PolarHBondContact O-N 2.87Å; V329-A332 PolarHBondContact O-N 3.29Å; V329-W333 VanDerWaalsContact O-CB 3.25Å; V329-W333 WeakPolarHBondContact O-CB 3.02Å; V329-W333 PolarHBondContact O-N 3.47Å
330L89Confident90.1Very high12 Ų1241.1 Ų41.16%0.06320%0.195CC..Hα-helixtrans-68.5-36.5179.7-69.4169.9000111.8M274 M278 W326 N327 P328 L334M274-L330 HydrophobicContact CG-CB 4.47Å; M278-L330 HydrophobicContact CB-CD1 4.3Å; M278-L330 HydrophobicContact CE-CB 3.52Å; M278-L330 HydrophobicContact CE-CD1 4.47Å; M278-L330 HydrophobicContact CG-CB 4.27Å; M278-L330 HydrophobicContact CG-CD1 3.55Å; W326-L330 HydrophobicContact CB-CD1 4.48Å; W326-L330 VanDerWaalsContact O-CB 3.24Å; W326-L330 WeakPolarHBondContact O-CB 2.94Å; W326-L330 WeakPolarHBondContact O-CD1 3.42Å; W326-L330 WeakPolarHBondContact O-CG 3.3Å; W326-L330 PolarHBondContact O-N 3.38Å; N327-L330 PolarHBondContact O-N 2.72Å; P328-L330 PolarHBondContact O-N 3.46Å; L330-L334 HydrophobicContact CD2-CD1 3.98Å; L330-L334 VanDerWaalsContact O-CB 3.29Å; L330-L334 WeakPolarHBondContact O-CB 3.28Å; L330-L334 PolarHBondContact O-N 2.91Å
331Y86.1Confident89.7Confident0 Ų041.1 Ų41.10%020%0.195CC..Hα-helixtrans-63.9-47.8172.7-64.2-52.8000111.8V54 I72 M274 M278 N327 P328 W333 N335 F338V54-Y331 HydrophobicContact CG2-CD2 4.01Å; I72-Y331 HydrophobicContact CD1-CD1 4.16Å; I72-Y331 HydrophobicContact CD1-CE1 3.32Å; I72-Y331 HydrophobicContact CG1-CE1 3.88Å; I72-Y331 WeakPolarHBondContact CG1-OH 3.43Å; I72-Y331 HydrophobicContact CG2-CD2 4.11Å; I72-Y331 HydrophobicContact CG2-CE1 4.05Å; I72-Y331 HydrophobicContact CG2-CE2 3.47Å; I72-Y331 VanDerWaalsContact CG2-CE2 3.47Å; I72-Y331 VanDerWaalsContact CG2-CZ 3.47Å; M274-Y331 HydrophobicContact CE-CD1 3.91Å; M274-Y331 HydrophobicContact CE-CE1 3.94Å; M274-Y331 HydrophobicContact SD-CD1 3.92Å; M274-Y331 HydrophobicContact SD-CE1 4.46Å; M278-Y331 HydrophobicContact CE-CD1 3.31Å; M278-Y331 HydrophobicContact CE-CD2 4.18Å; M278-Y331 HydrophobicContact CE-CE1 3.01Å; M278-Y331 HydrophobicContact CE-CE2 3.93Å; M278-Y331 HydrophobicContact CE-CG 3.86Å; M278-Y331 HydrophobicContact SD-CD1 4.44Å; M278-Y331 HydrophobicContact SD-CE1 3.59Å; M278-Y331 VanDerWaalsContact SD-CE1 3.59Å; M278-Y331 PolarHBondContact SD-OH 3.11Å; M278-Y331 VanDerWaalsContact SD-OH 3.34Å; N327-Y331 VanDerWaalsContact C-CD2 3.41Å; N327-Y331 HydrophobicContact CB-CE2 3.96Å; N327-Y331 WeakPolarHBondContact O-CD2 3.35Å; N327-Y331 WeakPolarHBondContact O-CE2 3.47Å; N327-Y331 PolarHBondContact O-N 2.9Å; P328-Y331 PolarHBondContact O-N 3.19Å; Y331-W333 VanDerWaalsContact C-N 3.34Å; Y331-W333 PolarHBondContact O-N 3.41Å; Y331-N335 WeakPolarHBondContact O-CA 3.38Å; Y331-N335 VanDerWaalsContact O-CB 3.24Å; Y331-N335 WeakPolarHBondContact O-CB 3.4Å; Y331-N335 PolarHBondContact O-N 2.83Å; Y331-F338 HydrophobicContact CD1-CD2 4.47Å; Y331-F338 HydrophobicContact CD1-CE2 4.44Å
332A85.1Confident89.2Confident25 Ų2542.2 Ų42.221%0.20720%0.2CC..Hα-helixtrans-64.2-38.9179.400000112P328 V329 R339 F342P328-A332 WeakPolarHBondContact O-CB 3.42Å; P328-A332 PolarHBondContact O-N 3.02Å; V329-A332 PolarHBondContact O-N 3.29Å; A332-R339 VanDerWaalsContact O-CB 3.27Å; A332-R339 WeakPolarHBondContact O-CB 3.33Å; A332-R339 VanDerWaalsContact O-CD 3.31Å; A332-R339 WeakPolarHBondContact O-CD 3.33Å; A332-R339 WeakPolarHBondContact O-CG 3.35Å; A332-F342 HydrophobicContact CB-CD1 3.75Å; A332-F342 HydrophobicContact CB-CE1 3.89Å
333W81.7Confident88.7Confident177 Ų17743 Ų4367%0.6720%0.201SC*.Hα-helixtrans-78.5-46.1-177.7-170.512.6000112.7R270 V329 Y331R270-W333 PolarHBondContact NH2-O 3.13Å; R270-W333 VanDerWaalsContact NH2-O 3.11Å; V329-W333 VanDerWaalsContact O-CB 3.25Å; V329-W333 WeakPolarHBondContact O-CB 3.02Å; V329-W333 PolarHBondContact O-N 3.47Å; Y331-W333 VanDerWaalsContact C-N 3.34Å; Y331-W333 PolarHBondContact O-N 3.41Å
334L81.3Confident88.2Confident41 Ų4148.9 Ų48.922%0.21523%0.227CC..Hα-helixtrans-100.4-13.9-169.1-57.7176.9000113.8R270 M274 L330R270-L334 WeakPolarHBondContact CD-O 3.01Å; R270-L334 PolarHBondContact NE-O 3.19Å; R270-L334 PolarHBondContact NH2-O 3.33Å; M274-L334 HydrophobicContact CB-CB 3.73Å; M274-L334 HydrophobicContact CB-CD1 3.63Å; M274-L334 HydrophobicContact CB-CG 4.34Å; M274-L334 HydrophobicContact CG-CB 3.73Å; M274-L334 HydrophobicContact CG-CD1 3.88Å; M274-L334 HydrophobicContact CG-CG 4.41Å; M274-L334 HydrophobicContact SD-CB 4.04Å; L330-L334 HydrophobicContact CD2-CD1 3.98Å; L330-L334 VanDerWaalsContact O-CB 3.29Å; L330-L334 WeakPolarHBondContact O-CB 3.28Å; L330-L334 PolarHBondContact O-N 2.91Å
335N82.5Confident87.6Confident16 Ų1650.6 Ų50.69%0.08624%0.236CC..  trans-114.6105176.4-168.6-34000111.8M274 Y331 S337 F338 R339M274-N335 HydrophobicContact SD-CB 3.9Å; Y331-N335 WeakPolarHBondContact O-CA 3.38Å; Y331-N335 VanDerWaalsContact O-CB 3.24Å; Y331-N335 WeakPolarHBondContact O-CB 3.4Å; Y331-N335 PolarHBondContact O-N 2.83Å; N335-S337 VanDerWaalsContact C-N 3.25Å; N335-S337 PolarHBondContact O-N 2.03Å; N335-S337 WeakPolarHBondContact OD1-CB 3.5Å; N335-S337 PolarHBondContact OD1-N 3.38Å; N335-S337 VanDerWaalsContact OD1-N 3.07Å; N335-F338 HydrophobicContact CB-CB 4.16Å; N335-F338 HydrophobicContact CB-CD2 3.99Å; N335-F338 WeakPolarHBondContact ND2-CD2 3.34Å; N335-F338 PolarHBondContact O-N 3.4Å; N335-F338 VanDerWaalsContact O-N 3.15Å; N335-F338 PolarHBondContact OD1-N 3.45Å; N335-R339 PolarHBondContact O-N 3.33Å
336E85.8Confident86.9Confident84 Ų8452 Ų5239%0.39324%0.243SC..Hα-helixtrans-59.1-34.8-177.9-170.9-175.7155.900113.4R339 K340E336-R339 PolarHBondContact O-N 3.08Å; E336-K340 WeakPolarHBondContact O-CG 3.47Å; E336-K340 PolarHBondContact O-N 3.37Å; E336-K340 WeakPolarHBondContact OE1-CE 3.45Å; E336-K340 IonicContact OE1-NZ 2.77Å; E336-K340 PolarHBondContact OE1-NZ 2.89Å
337S86.2Confident85.9Confident44 Ų4450.7 Ų50.731%0.30825%0.249SC..Hα-helixtrans-68.7-39.7179-55.10000111.6N335 A341N335-S337 VanDerWaalsContact C-N 3.25Å; N335-S337 PolarHBondContact O-N 2.03Å; N335-S337 WeakPolarHBondContact OD1-CB 3.5Å; N335-S337 PolarHBondContact OD1-N 3.38Å; N335-S337 VanDerWaalsContact OD1-N 3.07Å; S337-A341 PolarHBondContact O-N 3.04Å
338F86.2Confident84.8Confident0 Ų055.1 Ų55.10%028%0.279CS..Hα-helixtrans-67.8-44.2172.4-89.6-73.8000111.6V54 V58 L64 N69 I72 Y331 N335 K340 A341 F342V54-F338 HydrophobicContact CG1-CE1 4.15Å; V58-F338 HydrophobicContact CG2-CE1 3.69Å; V58-F338 HydrophobicContact CG2-CZ 3.72Å; L64-F338 HydrophobicContact CD1-CD1 4.25Å; L64-F338 HydrophobicContact CD1-CE1 4.33Å; N69-F338 VanDerWaalsContact OD1-CE2 3.29Å; N69-F338 WeakPolarHBondContact OD1-CE2 3.43Å; I72-F338 HydrophobicContact CG2-CZ 4.47Å; Y331-F338 HydrophobicContact CD1-CD2 4.47Å; Y331-F338 HydrophobicContact CD1-CE2 4.44Å; N335-F338 HydrophobicContact CB-CB 4.16Å; N335-F338 HydrophobicContact CB-CD2 3.99Å; N335-F338 WeakPolarHBondContact ND2-CD2 3.34Å; N335-F338 PolarHBondContact O-N 3.4Å; N335-F338 VanDerWaalsContact O-N 3.15Å; N335-F338 PolarHBondContact OD1-N 3.45Å; F338-K340 VanDerWaalsContact C-N 3.31Å; F338-K340 PolarHBondContact O-N 3.31Å; F338-A341 CarbonylContact O-C 3.4Å; F338-A341 WeakPolarHBondContact O-CA 3.47Å; F338-A341 WeakPolarHBondContact O-CB 3.45Å; F338-A341 PolarHBondContact O-N 3.46Å; F338-F342 HydrophobicContact CD1-CE2 4.12Å; F338-F342 WeakPolarHBondContact O-CD2 3.08Å; F338-F342 PolarHBondContact O-N 3.43Å
339R88.6Confident83.4Confident87 Ų8757.7 Ų57.733%0.32830%0.295SS..Hα-helixtrans-54.7-45.8178.1-168.8171.658.7-170.92.6112.6A332 N335 E336 A341 F342 F343A332-R339 VanDerWaalsContact O-CB 3.27Å; A332-R339 WeakPolarHBondContact O-CB 3.33Å; A332-R339 VanDerWaalsContact O-CD 3.31Å; A332-R339 WeakPolarHBondContact O-CD 3.33Å; A332-R339 WeakPolarHBondContact O-CG 3.35Å; N335-R339 PolarHBondContact O-N 3.33Å; E336-R339 PolarHBondContact O-N 3.08Å; R339-A341 VanDerWaalsContact C-N 3.34Å; R339-A341 PolarHBondContact O-N 3.28Å; R339-F342 PolarHBondContact O-N 2.8Å; R339-F343 HydrophobicContact CG-CD2 4.07Å; R339-F343 HydrophobicContact CG-CE2 3.51Å; R339-F343 HydrophobicContact CG-CZ 3.93Å; R339-F343 WeakPolarHBondContact O-CD2 3.07Å; R339-F343 WeakPolarHBondContact O-CG 3.14Å; R339-F343 PolarHBondContact O-N 2.8Å; R339-F343 VanDerWaalsContact O-N 3.1Å
340K88.9Confident81.7Confident114 Ų11462.1 Ų62.150%0.49630%0.304SS..Hα-helixtrans-61.8-42176.1-72.2177.1-175.5171.60111.5E336 F338 F343 E344E336-K340 WeakPolarHBondContact O-CG 3.47Å; E336-K340 PolarHBondContact O-N 3.37Å; E336-K340 WeakPolarHBondContact OE1-CE 3.45Å; E336-K340 IonicContact OE1-NZ 2.77Å; E336-K340 PolarHBondContact OE1-NZ 2.89Å; F338-K340 VanDerWaalsContact C-N 3.31Å; F338-K340 PolarHBondContact O-N 3.31Å; K340-F343 PolarHBondContact O-N 3.38Å; K340-E344 PolarHBondContact O-N 3.03Å
341A87.8Confident80.1Confident1 Ų167.1 Ų67.11%0.00834%0.335CS..Hα-helixtrans-64.4-38.7175.900000113S57 K61 L64 S337 F338 R339 E344 I345S57-A341 WeakPolarHBondContact OG-CB 3.46Å; K61-A341 HydrophobicContact CD-CB 3.85Å; L64-A341 HydrophobicContact CD1-CB 3.9Å; S337-A341 PolarHBondContact O-N 3.04Å; F338-A341 CarbonylContact O-C 3.4Å; F338-A341 WeakPolarHBondContact O-CA 3.47Å; F338-A341 WeakPolarHBondContact O-CB 3.45Å; F338-A341 PolarHBondContact O-N 3.46Å; R339-A341 VanDerWaalsContact C-N 3.34Å; R339-A341 PolarHBondContact O-N 3.28Å; A341-E344 PolarHBondContact O-N 2.83Å; A341-I345 WeakPolarHBondContact O-CG1 3.45Å; A341-I345 PolarHBondContact O-N 3.49Å
342F88.1Confident78.5Confident23 Ų2375.6 Ų75.610%0.10137%0.372CS..Hα-helixtrans-64.3-43.6177.3-82-152.8000111.6C53 V54 S57 P328 A332 F338 R339 E344 I345 L346C53-F342 HydrophobicContact CB-CD2 4.17Å; C53-F342 HydrophobicContact CB-CE1 4.25Å; C53-F342 HydrophobicContact CB-CE2 3.88Å; C53-F342 HydrophobicContact CB-CG 4.47Å; C53-F342 HydrophobicContact CB-CZ 3.92Å; V54-F342 HydrophobicContact CB-CZ 4.48Å; V54-F342 HydrophobicContact CG2-CE2 4.22Å; V54-F342 HydrophobicContact CG2-CZ 3.63Å; S57-F342 VanDerWaalsContact OG-CD2 3.31Å; S57-F342 WeakPolarHBondContact OG-CD2 3.24Å; S57-F342 WeakPolarHBondContact OG-CE2 3.24Å; P328-F342 HydrophobicContact CB-CE1 4.43Å; A332-F342 HydrophobicContact CB-CD1 3.75Å; A332-F342 HydrophobicContact CB-CE1 3.89Å; F338-F342 HydrophobicContact CD1-CE2 4.12Å; F338-F342 WeakPolarHBondContact O-CD2 3.08Å; F338-F342 PolarHBondContact O-N 3.43Å; R339-F342 PolarHBondContact O-N 2.8Å; F342-E344 PolarHBondContact O-N 2.8Å; F342-I345 PolarHBondContact O-N 2.99Å; F342-I345 VanDerWaalsContact O-N 3.12Å; F342-L346 PolarHBondContact O-N 2.91Å
343F86.5Confident76.9Confident51 Ų5178.3 Ų78.322%0.22439%0.389CS..Hα-helixtrans-67.6-22.6177.6-66.6-36.2000114R339 K340 V349 R350 C353R339-F343 HydrophobicContact CG-CD2 4.07Å; R339-F343 HydrophobicContact CG-CE2 3.51Å; R339-F343 HydrophobicContact CG-CZ 3.93Å; R339-F343 WeakPolarHBondContact O-CD2 3.07Å; R339-F343 WeakPolarHBondContact O-CG 3.14Å; R339-F343 PolarHBondContact O-N 2.8Å; R339-F343 VanDerWaalsContact O-N 3.1Å; K340-F343 PolarHBondContact O-N 3.38Å; F343-V349 HydrophobicContact CE1-CG1 4.08Å; F343-R350 HydrophobicContact CD1-CB 4.4Å; F343-C353 HydrophobicContact CE1-CB 4.11Å; F343-C353 HydrophobicContact CZ-CB 3.83Å
344E86Confident75.1Confident130 Ų13073.8 Ų73.861%0.60738%0.383SS*.Hα-helixtrans-76.6-30.1171.2-74.3167-145.900112.4K61 K340 A341 F342K61-E344 WeakPolarHBondContact CE-OE2 3.08Å; K61-E344 IonicContact NZ-OE1 3.48Å; K61-E344 PolarHBondContact NZ-OE1 2.04Å; K61-E344 IonicContact NZ-OE2 2.7Å; K61-E344 PolarHBondContact NZ-OE2 2.88Å; K340-E344 PolarHBondContact O-N 3.03Å; A341-E344 PolarHBondContact O-N 2.83Å; F342-E344 PolarHBondContact O-N 2.8Å
345I84.6Confident73.5Confident37 Ų3776 Ų7619%0.1941%0.407CS..Hα-helixtrans-81.9-42.5177.5-63164.6000110.9I56 S57 A341 F342 P347I56-I345 HydrophobicContact CB-CD1 3.99Å; I56-I345 HydrophobicContact CG2-CD1 3.62Å; I56-I345 HydrophobicContact CG2-CG1 4.12Å; S57-I345 VanDerWaalsContact OG-CD1 3.29Å; S57-I345 WeakPolarHBondContact OG-CD1 3.38Å; A341-I345 WeakPolarHBondContact O-CG1 3.45Å; A341-I345 PolarHBondContact O-N 3.49Å; F342-I345 PolarHBondContact O-N 2.99Å; F342-I345 VanDerWaalsContact O-N 3.12Å; I345-P347 VanDerWaalsContact C-CD 3.46Å; I345-P347 VanDerWaalsContact O-CD 3.23Å; I345-P347 WeakPolarHBondContact O-CD 3.42Å
346L82.6Confident71.2Confident60 Ų6084.2 Ų84.231%0.31444%0.442SS..  trans-116.175.6-178.2-61.4177.9000110.2T49 F342 C348 V349T49-L346 HydrophobicContact CG2-CD1 4.17Å; F342-L346 PolarHBondContact O-N 2.91Å; L346-C348 PolarHBondContact O-N 2.83Å; L346-C348 VanDerWaalsContact O-N 3.15Å; L346-V349 HydrophobicContact CB-CB 4.37Å; L346-V349 HydrophobicContact CB-CG2 3.81Å; L346-V349 HydrophobicContact CD1-CG2 4.09Å; L346-V349 PolarHBondContact O-N 3.24Å; L346-V349 VanDerWaalsContact O-N 3.09Å
347P72.6Confident68.8Low82 Ų8291.4 Ų91.453%0.53247%0.466SS..Hα-helixtrans-57.9-31-179.121.6-31.8000112.4I345 V349 R350I345-P347 VanDerWaalsContact C-CD 3.46Å; I345-P347 VanDerWaalsContact O-CD 3.23Å; I345-P347 WeakPolarHBondContact O-CD 3.42Å; P347-V349 VanDerWaalsContact C-N 3.27Å; P347-V349 PolarHBondContact O-N 3.24Å; P347-R350 WeakPolarHBondContact O-CB 3.29Å; P347-R350 PolarHBondContact O-N 3.43Å; P347-R350 VanDerWaalsContact O-N 3.1Å
348C68Low66.3Low98 Ų9894.4 Ų94.466%0.66248%0.484SS*.Hα-helixtrans-60.8-30.5178.3-53.90000113.6L346 R350 V351L346-C348 PolarHBondContact O-N 2.83Å; L346-C348 VanDerWaalsContact O-N 3.15Å; C348-R350 VanDerWaalsContact C-N 3.29Å; C348-R350 PolarHBondContact O-N 2.84Å; C348-V351 PolarHBondContact O-N 2.78Å
349V62.4Low63.8Low61 Ų61102.4 Ų102.437%0.3752%0.522SS..Hα-helixtrans-74.6-23.3179.6-175.80000111.4F343 L346 P347 V351 F352 C353F343-V349 HydrophobicContact CE1-CG1 4.08Å; L346-V349 HydrophobicContact CB-CB 4.37Å; L346-V349 HydrophobicContact CB-CG2 3.81Å; L346-V349 HydrophobicContact CD1-CG2 4.09Å; L346-V349 PolarHBondContact O-N 3.24Å; L346-V349 VanDerWaalsContact O-N 3.09Å; P347-V349 VanDerWaalsContact C-N 3.27Å; P347-V349 PolarHBondContact O-N 3.24Å; V349-V351 PolarHBondContact O-N 2.96Å; V349-F352 PolarHBondContact O-N 2.88Å; V349-C353 PolarHBondContact O-N 2.75Å; V349-C353 VanDerWaalsContact O-N 3.12Å
350R55.1Low61.3Low161 Ų161105.2 Ų105.261%0.60854%0.541SS*.Hα-helixtrans-59.5-35.2175.5-167.5177.3178.5177.3-2111.4F343 P347 C348 C354F343-R350 HydrophobicContact CD1-CB 4.4Å; P347-R350 WeakPolarHBondContact O-CB 3.29Å; P347-R350 PolarHBondContact O-N 3.43Å; P347-R350 VanDerWaalsContact O-N 3.1Å; C348-R350 VanDerWaalsContact C-N 3.29Å; C348-R350 PolarHBondContact O-N 2.84Å; R350-C354 VanDerWaalsContact O-CB 3.23Å; R350-C354 WeakPolarHBondContact O-CB 3.38Å; R350-C354 PolarHBondContact O-N 2.89Å; R350-C354 VanDerWaalsContact O-N 3.14Å
351V55.7Low58.6Low118 Ų118105 Ų10572%0.71555%0.546SS*.Hα-helixtrans-65.8-40.7-180-177.20000111.3C348 V349C348-V351 PolarHBondContact O-N 2.78Å; V349-V351 PolarHBondContact O-N 2.96Å
352F53.7Low56.1Low177 Ų177112.1 Ų112.178%0.77658%0.584SS**Hα-helixtrans-78.2-34.3-179.1-70.8-80.2000113.8V349V349-F352 PolarHBondContact O-N 2.88Å
353C51.4Low53.7Low83 Ų83118.2 Ų118.256%0.56161%0.61SS**Hα-helixtrans-84.7-15179.7-73.10000114.4F343 V349 A355F343-C353 HydrophobicContact CE1-CB 4.11Å; F343-C353 HydrophobicContact CZ-CB 3.83Å; V349-C353 PolarHBondContact O-N 2.75Å; V349-C353 VanDerWaalsContact O-N 3.12Å; C353-A355 VanDerWaalsContact C-N 3.26Å; C353-A355 PolarHBondContact O-N 3.24Å
354C43.6Very low51.3Low82 Ų82120.9 Ų120.955%0.55464%0.635SS**THydrogen-bonded Turntrans-87.827.5177.3-80.20000113.9R350 K356R350-C354 VanDerWaalsContact O-CB 3.23Å; R350-C354 WeakPolarHBondContact O-CB 3.38Å; R350-C354 PolarHBondContact O-N 2.89Å; R350-C354 VanDerWaalsContact O-N 3.14Å; C354-K356 PolarHBondContact O-N 2.75Å
355A46.4Very low48.9Very low87 Ų87123.1 Ų123.172%0.71965%0.651SS**SBendtrans-62.387.2153.100000108.3C353 R357C353-A355 VanDerWaalsContact C-N 3.26Å; C353-A355 PolarHBondContact O-N 3.24Å; A355-R357 PolarHBondContact O-N 3.08Å
356K34.6Very low46.6Very low189 Ų189128.3 Ų128.382%0.82267%0.669SS**  trans6.4100.6173.3-65.8177.3178.6177.50115.6C354C354-K356 PolarHBondContact O-N 2.75Å
357R36.1Very low44.4Very low235 Ų235135.2 Ų135.289%0.88769%0.69SS**  trans-75.1121.9132.2-102-174.1-171.2-162.60105.6A355 Q359A355-R357 PolarHBondContact O-N 3.08Å; R357-Q359 PolarHBondContact O-N 2.69Å; R357-Q359 VanDerWaalsContact O-N 3.1Å
358P33.6Very low42.8Very low106 Ų106136.5 Ų136.569%0.68871%0.708SS**  trans-53.4125168.1-12.523.8000106.4I360P358-I360 VanDerWaalsContact C-N 3.27Å; P358-I360 PolarHBondContact O-N 2.72Å
359Q33.4Very low41.5Very low169 Ų169135.8 Ų135.879%0.7972%0.717SS**  trans-58.8106.6156.7-75.3-174.3-54.900104.5R357 N361R357-Q359 PolarHBondContact O-N 2.69Å; R357-Q359 VanDerWaalsContact O-N 3.1Å; Q359-N361 PolarHBondContact O-N 2.72Å
360I35.7Very low40.3Very low145 Ų145137.2 Ų137.274%0.74473%0.73SS**  trans-6296.5154-63.5173.4000102.4P358 D362P358-I360 VanDerWaalsContact C-N 3.27Å; P358-I360 PolarHBondContact O-N 2.72Å; I360-D362 VanDerWaalsContact C-N 3.28Å; I360-D362 PolarHBondContact O-N 3.02Å
361N33.6Very low39.6Very low111 Ų111138.5 Ų138.559%0.59475%0.747SS**  trans-60.7100.8169.2-78-16.9000105.3Q359 F363Q359-N361 PolarHBondContact O-N 2.72Å; N361-F363 HydrophobicContact CB-CB 4.5Å; N361-F363 PolarHBondContact O-N 3.31Å
362D34.6Very low39.2Very low149 Ų149136.3 Ų136.380%0.79775%0.749SS**THydrogen-bonded Turntrans-66.953.5162.2-81.1-25.8000109.4I360I360-D362 VanDerWaalsContact C-N 3.28Å; I360-D362 PolarHBondContact O-N 3.02Å
363F38.5Very low38.6Very low152 Ų152141 Ų14167%0.66777%0.773SS**THydrogen-bonded Turntrans-110.25.5171.4-135.3-95.5000112.1N361 Y366N361-F363 HydrophobicContact CB-CB 4.5Å; N361-F363 PolarHBondContact O-N 3.31Å; F363-Y366 AromaticContact CD1-CD2 3.94Å; F363-Y366 HydrophobicContact CD1-CD2 3.94Å; F363-Y366 AromaticContact CD1-CE2 3.85Å; F363-Y366 HydrophobicContact CD1-CE2 3.85Å; F363-Y366 AromaticContact CE1-CD2 3.79Å; F363-Y366 HydrophobicContact CE1-CD2 3.79Å; F363-Y366 AromaticContact CE1-CE2 3.22Å; F363-Y366 HydrophobicContact CE1-CE2 3.22Å; F363-Y366 AromaticContact CZ-CE2 3.66Å; F363-Y366 HydrophobicContact CZ-CE2 3.66Å
364S36Very low37.9Very low106 Ų106143.9 Ų143.974%0.74178%0.784SS**  trans-107.844.7172.849.20000112
365L35.1Very low37.6Very low178 Ų178147.2 Ų147.293%0.93280%0.796SS**  trans-119.243.5146.9-81.1164000108.4
366Y35.3Very low37.2Very low146 Ų146150.5 Ų150.557%0.57380%0.8SS**  trans-80121158.1-105.3-99.9000108.1F363F363-Y366 AromaticContact CD1-CD2 3.94Å; F363-Y366 HydrophobicContact CD1-CD2 3.94Å; F363-Y366 AromaticContact CD1-CE2 3.85Å; F363-Y366 HydrophobicContact CD1-CE2 3.85Å; F363-Y366 AromaticContact CE1-CD2 3.79Å; F363-Y366 HydrophobicContact CE1-CD2 3.79Å; F363-Y366 AromaticContact CE1-CE2 3.22Å; F363-Y366 HydrophobicContact CE1-CE2 3.22Å; F363-Y366 AromaticContact CZ-CE2 3.66Å; F363-Y366 HydrophobicContact CZ-CE2 3.66Å
367R37.1Very low37.3Very low204 Ų204148.2 Ų148.277%0.7780%0.799SS**  trans67.772.9134.1-148.8-174.9-67.6176.9-2.9115.9
368A39.3Very low37.4Very low110 Ų110142.8 Ų142.891%0.90979%0.793SS**  trans-135.490.715400000108.2
369G39.8Very low37.6Very low82 Ų82145.3 Ų145.385%0.84580%0.8SS**  trans171.934.7-17900000113.7
370S37.8Very low37.9Very low92 Ų92143.6 Ų143.664%0.64380%0.801SS**  trans-149.590.2167.460.10000106.8
371I40.3Very low38.1Very low187 Ų187143.5 Ų143.596%0.95981%0.805SS**  trans-165.8126154-84.1135.4000105.2
372G48.4Very low38.5Very low73 Ų73146.2 Ų146.275%0.75382%0.823SS**  trans150.567.9179.600000108.8
373E39.8Very low38.8Very low275 Ų275145.9 Ų145.9100%1.28583%0.825SS**  trans-51.20170.8-69.4175.6146.800112.9

Retrieved 373 of 373 residues in 315.8 ms (Link to these results)

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