A0A077ZC42_TRITR Loading...

MFS 1 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZC42, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 402 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

 

Download Structure   PDB   PAE   Table  
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
1M60Low86.9Confident81 Ų8175.5 Ų75.540%0.39939%0.393SS..  0143.90-70.5168.37500109.3R5 Q6 F9M1-R5 HydrophobicContact CE-CB 4.37Å; M1-R5 HydrophobicContact CE-CG 3.69Å; M1-Q6 HydrophobicContact CB-CG 3.49Å; M1-Q6 VanDerWaalsContact CB-CG 3.49Å; M1-Q6 HydrophobicContact CE-CB 4.38Å; M1-Q6 HydrophobicContact CE-CG 3.83Å; M1-Q6 HydrophobicContact CG-CG 4.29Å; M1-Q6 HydrophobicContact SD-CG 3.87Å; M1-F9 HydrophobicContact CE-CB 3.91Å; M1-F9 HydrophobicContact CE-CG 4.29Å
2S83.2Confident87.4Confident71 Ų7169.2 Ų69.250%0.49736%0.361SS..  trans-64.8152.4168.359.80000110E4 R5 Q6S2-E4 PolarHBondContact O-N 3.03Å; S2-R5 PolarHBondContact O-N 3.46Å; S2-R5 WeakPolarHBondContact OG-CB 3.46Å; S2-R5 PolarHBondContact OG-N 2.9Å; S2-Q6 PolarHBondContact O-N 3.32Å
3A86.5Confident87.8Confident81 Ų8165.2 Ų65.267%0.66934%0.342SS*.Hα-helixtrans-55.3-37.3178.300000111.8Q6 K7A3-Q6 PolarHBondContact O-N 3.04Å; A3-K7 WeakPolarHBondContact O-CB 3.29Å; A3-K7 PolarHBondContact O-N 2.93Å
4E88.4Confident88.3Confident140 Ų14067.5 Ų67.565%0.65435%0.354SS*.Hα-helixtrans-64-45.3175.4-171.6179.3-174.900112.6S2 Q6 K7 L8S2-E4 PolarHBondContact O-N 3.03Å; E4-Q6 VanDerWaalsContact C-N 3.34Å; E4-Q6 PolarHBondContact O-N 3.28Å; E4-K7 WeakPolarHBondContact O-CB 3.46Å; E4-K7 PolarHBondContact O-N 3.15Å; E4-L8 WeakPolarHBondContact O-CG 3.5Å; E4-L8 PolarHBondContact O-N 3.03Å
5R86.5Confident88.8Confident22 Ų2263.1 Ų63.18%0.08333%0.331CS..Hα-helixtrans-64-40177.4-176.6-174.5155.7-160.5-8.1111.7M1 S2 K7 L8 F9 I123 E128 D132M1-R5 HydrophobicContact CE-CB 4.37Å; M1-R5 HydrophobicContact CE-CG 3.69Å; S2-R5 PolarHBondContact O-N 3.46Å; S2-R5 WeakPolarHBondContact OG-CB 3.46Å; S2-R5 PolarHBondContact OG-N 2.9Å; R5-K7 VanDerWaalsContact C-N 3.31Å; R5-L8 PolarHBondContact O-N 3.16Å; R5-F9 WeakPolarHBondContact O-CB 3.33Å; R5-F9 PolarHBondContact O-N 3.1Å; R5-I123 WeakPolarHBondContact CD-O 3.38Å; R5-I123 PolarHBondContact NE-O 3.45Å; R5-I123 VanDerWaalsContact NE-O 3.14Å; R5-E128 IonicContact CZ-OE2 3.55Å; R5-E128 IonicContact NH1-OE2 3.94Å; R5-E128 PolarHBondContact NH1-OE2 3.39Å; R5-E128 IonicContact NH2-OE2 2.73Å; R5-E128 PolarHBondContact NH2-OE2 3.44Å; R5-D132 IonicContact CZ-OD2 3.14Å; R5-D132 IonicContact NH2-OD2 2.71Å; R5-D132 PolarHBondContact NH2-OD2 3.3Å
6Q88.8Confident89.2Confident107 Ų10759.2 Ų59.250%0.531%0.311SS..Hα-helixtrans-62.4-41.9176.3-71.5-179.8-26.200111.3M1 S2 A3 E4 F9 L10M1-Q6 HydrophobicContact CB-CG 3.49Å; M1-Q6 VanDerWaalsContact CB-CG 3.49Å; M1-Q6 HydrophobicContact CE-CB 4.38Å; M1-Q6 HydrophobicContact CE-CG 3.83Å; M1-Q6 HydrophobicContact CG-CG 4.29Å; M1-Q6 HydrophobicContact SD-CG 3.87Å; S2-Q6 PolarHBondContact O-N 3.32Å; A3-Q6 PolarHBondContact O-N 3.04Å; E4-Q6 VanDerWaalsContact C-N 3.34Å; E4-Q6 PolarHBondContact O-N 3.28Å; Q6-F9 PolarHBondContact O-N 3.21Å; Q6-L10 WeakPolarHBondContact O-CB 3.39Å; Q6-L10 PolarHBondContact O-N 3.31Å
7K92Very high89.5Confident118 Ų11857.1 Ų57.151%0.51330%0.304SS..Hα-helixtrans-61.6-47.2176-174.1-179.9179.8-176.10111.8A3 E4 R5 L10 Y11A3-K7 WeakPolarHBondContact O-CB 3.29Å; A3-K7 PolarHBondContact O-N 2.93Å; E4-K7 WeakPolarHBondContact O-CB 3.46Å; E4-K7 PolarHBondContact O-N 3.15Å; R5-K7 VanDerWaalsContact C-N 3.31Å; K7-L10 PolarHBondContact O-N 2.97Å; K7-Y11 HydrophobicContact CD-CE2 4.1Å; K7-Y11 WeakPolarHBondContact CE-OH 3.34Å; K7-Y11 HydrophobicContact CG-CD2 4.22Å; K7-Y11 HydrophobicContact CG-CE2 3.55Å; K7-Y11 WeakPolarHBondContact O-CD2 3.48Å; K7-Y11 PolarHBondContact O-N 3.15Å
8L92.1Very high89.9Confident23 Ų2355.5 Ų55.512%0.1230%0.296CS..Hα-helixtrans-61.4-45.2175.9-69.8177.7000112.1E4 R5 L10 Y11 V12 I123 P184E4-L8 WeakPolarHBondContact O-CG 3.5Å; E4-L8 PolarHBondContact O-N 3.03Å; R5-L8 PolarHBondContact O-N 3.16Å; L8-L10 VanDerWaalsContact C-N 3.32Å; L8-L10 PolarHBondContact O-N 3.16Å; L8-Y11 PolarHBondContact O-N 2.62Å; L8-V12 WeakPolarHBondContact O-CG2 3.26Å; L8-V12 PolarHBondContact O-N 3.31Å; L8-I123 HydrophobicContact CB-CD1 4.09Å; L8-P184 HydrophobicContact CD1-CG 3.98Å; L8-P184 HydrophobicContact CD2-CG 3.95Å
9F91.5Very high90.3Very high23 Ų2352.9 Ų52.910%0.10128%0.282CS..Hα-helixtrans-59.4-44.4177.3-176-96.3000111.6M1 R5 Q6 Y11 V12 C13 V120 I123 D132 K135M1-F9 HydrophobicContact CE-CB 3.91Å; M1-F9 HydrophobicContact CE-CG 4.29Å; R5-F9 WeakPolarHBondContact O-CB 3.33Å; R5-F9 PolarHBondContact O-N 3.1Å; Q6-F9 PolarHBondContact O-N 3.21Å; F9-Y11 VanDerWaalsContact C-N 3.33Å; F9-Y11 PolarHBondContact O-N 3.38Å; F9-V12 PolarHBondContact O-N 3.3Å; F9-C13 WeakPolarHBondContact CE1-SG 3.3Å; F9-C13 VanDerWaalsContact CZ-SG 3.55Å; F9-C13 PolarHBondContact O-N 3.35Å; F9-C13 PolarHBondContact O-SG 2.97Å; F9-C13 VanDerWaalsContact O-SG 3.41Å; F9-V120 HydrophobicContact CD2-CG1 4.19Å; F9-V120 HydrophobicContact CD2-CG2 4.04Å; F9-V120 HydrophobicContact CE2-CG1 3.82Å; F9-V120 HydrophobicContact CE2-CG2 3.9Å; F9-I123 HydrophobicContact CB-CD1 4.39Å; F9-D132 HydrophobicContact CD2-CB 4.49Å; F9-D132 HydrophobicContact CE2-CB 3.88Å; F9-D132 WeakPolarHBondContact CE2-O 3.2Å; F9-D132 HydrophobicContact CZ-CB 4.45Å; F9-D132 WeakPolarHBondContact CZ-O 3.45Å; F9-K135 HydrophobicContact CE1-CB 4.06Å; F9-K135 HydrophobicContact CE1-CD 3.97Å; F9-K135 HydrophobicContact CZ-CB 3.57Å; F9-K135 HydrophobicContact CZ-CD 3.97Å; F9-K135 HydrophobicContact CZ-CG 4.45Å
10L92.2Very high90.6Very high113 Ų11351.8 Ų51.859%0.59228%0.275SS*.Hα-helixtrans-61-40.9176.1-177.164.4000112Q6 K7 L8 C13 L14Q6-L10 WeakPolarHBondContact O-CB 3.39Å; Q6-L10 PolarHBondContact O-N 3.31Å; K7-L10 PolarHBondContact O-N 2.97Å; L8-L10 VanDerWaalsContact C-N 3.32Å; L8-L10 PolarHBondContact O-N 3.16Å; L10-C13 PolarHBondContact O-N 3.22Å; L10-L14 WeakPolarHBondContact O-CB 3.3Å; L10-L14 PolarHBondContact O-N 3.18Å
11Y94.2Very high90.9Very high51 Ų5151 Ų5120%0.227%0.27CS..Hα-helixtrans-63.9-41.1175.6-65.6-31000112.7K7 L8 F9 L14 V15 L182K7-Y11 HydrophobicContact CD-CE2 4.1Å; K7-Y11 WeakPolarHBondContact CE-OH 3.34Å; K7-Y11 HydrophobicContact CG-CD2 4.22Å; K7-Y11 HydrophobicContact CG-CE2 3.55Å; K7-Y11 WeakPolarHBondContact O-CD2 3.48Å; K7-Y11 PolarHBondContact O-N 3.15Å; L8-Y11 PolarHBondContact O-N 2.62Å; F9-Y11 VanDerWaalsContact C-N 3.33Å; F9-Y11 PolarHBondContact O-N 3.38Å; Y11-L14 PolarHBondContact O-N 2.93Å; Y11-V15 WeakPolarHBondContact O-CG2 3.48Å; Y11-V15 PolarHBondContact O-N 2.75Å; Y11-L182 HydrophobicContact CD1-CD1 4.07Å; Y11-L182 HydrophobicContact CD2-CB 3.74Å; Y11-L182 HydrophobicContact CD2-CD1 4.3Å; Y11-L182 HydrophobicContact CE1-CD1 3.89Å; Y11-L182 HydrophobicContact CE2-CB 3.83Å; Y11-L182 HydrophobicContact CE2-CD1 4.11Å; Y11-L182 HydrophobicContact CE2-CD2 4.32Å; Y11-L182 HydrophobicContact CE2-CG 4.31Å; Y11-L182 HydrophobicContact CG-CB 4.29Å; Y11-L182 HydrophobicContact CG-CD1 4.28Å
12V93.3Very high92.7Very high0 Ų047.1 Ų47.10%025%0.252CS..Hα-helixtrans-64-43.6175.6179.80000111L8 F9 L14 V15 S16 T116 F119 V120 L136 L183L8-V12 WeakPolarHBondContact O-CG2 3.26Å; L8-V12 PolarHBondContact O-N 3.31Å; F9-V12 PolarHBondContact O-N 3.3Å; V12-L14 VanDerWaalsContact C-N 3.3Å; V12-L14 PolarHBondContact O-N 3.5Å; V12-V15 VanDerWaalsContact O-CG2 3.31Å; V12-V15 WeakPolarHBondContact O-CG2 3.32Å; V12-V15 PolarHBondContact O-N 2.71Å; V12-S16 WeakPolarHBondContact O-CB 3.2Å; V12-S16 PolarHBondContact O-N 3.36Å; V12-T116 HydrophobicContact CG1-CG2 3.98Å; V12-F119 HydrophobicContact CG2-CD1 3.4Å; V12-F119 VanDerWaalsContact CG2-CD1 3.4Å; V12-F119 HydrophobicContact CG2-CE1 3.69Å; V12-F119 HydrophobicContact CG2-CG 4.14Å; V12-V120 HydrophobicContact CB-CG2 4.35Å; V12-V120 HydrophobicContact CG1-CG2 3.79Å; V12-L136 HydrophobicContact CG1-CD2 4.19Å; V12-L183 HydrophobicContact CG2-CD2 3.91Å
13C92.9Very high93.2Very high18 Ų1844.4 Ų44.412%0.12223%0.232CC..Hα-helixtrans-59.5-40.5174.1-73.40000112.2F9 L10 A17 P139F9-C13 WeakPolarHBondContact CE1-SG 3.3Å; F9-C13 VanDerWaalsContact CZ-SG 3.55Å; F9-C13 PolarHBondContact O-N 3.35Å; F9-C13 PolarHBondContact O-SG 2.97Å; F9-C13 VanDerWaalsContact O-SG 3.41Å; L10-C13 PolarHBondContact O-N 3.22Å; C13-A17 WeakPolarHBondContact O-CB 3.26Å; C13-A17 PolarHBondContact O-N 3.28Å; C13-P139 HydrophobicContact CB-CG 3.96Å
14L94Very high93.5Very high97 Ų9742 Ų4251%0.50821%0.207SC..Hα-helixtrans-65.4-50178.9-176.868.1000111.6L10 Y11 V12 S16 A17 V18L10-L14 WeakPolarHBondContact O-CB 3.3Å; L10-L14 PolarHBondContact O-N 3.18Å; Y11-L14 PolarHBondContact O-N 2.93Å; V12-L14 VanDerWaalsContact C-N 3.3Å; V12-L14 PolarHBondContact O-N 3.5Å; L14-S16 VanDerWaalsContact C-N 3.31Å; L14-S16 PolarHBondContact O-N 2.86Å; L14-A17 WeakPolarHBondContact O-CB 3.46Å; L14-A17 PolarHBondContact O-N 2.86Å; L14-V18 WeakPolarHBondContact O-CG2 3.45Å; L14-V18 PolarHBondContact O-N 3.17Å
15V96.2Very high93.9Very high1 Ų135.6 Ų35.61%0.00618%0.177CC..Hα-helixtrans-67.5-34.4179.2-60.90000111.9Y11 V12 V18 W19 F112 T116 P178 V179Y11-V15 WeakPolarHBondContact O-CG2 3.48Å; Y11-V15 PolarHBondContact O-N 2.75Å; V12-V15 VanDerWaalsContact O-CG2 3.31Å; V12-V15 WeakPolarHBondContact O-CG2 3.32Å; V12-V15 PolarHBondContact O-N 2.71Å; V15-V18 PolarHBondContact O-N 2.6Å; V15-W19 WeakPolarHBondContact O-CB 3.34Å; V15-W19 PolarHBondContact O-N 3.4Å; V15-F112 HydrophobicContact CB-CE1 4.11Å; V15-F112 HydrophobicContact CB-CZ 4.05Å; V15-F112 HydrophobicContact CG2-CE1 3.91Å; V15-F112 HydrophobicContact CG2-CZ 3.91Å; V15-T116 HydrophobicContact CG2-CG2 4.42Å; V15-P178 HydrophobicContact CG1-CB 3.61Å; V15-P178 HydrophobicContact CG1-CG 4.28Å; V15-V179 HydrophobicContact CG1-CG2 4.37Å
16S95Very high94.3Very high1 Ų134.8 Ų34.81%0.00717%0.174CC..Hα-helixtrans-63.4-42.8172.6177.90000111.1V12 L14 V18 W19 H20V12-S16 WeakPolarHBondContact O-CB 3.2Å; V12-S16 PolarHBondContact O-N 3.36Å; L14-S16 VanDerWaalsContact C-N 3.31Å; L14-S16 PolarHBondContact O-N 2.86Å; S16-V18 PolarHBondContact O-N 2.88Å; S16-W19 PolarHBondContact O-N 3.46Å; S16-H20 PolarHBondContact O-CD2 3.5Å; S16-H20 PolarHBondContact O-N 3.3Å; S16-H20 PolarHBondContact OG-CD2 3.48Å
17A95Very high94.3Very high23 Ų2332.6 Ų32.619%0.1917%0.166CC..Hα-helixtrans-58.5-49.5175.100000111.5C13 L14 W19 H20 I21 P139C13-A17 WeakPolarHBondContact O-CB 3.26Å; C13-A17 PolarHBondContact O-N 3.28Å; L14-A17 WeakPolarHBondContact O-CB 3.46Å; L14-A17 PolarHBondContact O-N 2.86Å; A17-W19 VanDerWaalsContact C-N 3.35Å; A17-W19 PolarHBondContact O-N 3.28Å; A17-H20 PolarHBondContact O-N 2.93Å; A17-I21 WeakPolarHBondContact O-CB 3.48Å; A17-I21 VanDerWaalsContact O-CG1 3.22Å; A17-I21 WeakPolarHBondContact O-CG1 3.46Å; A17-I21 PolarHBondContact O-N 3.09Å; A17-P139 HydrophobicContact CB-CB 3.83Å
18V96.6Very high94.3Very high29 Ų2927 Ų2718%0.17614%0.141CC..Hα-helixtrans-60.8-45.2178.9174.90000110.9L14 V15 S16 I21 G22 F174 I175L14-V18 WeakPolarHBondContact O-CG2 3.45Å; L14-V18 PolarHBondContact O-N 3.17Å; V15-V18 PolarHBondContact O-N 2.6Å; S16-V18 PolarHBondContact O-N 2.88Å; V18-I21 PolarHBondContact O-N 2.89Å; V18-G22 PolarHBondContact O-N 2.85Å; V18-G22 VanDerWaalsContact O-N 3.08Å; V18-F174 HydrophobicContact CG1-CB 3.68Å; V18-F174 HydrophobicContact CG2-CB 4.24Å; V18-I175 HydrophobicContact CB-CG1 4.07Å; V18-I175 HydrophobicContact CG1-CD1 4.22Å; V18-I175 HydrophobicContact CG1-CG1 3.68Å
19W97.4Very high94.3Very high7 Ų725.9 Ų25.93%0.02714%0.136CC..Hα-helixtrans-59.3-50.9177.5-175.880.5000111.4V15 S16 A17 I21 G22 V23 F110 F112 D113 I175V15-W19 WeakPolarHBondContact O-CB 3.34Å; V15-W19 PolarHBondContact O-N 3.4Å; S16-W19 PolarHBondContact O-N 3.46Å; A17-W19 VanDerWaalsContact C-N 3.35Å; A17-W19 PolarHBondContact O-N 3.28Å; W19-I21 VanDerWaalsContact C-N 3.31Å; W19-I21 PolarHBondContact O-N 3.5Å; W19-G22 PolarHBondContact O-N 3.32Å; W19-G22 VanDerWaalsContact O-N 3.08Å; W19-V23 HydrophobicContact CD2-CG2 3.8Å; W19-V23 HydrophobicContact CE3-CG2 3.77Å; W19-V23 HydrophobicContact CH2-CG2 3.65Å; W19-V23 HydrophobicContact CZ2-CG2 3.65Å; W19-V23 HydrophobicContact CZ3-CG2 3.67Å; W19-V23 WeakPolarHBondContact O-CG2 3.43Å; W19-V23 PolarHBondContact O-N 3.15Å; W19-F110 HydrophobicContact CH2-CD1 4.35Å; W19-F110 AromaticContact CH2-CE1 3.95Å; W19-F110 HydrophobicContact CH2-CE1 3.95Å; W19-F110 HydrophobicContact CH2-CZ 4.47Å; W19-F110 AromaticContact CZ2-CD1 3.89Å; W19-F110 HydrophobicContact CZ2-CD1 3.89Å; W19-F110 AromaticContact CZ2-CE1 3.67Å; W19-F110 HydrophobicContact CZ2-CE1 3.67Å; W19-F110 HydrophobicContact CZ2-CE2 4.37Å; W19-F110 HydrophobicContact CZ2-CG 4.35Å; W19-F110 AromaticContact CZ2-CZ 3.96Å; W19-F110 HydrophobicContact CZ2-CZ 3.96Å; W19-F112 HydrophobicContact CB-CD1 3.61Å; W19-F112 HydrophobicContact CB-CE1 4.06Å; W19-F112 HydrophobicContact CB-CG 4.37Å; W19-F112 VanDerWaalsContact CD1-CB 3.46Å; W19-F112 AromaticContact CD1-CD1 3.83Å; W19-F112 AromaticContact CD1-CG 3.7Å; W19-F112 HydrophobicContact CD2-CB 3.87Å; W19-F112 HydrophobicContact CD2-CD1 4.2Å; W19-F112 HydrophobicContact CD2-CG 4.44Å; W19-F112 HydrophobicContact CG-CB 3.79Å; W19-F112 AromaticContact CG-CD1 3.58Å; W19-F112 HydrophobicContact CG-CD1 3.58Å; W19-F112 HydrophobicContact CG-CE1 4.46Å; W19-F112 AromaticContact CG-CG 3.91Å; W19-F112 HydrophobicContact CG-CG 3.91Å; W19-F112 HydrophobicContact CZ2-CB 4.24Å; W19-F112 VanDerWaalsContact NE1-CB 3.32Å; W19-D113 HydrophobicContact CE3-CB 4.11Å; W19-D113 HydrophobicContact CH2-CB 3.9Å; W19-D113 HydrophobicContact CZ3-CB 3.51Å; W19-I175 HydrophobicContact CB-CD1 3.67Å; W19-I175 HydrophobicContact CG-CD1 4.26Å
20H95.7Very high94.2Very high29 Ų2925.2 Ų25.213%0.13413%0.133CC..Hα-helixtrans-65-33.7179.7-75.4-71.7000112.6S16 A17 G22 V23 Q24 S143S16-H20 PolarHBondContact O-CD2 3.5Å; S16-H20 PolarHBondContact O-N 3.3Å; S16-H20 PolarHBondContact OG-CD2 3.48Å; A17-H20 PolarHBondContact O-N 2.93Å; H20-G22 VanDerWaalsContact C-N 3.29Å; H20-G22 PolarHBondContact O-N 3.22Å; H20-V23 PolarHBondContact O-N 3.48Å; H20-Q24 VanDerWaalsContact O-CG 3.31Å; H20-Q24 WeakPolarHBondContact O-CG 3.17Å; H20-Q24 PolarHBondContact O-N 3.19Å; H20-S143 WeakPolarHBondContact CB-OG 3.41Å
21I96.8Very high94Very high35 Ų3520.6 Ų20.618%0.17911%0.11CC..Hα-helixtrans-57.4-47172-74.9165.8000109.4A17 V18 W19 V23 Q24 W25 I146 L150A17-I21 WeakPolarHBondContact O-CB 3.48Å; A17-I21 VanDerWaalsContact O-CG1 3.22Å; A17-I21 WeakPolarHBondContact O-CG1 3.46Å; A17-I21 PolarHBondContact O-N 3.09Å; V18-I21 PolarHBondContact O-N 2.89Å; W19-I21 VanDerWaalsContact C-N 3.31Å; W19-I21 PolarHBondContact O-N 3.5Å; I21-V23 VanDerWaalsContact C-N 3.34Å; I21-V23 PolarHBondContact O-N 3.28Å; I21-Q24 PolarHBondContact O-N 2.94Å; I21-W25 WeakPolarHBondContact O-CB 3.16Å; I21-W25 PolarHBondContact O-N 3.47Å; I21-I146 HydrophobicContact CD1-CB 4.33Å; I21-I146 HydrophobicContact CD1-CG2 3.76Å; I21-I146 HydrophobicContact CG1-CB 4.19Å; I21-I146 HydrophobicContact CG1-CG2 3.98Å; I21-I146 HydrophobicContact CG2-CG2 4.43Å; I21-L150 HydrophobicContact CG2-CD1 4.19Å
22G97.6Very high93.8Very high1 Ų118.6 Ų18.61%0.0110%0.102CC..Hα-helixtrans-66.4-33.1178.300000114V18 W19 H20 T26 Y88 N167V18-G22 PolarHBondContact O-N 2.85Å; V18-G22 VanDerWaalsContact O-N 3.08Å; W19-G22 PolarHBondContact O-N 3.32Å; W19-G22 VanDerWaalsContact O-N 3.08Å; H20-G22 VanDerWaalsContact C-N 3.29Å; H20-G22 PolarHBondContact O-N 3.22Å; G22-T26 WeakPolarHBondContact O-CB 3.3Å; G22-T26 PolarHBondContact O-N 3.22Å; G22-T26 PolarHBondContact O-OG1 2.99Å; G22-Y88 PolarHBondContact O-OH 3.31Å; G22-N167 WeakPolarHBondContact CA-OD1 3.48Å; G22-N167 PolarHBondContact O-ND2 3.05Å
23V95.4Very high93.7Very high14 Ų1418.6 Ų18.69%0.08510%0.102CC..Hα-helixtrans-64.5-51.4172.81750000110.4W19 H20 I21 W25 T26 N27 Y88 F110W19-V23 HydrophobicContact CD2-CG2 3.8Å; W19-V23 HydrophobicContact CE3-CG2 3.77Å; W19-V23 HydrophobicContact CH2-CG2 3.65Å; W19-V23 HydrophobicContact CZ2-CG2 3.65Å; W19-V23 HydrophobicContact CZ3-CG2 3.67Å; W19-V23 WeakPolarHBondContact O-CG2 3.43Å; W19-V23 PolarHBondContact O-N 3.15Å; H20-V23 PolarHBondContact O-N 3.48Å; I21-V23 VanDerWaalsContact C-N 3.34Å; I21-V23 PolarHBondContact O-N 3.28Å; V23-W25 VanDerWaalsContact C-N 3.33Å; V23-W25 PolarHBondContact O-N 2.92Å; V23-T26 PolarHBondContact O-N 2.97Å; V23-N27 WeakPolarHBondContact O-CB 3.25Å; V23-N27 PolarHBondContact O-N 3.48Å; V23-N27 PolarHBondContact O-OD1 2.88Å; V23-Y88 WeakPolarHBondContact CA-OH 3.17Å; V23-Y88 WeakPolarHBondContact CG2-OH 3.35Å; V23-Y88 PolarHBondContact N-OH 3.43Å; V23-F110 HydrophobicContact CG1-CZ 4.29Å; V23-F110 HydrophobicContact CG2-CE1 4.27Å; V23-F110 HydrophobicContact CG2-CE2 4.47Å; V23-F110 HydrophobicContact CG2-CZ 3.7Å
24Q92.8Very high93.6Very high30 Ų3018 Ų1814%0.1410%0.097CC..Hα-helixtrans-70.8-32-176.4-59.2-56.1-19.900112.5H20 I21 N27 L28 L144 P148H20-Q24 VanDerWaalsContact O-CG 3.31Å; H20-Q24 WeakPolarHBondContact O-CG 3.17Å; H20-Q24 PolarHBondContact O-N 3.19Å; I21-Q24 PolarHBondContact O-N 2.94Å; Q24-N27 PolarHBondContact O-N 3.02Å; Q24-N27 PolarHBondContact OE1-ND2 3.25Å; Q24-N27 VanDerWaalsContact OE1-ND2 3.15Å; Q24-L28 PolarHBondContact O-N 3.43Å; Q24-L28 VanDerWaalsContact O-N 3.1Å; Q24-L144 HydrophobicContact CG-CD2 3.93Å; Q24-L144 HydrophobicContact CG-CG 4.27Å; Q24-P148 HydrophobicContact CB-CG 4.27Å
25W95.3Very high93.3Very high6 Ų617.4 Ų17.42%0.0239%0.088CC..Hα-helixtrans-56.7-53.2166.6-175.9-51.4000111.5I21 V23 N27 L28 L29 L150 A151 M154 A163 N167 L170I21-W25 WeakPolarHBondContact O-CB 3.16Å; I21-W25 PolarHBondContact O-N 3.47Å; V23-W25 VanDerWaalsContact C-N 3.33Å; V23-W25 PolarHBondContact O-N 2.92Å; W25-N27 VanDerWaalsContact C-N 3.33Å; W25-N27 PolarHBondContact O-N 3.11Å; W25-L28 PolarHBondContact O-N 3.42Å; W25-L29 VanDerWaalsContact NE1-CD1 3.27Å; W25-L29 PolarHBondContact O-N 3.32Å; W25-L150 HydrophobicContact CE3-CB 3.72Å; W25-L150 HydrophobicContact CH2-CB 4.12Å; W25-L150 HydrophobicContact CZ3-CB 3.32Å; W25-L150 HydrophobicContact CZ3-CD1 4.24Å; W25-L150 HydrophobicContact CZ3-CG 4.41Å; W25-A151 HydrophobicContact CB-CB 4.16Å; W25-A151 HydrophobicContact CD2-CB 3.6Å; W25-A151 HydrophobicContact CE3-CB 4.3Å; W25-A151 HydrophobicContact CG-CB 3.52Å; W25-M154 HydrophobicContact CH2-CB 4.13Å; W25-M154 HydrophobicContact CH2-CG 3.34Å; W25-M154 HydrophobicContact CZ2-CB 3.76Å; W25-M154 HydrophobicContact CZ2-CG 3.49Å; W25-M154 VanDerWaalsContact CZ2-CG 3.49Å; W25-A163 WeakPolarHBondContact CZ2-O 3.34Å; W25-A163 PolarHBondContact NE1-O 3.47Å; W25-N167 HydrophobicContact CD2-CB 3.95Å; W25-N167 HydrophobicContact CG-CB 3.92Å; W25-N167 HydrophobicContact CZ2-CB 4.38Å; W25-L170 HydrophobicContact CH2-CD1 4.37Å; W25-L170 HydrophobicContact CZ3-CD1 4.46Å
26T95.1Very high92.9Very high4 Ų421.1 Ų21.13%0.02511%0.106CC..Hα-helixtrans-62.6-43.4-179.7-60.50000110.8G22 V23 L28 L29 F30 Y87 Y88 I91 Q164 N167G22-T26 WeakPolarHBondContact O-CB 3.3Å; G22-T26 PolarHBondContact O-N 3.22Å; G22-T26 PolarHBondContact O-OG1 2.99Å; V23-T26 PolarHBondContact O-N 2.97Å; T26-L28 VanDerWaalsContact C-N 3.29Å; T26-L28 PolarHBondContact O-N 3.01Å; T26-L29 PolarHBondContact O-N 3.04Å; T26-L29 VanDerWaalsContact O-N 3.13Å; T26-F30 HydrophobicContact CG2-CB 4.45Å; T26-F30 WeakPolarHBondContact O-CB 3.32Å; T26-F30 PolarHBondContact O-N 3.38Å; T26-Y87 HydrophobicContact CG2-CE1 4.39Å; T26-Y88 HydrophobicContact CG2-CD1 4.09Å; T26-Y88 HydrophobicContact CG2-CE1 4Å; T26-Y88 VanDerWaalsContact OG1-CD1 3.27Å; T26-Y88 WeakPolarHBondContact OG1-CD1 3.44Å; T26-Y88 WeakPolarHBondContact OG1-CE1 3.5Å; T26-I91 HydrophobicContact CG2-CD1 3.38Å; T26-Q164 PolarHBondContact OG1-NE2 3.33Å; T26-N167 PolarHBondContact OG1-ND2 2.9Å
27N90.1Very high92.7Very high61 Ų6121.1 Ų21.133%0.32611%0.106SC..Hα-helixtrans-53.3-49.6177.2-73.1-13.1000110.1V23 Q24 W25 L29 P31 W233V23-N27 WeakPolarHBondContact O-CB 3.25Å; V23-N27 PolarHBondContact O-N 3.48Å; V23-N27 PolarHBondContact O-OD1 2.88Å; Q24-N27 PolarHBondContact O-N 3.02Å; Q24-N27 PolarHBondContact OE1-ND2 3.25Å; Q24-N27 VanDerWaalsContact OE1-ND2 3.15Å; W25-N27 VanDerWaalsContact C-N 3.33Å; W25-N27 PolarHBondContact O-N 3.11Å; N27-L29 PolarHBondContact O-N 3.16Å; N27-P31 VanDerWaalsContact O-CD 3.27Å; N27-P31 WeakPolarHBondContact O-CD 3.45Å; N27-W233 VanDerWaalsContact C-CH2 3.4Å; N27-W233 HydrophobicContact CB-CH2 3.99Å; N27-W233 WeakPolarHBondContact O-CH2 3.45Å; N27-W233 WeakPolarHBondContact O-CZ2 3.47Å
28L90.3Very high92.3Very high0 Ų026.8 Ų26.80%013%0.128CC..Hα-helixtrans-55.8-49.6177.5178.372.6000112.1Q24 W25 T26 F32 P148 A151 A247 T248 F251Q24-L28 PolarHBondContact O-N 3.43Å; Q24-L28 VanDerWaalsContact O-N 3.1Å; W25-L28 PolarHBondContact O-N 3.42Å; T26-L28 VanDerWaalsContact C-N 3.29Å; T26-L28 PolarHBondContact O-N 3.01Å; L28-F32 VanDerWaalsContact O-CD2 3.26Å; L28-F32 WeakPolarHBondContact O-CD2 3.48Å; L28-F32 WeakPolarHBondContact O-CE2 3.41Å; L28-P148 HydrophobicContact CB-CB 4.41Å; L28-P148 HydrophobicContact CD2-CB 4.15Å; L28-P148 WeakPolarHBondContact CD2-O 3.3Å; L28-A151 HydrophobicContact CD2-CB 3.68Å; L28-A247 HydrophobicContact CD1-CB 3.66Å; L28-T248 WeakPolarHBondContact CD2-OG1 3.26Å; L28-F251 HydrophobicContact CD1-CD2 3.38Å; L28-F251 HydrophobicContact CD1-CE2 3.6Å; L28-F251 HydrophobicContact CD1-CG 4.22Å
29L92.3Very high91.9Very high0 Ų030.5 Ų30.50%015%0.153CC..Hα-helixtrans-81.4-25.2-170.6-59.9-169.7000113.9W25 T26 N27 F32 L33 A151 T155 I160 A163 Q164W25-L29 VanDerWaalsContact NE1-CD1 3.27Å; W25-L29 PolarHBondContact O-N 3.32Å; T26-L29 PolarHBondContact O-N 3.04Å; T26-L29 VanDerWaalsContact O-N 3.13Å; N27-L29 PolarHBondContact O-N 3.16Å; L29-F32 PolarHBondContact O-N 3.36Å; L29-F32 VanDerWaalsContact O-N 3.09Å; L29-L33 HydrophobicContact CB-CD1 4.49Å; L29-L33 WeakPolarHBondContact O-CG 3.39Å; L29-L33 PolarHBondContact O-N 2.8Å; L29-A151 HydrophobicContact CD1-CB 4.4Å; L29-A151 HydrophobicContact CD2-CB 4.24Å; L29-A151 HydrophobicContact CG-CB 4.17Å; L29-T155 HydrophobicContact CD1-CG2 4.26Å; L29-T155 HydrophobicContact CD2-CG2 3.49Å; L29-T155 VanDerWaalsContact CD2-CG2 3.49Å; L29-I160 HydrophobicContact CB-CG2 4.33Å; L29-I160 HydrophobicContact CD2-CG2 4.45Å; L29-A163 HydrophobicContact CD1-CB 3.89Å; L29-Q164 HydrophobicContact CD1-CB 4.18Å
30F91Very high91.5Very high10 Ų1034.8 Ų34.84%0.04418%0.182CC..Hα-helixtrans-56.7-46.6-169.7-172-96000113.3T26 F32 L33 E34 I49 H50 Y87 I91 F100T26-F30 HydrophobicContact CG2-CB 4.45Å; T26-F30 WeakPolarHBondContact O-CB 3.32Å; T26-F30 PolarHBondContact O-N 3.38Å; F30-F32 VanDerWaalsContact C-N 3.3Å; F30-F32 PolarHBondContact O-N 3.11Å; F30-L33 WeakPolarHBondContact O-CB 3.1Å; F30-L33 PolarHBondContact O-N 2.88Å; F30-L33 VanDerWaalsContact O-N 3.16Å; F30-E34 HydrophobicContact CD1-CG 4.36Å; F30-E34 VanDerWaalsContact CE1-CD 3.43Å; F30-E34 HydrophobicContact CE1-CG 4.07Å; F30-E34 WeakPolarHBondContact CE1-OE1 3.43Å; F30-E34 HydrophobicContact CZ-CG 4.42Å; F30-E34 PolarHBondContact O-N 3.25Å; F30-E34 VanDerWaalsContact O-N 3.08Å; F30-I49 HydrophobicContact CZ-CG2 4.07Å; F30-H50 AromaticContact CD1-CE1 3.75Å; F30-H50 AromaticContact CD1-NE2 3.85Å; F30-H50 AromaticContact CE1-CE1 3.52Å; F30-H50 AromaticContact CE1-NE2 3.47Å; F30-H50 WeakPolarHBondContact CE1-NE2 3.46Å; F30-Y87 WeakPolarHBondContact CE2-OH 3.2Å; F30-I91 HydrophobicContact CD2-CD1 4.02Å; F30-I91 HydrophobicContact CE2-CB 4.41Å; F30-I91 HydrophobicContact CE2-CD1 4.44Å; F30-I91 HydrophobicContact CE2-CG2 4.01Å; F30-F100 HydrophobicContact CE2-CD1 4.01Å; F30-F100 AromaticContact CE2-CE1 3.9Å; F30-F100 HydrophobicContact CE2-CE1 3.9Å; F30-F100 HydrophobicContact CZ-CD1 4.06Å; F30-F100 HydrophobicContact CZ-CE1 4.22Å
31P87.3Confident91.2Very high16 Ų1634.4 Ų34.410%0.10418%0.181CC..Hα-helixtrans-65-33.4178.5-26.940.8000113.3N27 E34 W35 W233N27-P31 VanDerWaalsContact O-CD 3.27Å; N27-P31 WeakPolarHBondContact O-CD 3.45Å; P31-E34 PolarHBondContact O-N 3.47Å; P31-W35 PolarHBondContact O-N 3.08Å; P31-W35 VanDerWaalsContact O-N 3.1Å; P31-W35 PolarHBondContact O-NE1 3.22Å; P31-W233 HydrophobicContact CG-CD2 4.48Å; P31-W233 HydrophobicContact CG-CZ2 3.66Å
32F89.4Confident90.8Very high9 Ų934.6 Ų34.64%0.03919%0.188CC..Hα-helixtrans-70.5-35.9175.9-60.8-83.8000111.6L28 L29 F30 E34 W35 E36 I160 V237 P244 A247L28-F32 VanDerWaalsContact O-CD2 3.26Å; L28-F32 WeakPolarHBondContact O-CD2 3.48Å; L28-F32 WeakPolarHBondContact O-CE2 3.41Å; L29-F32 PolarHBondContact O-N 3.36Å; L29-F32 VanDerWaalsContact O-N 3.09Å; F30-F32 VanDerWaalsContact C-N 3.3Å; F30-F32 PolarHBondContact O-N 3.11Å; F32-E34 VanDerWaalsContact C-N 3.3Å; F32-E34 PolarHBondContact O-N 2.66Å; F32-W35 AromaticContact CD1-CE3 3.71Å; F32-W35 HydrophobicContact CD1-CE3 3.71Å; F32-W35 AromaticContact CD1-CZ3 3.71Å; F32-W35 HydrophobicContact CD1-CZ3 3.71Å; F32-W35 HydrophobicContact CE1-CE3 4.17Å; F32-W35 AromaticContact CE1-CZ3 3.67Å; F32-W35 HydrophobicContact CE1-CZ3 3.67Å; F32-W35 HydrophobicContact CG-CE3 4.46Å; F32-W35 PolarHBondContact O-N 3.16Å; F32-E36 PolarHBondContact O-N 2.99Å; F32-I160 HydrophobicContact CB-CD1 4.03Å; F32-I160 HydrophobicContact CB-CG2 4.32Å; F32-V237 HydrophobicContact CE1-CG1 3.8Å; F32-V237 HydrophobicContact CE2-CG1 4.17Å; F32-V237 HydrophobicContact CZ-CG1 3.45Å; F32-V237 VanDerWaalsContact CZ-CG1 3.45Å; F32-P244 HydrophobicContact CD1-CG 4.01Å; F32-P244 HydrophobicContact CD2-CB 4.38Å; F32-P244 HydrophobicContact CD2-CG 4.21Å; F32-P244 HydrophobicContact CE1-CG 4.15Å; F32-P244 HydrophobicContact CE2-CB 4.19Å; F32-P244 HydrophobicContact CE2-CG 4.35Å; F32-P244 HydrophobicContact CG-CG 4.04Å; F32-P244 HydrophobicContact CZ-CB 4.32Å; F32-P244 HydrophobicContact CZ-CG 4.31Å; F32-A247 HydrophobicContact CE2-CB 4.04Å; F32-A247 HydrophobicContact CZ-CB 3.85Å
33L92.4Very high90.1Very high0 Ų036.6 Ų36.60%020%0.197CC..Hα-helixtrans-62.7-37.6173.3-69.6168.9000112L29 F30 W35 F100 I160 R161 Q164L29-L33 HydrophobicContact CB-CD1 4.49Å; L29-L33 WeakPolarHBondContact O-CG 3.39Å; L29-L33 PolarHBondContact O-N 2.8Å; F30-L33 WeakPolarHBondContact O-CB 3.1Å; F30-L33 PolarHBondContact O-N 2.88Å; F30-L33 VanDerWaalsContact O-N 3.16Å; L33-W35 VanDerWaalsContact C-N 3.35Å; L33-F100 HydrophobicContact CB-CE1 4.45Å; L33-F100 HydrophobicContact CB-CZ 4.01Å; L33-I160 HydrophobicContact CD2-CG2 3.74Å; L33-I160 HydrophobicContact CG-CG2 3.93Å; L33-R161 HydrophobicContact CD2-CB 4.4Å; L33-R161 HydrophobicContact CD2-CG 3.57Å; L33-R161 PolarHBondContact O-NH2 2.92Å; L33-Q164 HydrophobicContact CD1-CB 4.06Å; L33-Q164 HydrophobicContact CD1-CG 3.84Å
34E90.1Very high89.7Confident5 Ų538.3 Ų38.32%0.02321%0.208CC..Hα-helixtrans-68.2-33.2174.8-69-17914000112.3F30 P31 F32 E36 V37 L41 H50 F100F30-E34 HydrophobicContact CD1-CG 4.36Å; F30-E34 VanDerWaalsContact CE1-CD 3.43Å; F30-E34 HydrophobicContact CE1-CG 4.07Å; F30-E34 WeakPolarHBondContact CE1-OE1 3.43Å; F30-E34 HydrophobicContact CZ-CG 4.42Å; F30-E34 PolarHBondContact O-N 3.25Å; F30-E34 VanDerWaalsContact O-N 3.08Å; P31-E34 PolarHBondContact O-N 3.47Å; F32-E34 VanDerWaalsContact C-N 3.3Å; F32-E34 PolarHBondContact O-N 2.66Å; E34-E36 VanDerWaalsContact C-N 3.34Å; E34-V37 WeakPolarHBondContact O-CB 3.48Å; E34-V37 WeakPolarHBondContact O-CG2 3.41Å; E34-V37 PolarHBondContact O-N 3.46Å; E34-L41 HydrophobicContact CB-CD1 4.17Å; E34-L41 HydrophobicContact CG-CD1 4.46Å; E34-H50 IonicContact OE1-CD2 3.79Å; E34-H50 IonicContact OE1-NE2 2.8Å; E34-H50 IonicContact OE2-NE2 3.45Å; E34-F100 HydrophobicContact CG-CD1 4.46Å; E34-F100 HydrophobicContact CG-CE1 4.04Å; E34-F100 HydrophobicContact CG-CZ 4.2Å
35W86.8Confident89.6Confident84 Ų8439.3 Ų39.332%0.31821%0.214SC..Hα-helixtrans-72.3-26178.1-65.2-9.1000113.8P31 F32 L33 V37 V237 R238P31-W35 PolarHBondContact O-N 3.08Å; P31-W35 VanDerWaalsContact O-N 3.1Å; P31-W35 PolarHBondContact O-NE1 3.22Å; F32-W35 AromaticContact CD1-CE3 3.71Å; F32-W35 HydrophobicContact CD1-CE3 3.71Å; F32-W35 AromaticContact CD1-CZ3 3.71Å; F32-W35 HydrophobicContact CD1-CZ3 3.71Å; F32-W35 HydrophobicContact CE1-CE3 4.17Å; F32-W35 AromaticContact CE1-CZ3 3.67Å; F32-W35 HydrophobicContact CE1-CZ3 3.67Å; F32-W35 HydrophobicContact CG-CE3 4.46Å; F32-W35 PolarHBondContact O-N 3.16Å; L33-W35 VanDerWaalsContact C-N 3.35Å; W35-V37 PolarHBondContact O-N 3.34Å; W35-V237 HydrophobicContact CH2-CB 3.84Å; W35-V237 HydrophobicContact CH2-CG1 3.24Å; W35-V237 HydrophobicContact CZ2-CG1 4.18Å; W35-V237 HydrophobicContact CZ3-CG1 3.69Å; W35-R238 HydrophobicContact CH2-CG 3.9Å; W35-R238 HydrophobicContact CZ2-CG 3.59Å
36E88.6Confident89.3Confident79 Ų7939.3 Ų39.337%0.36921%0.214SC..THydrogen-bonded Turntrans-74.7-6.1174.3-72.7-171.6166.600113.6F32 E34 R161F32-E36 PolarHBondContact O-N 2.99Å; E34-E36 VanDerWaalsContact C-N 3.34Å; E36-R161 IonicContact OE2-CZ 3.37Å; E36-R161 IonicContact OE2-NE 2.75Å; E36-R161 PolarHBondContact OE2-NE 2.88Å; E36-R161 IonicContact OE2-NH2 3.3Å; E36-R161 PolarHBondContact OE2-NH2 3.23Å
37V90Very high88.9Confident2 Ų239.1 Ų39.11%0.01221%0.213CC..  trans-68.8136.8-179.6176.80000110.9E34 W35 P39 P40 L41 F100E34-V37 WeakPolarHBondContact O-CB 3.48Å; E34-V37 WeakPolarHBondContact O-CG2 3.41Å; E34-V37 PolarHBondContact O-N 3.46Å; W35-V37 PolarHBondContact O-N 3.34Å; V37-P39 CarbonylContact C-O 3.56Å; V37-P39 CarbonylContact O-C 3.6Å; V37-P40 WeakPolarHBondContact O-CA 3.36Å; V37-L41 HydrophobicContact CB-CD1 4.21Å; V37-L41 HydrophobicContact CB-CG 3.98Å; V37-L41 HydrophobicContact CG1-CD1 4.35Å; V37-L41 HydrophobicContact CG1-CD2 3.9Å; V37-L41 HydrophobicContact CG1-CG 3.86Å; V37-L41 HydrophobicContact CG2-CD1 4.06Å; V37-L41 HydrophobicContact CG2-CG 4.37Å; V37-F100 HydrophobicContact CG2-CD2 3.95Å; V37-F100 HydrophobicContact CG2-CE2 3.38Å; V37-F100 HydrophobicContact CG2-CZ 4.34Å
38Q87.3Confident89Confident141 Ų14138.5 Ų38.566%0.65921%0.211SC*.SBendtrans-123.2123.2177.1-65.7-61.3-35.100110.1
39P89.2Confident89.1Confident107 Ų10738.5 Ų38.570%0.69521%0.211SC*.SBendcis-66.6158.2-3.530.4-36.1000112.8V37 L41V37-P39 CarbonylContact C-O 3.56Å; V37-P39 CarbonylContact O-C 3.6Å; P39-L41 PolarHBondContact O-N 3.09Å
40P88.9Confident89Confident97 Ų9741.2 Ų41.263%0.6322%0.224SC*.PPolyproline II helixtrans-56.6135.2-179.5-25.234.3000112.6V37V37-P40 WeakPolarHBondContact O-CA 3.36Å
41L89.2Confident89Confident22 Ų2241 Ų4112%0.11522%0.224CC..PPolyproline II helixtrans-70136.3179.2-64.5177.2000111.5E34 V37 P39 D45 I46 I49 Y97E34-L41 HydrophobicContact CB-CD1 4.17Å; E34-L41 HydrophobicContact CG-CD1 4.46Å; V37-L41 HydrophobicContact CB-CD1 4.21Å; V37-L41 HydrophobicContact CB-CG 3.98Å; V37-L41 HydrophobicContact CG1-CD1 4.35Å; V37-L41 HydrophobicContact CG1-CD2 3.9Å; V37-L41 HydrophobicContact CG1-CG 3.86Å; V37-L41 HydrophobicContact CG2-CD1 4.06Å; V37-L41 HydrophobicContact CG2-CG 4.37Å; P39-L41 PolarHBondContact O-N 3.09Å; L41-D45 HydrophobicContact CB-CB 4.22Å; L41-D45 HydrophobicContact CD2-CB 4.18Å; L41-I46 HydrophobicContact CB-CG1 4.07Å; L41-I46 HydrophobicContact CD1-CG1 4.4Å; L41-I49 HydrophobicContact CD1-CD1 3.87Å; L41-Y97 HydrophobicContact CD2-CD2 3.9Å; L41-Y97 HydrophobicContact CD2-CG 4.32Å
42A88Confident89.3Confident39 Ų3942.4 Ų42.432%0.32223%0.23SC..PPolyproline II helixtrans-71.2161.3169.500000110.8V44 D45 I46A42-V44 PolarHBondContact O-N 3.33Å; A42-D45 WeakPolarHBondContact CB-OD2 3.34Å; A42-D45 PolarHBondContact N-OD2 3.2Å; A42-D45 WeakPolarHBondContact O-CB 3.5Å; A42-D45 PolarHBondContact O-N 2.97Å; A42-I46 PolarHBondContact O-N 3.33Å; A42-I46 VanDerWaalsContact O-N 3.15Å
43M82.9Confident89.5Confident43 Ų4342 Ų4221%0.21223%0.228CC..Hα-helixtrans-58.8-37.9177-63.4-48129.400112.7D45 I46 G47 R238 S356 I359M43-D45 VanDerWaalsContact C-N 3.33Å; M43-I46 PolarHBondContact O-N 3.47Å; M43-I46 HydrophobicContact SD-CD1 4.39Å; M43-G47 PolarHBondContact O-N 3.28Å; M43-R238 PolarHBondContact SD-NH1 3.22Å; M43-R238 PolarHBondContact SD-NH2 3.14Å; M43-S356 WeakPolarHBondContact O-CB 3.48Å; M43-S356 PolarHBondContact O-OG 3.03Å; M43-I359 HydrophobicContact CG-CG2 4.5Å
44V87.6Confident89.4Confident50 Ų5042.4 Ų42.430%0.30323%0.231SC..Hα-helixtrans-63.6-40.1175.6167.10000110.8A42 I46 G47 V48A42-V44 PolarHBondContact O-N 3.33Å; V44-I46 PolarHBondContact O-N 3.37Å; V44-G47 CarbonylContact O-C 3.36Å; V44-G47 WeakPolarHBondContact O-CA 3.44Å; V44-G47 PolarHBondContact O-N 3.21Å; V44-G47 VanDerWaalsContact O-N 3.15Å; V44-V48 HydrophobicContact CG1-CG2 4.37Å; V44-V48 WeakPolarHBondContact O-CG2 3.4Å; V44-V48 PolarHBondContact O-N 3.01Å
45D90.7Very high89.6Confident51 Ų5145.1 Ų45.127%0.27325%0.245SC..Hα-helixtrans-62.5-45.6178.6-60.2-33.8000111.5L41 A42 M43 G47 V48 I49 Y97L41-D45 HydrophobicContact CB-CB 4.22Å; L41-D45 HydrophobicContact CD2-CB 4.18Å; A42-D45 WeakPolarHBondContact CB-OD2 3.34Å; A42-D45 PolarHBondContact N-OD2 3.2Å; A42-D45 WeakPolarHBondContact O-CB 3.5Å; A42-D45 PolarHBondContact O-N 2.97Å; M43-D45 VanDerWaalsContact C-N 3.33Å; D45-G47 VanDerWaalsContact C-N 3.32Å; D45-G47 PolarHBondContact O-N 2.96Å; D45-V48 PolarHBondContact O-N 3.4Å; D45-I49 WeakPolarHBondContact O-CG1 3.5Å; D45-I49 PolarHBondContact O-N 2.86Å; D45-Y97 HydrophobicContact CB-CD2 3.87Å; D45-Y97 HydrophobicContact CB-CE2 3.72Å
46I88.2Confident90Very high5 Ų544.8 Ų44.83%0.02624%0.244CC..Hα-helixtrans-57.5-48.1173.3-64.7170.7000109.5L41 A42 M43 V44 V48 I49 H50L41-I46 HydrophobicContact CB-CG1 4.07Å; L41-I46 HydrophobicContact CD1-CG1 4.4Å; A42-I46 PolarHBondContact O-N 3.33Å; A42-I46 VanDerWaalsContact O-N 3.15Å; M43-I46 PolarHBondContact O-N 3.47Å; M43-I46 HydrophobicContact SD-CD1 4.39Å; V44-I46 PolarHBondContact O-N 3.37Å; I46-V48 VanDerWaalsContact C-N 3.3Å; I46-V48 PolarHBondContact O-N 3.43Å; I46-I49 PolarHBondContact O-N 3.37Å; I46-H50 PolarHBondContact O-CD2 3.35Å; I46-H50 VanDerWaalsContact O-CD2 3.22Å; I46-H50 PolarHBondContact O-N 2.86Å
47G87.3Confident90.1Very high1 Ų141 Ų411%0.0123%0.226CC..Hα-helixtrans-56.1-43176.900000113M43 V44 D45 A51 S356M43-G47 PolarHBondContact O-N 3.28Å; V44-G47 CarbonylContact O-C 3.36Å; V44-G47 WeakPolarHBondContact O-CA 3.44Å; V44-G47 PolarHBondContact O-N 3.21Å; V44-G47 VanDerWaalsContact O-N 3.15Å; D45-G47 VanDerWaalsContact C-N 3.32Å; D45-G47 PolarHBondContact O-N 2.96Å; G47-A51 WeakPolarHBondContact O-CB 3.37Å; G47-A51 PolarHBondContact O-N 3.48Å; G47-S356 VanDerWaalsContact CA-OG 3.26Å; G47-S356 WeakPolarHBondContact CA-OG 3.43Å; G47-S356 PolarHBondContact N-OG 3.35Å
48V91.9Very high90Very high47 Ų4742.9 Ų42.929%0.28524%0.235SC..Hα-helixtrans-66.2-43.1177.4172.90000111.7V44 D45 I46 A51 L52 Y97 I101 L353V44-V48 HydrophobicContact CG1-CG2 4.37Å; V44-V48 WeakPolarHBondContact O-CG2 3.4Å; V44-V48 PolarHBondContact O-N 3.01Å; D45-V48 PolarHBondContact O-N 3.4Å; I46-V48 VanDerWaalsContact C-N 3.3Å; I46-V48 PolarHBondContact O-N 3.43Å; V48-A51 PolarHBondContact O-N 3.47Å; V48-L52 VanDerWaalsContact O-CB 3.31Å; V48-L52 WeakPolarHBondContact O-CB 3.19Å; V48-L52 PolarHBondContact O-N 3.32Å; V48-Y97 WeakPolarHBondContact CG1-OH 3.46Å; V48-I101 HydrophobicContact CG1-CD1 4.14Å; V48-L353 HydrophobicContact CB-CD2 4.46Å; V48-L353 HydrophobicContact CG2-CD2 3.9Å
49I92.4Very high90.1Very high0 Ų039 Ų390%022%0.218CC..Hα-helixtrans-58.1-51.3176.4-69.7162.9000110.1F30 L41 D45 I46 A51 L52 G53 Y97 F100 I101 Q104F30-I49 HydrophobicContact CZ-CG2 4.07Å; L41-I49 HydrophobicContact CD1-CD1 3.87Å; D45-I49 WeakPolarHBondContact O-CG1 3.5Å; D45-I49 PolarHBondContact O-N 2.86Å; I46-I49 PolarHBondContact O-N 3.37Å; I49-A51 PolarHBondContact O-N 2.89Å; I49-L52 PolarHBondContact O-N 2.71Å; I49-G53 PolarHBondContact O-N 3.22Å; I49-Y97 HydrophobicContact CD1-CD2 4Å; I49-Y97 HydrophobicContact CD1-CE2 4.24Å; I49-Y97 HydrophobicContact CG1-CD2 4.32Å; I49-Y97 HydrophobicContact CG1-CE2 4.1Å; I49-F100 HydrophobicContact CD1-CB 3.74Å; I49-F100 HydrophobicContact CD1-CG 4.32Å; I49-F100 HydrophobicContact CG1-CB 4.14Å; I49-F100 HydrophobicContact CG2-CB 4.13Å; I49-I101 HydrophobicContact CB-CD1 4.48Å; I49-I101 HydrophobicContact CG1-CD1 3.76Å; I49-I101 HydrophobicContact CG1-CG1 4.16Å; I49-Q104 HydrophobicContact CG2-CG 3.97Å; I49-Q104 WeakPolarHBondContact O-CG 3.31Å
50H89.6Confident90Very high58 Ų5833.9 Ų33.927%0.26919%0.186SC..Hα-helixtrans-62.1-45.1179-80.3-86000112.2F30 E34 I46 L52 G53 N54 P352F30-H50 AromaticContact CD1-CE1 3.75Å; F30-H50 AromaticContact CD1-NE2 3.85Å; F30-H50 AromaticContact CE1-CE1 3.52Å; F30-H50 AromaticContact CE1-NE2 3.47Å; F30-H50 WeakPolarHBondContact CE1-NE2 3.46Å; E34-H50 IonicContact OE1-CD2 3.79Å; E34-H50 IonicContact OE1-NE2 2.8Å; E34-H50 IonicContact OE2-NE2 3.45Å; I46-H50 PolarHBondContact O-CD2 3.35Å; I46-H50 VanDerWaalsContact O-CD2 3.22Å; I46-H50 PolarHBondContact O-N 2.86Å; H50-L52 PolarHBondContact O-N 3.49Å; H50-G53 PolarHBondContact O-N 3.11Å; H50-N54 WeakPolarHBondContact O-CB 3.15Å; H50-N54 VanDerWaalsContact O-CG 3.3Å; H50-N54 PolarHBondContact O-N 2.82Å; H50-N54 PolarHBondContact O-ND2 3.21Å; H50-N54 VanDerWaalsContact O-ND2 3.09Å; H50-P352 HydrophobicContact CB-CB 4.36Å
51A91Very high89.8Confident4 Ų430.4 Ų30.43%0.03317%0.165CC..Hα-helixtrans-62.8-43.3-179.400000112.4G47 V48 I49 G53 N54 L55 C349 L353G47-A51 WeakPolarHBondContact O-CB 3.37Å; G47-A51 PolarHBondContact O-N 3.48Å; V48-A51 PolarHBondContact O-N 3.47Å; I49-A51 PolarHBondContact O-N 2.89Å; A51-G53 VanDerWaalsContact C-N 3.35Å; A51-G53 PolarHBondContact O-N 3.37Å; A51-N54 CarbonylContact O-C 3.34Å; A51-N54 PolarHBondContact O-N 3.17Å; A51-L55 WeakPolarHBondContact O-CB 3.33Å; A51-L55 PolarHBondContact O-N 3.25Å; A51-C349 WeakPolarHBondContact CB-O 3.42Å; A51-C349 PolarHBondContact O-SG 3.45Å; A51-L353 HydrophobicContact CB-CD1 3.8Å; A51-L353 HydrophobicContact CB-CD2 3.49Å; A51-L353 VanDerWaalsContact CB-CD2 3.49Å; A51-L353 HydrophobicContact CB-CG 3.37Å
52L93.5Very high89.4Confident46 Ų4633.3 Ų33.324%0.24118%0.177CC..Hα-helixtrans-64-41.4176.4-176.163.9000111.4V48 I49 H50 N54 L55 W56 I101V48-L52 VanDerWaalsContact O-CB 3.31Å; V48-L52 WeakPolarHBondContact O-CB 3.19Å; V48-L52 PolarHBondContact O-N 3.32Å; I49-L52 PolarHBondContact O-N 2.71Å; H50-L52 PolarHBondContact O-N 3.49Å; L52-N54 VanDerWaalsContact C-N 3.31Å; L52-N54 PolarHBondContact O-N 3.29Å; L52-L55 HydrophobicContact CD1-CD2 4.22Å; L52-L55 WeakPolarHBondContact O-CB 3.26Å; L52-L55 PolarHBondContact O-N 3.28Å; L52-W56 PolarHBondContact O-N 3.27Å; L52-I101 HydrophobicContact CD2-CB 4.42Å; L52-I101 HydrophobicContact CD2-CD1 3.82Å; L52-I101 HydrophobicContact CD2-CG2 3.66Å
53G93.1Very high89.2Confident0 Ų035 Ų350%018%0.18CC..Hα-helixtrans-60.6-40173.400000113.3I49 H50 A51 W56 N57 Q104I49-G53 PolarHBondContact O-N 3.22Å; H50-G53 PolarHBondContact O-N 3.11Å; A51-G53 VanDerWaalsContact C-N 3.35Å; A51-G53 PolarHBondContact O-N 3.37Å; G53-W56 PolarHBondContact O-N 3.27Å; G53-N57 PolarHBondContact O-N 3.26Å; G53-Q104 VanDerWaalsContact CA-OE1 3.27Å
54N92.1Very high89.2Confident9 Ų933.4 Ų33.45%0.04817%0.172CC..Hα-helixtrans-73-31176.8-69-34.3000112.4H50 A51 L52 N57 M58 R107 Q348 C349H50-N54 WeakPolarHBondContact O-CB 3.15Å; H50-N54 VanDerWaalsContact O-CG 3.3Å; H50-N54 PolarHBondContact O-N 2.82Å; H50-N54 PolarHBondContact O-ND2 3.21Å; H50-N54 VanDerWaalsContact O-ND2 3.09Å; A51-N54 CarbonylContact O-C 3.34Å; A51-N54 PolarHBondContact O-N 3.17Å; L52-N54 VanDerWaalsContact C-N 3.31Å; L52-N54 PolarHBondContact O-N 3.29Å; N54-N57 PolarHBondContact O-N 3.44Å; N54-M58 WeakPolarHBondContact O-CB 3.38Å; N54-M58 PolarHBondContact O-N 3.21Å; N54-R107 PolarHBondContact OD1-NH2 2.88Å; N54-Q348 HydrophobicContact CB-CB 4.08Å; N54-Q348 WeakPolarHBondContact ND2-CB 3.33Å; N54-Q348 PolarHBondContact ND2-O 3.18Å; N54-C349 HydrophobicContact CB-CB 4.1Å
55L93.2Very high88.6Confident63 Ų6332.1 Ų32.133%0.3317%0.169SC..Hα-helixtrans-62.3-45.5169.1178.761.6000110.9A51 L52 M58 I59A51-L55 WeakPolarHBondContact O-CB 3.33Å; A51-L55 PolarHBondContact O-N 3.25Å; L52-L55 HydrophobicContact CD1-CD2 4.22Å; L52-L55 WeakPolarHBondContact O-CB 3.26Å; L52-L55 PolarHBondContact O-N 3.28Å; L55-M58 HydrophobicContact CD1-CE 3.77Å; L55-M58 WeakPolarHBondContact O-CB 3.41Å; L55-M58 PolarHBondContact O-N 2.92Å; L55-M58 VanDerWaalsContact O-N 3.16Å; L55-I59 HydrophobicContact CD1-CD1 4.32Å; L55-I59 HydrophobicContact CG-CD1 4.18Å; L55-I59 WeakPolarHBondContact O-CG1 3.49Å; L55-I59 PolarHBondContact O-N 3.5Å
56W95.1Very high88Confident76 Ų7633.6 Ų33.629%0.28818%0.176SC..Hα-helixtrans-62.5-41.4174.8-74.6120.9000112.6L52 G53 M58 I59 G60 Q104 T105 R107 L108L52-W56 PolarHBondContact O-N 3.27Å; G53-W56 PolarHBondContact O-N 3.27Å; W56-M58 VanDerWaalsContact C-N 3.32Å; W56-M58 PolarHBondContact O-N 3.07Å; W56-I59 HydrophobicContact CE3-CD1 4.08Å; W56-I59 HydrophobicContact CZ3-CD1 4.21Å; W56-I59 PolarHBondContact O-N 3.08Å; W56-G60 PolarHBondContact O-N 2.95Å; W56-Q104 VanDerWaalsContact CD1-O 3.28Å; W56-T105 HydrophobicContact CZ2-CG2 4.03Å; W56-R107 HydrophobicContact CB-CB 4.21Å; W56-L108 HydrophobicContact CE3-CB 4.48Å; W56-L108 HydrophobicContact CE3-CD1 3.87Å; W56-L108 HydrophobicContact CZ3-CD1 4.34Å
57N91.6Very high87.8Confident0 Ų036.6 Ų36.60%019%0.192CC..Hα-helixtrans-59.2-41.9171.2-831.8000112.2G53 N54 G60 A61 R107 F110 H111 W345G53-N57 PolarHBondContact O-N 3.26Å; N54-N57 PolarHBondContact O-N 3.44Å; N57-G60 PolarHBondContact O-N 3.22Å; N57-A61 WeakPolarHBondContact O-CB 3.31Å; N57-A61 PolarHBondContact O-N 3.49Å; N57-R107 PolarHBondContact ND2-NH2 2.79Å; N57-R107 VanDerWaalsContact OD1-CB 3.3Å; N57-R107 WeakPolarHBondContact OD1-CB 3.02Å; N57-R107 PolarHBondContact OD1-O 2.9Å; N57-F110 WeakPolarHBondContact OD1-CB 3.45Å; N57-H111 PolarHBondContact O-CE1 3.28Å; N57-H111 PolarHBondContact O-NE2 3.04Å; N57-H111 VanDerWaalsContact O-NE2 3.13Å; N57-W345 HydrophobicContact CB-CD2 3.63Å; N57-W345 HydrophobicContact CB-CE3 3.7Å; N57-W345 HydrophobicContact CB-CG 4.11Å; N57-W345 HydrophobicContact CB-CH2 4.36Å; N57-W345 HydrophobicContact CB-CZ2 4.24Å; N57-W345 HydrophobicContact CB-CZ3 4.08Å; N57-W345 WeakPolarHBondContact ND2-CH2 3.42Å; N57-W345 WeakPolarHBondContact ND2-CZ2 3.45Å; N57-W345 WeakPolarHBondContact ND2-CZ3 3.48Å
58M88.2Confident87.6Confident41 Ų4136.9 Ų36.920%0.20219%0.193CC..Hα-helixtrans-62.8-46.9178.6-172.6-175.276.400111.2N54 L55 W56 A61 F62 W345 L346N54-M58 WeakPolarHBondContact O-CB 3.38Å; N54-M58 PolarHBondContact O-N 3.21Å; L55-M58 HydrophobicContact CD1-CE 3.77Å; L55-M58 WeakPolarHBondContact O-CB 3.41Å; L55-M58 PolarHBondContact O-N 2.92Å; L55-M58 VanDerWaalsContact O-N 3.16Å; W56-M58 VanDerWaalsContact C-N 3.32Å; W56-M58 PolarHBondContact O-N 3.07Å; M58-A61 PolarHBondContact O-N 3.49Å; M58-F62 HydrophobicContact CG-CE2 4.07Å; M58-F62 WeakPolarHBondContact O-CD2 3.27Å; M58-W345 HydrophobicContact CB-CB 3.87Å; M58-W345 HydrophobicContact CG-CB 4.36Å; M58-L346 HydrophobicContact SD-CB 4.24Å; M58-L346 HydrophobicContact SD-CD1 4.11Å
59I89Confident86.8Confident59 Ų5935.3 Ų35.330%0.30318%0.183SC..Hα-helixtrans-62.5-45.8177-63.8166.9000110.2L55 W56 A61 F62 L63 L108L55-I59 HydrophobicContact CD1-CD1 4.32Å; L55-I59 HydrophobicContact CG-CD1 4.18Å; L55-I59 WeakPolarHBondContact O-CG1 3.49Å; L55-I59 PolarHBondContact O-N 3.5Å; W56-I59 HydrophobicContact CE3-CD1 4.08Å; W56-I59 HydrophobicContact CZ3-CD1 4.21Å; W56-I59 PolarHBondContact O-N 3.08Å; I59-A61 VanDerWaalsContact C-N 3.27Å; I59-A61 PolarHBondContact O-N 3.45Å; I59-F62 PolarHBondContact O-N 2.89Å; I59-F62 VanDerWaalsContact O-N 3.13Å; I59-L63 HydrophobicContact CG2-CD1 4.07Å; I59-L63 HydrophobicContact CG2-CG 4.3Å; I59-L63 PolarHBondContact O-N 2.93Å; I59-L108 HydrophobicContact CB-CD1 4.07Å; I59-L108 HydrophobicContact CG2-CD1 3.75Å
60G87.5Confident86.4Confident1 Ų140.7 Ų40.71%0.0121%0.211CC..Hα-helixtrans-57.7-38.717800000112.8W56 N57 F62 L63 I64 L108 H111W56-G60 PolarHBondContact O-N 2.95Å; N57-G60 PolarHBondContact O-N 3.22Å; G60-F62 VanDerWaalsContact C-N 3.28Å; G60-F62 PolarHBondContact O-N 3.09Å; G60-L63 PolarHBondContact O-N 3.5Å; G60-I64 WeakPolarHBondContact O-CB 3.16Å; G60-I64 PolarHBondContact O-N 2.81Å; G60-L108 VanDerWaalsContact CA-O 3.27Å; G60-L108 WeakPolarHBondContact CA-O 3.25Å; G60-H111 VanDerWaalsContact CA-NE2 3.32Å; G60-H111 WeakPolarHBondContact CA-NE2 3.4Å
61A83.5Confident86.3Confident23 Ų2344.1 Ų44.119%0.1922%0.222CC..Hα-helixtrans-63.3-32.9178.500000112.6N57 M58 I59 H111N57-A61 WeakPolarHBondContact O-CB 3.31Å; N57-A61 PolarHBondContact O-N 3.49Å; M58-A61 PolarHBondContact O-N 3.49Å; I59-A61 VanDerWaalsContact C-N 3.27Å; I59-A61 PolarHBondContact O-N 3.45Å; A61-H111 PolarHBondContact N-CE1 3.48Å; A61-H111 PolarHBondContact N-NE2 3.38Å
62F80.3Confident86.1Confident83 Ų8344 Ų4436%0.36422%0.221SC..Hα-helixtrans-77.2-41.5173.6-68.1-69.2000112.1M58 I59 G60 L199 A342M58-F62 HydrophobicContact CG-CE2 4.07Å; M58-F62 WeakPolarHBondContact O-CD2 3.27Å; I59-F62 PolarHBondContact O-N 2.89Å; I59-F62 VanDerWaalsContact O-N 3.13Å; G60-F62 VanDerWaalsContact C-N 3.28Å; G60-F62 PolarHBondContact O-N 3.09Å; F62-L199 HydrophobicContact CD1-CD1 4.28Å; F62-L199 HydrophobicContact CE1-CD1 4.5Å; F62-A342 HydrophobicContact CE1-CB 4.49Å; F62-A342 HydrophobicContact CE2-CB 4.3Å; F62-A342 HydrophobicContact CZ-CB 3.82Å
63L84.5Confident85.8Confident74 Ų7441.8 Ų41.839%0.38721%0.21SC..Hα-helixtrans-67.6-39.9-179.2-67.4-175.8000112.2I59 G60 G65 L66 L67 L108I59-L63 HydrophobicContact CG2-CD1 4.07Å; I59-L63 HydrophobicContact CG2-CG 4.3Å; I59-L63 PolarHBondContact O-N 2.93Å; G60-L63 PolarHBondContact O-N 3.5Å; L63-G65 PolarHBondContact O-N 2.89Å; L63-L66 WeakPolarHBondContact O-CB 3.47Å; L63-L66 PolarHBondContact O-N 2.85Å; L63-L67 WeakPolarHBondContact O-CG 3.06Å; L63-L67 PolarHBondContact O-N 3.19Å; L63-L108 HydrophobicContact CD1-CD1 3.98Å; L63-L108 HydrophobicContact CD1-CD2 4.33Å; L63-L108 HydrophobicContact CD1-CG 4.48Å
64I82.9Confident85.9Confident11 Ų1144 Ų446%0.05622%0.219CC..Hα-helixtrans-62.4-35-175.8-158.269.2000111.5G60 L66 L67 I68 C76 H111 L115G60-I64 WeakPolarHBondContact O-CB 3.16Å; G60-I64 PolarHBondContact O-N 2.81Å; I64-L66 VanDerWaalsContact C-N 3.33Å; I64-L66 PolarHBondContact O-N 3.3Å; I64-L67 HydrophobicContact CD1-CD1 4.42Å; I64-L67 PolarHBondContact O-N 3.1Å; I64-I68 HydrophobicContact CG1-CD1 4.32Å; I64-I68 HydrophobicContact CG1-CG1 4.43Å; I64-I68 WeakPolarHBondContact O-CD1 3.21Å; I64-I68 WeakPolarHBondContact O-CG1 3.29Å; I64-I68 PolarHBondContact O-N 3.38Å; I64-C76 HydrophobicContact CD1-CB 3.91Å; I64-H111 HydrophobicContact CG1-CB 4.49Å; I64-H111 HydrophobicContact CG2-CB 4.47Å; I64-L115 HydrophobicContact CD1-CD1 4.23Å; I64-L115 HydrophobicContact CD1-CD2 4.36Å; I64-L115 HydrophobicContact CG1-CD1 4.23Å; I64-L115 HydrophobicContact CG1-CD2 3.78Å; I64-L115 HydrophobicContact CG1-CG 4.22Å
65G74.1Confident85.9Confident22 Ų2247.2 Ų47.223%0.22724%0.236CC..Hα-helixtrans-58.5-44.2173.700000112.3L63 D69L63-G65 PolarHBondContact O-N 2.89Å; G65-D69 PolarHBondContact O-N 3.11Å
66L78.7Confident85.9Confident82 Ų8244.3 Ų44.343%0.42922%0.221SC..Hα-helixtrans-69.7-36.6176.2-61.4171.6000112.2L63 I64 D69 I70L63-L66 WeakPolarHBondContact O-CB 3.47Å; L63-L66 PolarHBondContact O-N 2.85Å; I64-L66 VanDerWaalsContact C-N 3.33Å; I64-L66 PolarHBondContact O-N 3.3Å; L66-D69 WeakPolarHBondContact O-CB 3.31Å; L66-D69 PolarHBondContact O-N 3.22Å; L66-I70 WeakPolarHBondContact O-CG1 3.49Å; L66-I70 PolarHBondContact O-N 3.15Å; L66-I70 VanDerWaalsContact O-N 3.14Å
67L84.5Confident85.9Confident68 Ų6840.8 Ų40.836%0.35621%0.207SC..Hα-helixtrans-70.6-37.8-179.9-67.7175000112.3L63 I64 D69 I70 Y71L63-L67 WeakPolarHBondContact O-CG 3.06Å; L63-L67 PolarHBondContact O-N 3.19Å; I64-L67 HydrophobicContact CD1-CD1 4.42Å; I64-L67 PolarHBondContact O-N 3.1Å; L67-D69 PolarHBondContact O-N 3.05Å; L67-I70 PolarHBondContact O-N 3.27Å; L67-Y71 HydrophobicContact CB-CD2 4.41Å; L67-Y71 HydrophobicContact CD2-CD2 3.77Å; L67-Y71 HydrophobicContact CD2-CE2 3.61Å; L67-Y71 WeakPolarHBondContact O-CB 3.44Å; L67-Y71 PolarHBondContact O-N 2.9Å
68I82.2Confident86.2Confident8 Ų842.9 Ų42.94%0.04122%0.218CC..Hα-helixtrans-59.5-41.2174.8-69161.8000110I64 G72 L73 C76 L115 I118I64-I68 HydrophobicContact CG1-CD1 4.32Å; I64-I68 HydrophobicContact CG1-CG1 4.43Å; I64-I68 WeakPolarHBondContact O-CD1 3.21Å; I64-I68 WeakPolarHBondContact O-CG1 3.29Å; I64-I68 PolarHBondContact O-N 3.38Å; I68-G72 CarbonylContact O-C 3.1Å; I68-G72 WeakPolarHBondContact O-CA 3.36Å; I68-G72 PolarHBondContact O-N 3.43Å; I68-L73 HydrophobicContact CD1-CD1 4.26Å; I68-L73 HydrophobicContact CG1-CD1 4.2Å; I68-L73 HydrophobicContact CG2-CB 4.39Å; I68-L73 HydrophobicContact CG2-CD1 4.46Å; I68-C76 VanDerWaalsContact CA-SG 3.58Å; I68-C76 HydrophobicContact CG1-CB 3.97Å; I68-C76 PolarHBondContact N-SG 3.34Å; I68-C76 VanDerWaalsContact N-SG 3.38Å; I68-L115 HydrophobicContact CD1-CD2 3.49Å; I68-L115 VanDerWaalsContact CD1-CD2 3.49Å; I68-L115 HydrophobicContact CG1-CD2 3.76Å; I68-I118 HydrophobicContact CD1-CD1 3.69Å
69D76.7Confident86.6Confident14 Ų1444 Ų448%0.07523%0.23CC..Hα-helixtrans-63.8-42.9178.3-90.411000112.5G65 L66 L67 H187 L189 T194 L197G65-D69 PolarHBondContact O-N 3.11Å; L66-D69 WeakPolarHBondContact O-CB 3.31Å; L66-D69 PolarHBondContact O-N 3.22Å; L67-D69 PolarHBondContact O-N 3.05Å; D69-H187 IonicContact OD1-CE1 3.18Å; D69-L189 WeakPolarHBondContact OD1-CD1 3.47Å; D69-T194 HydrophobicContact CB-CG2 3.33Å; D69-T194 WeakPolarHBondContact O-CG2 3.2Å; D69-T194 WeakPolarHBondContact OD2-CA 3.5Å; D69-L197 WeakPolarHBondContact OD2-CD1 3.27Å
70I83.4Confident86.9Confident113 Ų11341.2 Ų41.258%0.57922%0.216SC*.Hα-helixtrans-81.6-48.1-175.9-64.6166.3000112.2L66 L67L66-I70 WeakPolarHBondContact O-CG1 3.49Å; L66-I70 PolarHBondContact O-N 3.15Å; L66-I70 VanDerWaalsContact O-N 3.14Å; L67-I70 PolarHBondContact O-N 3.27Å
71Y86.8Confident87.4Confident130 Ų13041.1 Ų41.151%0.5122%0.215SC..Hα-helixtrans-104.2-17.9-168.8-63.8-69.8000113.4L67 I75L67-Y71 HydrophobicContact CB-CD2 4.41Å; L67-Y71 HydrophobicContact CD2-CD2 3.77Å; L67-Y71 HydrophobicContact CD2-CE2 3.61Å; L67-Y71 WeakPolarHBondContact O-CB 3.44Å; L67-Y71 PolarHBondContact O-N 2.9Å; Y71-I75 WeakPolarHBondContact O-CD1 3.39Å
72G86.5Confident88.1Confident1 Ų142.7 Ų42.71%0.0122%0.222CC..  trans93.8163.4-173.200000113.1I68 C76 E185 H187I68-G72 CarbonylContact O-C 3.1Å; I68-G72 WeakPolarHBondContact O-CA 3.36Å; I68-G72 PolarHBondContact O-N 3.43Å; G72-C76 PolarHBondContact O-N 3.13Å; G72-C76 PolarHBondContact O-SG 3.19Å; G72-E185 WeakPolarHBondContact CA-OE1 3.47Å; G72-H187 WeakPolarHBondContact CA-O 3.39Å
73L89Confident89Confident0 Ų039.7 Ų39.70%021%0.212CC..Hα-helixtrans-71-35.9-172.9-177.757.9000112.2I68 C76 L77 L115 I118 F119 E185 H187I68-L73 HydrophobicContact CD1-CD1 4.26Å; I68-L73 HydrophobicContact CG1-CD1 4.2Å; I68-L73 HydrophobicContact CG2-CB 4.39Å; I68-L73 HydrophobicContact CG2-CD1 4.46Å; L73-C76 WeakPolarHBondContact O-CB 3.46Å; L73-C76 PolarHBondContact O-N 3.4Å; L73-L77 HydrophobicContact CG-CD1 4.33Å; L73-L77 WeakPolarHBondContact O-CG 3.18Å; L73-L77 PolarHBondContact O-N 3.14Å; L73-L115 HydrophobicContact CD1-CB 4.27Å; L73-L115 HydrophobicContact CD1-CD2 3.58Å; L73-I118 HydrophobicContact CD1-CB 4.46Å; L73-I118 HydrophobicContact CD1-CG2 4.17Å; L73-I118 HydrophobicContact CD2-CG2 4.08Å; L73-F119 HydrophobicContact CD2-CB 3.71Å; L73-F119 HydrophobicContact CD2-CD2 3.54Å; L73-F119 HydrophobicContact CD2-CG 4.01Å; L73-F119 HydrophobicContact CG-CD2 4.14Å; L73-E185 PolarHBondContact N-OE1 3.08Å; L73-H187 HydrophobicContact CB-CB 4.31Å
74K93.5Very high89.6Confident45 Ų4536.2 Ų36.220%0.19619%0.193CC..Hα-helixtrans-66-43.5-178.5-172.6174.6175.51570112.1C76 L77 I78 V179 I180 L183 E185K74-C76 VanDerWaalsContact C-N 3.27Å; K74-C76 PolarHBondContact O-N 3.21Å; K74-L77 PolarHBondContact O-N 2.87Å; K74-I78 HydrophobicContact CG-CD1 4.25Å; K74-I78 WeakPolarHBondContact O-CG1 3.36Å; K74-I78 PolarHBondContact O-N 3.33Å; K74-V179 VanDerWaalsContact CE-O 3.23Å; K74-V179 WeakPolarHBondContact CE-O 3.42Å; K74-V179 HydrophobicContact CG-CG1 4.44Å; K74-I180 WeakPolarHBondContact CE-O 3.36Å; K74-I180 PolarHBondContact NZ-O 3.21Å; K74-L183 WeakPolarHBondContact CE-O 3.23Å; K74-L183 PolarHBondContact NZ-O 3.08Å; K74-E185 WeakPolarHBondContact CB-OE2 3.14Å; K74-E185 PolarHBondContact N-OE1 3.38Å
75I93.7Very high90.3Very high77 Ų7735.8 Ų35.840%0.39519%0.192SC..Hα-helixtrans-63.5-38.1177.2-61.7-173.8000110.2Y71 I78 S79Y71-I75 WeakPolarHBondContact O-CD1 3.39Å; I75-I78 PolarHBondContact O-N 2.79Å; I75-S79 WeakPolarHBondContact O-CB 3.42Å; I75-S79 PolarHBondContact O-N 3.42Å; I75-S79 PolarHBondContact O-OG 2.88Å
76C92.9Very high91.5Very high3 Ų338.2 Ų38.22%0.0220%0.199CC..Hα-helixtrans-65.1-42175-67.70000112.4I64 I68 G72 L73 K74 S79 S80 L115I64-C76 HydrophobicContact CD1-CB 3.91Å; I68-C76 VanDerWaalsContact CA-SG 3.58Å; I68-C76 HydrophobicContact CG1-CB 3.97Å; I68-C76 PolarHBondContact N-SG 3.34Å; I68-C76 VanDerWaalsContact N-SG 3.38Å; G72-C76 PolarHBondContact O-N 3.13Å; G72-C76 PolarHBondContact O-SG 3.19Å; L73-C76 WeakPolarHBondContact O-CB 3.46Å; L73-C76 PolarHBondContact O-N 3.4Å; K74-C76 VanDerWaalsContact C-N 3.27Å; K74-C76 PolarHBondContact O-N 3.21Å; C76-S79 PolarHBondContact O-N 2.86Å; C76-S80 VanDerWaalsContact O-CB 3.23Å; C76-S80 WeakPolarHBondContact O-CB 3.26Å; C76-S80 PolarHBondContact O-N 3.26Å; C76-L115 HydrophobicContact CB-CD1 4.17Å; C76-L115 HydrophobicContact CB-CD2 3.68Å; C76-L115 WeakPolarHBondContact O-CD1 3.3Å
77L95.4Very high92.4Very high1 Ų134.9 Ų34.91%0.00518%0.18CC..Hα-helixtrans-60.1-46174.1-77.8165.3000111.8L73 K74 S80 A81 F112 L115 T116 F119 V179 L183L73-L77 HydrophobicContact CG-CD1 4.33Å; L73-L77 WeakPolarHBondContact O-CG 3.18Å; L73-L77 PolarHBondContact O-N 3.14Å; K74-L77 PolarHBondContact O-N 2.87Å; L77-S80 PolarHBondContact O-N 3.34Å; L77-A81 WeakPolarHBondContact O-CB 3.42Å; L77-A81 PolarHBondContact O-N 3.28Å; L77-F112 HydrophobicContact CB-CE2 4.22Å; L77-F112 HydrophobicContact CD2-CD2 3.92Å; L77-F112 HydrophobicContact CD2-CE2 3.6Å; L77-F112 HydrophobicContact CD2-CG 4.48Å; L77-F112 HydrophobicContact CD2-CZ 3.92Å; L77-L115 HydrophobicContact CD2-CB 3.45Å; L77-L115 VanDerWaalsContact CD2-CB 3.45Å; L77-L115 HydrophobicContact CD2-CD1 4.37Å; L77-L115 HydrophobicContact CG-CB 4.01Å; L77-T116 HydrophobicContact CD2-CG2 4.12Å; L77-F119 HydrophobicContact CD1-CD2 4.03Å; L77-V179 HydrophobicContact CB-CG1 3.8Å; L77-L183 HydrophobicContact CD1-CD1 4.09Å
78I97.4Very high93.1Very high45 Ų4531.7 Ų31.723%0.23116%0.164CC..Hα-helixtrans-60.6-50.4176.4-69166.8000110.4K74 I75 S80 A81 V82 L176 V179 I180K74-I78 HydrophobicContact CG-CD1 4.25Å; K74-I78 WeakPolarHBondContact O-CG1 3.36Å; K74-I78 PolarHBondContact O-N 3.33Å; I75-I78 PolarHBondContact O-N 2.79Å; I78-S80 VanDerWaalsContact C-N 3.29Å; I78-S80 PolarHBondContact O-N 2.98Å; I78-A81 PolarHBondContact O-N 3.27Å; I78-V82 HydrophobicContact CG2-CG2 4.48Å; I78-V82 WeakPolarHBondContact O-CG2 3.27Å; I78-V82 PolarHBondContact O-N 3.48Å; I78-L176 HydrophobicContact CB-CD1 4.26Å; I78-L176 HydrophobicContact CG1-CD1 4.08Å; I78-L176 HydrophobicContact CG2-CD1 3.74Å; I78-V179 HydrophobicContact CD1-CG1 4.49Å; I78-V179 HydrophobicContact CG1-CG1 3.69Å; I78-I180 HydrophobicContact CD1-CG1 3.83Å; I78-I180 HydrophobicContact CG1-CG1 4.19Å
79S95.9Very high93.8Very high63 Ų6335.3 Ų35.344%0.44118%0.18SC..Hα-helixtrans-61.1-40.2-179-570000111.5I75 C76 V82 S83I75-S79 WeakPolarHBondContact O-CB 3.42Å; I75-S79 PolarHBondContact O-N 3.42Å; I75-S79 PolarHBondContact O-OG 2.88Å; C76-S79 PolarHBondContact O-N 2.86Å; S79-V82 PolarHBondContact O-N 2.64Å; S79-S83 VanDerWaalsContact O-CB 3.3Å; S79-S83 WeakPolarHBondContact O-CB 3.48Å; S79-S83 PolarHBondContact O-N 2.92Å
80S96.7Very high94.8Very high1 Ų136.1 Ų36.11%0.00719%0.186CC..Hα-helixtrans-66.7-42.3177.4-177.70000112.5C76 L77 I78 S83 T84 G109 H111 F112C76-S80 VanDerWaalsContact O-CB 3.23Å; C76-S80 WeakPolarHBondContact O-CB 3.26Å; C76-S80 PolarHBondContact O-N 3.26Å; L77-S80 PolarHBondContact O-N 3.34Å; I78-S80 VanDerWaalsContact C-N 3.29Å; I78-S80 PolarHBondContact O-N 2.98Å; S80-S83 PolarHBondContact O-N 2.72Å; S80-T84 VanDerWaalsContact O-CB 3.3Å; S80-T84 WeakPolarHBondContact O-CB 3.49Å; S80-T84 PolarHBondContact O-N 3.17Å; S80-T84 PolarHBondContact O-OG1 3.18Å; S80-G109 VanDerWaalsContact CA-O 3.24Å; S80-G109 WeakPolarHBondContact CA-O 2.88Å; S80-G109 VanDerWaalsContact CB-O 3.25Å; S80-G109 WeakPolarHBondContact CB-O 2.91Å; S80-G109 PolarHBondContact OG-O 2.82Å; S80-H111 PolarHBondContact OG-N 2.95Å; S80-F112 WeakPolarHBondContact OG-CA 3.34Å; S80-F112 PolarHBondContact OG-N 2.91Å
81A97.7Very high95.5Very high0 Ų030.7 Ų30.70%016%0.158CC..Hα-helixtrans-63.4-45.4175.900000111.5L77 I78 T84 S85 F112 I175L77-A81 WeakPolarHBondContact O-CB 3.42Å; L77-A81 PolarHBondContact O-N 3.28Å; I78-A81 PolarHBondContact O-N 3.27Å; A81-T84 PolarHBondContact O-N 3.38Å; A81-S85 PolarHBondContact O-N 3.41Å; A81-S85 PolarHBondContact O-OG 3.23Å; A81-F112 HydrophobicContact CB-CD2 4.25Å; A81-F112 HydrophobicContact CB-CE2 4.15Å; A81-I175 HydrophobicContact CB-CB 4.41Å; A81-I175 HydrophobicContact CB-CG2 3.7Å
82V98.2Very high96Very high56 Ų5624.8 Ų24.834%0.33914%0.136SC..Hα-helixtrans-61.2-48.3176.1172.30000110.9I78 S79 T84 S85 L86 L172I78-V82 HydrophobicContact CG2-CG2 4.48Å; I78-V82 WeakPolarHBondContact O-CG2 3.27Å; I78-V82 PolarHBondContact O-N 3.48Å; S79-V82 PolarHBondContact O-N 2.64Å; V82-T84 VanDerWaalsContact C-N 3.32Å; V82-T84 PolarHBondContact O-N 3.23Å; V82-S85 PolarHBondContact O-N 2.93Å; V82-L86 HydrophobicContact CG1-CD1 3.95Å; V82-L86 HydrophobicContact CG1-CG 4.35Å; V82-L86 WeakPolarHBondContact O-CB 3.49Å; V82-L86 WeakPolarHBondContact O-CG 3.33Å; V82-L86 PolarHBondContact O-N 3.23Å; V82-L172 HydrophobicContact CG2-CD1 4.06Å
83S97.6Very high96.5Very high20 Ų2027.9 Ų27.914%0.1416%0.158CC..Hα-helixtrans-61.8-40.3178.9-161.20000112S79 S80 L86 Y87 F106S79-S83 VanDerWaalsContact O-CB 3.3Å; S79-S83 WeakPolarHBondContact O-CB 3.48Å; S79-S83 PolarHBondContact O-N 2.92Å; S80-S83 PolarHBondContact O-N 2.72Å; S83-L86 PolarHBondContact O-N 3.19Å; S83-Y87 WeakPolarHBondContact O-CB 3.35Å; S83-Y87 PolarHBondContact O-N 2.97Å; S83-F106 PolarHBondContact OG-O 3.22Å
84T97.7Very high96.8Very high0 Ų028 Ų280%016%0.159CC..Hα-helixtrans-63.4-45176.2-59.60000111.3S80 A81 V82 Y87 Y88 F110 T171S80-T84 VanDerWaalsContact O-CB 3.3Å; S80-T84 WeakPolarHBondContact O-CB 3.49Å; S80-T84 PolarHBondContact O-N 3.17Å; S80-T84 PolarHBondContact O-OG1 3.18Å; A81-T84 PolarHBondContact O-N 3.38Å; V82-T84 VanDerWaalsContact C-N 3.32Å; V82-T84 PolarHBondContact O-N 3.23Å; T84-Y87 WeakPolarHBondContact O-CB 3.35Å; T84-Y87 PolarHBondContact O-N 3.46Å; T84-Y88 HydrophobicContact CG2-CD2 4.22Å; T84-Y88 HydrophobicContact CG2-CE1 4.03Å; T84-Y88 HydrophobicContact CG2-CE2 3.55Å; T84-Y88 VanDerWaalsContact CG2-CZ 3.42Å; T84-Y88 WeakPolarHBondContact CG2-OH 3.5Å; T84-Y88 VanDerWaalsContact O-CG 3.31Å; T84-Y88 PolarHBondContact O-N 2.82Å; T84-F110 HydrophobicContact CG2-CD2 3.96Å; T84-F110 HydrophobicContact CG2-CE2 3.82Å; T84-T171 HydrophobicContact CG2-CG2 4.34Å
85S98.3Very high96.8Very high3 Ų333.1 Ų33.12%0.02118%0.181CC..Hα-helixtrans-67.3-39.2177-730000112.5A81 V82 Y87 Y88 F89 S168 L172A81-S85 PolarHBondContact O-N 3.41Å; A81-S85 PolarHBondContact O-OG 3.23Å; V82-S85 PolarHBondContact O-N 2.93Å; S85-Y87 VanDerWaalsContact C-N 3.33Å; S85-Y88 PolarHBondContact O-N 3.2Å; S85-F89 WeakPolarHBondContact O-CB 3.45Å; S85-F89 PolarHBondContact O-N 3.19Å; S85-S168 WeakPolarHBondContact O-CB 3.28Å; S85-S168 PolarHBondContact O-OG 3.43Å; S85-S168 PolarHBondContact OG-O 3.34Å; S85-L172 WeakPolarHBondContact OG-CB 3.5Å; S85-L172 PolarHBondContact OG-N 3.39Å
86L98.2Very high96.9Very high72 Ų7230.6 Ų30.638%0.37717%0.174SC..Hα-helixtrans-62.1-42.2173-72.4175.3000111.3V82 S83 Y88 F89 C90 F106V82-L86 HydrophobicContact CG1-CD1 3.95Å; V82-L86 HydrophobicContact CG1-CG 4.35Å; V82-L86 WeakPolarHBondContact O-CB 3.49Å; V82-L86 WeakPolarHBondContact O-CG 3.33Å; V82-L86 PolarHBondContact O-N 3.23Å; S83-L86 PolarHBondContact O-N 3.19Å; L86-Y88 PolarHBondContact O-N 2.72Å; L86-F89 PolarHBondContact O-N 3.21Å; L86-C90 WeakPolarHBondContact O-CB 3.39Å; L86-C90 PolarHBondContact O-N 2.94Å; L86-C90 PolarHBondContact O-SG 2.83Å; L86-F106 HydrophobicContact CB-CD1 3.7Å; L86-F106 HydrophobicContact CB-CE1 3.8Å; L86-F106 HydrophobicContact CB-CG 4.11Å; L86-F106 HydrophobicContact CB-CZ 4.29Å; L86-F106 HydrophobicContact CD1-CD1 4.12Å; L86-F106 HydrophobicContact CD1-CE1 3.69Å; L86-F106 HydrophobicContact CD1-CZ 4.49Å; L86-F106 HydrophobicContact CG-CE1 4.35Å
87Y98.3Very high97Very high12 Ų1233.1 Ų33.15%0.04718%0.183CC..Hα-helixtrans-54.7-53.2171.6171.3-118.3000111.1T26 F30 S83 T84 S85 F89 C90 I91 A103 R107 F110T26-Y87 HydrophobicContact CG2-CE1 4.39Å; F30-Y87 WeakPolarHBondContact CE2-OH 3.2Å; S83-Y87 WeakPolarHBondContact O-CB 3.35Å; S83-Y87 PolarHBondContact O-N 2.97Å; T84-Y87 WeakPolarHBondContact O-CB 3.35Å; T84-Y87 PolarHBondContact O-N 3.46Å; S85-Y87 VanDerWaalsContact C-N 3.33Å; Y87-F89 VanDerWaalsContact C-N 3.3Å; Y87-F89 PolarHBondContact O-N 3.12Å; Y87-C90 PolarHBondContact O-N 3.39Å; Y87-I91 HydrophobicContact CD2-CG2 3.88Å; Y87-I91 HydrophobicContact CE1-CD1 4.07Å; Y87-I91 HydrophobicContact CE2-CG2 3.42Å; Y87-I91 VanDerWaalsContact CE2-CG2 3.42Å; Y87-I91 WeakPolarHBondContact O-CG1 3.37Å; Y87-I91 PolarHBondContact O-N 3.38Å; Y87-A103 WeakPolarHBondContact CD2-O 3.37Å; Y87-R107 HydrophobicContact CD1-CG 4.42Å; Y87-R107 HydrophobicContact CD2-CG 3.88Å; Y87-R107 HydrophobicContact CE1-CG 4.39Å; Y87-R107 HydrophobicContact CE2-CG 3.81Å; Y87-R107 HydrophobicContact CG-CG 4.19Å; Y87-F110 HydrophobicContact CD1-CD2 4.31Å; Y87-F110 HydrophobicContact CD1-CE2 4.12Å; Y87-F110 HydrophobicContact CE1-CE2 4.37Å
88Y98.3Very high97Very high1 Ų141.9 Ų41.90%0.00422%0.216CC..Hα-helixtrans-59.6-38.2179.1-64.6-14.6000113.3G22 V23 T26 T84 S85 L86 I91 A92 F110 T171G22-Y88 PolarHBondContact O-OH 3.31Å; V23-Y88 WeakPolarHBondContact CA-OH 3.17Å; V23-Y88 WeakPolarHBondContact CG2-OH 3.35Å; V23-Y88 PolarHBondContact N-OH 3.43Å; T26-Y88 HydrophobicContact CG2-CD1 4.09Å; T26-Y88 HydrophobicContact CG2-CE1 4Å; T26-Y88 VanDerWaalsContact OG1-CD1 3.27Å; T26-Y88 WeakPolarHBondContact OG1-CD1 3.44Å; T26-Y88 WeakPolarHBondContact OG1-CE1 3.5Å; T84-Y88 HydrophobicContact CG2-CD2 4.22Å; T84-Y88 HydrophobicContact CG2-CE1 4.03Å; T84-Y88 HydrophobicContact CG2-CE2 3.55Å; T84-Y88 VanDerWaalsContact CG2-CZ 3.42Å; T84-Y88 WeakPolarHBondContact CG2-OH 3.5Å; T84-Y88 VanDerWaalsContact O-CG 3.31Å; T84-Y88 PolarHBondContact O-N 2.82Å; S85-Y88 PolarHBondContact O-N 3.2Å; L86-Y88 PolarHBondContact O-N 2.72Å; Y88-I91 HydrophobicContact CD1-CD1 4.24Å; Y88-I91 VanDerWaalsContact O-CG1 3.23Å; Y88-I91 WeakPolarHBondContact O-CG1 3.48Å; Y88-A92 WeakPolarHBondContact O-CB 3.39Å; Y88-A92 PolarHBondContact O-N 3.42Å; Y88-F110 AromaticContact CE1-CE2 3.93Å; Y88-F110 HydrophobicContact CE1-CE2 3.93Å; Y88-T171 HydrophobicContact CD2-CG2 4.44Å; Y88-T171 HydrophobicContact CE2-CG2 4.04Å
89F98.3Very high96.9Very high85 Ų8541.5 Ų41.537%0.37322%0.218SC..Hα-helixtrans-66.6-46.3175.9171.2-100.1000111.8S85 L86 Y87 A92 S93 F165S85-F89 WeakPolarHBondContact O-CB 3.45Å; S85-F89 PolarHBondContact O-N 3.19Å; L86-F89 PolarHBondContact O-N 3.21Å; Y87-F89 VanDerWaalsContact C-N 3.3Å; Y87-F89 PolarHBondContact O-N 3.12Å; F89-A92 PolarHBondContact O-N 3.37Å; F89-S93 PolarHBondContact O-N 3.34Å; F89-S93 VanDerWaalsContact O-N 3.14Å; F89-S93 PolarHBondContact O-OG 2.83Å; F89-F165 AromaticContact CD2-CD2 3.56Å; F89-F165 HydrophobicContact CD2-CD2 3.56Å; F89-F165 AromaticContact CD2-CE2 3.45Å; F89-F165 HydrophobicContact CD2-CE2 3.45Å; F89-F165 VanDerWaalsContact CD2-CE2 3.45Å; F89-F165 AromaticContact CE2-CD2 3.84Å; F89-F165 HydrophobicContact CE2-CD2 3.84Å; F89-F165 AromaticContact CE2-CE2 3.49Å; F89-F165 HydrophobicContact CE2-CE2 3.49Å; F89-F165 VanDerWaalsContact CE2-CE2 3.49Å
90C98Very high96.9Very high30 Ų3038.5 Ų38.520%0.20320%0.197CC..Hα-helixtrans-65.2-42-179-730000111.8L86 Y87 S93 S94 A103 F106L86-C90 WeakPolarHBondContact O-CB 3.39Å; L86-C90 PolarHBondContact O-N 2.94Å; L86-C90 PolarHBondContact O-SG 2.83Å; Y87-C90 PolarHBondContact O-N 3.39Å; C90-S93 CarbonylContact O-C 3.52Å; C90-S93 PolarHBondContact O-N 2.92Å; C90-S94 WeakPolarHBondContact O-CB 3.4Å; C90-S94 PolarHBondContact O-N 3.44Å; C90-S94 PolarHBondContact O-OG 3.29Å; C90-A103 HydrophobicContact CB-CB 3.67Å; C90-F106 HydrophobicContact CB-CD2 4.4Å; C90-F106 HydrophobicContact CB-CE2 4.43Å; C90-F106 WeakPolarHBondContact SG-CE2 3.49Å
91I96.9Very high96.9Very high0 Ų039.4 Ų39.40%020%0.201CC..Hα-helixtrans-67.8-36.1177.363.1178.3000112.3T26 F30 Y87 Y88 S93 S94 F100 A103 Q164T26-I91 HydrophobicContact CG2-CD1 3.38Å; F30-I91 HydrophobicContact CD2-CD1 4.02Å; F30-I91 HydrophobicContact CE2-CB 4.41Å; F30-I91 HydrophobicContact CE2-CD1 4.44Å; F30-I91 HydrophobicContact CE2-CG2 4.01Å; Y87-I91 HydrophobicContact CD2-CG2 3.88Å; Y87-I91 HydrophobicContact CE1-CD1 4.07Å; Y87-I91 HydrophobicContact CE2-CG2 3.42Å; Y87-I91 VanDerWaalsContact CE2-CG2 3.42Å; Y87-I91 WeakPolarHBondContact O-CG1 3.37Å; Y87-I91 PolarHBondContact O-N 3.38Å; Y88-I91 HydrophobicContact CD1-CD1 4.24Å; Y88-I91 VanDerWaalsContact O-CG1 3.23Å; Y88-I91 WeakPolarHBondContact O-CG1 3.48Å; I91-S93 PolarHBondContact O-N 3.27Å; I91-S94 PolarHBondContact O-N 3.3Å; I91-F100 HydrophobicContact CB-CE1 4.45Å; I91-A103 HydrophobicContact CG2-CB 3.68Å; I91-Q164 HydrophobicContact CD1-CG 4.18Å; I91-Q164 HydrophobicContact CG1-CG 4.01Å
92A97.1Very high96.8Very high6 Ų645 Ų455%0.0523%0.23CC..Hα-helixtrans-59.4-38.8173.100000111.4Y88 F89 R161 Q164 F165Y88-A92 WeakPolarHBondContact O-CB 3.39Å; Y88-A92 PolarHBondContact O-N 3.42Å; F89-A92 PolarHBondContact O-N 3.37Å; A92-R161 WeakPolarHBondContact O-CG 3.45Å; A92-R161 PolarHBondContact O-NH1 3.3Å; A92-Q164 HydrophobicContact CB-CB 3.92Å; A92-Q164 HydrophobicContact CB-CG 3.88Å; A92-F165 HydrophobicContact CB-CB 4.2Å
93S96.6Very high96.8Very high66 Ų6642.4 Ų42.446%0.46222%0.215SC..Hα-helixtrans-83.6-9.3-179.3-54.20000114F89 C90 I91 K95F89-S93 PolarHBondContact O-N 3.34Å; F89-S93 VanDerWaalsContact O-N 3.14Å; F89-S93 PolarHBondContact O-OG 2.83Å; C90-S93 CarbonylContact O-C 3.52Å; C90-S93 PolarHBondContact O-N 2.92Å; I91-S93 PolarHBondContact O-N 3.27Å; S93-K95 PolarHBondContact O-N 3.21Å
94S95.9Very high96.7Very high3 Ų341.5 Ų41.52%0.02121%0.208CC..  trans-79.9113.4-172.5-71.10000111.8C90 I91 S99 F100 R161C90-S94 WeakPolarHBondContact O-CB 3.4Å; C90-S94 PolarHBondContact O-N 3.44Å; C90-S94 PolarHBondContact O-OG 3.29Å; I91-S94 PolarHBondContact O-N 3.3Å; S94-S99 VanDerWaalsContact CA-OG 3.26Å; S94-S99 WeakPolarHBondContact CA-OG 3.38Å; S94-S99 VanDerWaalsContact CB-OG 3.3Å; S94-S99 WeakPolarHBondContact CB-OG 3.02Å; S94-S99 PolarHBondContact OG-O 2.91Å; S94-F100 VanDerWaalsContact O-CE2 3.3Å; S94-F100 WeakPolarHBondContact O-CE2 3.46Å; S94-R161 PolarHBondContact O-NH1 3.02Å; S94-R161 PolarHBondContact O-NH2 3.3Å
95K94.4Very high96.7Very high151 Ų15144 Ų4466%0.65722%0.224SC*.  trans-109.2-2.3-179.4-64.3-174.7179.8-177.10114.3S93 S99S93-K95 PolarHBondContact O-N 3.21Å; K95-S99 PolarHBondContact N-OG 2.72Å; K95-S99 VanDerWaalsContact N-OG 3.15Å
96G94.4Very high96.6Very high24 Ų2446.9 Ų46.925%0.24724%0.236CC..SBendtrans-142.9160-175.900000112.8W98 S99 F100G96-W98 VanDerWaalsContact C-N 3.34Å; G96-W98 PolarHBondContact O-N 3.33Å; G96-S99 PolarHBondContact N-OG 3.33Å; G96-S99 PolarHBondContact O-N 2.82Å; G96-S99 PolarHBondContact O-OG 2.63Å; G96-F100 WeakPolarHBondContact O-CD2 3.48Å; G96-F100 PolarHBondContact O-N 3.07Å; G96-F100 VanDerWaalsContact O-N 3.16Å
97Y95Very high96.5Very high56 Ų5644.5 Ų44.522%0.2222%0.222CC..Hα-helixtrans-46.8-53.8178.1175.1-105.6000112.9L41 D45 V48 I49 S99 F100 I101L41-Y97 HydrophobicContact CD2-CD2 3.9Å; L41-Y97 HydrophobicContact CD2-CG 4.32Å; D45-Y97 HydrophobicContact CB-CD2 3.87Å; D45-Y97 HydrophobicContact CB-CE2 3.72Å; V48-Y97 WeakPolarHBondContact CG1-OH 3.46Å; I49-Y97 HydrophobicContact CD1-CD2 4Å; I49-Y97 HydrophobicContact CD1-CE2 4.24Å; I49-Y97 HydrophobicContact CG1-CD2 4.32Å; I49-Y97 HydrophobicContact CG1-CE2 4.1Å; Y97-S99 VanDerWaalsContact C-N 3.3Å; Y97-S99 PolarHBondContact O-N 3.25Å; Y97-F100 WeakPolarHBondContact O-CB 3.5Å; Y97-F100 PolarHBondContact O-N 3.26Å; Y97-F100 VanDerWaalsContact O-N 3.16Å; Y97-I101 HydrophobicContact CD1-CG1 4.32Å; Y97-I101 HydrophobicContact CD2-CG1 4.47Å; Y97-I101 HydrophobicContact CE1-CG1 3.91Å; Y97-I101 HydrophobicContact CE2-CD1 4.23Å; Y97-I101 HydrophobicContact CE2-CG1 4.09Å; Y97-I101 WeakPolarHBondContact O-CG1 3.31Å; Y97-I101 PolarHBondContact O-N 2.95Å
98W95.9Very high96.3Very high185 Ų18546.9 Ų46.970%0.70124%0.235SC*.Hα-helixtrans-64.8-31.8-178.6-65.5114.6000113.6G96 I101 L102G96-W98 VanDerWaalsContact C-N 3.34Å; G96-W98 PolarHBondContact O-N 3.33Å; W98-I101 HydrophobicContact CE3-CB 4.4Å; W98-I101 HydrophobicContact CE3-CG2 4.2Å; W98-I101 HydrophobicContact CZ3-CG2 4.45Å; W98-I101 PolarHBondContact O-N 3.47Å; W98-L102 WeakPolarHBondContact O-CB 3.39Å; W98-L102 VanDerWaalsContact O-CG 3.29Å; W98-L102 WeakPolarHBondContact O-CG 3.25Å; W98-L102 PolarHBondContact O-N 3.28Å
99S95.7Very high96.1Very high38 Ų3847.4 Ų47.427%0.26624%0.242SC..Hα-helixtrans-67.5-38.5175.459.80000112S94 K95 G96 Y97 L102 A103S94-S99 VanDerWaalsContact CA-OG 3.26Å; S94-S99 WeakPolarHBondContact CA-OG 3.38Å; S94-S99 VanDerWaalsContact CB-OG 3.3Å; S94-S99 WeakPolarHBondContact CB-OG 3.02Å; S94-S99 PolarHBondContact OG-O 2.91Å; K95-S99 PolarHBondContact N-OG 2.72Å; K95-S99 VanDerWaalsContact N-OG 3.15Å; G96-S99 PolarHBondContact N-OG 3.33Å; G96-S99 PolarHBondContact O-N 2.82Å; G96-S99 PolarHBondContact O-OG 2.63Å; Y97-S99 VanDerWaalsContact C-N 3.3Å; Y97-S99 PolarHBondContact O-N 3.25Å; S99-L102 PolarHBondContact O-N 3.12Å; S99-A103 WeakPolarHBondContact O-CB 3.29Å; S99-A103 PolarHBondContact O-N 2.98Å
100F95.5Very high95.9Very high0 Ų044.3 Ų44.30%023%0.228CC..Hα-helixtrans-64.3-45.6172.5-85.3-82.2000111.5F30 L33 E34 V37 I49 I91 S94 G96 Y97 L102 A103 Q104F30-F100 HydrophobicContact CE2-CD1 4.01Å; F30-F100 AromaticContact CE2-CE1 3.9Å; F30-F100 HydrophobicContact CE2-CE1 3.9Å; F30-F100 HydrophobicContact CZ-CD1 4.06Å; F30-F100 HydrophobicContact CZ-CE1 4.22Å; L33-F100 HydrophobicContact CB-CE1 4.45Å; L33-F100 HydrophobicContact CB-CZ 4.01Å; E34-F100 HydrophobicContact CG-CD1 4.46Å; E34-F100 HydrophobicContact CG-CE1 4.04Å; E34-F100 HydrophobicContact CG-CZ 4.2Å; V37-F100 HydrophobicContact CG2-CD2 3.95Å; V37-F100 HydrophobicContact CG2-CE2 3.38Å; V37-F100 HydrophobicContact CG2-CZ 4.34Å; I49-F100 HydrophobicContact CD1-CB 3.74Å; I49-F100 HydrophobicContact CD1-CG 4.32Å; I49-F100 HydrophobicContact CG1-CB 4.14Å; I49-F100 HydrophobicContact CG2-CB 4.13Å; I91-F100 HydrophobicContact CB-CE1 4.45Å; S94-F100 VanDerWaalsContact O-CE2 3.3Å; S94-F100 WeakPolarHBondContact O-CE2 3.46Å; G96-F100 WeakPolarHBondContact O-CD2 3.48Å; G96-F100 PolarHBondContact O-N 3.07Å; G96-F100 VanDerWaalsContact O-N 3.16Å; Y97-F100 WeakPolarHBondContact O-CB 3.5Å; Y97-F100 PolarHBondContact O-N 3.26Å; Y97-F100 VanDerWaalsContact O-N 3.16Å; F100-L102 VanDerWaalsContact C-N 3.33Å; F100-L102 PolarHBondContact O-N 3.42Å; F100-A103 WeakPolarHBondContact O-CB 3.1Å; F100-A103 PolarHBondContact O-N 3.1Å; F100-A103 VanDerWaalsContact O-N 3.16Å; F100-Q104 WeakPolarHBondContact O-CG 3.34Å; F100-Q104 PolarHBondContact O-N 3.24Å
101I96Very high95.5Very high20 Ų2043 Ų4310%0.10322%0.219CC..Hα-helixtrans-56.6-45.6176.1-70.6-67.1000111.5V48 I49 L52 Y97 W98 Q104V48-I101 HydrophobicContact CG1-CD1 4.14Å; I49-I101 HydrophobicContact CB-CD1 4.48Å; I49-I101 HydrophobicContact CG1-CD1 3.76Å; I49-I101 HydrophobicContact CG1-CG1 4.16Å; L52-I101 HydrophobicContact CD2-CB 4.42Å; L52-I101 HydrophobicContact CD2-CD1 3.82Å; L52-I101 HydrophobicContact CD2-CG2 3.66Å; Y97-I101 HydrophobicContact CD1-CG1 4.32Å; Y97-I101 HydrophobicContact CD2-CG1 4.47Å; Y97-I101 HydrophobicContact CE1-CG1 3.91Å; Y97-I101 HydrophobicContact CE2-CD1 4.23Å; Y97-I101 HydrophobicContact CE2-CG1 4.09Å; Y97-I101 WeakPolarHBondContact O-CG1 3.31Å; Y97-I101 PolarHBondContact O-N 2.95Å; W98-I101 HydrophobicContact CE3-CB 4.4Å; W98-I101 HydrophobicContact CE3-CG2 4.2Å; W98-I101 HydrophobicContact CZ3-CG2 4.45Å; W98-I101 PolarHBondContact O-N 3.47Å; I101-Q104 WeakPolarHBondContact O-CB 3.44Å; I101-Q104 PolarHBondContact O-N 3.28Å
102L96.8Very high95.4Very high116 Ų11643 Ų4361%0.60722%0.219SC*.Hα-helixtrans-66.7-40.3176-71.1172.6000111.8W98 S99 F100 Q104 T105W98-L102 WeakPolarHBondContact O-CB 3.39Å; W98-L102 VanDerWaalsContact O-CG 3.29Å; W98-L102 WeakPolarHBondContact O-CG 3.25Å; W98-L102 PolarHBondContact O-N 3.28Å; S99-L102 PolarHBondContact O-N 3.12Å; F100-L102 VanDerWaalsContact C-N 3.33Å; F100-L102 PolarHBondContact O-N 3.42Å; L102-Q104 PolarHBondContact O-N 3.1Å; L102-T105 WeakPolarHBondContact O-CG2 3.49Å; L102-T105 PolarHBondContact O-N 3.22Å; L102-T105 VanDerWaalsContact O-N 3.11Å; L102-T105 PolarHBondContact O-OG1 3.41Å
103A97.6Very high95.1Very high2 Ų243.5 Ų43.52%0.01722%0.221CC..Hα-helixtrans-59.2-34.3176.400000111.8Y87 C90 I91 S99 F100 T105 F106Y87-A103 WeakPolarHBondContact CD2-O 3.37Å; C90-A103 HydrophobicContact CB-CB 3.67Å; I91-A103 HydrophobicContact CG2-CB 3.68Å; S99-A103 WeakPolarHBondContact O-CB 3.29Å; S99-A103 PolarHBondContact O-N 2.98Å; F100-A103 WeakPolarHBondContact O-CB 3.1Å; F100-A103 PolarHBondContact O-N 3.1Å; F100-A103 VanDerWaalsContact O-N 3.16Å; A103-T105 PolarHBondContact O-N 3.37Å; A103-T105 VanDerWaalsContact O-N 3.1Å; A103-F106 PolarHBondContact O-N 2.98Å
104Q96.5Very high94.6Very high1 Ų141.6 Ų41.61%0.00520%0.204CC..G310 helixtrans-59.3-22178-62.2-48.4-5000113.7I49 G53 W56 F100 I101 L102 F106 R107I49-Q104 HydrophobicContact CG2-CG 3.97Å; I49-Q104 WeakPolarHBondContact O-CG 3.31Å; G53-Q104 VanDerWaalsContact CA-OE1 3.27Å; W56-Q104 VanDerWaalsContact CD1-O 3.28Å; F100-Q104 WeakPolarHBondContact O-CG 3.34Å; F100-Q104 PolarHBondContact O-N 3.24Å; I101-Q104 WeakPolarHBondContact O-CB 3.44Å; I101-Q104 PolarHBondContact O-N 3.28Å; L102-Q104 PolarHBondContact O-N 3.1Å; Q104-F106 PolarHBondContact O-N 3.45Å; Q104-R107 WeakPolarHBondContact O-CB 3.43Å; Q104-R107 PolarHBondContact O-N 2.83Å
105T96.8Very high94.3Very high54 Ų5441.4 Ų41.433%0.33120%0.203SC..G310 helixtrans-63.6-30.1179.464.70000112.5W56 L102 A103 R107 L108W56-T105 HydrophobicContact CZ2-CG2 4.03Å; L102-T105 WeakPolarHBondContact O-CG2 3.49Å; L102-T105 PolarHBondContact O-N 3.22Å; L102-T105 VanDerWaalsContact O-N 3.11Å; L102-T105 PolarHBondContact O-OG1 3.41Å; A103-T105 PolarHBondContact O-N 3.37Å; A103-T105 VanDerWaalsContact O-N 3.1Å; T105-R107 PolarHBondContact O-N 3.37Å; T105-L108 VanDerWaalsContact O-CB 3.29Å; T105-L108 WeakPolarHBondContact O-CB 3.49Å; T105-L108 PolarHBondContact O-N 3.16Å; T105-L108 VanDerWaalsContact O-N 3.15Å
106F97.5Very high94.1Very high63 Ų6334.4 Ų34.428%0.27617%0.173SC..G310 helixtrans-69.1-11.3177.1-70-71.8000113.4S83 L86 C90 A103 Q104 L108 G109S83-F106 PolarHBondContact OG-O 3.22Å; L86-F106 HydrophobicContact CB-CD1 3.7Å; L86-F106 HydrophobicContact CB-CE1 3.8Å; L86-F106 HydrophobicContact CB-CG 4.11Å; L86-F106 HydrophobicContact CB-CZ 4.29Å; L86-F106 HydrophobicContact CD1-CD1 4.12Å; L86-F106 HydrophobicContact CD1-CE1 3.69Å; L86-F106 HydrophobicContact CD1-CZ 4.49Å; L86-F106 HydrophobicContact CG-CE1 4.35Å; C90-F106 HydrophobicContact CB-CD2 4.4Å; C90-F106 HydrophobicContact CB-CE2 4.43Å; C90-F106 WeakPolarHBondContact SG-CE2 3.49Å; A103-F106 PolarHBondContact O-N 2.98Å; Q104-F106 PolarHBondContact O-N 3.45Å; F106-L108 PolarHBondContact O-N 3.35Å; F106-G109 PolarHBondContact O-N 3.22Å
107R95.7Very high93.7Very high22 Ų2235.4 Ų35.48%0.08317%0.171CC..G310 helixtrans-68.8-14.5172-68.5-171.766.1-178.8-1.5113N54 W56 N57 Y87 Q104 T105 G109 F110N54-R107 PolarHBondContact OD1-NH2 2.88Å; W56-R107 HydrophobicContact CB-CB 4.21Å; N57-R107 PolarHBondContact ND2-NH2 2.79Å; N57-R107 VanDerWaalsContact OD1-CB 3.3Å; N57-R107 WeakPolarHBondContact OD1-CB 3.02Å; N57-R107 PolarHBondContact OD1-O 2.9Å; Y87-R107 HydrophobicContact CD1-CG 4.42Å; Y87-R107 HydrophobicContact CD2-CG 3.88Å; Y87-R107 HydrophobicContact CE1-CG 4.39Å; Y87-R107 HydrophobicContact CE2-CG 3.81Å; Y87-R107 HydrophobicContact CG-CG 4.19Å; Q104-R107 WeakPolarHBondContact O-CB 3.43Å; Q104-R107 PolarHBondContact O-N 2.83Å; T105-R107 PolarHBondContact O-N 3.37Å; R107-G109 PolarHBondContact O-N 2.73Å; R107-F110 HydrophobicContact CB-CB 4.4Å; R107-F110 VanDerWaalsContact O-CB 3.26Å; R107-F110 WeakPolarHBondContact O-CB 3.36Å; R107-F110 PolarHBondContact O-N 3.28Å
108L94.5Very high93.1Very high61 Ų6134.3 Ų34.332%0.31917%0.169SC..G310 helixtrans-52.3-31.2168.8-170.575.2000113W56 I59 G60 L63 T105 F106 H111W56-L108 HydrophobicContact CE3-CB 4.48Å; W56-L108 HydrophobicContact CE3-CD1 3.87Å; W56-L108 HydrophobicContact CZ3-CD1 4.34Å; I59-L108 HydrophobicContact CB-CD1 4.07Å; I59-L108 HydrophobicContact CG2-CD1 3.75Å; G60-L108 VanDerWaalsContact CA-O 3.27Å; G60-L108 WeakPolarHBondContact CA-O 3.25Å; L63-L108 HydrophobicContact CD1-CD1 3.98Å; L63-L108 HydrophobicContact CD1-CD2 4.33Å; L63-L108 HydrophobicContact CD1-CG 4.48Å; T105-L108 VanDerWaalsContact O-CB 3.29Å; T105-L108 WeakPolarHBondContact O-CB 3.49Å; T105-L108 PolarHBondContact O-N 3.16Å; T105-L108 VanDerWaalsContact O-N 3.15Å; F106-L108 PolarHBondContact O-N 3.35Å; L108-H111 PolarHBondContact O-CD2 2.78Å
109G93.2Very high92.8Very high13 Ų1325.6 Ų25.613%0.13414%0.136CC..G310 helixtrans-97.27.9176.500000115S80 F106 R107 H111S80-G109 VanDerWaalsContact CA-O 3.24Å; S80-G109 WeakPolarHBondContact CA-O 2.88Å; S80-G109 VanDerWaalsContact CB-O 3.25Å; S80-G109 WeakPolarHBondContact CB-O 2.91Å; S80-G109 PolarHBondContact OG-O 2.82Å; F106-G109 PolarHBondContact O-N 3.22Å; R107-G109 PolarHBondContact O-N 2.73Å; G109-H111 PolarHBondContact O-N 3.46Å
110F93.6Very high92.3Very high19 Ų1923.8 Ų23.88%0.08312%0.123CC..  trans-8462-172.7-160-92.8000111.9W19 V23 N57 T84 Y87 Y88 R107W19-F110 HydrophobicContact CH2-CD1 4.35Å; W19-F110 AromaticContact CH2-CE1 3.95Å; W19-F110 HydrophobicContact CH2-CE1 3.95Å; W19-F110 HydrophobicContact CH2-CZ 4.47Å; W19-F110 AromaticContact CZ2-CD1 3.89Å; W19-F110 HydrophobicContact CZ2-CD1 3.89Å; W19-F110 AromaticContact CZ2-CE1 3.67Å; W19-F110 HydrophobicContact CZ2-CE1 3.67Å; W19-F110 HydrophobicContact CZ2-CE2 4.37Å; W19-F110 HydrophobicContact CZ2-CG 4.35Å; W19-F110 AromaticContact CZ2-CZ 3.96Å; W19-F110 HydrophobicContact CZ2-CZ 3.96Å; V23-F110 HydrophobicContact CG1-CZ 4.29Å; V23-F110 HydrophobicContact CG2-CE1 4.27Å; V23-F110 HydrophobicContact CG2-CE2 4.47Å; V23-F110 HydrophobicContact CG2-CZ 3.7Å; N57-F110 WeakPolarHBondContact OD1-CB 3.45Å; T84-F110 HydrophobicContact CG2-CD2 3.96Å; T84-F110 HydrophobicContact CG2-CE2 3.82Å; Y87-F110 HydrophobicContact CD1-CD2 4.31Å; Y87-F110 HydrophobicContact CD1-CE2 4.12Å; Y87-F110 HydrophobicContact CE1-CE2 4.37Å; Y88-F110 AromaticContact CE1-CE2 3.93Å; Y88-F110 HydrophobicContact CE1-CE2 3.93Å; R107-F110 HydrophobicContact CB-CB 4.4Å; R107-F110 VanDerWaalsContact O-CB 3.26Å; R107-F110 WeakPolarHBondContact O-CB 3.36Å; R107-F110 PolarHBondContact O-N 3.28Å
111H91Very high91.5Very high4 Ų425.1 Ų25.12%0.01913%0.133CC..  trans-130.321.3-173.5-65.1-58.5000113.4N57 G60 A61 I64 S80 L108 G109 D113 H114 L115N57-H111 PolarHBondContact O-CE1 3.28Å; N57-H111 PolarHBondContact O-NE2 3.04Å; N57-H111 VanDerWaalsContact O-NE2 3.13Å; G60-H111 VanDerWaalsContact CA-NE2 3.32Å; G60-H111 WeakPolarHBondContact CA-NE2 3.4Å; A61-H111 PolarHBondContact N-CE1 3.48Å; A61-H111 PolarHBondContact N-NE2 3.38Å; I64-H111 HydrophobicContact CG1-CB 4.49Å; I64-H111 HydrophobicContact CG2-CB 4.47Å; S80-H111 PolarHBondContact OG-N 2.95Å; L108-H111 PolarHBondContact O-CD2 2.78Å; G109-H111 PolarHBondContact O-N 3.46Å; H111-D113 VanDerWaalsContact C-N 3.34Å; H111-D113 PolarHBondContact O-N 3.04Å; H111-H114 PolarHBondContact O-N 3.3Å; H111-L115 VanDerWaalsContact O-CG 3.26Å; H111-L115 WeakPolarHBondContact O-CG 3.26Å; H111-L115 PolarHBondContact O-N 3.31Å
112F94.4Very high90.9Very high0 Ų026.7 Ų26.70%014%0.143CC..Hα-helixtrans-63.1-40.1-174.4-164.8-90.9000111.8V15 W19 L77 S80 A81 H114 L115 T116 I175 V179V15-F112 HydrophobicContact CB-CE1 4.11Å; V15-F112 HydrophobicContact CB-CZ 4.05Å; V15-F112 HydrophobicContact CG2-CE1 3.91Å; V15-F112 HydrophobicContact CG2-CZ 3.91Å; W19-F112 HydrophobicContact CB-CD1 3.61Å; W19-F112 HydrophobicContact CB-CE1 4.06Å; W19-F112 HydrophobicContact CB-CG 4.37Å; W19-F112 VanDerWaalsContact CD1-CB 3.46Å; W19-F112 AromaticContact CD1-CD1 3.83Å; W19-F112 AromaticContact CD1-CG 3.7Å; W19-F112 HydrophobicContact CD2-CB 3.87Å; W19-F112 HydrophobicContact CD2-CD1 4.2Å; W19-F112 HydrophobicContact CD2-CG 4.44Å; W19-F112 HydrophobicContact CG-CB 3.79Å; W19-F112 AromaticContact CG-CD1 3.58Å; W19-F112 HydrophobicContact CG-CD1 3.58Å; W19-F112 HydrophobicContact CG-CE1 4.46Å; W19-F112 AromaticContact CG-CG 3.91Å; W19-F112 HydrophobicContact CG-CG 3.91Å; W19-F112 HydrophobicContact CZ2-CB 4.24Å; W19-F112 VanDerWaalsContact NE1-CB 3.32Å; L77-F112 HydrophobicContact CB-CE2 4.22Å; L77-F112 HydrophobicContact CD2-CD2 3.92Å; L77-F112 HydrophobicContact CD2-CE2 3.6Å; L77-F112 HydrophobicContact CD2-CG 4.48Å; L77-F112 HydrophobicContact CD2-CZ 3.92Å; S80-F112 WeakPolarHBondContact OG-CA 3.34Å; S80-F112 PolarHBondContact OG-N 2.91Å; A81-F112 HydrophobicContact CB-CD2 4.25Å; A81-F112 HydrophobicContact CB-CE2 4.15Å; F112-H114 PolarHBondContact O-N 2.79Å; F112-L115 PolarHBondContact O-N 3.31Å; F112-T116 HydrophobicContact CD1-CG2 3.87Å; F112-T116 HydrophobicContact CE1-CG2 3.58Å; F112-T116 HydrophobicContact CZ-CG2 4.24Å; F112-T116 WeakPolarHBondContact O-CG2 3.26Å; F112-T116 PolarHBondContact O-N 3.5Å; F112-T116 PolarHBondContact O-OG1 3.42Å; F112-I175 HydrophobicContact CD2-CG2 4.44Å; F112-I175 HydrophobicContact CE1-CG2 4.23Å; F112-I175 HydrophobicContact CE2-CG2 3.49Å; F112-I175 VanDerWaalsContact CE2-CG2 3.49Å; F112-I175 HydrophobicContact CZ-CG2 3.36Å; F112-V179 HydrophobicContact CE2-CG2 4.26Å; F112-V179 HydrophobicContact CZ-CG2 4.07Å
113D91Very high90.3Very high16 Ų1622.5 Ų22.59%0.08612%0.121CC..Hα-helixtrans-54.4-51.7173.262.8-28.5000111.4W19 H111 L115 T116 E117 R341W19-D113 HydrophobicContact CE3-CB 4.11Å; W19-D113 HydrophobicContact CH2-CB 3.9Å; W19-D113 HydrophobicContact CZ3-CB 3.51Å; H111-D113 VanDerWaalsContact C-N 3.34Å; H111-D113 PolarHBondContact O-N 3.04Å; D113-L115 VanDerWaalsContact C-N 3.33Å; D113-L115 PolarHBondContact O-N 2.9Å; D113-T116 PolarHBondContact O-N 2.89Å; D113-T116 VanDerWaalsContact O-N 3.12Å; D113-T116 PolarHBondContact O-OG1 2.69Å; D113-E117 PolarHBondContact O-N 3.45Å; D113-R341 IonicContact OD2-CZ 3.92Å; D113-R341 IonicContact OD2-NH1 3.67Å; D113-R341 PolarHBondContact OD2-NH1 2.68Å; D113-R341 IonicContact OD2-NH2 2.67Å
114H85.3Confident89.5Confident25 Ų2522.8 Ų22.812%0.11612%0.123CC..Hα-helixtrans-62.8-40.3-179.5-173.649.9000112.3H111 F112 T116 E117 I118H111-H114 PolarHBondContact O-N 3.3Å; F112-H114 PolarHBondContact O-N 2.79Å; H114-T116 VanDerWaalsContact C-N 3.31Å; H114-T116 PolarHBondContact O-N 3.32Å; H114-E117 IonicContact ND1-OE2 2.94Å; H114-E117 WeakPolarHBondContact O-CB 3.34Å; H114-E117 PolarHBondContact O-N 3.17Å; H114-I118 WeakPolarHBondContact O-CG1 3.02Å; H114-I118 PolarHBondContact O-N 2.83Å
115L89.8Confident88.6Confident0 Ų031.7 Ų31.70%016%0.156CC..Hα-helixtrans-64-37.2175.8-69.2165000111.8I64 I68 L73 C76 L77 H111 F112 D113 I118 F119I64-L115 HydrophobicContact CD1-CD1 4.23Å; I64-L115 HydrophobicContact CD1-CD2 4.36Å; I64-L115 HydrophobicContact CG1-CD1 4.23Å; I64-L115 HydrophobicContact CG1-CD2 3.78Å; I64-L115 HydrophobicContact CG1-CG 4.22Å; I68-L115 HydrophobicContact CD1-CD2 3.49Å; I68-L115 VanDerWaalsContact CD1-CD2 3.49Å; I68-L115 HydrophobicContact CG1-CD2 3.76Å; L73-L115 HydrophobicContact CD1-CB 4.27Å; L73-L115 HydrophobicContact CD1-CD2 3.58Å; C76-L115 HydrophobicContact CB-CD1 4.17Å; C76-L115 HydrophobicContact CB-CD2 3.68Å; C76-L115 WeakPolarHBondContact O-CD1 3.3Å; L77-L115 HydrophobicContact CD2-CB 3.45Å; L77-L115 VanDerWaalsContact CD2-CB 3.45Å; L77-L115 HydrophobicContact CD2-CD1 4.37Å; L77-L115 HydrophobicContact CG-CB 4.01Å; H111-L115 VanDerWaalsContact O-CG 3.26Å; H111-L115 WeakPolarHBondContact O-CG 3.26Å; H111-L115 PolarHBondContact O-N 3.31Å; F112-L115 PolarHBondContact O-N 3.31Å; D113-L115 VanDerWaalsContact C-N 3.33Å; D113-L115 PolarHBondContact O-N 2.9Å; L115-I118 PolarHBondContact O-N 3.1Å; L115-F119 WeakPolarHBondContact O-CB 3.48Å; L115-F119 PolarHBondContact O-N 3.07Å
116T91Very high87.2Confident3 Ų334.8 Ų34.82%0.01817%0.167CC..Hα-helixtrans-69.1-37.6174.159.90000112.7V12 V15 L77 F112 D113 H114 F119 V120V12-T116 HydrophobicContact CG1-CG2 3.98Å; V15-T116 HydrophobicContact CG2-CG2 4.42Å; L77-T116 HydrophobicContact CD2-CG2 4.12Å; F112-T116 HydrophobicContact CD1-CG2 3.87Å; F112-T116 HydrophobicContact CE1-CG2 3.58Å; F112-T116 HydrophobicContact CZ-CG2 4.24Å; F112-T116 WeakPolarHBondContact O-CG2 3.26Å; F112-T116 PolarHBondContact O-N 3.5Å; F112-T116 PolarHBondContact O-OG1 3.42Å; D113-T116 PolarHBondContact O-N 2.89Å; D113-T116 VanDerWaalsContact O-N 3.12Å; D113-T116 PolarHBondContact O-OG1 2.69Å; H114-T116 VanDerWaalsContact C-N 3.31Å; H114-T116 PolarHBondContact O-N 3.32Å; T116-F119 PolarHBondContact O-N 2.9Å; T116-V120 WeakPolarHBondContact O-CG2 3.45Å; T116-V120 PolarHBondContact O-N 3.27Å
117E85.9Confident86Confident45 Ų4534.1 Ų34.121%0.2118%0.178CC..Hα-helixtrans-60-46.5171.7-69.3173.7176.900110.9D113 H114 F119 V120 S121 L133 L136 R341D113-E117 PolarHBondContact O-N 3.45Å; H114-E117 IonicContact ND1-OE2 2.94Å; H114-E117 WeakPolarHBondContact O-CB 3.34Å; H114-E117 PolarHBondContact O-N 3.17Å; E117-F119 VanDerWaalsContact C-N 3.35Å; E117-F119 PolarHBondContact O-N 3.46Å; E117-V120 PolarHBondContact O-N 3.47Å; E117-S121 WeakPolarHBondContact O-CB 3.44Å; E117-S121 PolarHBondContact O-N 3.08Å; E117-L133 HydrophobicContact CB-CD2 4.07Å; E117-L133 HydrophobicContact CG-CD2 4.46Å; E117-L133 WeakPolarHBondContact O-CD2 2.94Å; E117-L136 HydrophobicContact CG-CD1 4.15Å; E117-R341 IonicContact OE1-CZ 3.98Å; E117-R341 IonicContact OE1-NH2 3.49Å; E117-R341 PolarHBondContact OE1-NH2 3.19Å; E117-R341 IonicContact OE2-NH2 3.69Å
118I82.1Confident85Confident34 Ų3436.5 Ų36.517%0.17419%0.19CC..Hα-helixtrans-60.8-46.1175.4-67.3170.6000109.8I68 L73 H114 L115 V120 S121 T122I68-I118 HydrophobicContact CD1-CD1 3.69Å; L73-I118 HydrophobicContact CD1-CB 4.46Å; L73-I118 HydrophobicContact CD1-CG2 4.17Å; L73-I118 HydrophobicContact CD2-CG2 4.08Å; H114-I118 WeakPolarHBondContact O-CG1 3.02Å; H114-I118 PolarHBondContact O-N 2.83Å; L115-I118 PolarHBondContact O-N 3.1Å; I118-V120 PolarHBondContact O-N 3.27Å; I118-S121 WeakPolarHBondContact O-CA 3.01Å; I118-S121 WeakPolarHBondContact O-CB 3.49Å; I118-S121 PolarHBondContact O-N 3.33Å; I118-S121 PolarHBondContact O-OG 3.28Å; I118-T122 HydrophobicContact CG2-CG2 4.46Å; I118-T122 WeakPolarHBondContact O-CG2 3.24Å; I118-T122 PolarHBondContact O-N 3.49Å
119F87.9Confident83.6Confident2 Ų235.7 Ų35.71%0.00918%0.183CC..Hα-helixtrans-57.5-50.4178.9-165.1-76.8000111.5V12 L73 L77 L115 T116 E117 S121 T122 I123 L183 P184 T186V12-F119 HydrophobicContact CG2-CD1 3.4Å; V12-F119 VanDerWaalsContact CG2-CD1 3.4Å; V12-F119 HydrophobicContact CG2-CE1 3.69Å; V12-F119 HydrophobicContact CG2-CG 4.14Å; L73-F119 HydrophobicContact CD2-CB 3.71Å; L73-F119 HydrophobicContact CD2-CD2 3.54Å; L73-F119 HydrophobicContact CD2-CG 4.01Å; L73-F119 HydrophobicContact CG-CD2 4.14Å; L77-F119 HydrophobicContact CD1-CD2 4.03Å; L115-F119 WeakPolarHBondContact O-CB 3.48Å; L115-F119 PolarHBondContact O-N 3.07Å; T116-F119 PolarHBondContact O-N 2.9Å; E117-F119 VanDerWaalsContact C-N 3.35Å; E117-F119 PolarHBondContact O-N 3.46Å; F119-S121 VanDerWaalsContact C-N 3.27Å; F119-S121 PolarHBondContact O-N 3.47Å; F119-T122 PolarHBondContact O-N 3.29Å; F119-T122 PolarHBondContact O-OG1 2.88Å; F119-I123 HydrophobicContact CD1-CD1 4.2Å; F119-I123 HydrophobicContact CD1-CG2 4.13Å; F119-I123 HydrophobicContact CE1-CD1 4.09Å; F119-I123 HydrophobicContact CE1-CG2 3.72Å; F119-I123 HydrophobicContact CZ-CG2 4.38Å; F119-I123 PolarHBondContact O-N 2.94Å; F119-L183 HydrophobicContact CE1-CD2 4.23Å; F119-L183 HydrophobicContact CE2-CB 4.22Å; F119-L183 HydrophobicContact CE2-CD1 4.47Å; F119-L183 HydrophobicContact CZ-CB 4.23Å; F119-L183 HydrophobicContact CZ-CD2 4.01Å; F119-P184 HydrophobicContact CZ-CG 4.43Å; F119-T186 HydrophobicContact CE1-CG2 4.26Å; F119-T186 HydrophobicContact CE2-CG2 3.83Å; F119-T186 HydrophobicContact CZ-CG2 3.64Å
120V86.2Confident82.3Confident0 Ų036.2 Ų36.20%018%0.183CC..Hα-helixtrans-57.1-43.8175.1170.60000110.2F9 V12 T116 E117 I118 T122 I123 T124 D132 L133 L136F9-V120 HydrophobicContact CD2-CG1 4.19Å; F9-V120 HydrophobicContact CD2-CG2 4.04Å; F9-V120 HydrophobicContact CE2-CG1 3.82Å; F9-V120 HydrophobicContact CE2-CG2 3.9Å; V12-V120 HydrophobicContact CB-CG2 4.35Å; V12-V120 HydrophobicContact CG1-CG2 3.79Å; T116-V120 WeakPolarHBondContact O-CG2 3.45Å; T116-V120 PolarHBondContact O-N 3.27Å; E117-V120 PolarHBondContact O-N 3.47Å; I118-V120 PolarHBondContact O-N 3.27Å; V120-T122 PolarHBondContact O-N 3.42Å; V120-I123 WeakPolarHBondContact O-CG1 3.45Å; V120-I123 PolarHBondContact O-N 3.49Å; V120-T124 HydrophobicContact CG1-CG2 3.73Å; V120-T124 VanDerWaalsContact O-CB 3.28Å; V120-T124 WeakPolarHBondContact O-CB 3.3Å; V120-T124 WeakPolarHBondContact O-CG2 3.3Å; V120-T124 PolarHBondContact O-N 3.3Å; V120-T124 PolarHBondContact O-OG1 3.26Å; V120-D132 HydrophobicContact CG1-CB 3.94Å; V120-L133 HydrophobicContact CB-CD2 4.17Å; V120-L133 HydrophobicContact CG1-CD2 4.03Å; V120-L133 HydrophobicContact CG1-CG 4.46Å; V120-L136 HydrophobicContact CB-CD1 4.13Å; V120-L136 HydrophobicContact CG2-CD1 3.73Å; V120-L136 HydrophobicContact CG2-CD2 3.96Å; V120-L136 HydrophobicContact CG2-CG 4.06Å
121S79.6Confident81.3Confident28 Ų2835.8 Ų35.820%0.19618%0.183CC..Hα-helixtrans-60.6-29.9178.583.20000113.8E117 I118 F119 T124 R129E117-S121 WeakPolarHBondContact O-CB 3.44Å; E117-S121 PolarHBondContact O-N 3.08Å; I118-S121 WeakPolarHBondContact O-CA 3.01Å; I118-S121 WeakPolarHBondContact O-CB 3.49Å; I118-S121 PolarHBondContact O-N 3.33Å; I118-S121 PolarHBondContact O-OG 3.28Å; F119-S121 VanDerWaalsContact C-N 3.27Å; F119-S121 PolarHBondContact O-N 3.47Å; S121-T124 PolarHBondContact O-OG1 2.96Å; S121-R129 PolarHBondContact O-NE 2.88Å; S121-R129 VanDerWaalsContact O-NE 3.17Å; S121-R129 PolarHBondContact O-NH2 2.88Å
122T81.7Confident80.6Confident52 Ų5235.7 Ų35.732%0.31918%0.183SC..Hα-helixtrans-78.7-34.2178.863.30000113.6I118 F119 V120 T186 H187I118-T122 HydrophobicContact CG2-CG2 4.46Å; I118-T122 WeakPolarHBondContact O-CG2 3.24Å; I118-T122 PolarHBondContact O-N 3.49Å; F119-T122 PolarHBondContact O-N 3.29Å; F119-T122 PolarHBondContact O-OG1 2.88Å; V120-T122 PolarHBondContact O-N 3.42Å; T122-T186 WeakPolarHBondContact OG1-CB 3.3Å; T122-T186 PolarHBondContact OG1-OG1 3.31Å; T122-H187 HydrophobicContact CG2-CB 4.47Å
123I84.6Confident79.8Confident29 Ų2937.2 Ų37.215%0.14919%0.191CC..Hα-helixtrans-89.8-10.4-179.866.3170.8000113R5 L8 F9 F119 V120 T186R5-I123 WeakPolarHBondContact CD-O 3.38Å; R5-I123 PolarHBondContact NE-O 3.45Å; R5-I123 VanDerWaalsContact NE-O 3.14Å; L8-I123 HydrophobicContact CB-CD1 4.09Å; F9-I123 HydrophobicContact CB-CD1 4.39Å; F119-I123 HydrophobicContact CD1-CD1 4.2Å; F119-I123 HydrophobicContact CD1-CG2 4.13Å; F119-I123 HydrophobicContact CE1-CD1 4.09Å; F119-I123 HydrophobicContact CE1-CG2 3.72Å; F119-I123 HydrophobicContact CZ-CG2 4.38Å; F119-I123 PolarHBondContact O-N 2.94Å; V120-I123 WeakPolarHBondContact O-CG1 3.45Å; V120-I123 PolarHBondContact O-N 3.49Å; I123-T186 HydrophobicContact CG2-CG2 3.76Å
124T80.8Confident79.1Confident8 Ų838.9 Ų38.95%0.04920%0.199CC..SBendtrans-98.5142-176.654.60000111.9V120 S121 D132V120-T124 HydrophobicContact CG1-CG2 3.73Å; V120-T124 VanDerWaalsContact O-CB 3.28Å; V120-T124 WeakPolarHBondContact O-CB 3.3Å; V120-T124 WeakPolarHBondContact O-CG2 3.3Å; V120-T124 PolarHBondContact O-N 3.3Å; V120-T124 PolarHBondContact O-OG1 3.26Å; S121-T124 PolarHBondContact O-OG1 2.96Å; T124-D132 HydrophobicContact CG2-CB 3.63Å; T124-D132 WeakPolarHBondContact CG2-OD2 3.46Å
125R78Confident79Confident187 Ų18739.9 Ų39.971%0.70620%0.203SC*.  trans-70.8150.9173.7-67.4-179.7178.9-177.5-2.4109.4G127 E128 R129R125-G127 VanDerWaalsContact C-N 3.27Å; R125-G127 PolarHBondContact O-N 3.23Å; R125-G127 VanDerWaalsContact O-N 3.16Å; R125-E128 PolarHBondContact O-N 3.41Å; R125-R129 PolarHBondContact O-N 3.36Å; R125-R129 VanDerWaalsContact O-N 3.09Å
126E67.3Low78.7Confident119 Ų11940.5 Ų40.556%0.55621%0.206SC*.THydrogen-bonded Turntrans-53.9-39.8-174.9-67.6-170.7168.800114E128 R330E126-E128 VanDerWaalsContact C-N 3.35Å; E126-E128 PolarHBondContact O-N 2.89Å; E126-R330 VanDerWaalsContact C-NH1 3.33Å; E126-R330 VanDerWaalsContact O-CZ 3.24Å; E126-R330 PolarHBondContact O-NE 3.14Å; E126-R330 PolarHBondContact O-NH1 3.43Å
127G71.7Confident78.2Confident49 Ų4943 Ų4351%0.50522%0.224SC..THydrogen-bonded Turntrans-75.7-1517900000115.5R125R125-G127 VanDerWaalsContact C-N 3.27Å; R125-G127 PolarHBondContact O-N 3.23Å; R125-G127 VanDerWaalsContact O-N 3.16Å
128E74.4Confident78.1Confident73 Ų7344.6 Ų44.634%0.34123%0.233SC..THydrogen-bonded Turntrans-109.8-4.6-178.6-64.8175161.500112.3R5 R125 E126 T130 A131 D132R5-E128 IonicContact CZ-OE2 3.55Å; R5-E128 IonicContact NH1-OE2 3.94Å; R5-E128 PolarHBondContact NH1-OE2 3.39Å; R5-E128 IonicContact NH2-OE2 2.73Å; R5-E128 PolarHBondContact NH2-OE2 3.44Å; R125-E128 PolarHBondContact O-N 3.41Å; E126-E128 VanDerWaalsContact C-N 3.35Å; E126-E128 PolarHBondContact O-N 2.89Å; E128-T130 PolarHBondContact O-N 3.02Å; E128-A131 WeakPolarHBondContact O-CB 3.11Å; E128-A131 PolarHBondContact O-N 2.93Å; E128-D132 WeakPolarHBondContact O-CB 3.32Å; E128-D132 PolarHBondContact O-N 3.37Å
129R65.2Low78.3Confident44 Ų4443.6 Ų43.617%0.16623%0.229CC..Hα-helixtrans-62.5-47.2-171.2-177.8178.6-69.5163.5-0.2112.8S121 R125 A131 D132 L133S121-R129 PolarHBondContact O-NE 2.88Å; S121-R129 VanDerWaalsContact O-NE 3.17Å; S121-R129 PolarHBondContact O-NH2 2.88Å; R125-R129 PolarHBondContact O-N 3.36Å; R125-R129 VanDerWaalsContact O-N 3.09Å; R129-A131 VanDerWaalsContact C-N 3.33Å; R129-A131 PolarHBondContact O-N 2.88Å; R129-D132 PolarHBondContact O-N 3.3Å; R129-L133 HydrophobicContact CG-CD1 3.9Å; R129-L133 HydrophobicContact CG-CG 4.26Å; R129-L133 WeakPolarHBondContact O-CB 3.45Å; R129-L133 VanDerWaalsContact O-CG 3.3Å; R129-L133 WeakPolarHBondContact O-CG 3.32Å; R129-L133 PolarHBondContact O-N 2.92Å
130T67.7Low78.2Confident23 Ų2344.7 Ų44.714%0.14124%0.238CC..Hα-helixtrans-59.9-46.3179.4-560000110.8E128 D132 L133 L134 I325E128-T130 PolarHBondContact O-N 3.02Å; T130-D132 PolarHBondContact O-N 2.86Å; T130-L133 PolarHBondContact O-N 3.22Å; T130-L134 HydrophobicContact CG2-CD1 4.23Å; T130-L134 WeakPolarHBondContact O-CB 3.34Å; T130-L134 VanDerWaalsContact O-CG 3.29Å; T130-L134 WeakPolarHBondContact O-CG 3.25Å; T130-L134 PolarHBondContact O-N 3Å; T130-I325 HydrophobicContact CG2-CG2 4.04Å
131A71.7Confident78Confident10 Ų1044.8 Ų44.88%0.08324%0.24CC..Hα-helixtrans-57.7-45.7175.800000112.8E128 R129 L134 K135 P397E128-A131 WeakPolarHBondContact O-CB 3.11Å; E128-A131 PolarHBondContact O-N 2.93Å; R129-A131 VanDerWaalsContact C-N 3.33Å; R129-A131 PolarHBondContact O-N 2.88Å; A131-L134 PolarHBondContact O-N 3.13Å; A131-K135 WeakPolarHBondContact O-CG 3.27Å; A131-K135 PolarHBondContact O-N 3.25Å; A131-P397 HydrophobicContact CB-CB 3.58Å; A131-P397 HydrophobicContact CB-CG 3.5Å
132D77.2Confident78.2Confident3 Ų345 Ų452%0.01624%0.243CC..Hα-helixtrans-74.8-33.2-178.1-74.9-12.9000112.8R5 F9 V120 T124 E128 R129 T130 K135R5-D132 IonicContact CZ-OD2 3.14Å; R5-D132 IonicContact NH2-OD2 2.71Å; R5-D132 PolarHBondContact NH2-OD2 3.3Å; F9-D132 HydrophobicContact CD2-CB 4.49Å; F9-D132 HydrophobicContact CE2-CB 3.88Å; F9-D132 WeakPolarHBondContact CE2-O 3.2Å; F9-D132 HydrophobicContact CZ-CB 4.45Å; F9-D132 WeakPolarHBondContact CZ-O 3.45Å; V120-D132 HydrophobicContact CG1-CB 3.94Å; T124-D132 HydrophobicContact CG2-CB 3.63Å; T124-D132 WeakPolarHBondContact CG2-OD2 3.46Å; E128-D132 WeakPolarHBondContact O-CB 3.32Å; E128-D132 PolarHBondContact O-N 3.37Å; R129-D132 PolarHBondContact O-N 3.3Å; T130-D132 PolarHBondContact O-N 2.86Å; D132-K135 WeakPolarHBondContact O-CB 3.17Å; D132-K135 PolarHBondContact O-N 2.86Å; D132-K135 IonicContact OD1-NZ 2.65Å; D132-K135 PolarHBondContact OD1-NZ 3.41Å
133L76.9Confident78.7Confident32 Ų3242.6 Ų42.617%0.16823%0.228CC..Hα-helixtrans-65.2-40.7170.7-73174.7000111.3E117 V120 R129 T130 K135 L136 L333E117-L133 HydrophobicContact CB-CD2 4.07Å; E117-L133 HydrophobicContact CG-CD2 4.46Å; E117-L133 WeakPolarHBondContact O-CD2 2.94Å; V120-L133 HydrophobicContact CB-CD2 4.17Å; V120-L133 HydrophobicContact CG1-CD2 4.03Å; V120-L133 HydrophobicContact CG1-CG 4.46Å; R129-L133 HydrophobicContact CG-CD1 3.9Å; R129-L133 HydrophobicContact CG-CG 4.26Å; R129-L133 WeakPolarHBondContact O-CB 3.45Å; R129-L133 VanDerWaalsContact O-CG 3.3Å; R129-L133 WeakPolarHBondContact O-CG 3.32Å; R129-L133 PolarHBondContact O-N 2.92Å; T130-L133 PolarHBondContact O-N 3.22Å; L133-K135 PolarHBondContact O-N 2.79Å; L133-L136 HydrophobicContact CD2-CD1 4.28Å; L133-L136 WeakPolarHBondContact O-CB 3.37Å; L133-L136 PolarHBondContact O-N 2.92Å; L133-L333 HydrophobicContact CD1-CD2 4.3Å
134L75.2Confident78.6Confident50 Ų5043 Ų4326%0.26223%0.231SC..Hα-helixtrans-63.1-31.7175.4-74.7171.2000112.3T130 A131 L136 S137 L396T130-L134 HydrophobicContact CG2-CD1 4.23Å; T130-L134 WeakPolarHBondContact O-CB 3.34Å; T130-L134 VanDerWaalsContact O-CG 3.29Å; T130-L134 WeakPolarHBondContact O-CG 3.25Å; T130-L134 PolarHBondContact O-N 3Å; A131-L134 PolarHBondContact O-N 3.13Å; L134-L136 PolarHBondContact O-N 3.5Å; L134-S137 VanDerWaalsContact O-CB 3.27Å; L134-S137 WeakPolarHBondContact O-CB 3.22Å; L134-S137 PolarHBondContact O-N 3.37Å; L134-S137 PolarHBondContact O-OG 3.35Å; L134-L396 HydrophobicContact CD1-CD2 3.55Å
135K83.3Confident78.9Confident47 Ų4745.9 Ų45.920%0.20424%0.244CC..Hα-helixtrans-65.8-23.2174.2-72.9171.6-164.2163.50113F9 A131 D132 L133 S137 I138 P139F9-K135 HydrophobicContact CE1-CB 4.06Å; F9-K135 HydrophobicContact CE1-CD 3.97Å; F9-K135 HydrophobicContact CZ-CB 3.57Å; F9-K135 HydrophobicContact CZ-CD 3.97Å; F9-K135 HydrophobicContact CZ-CG 4.45Å; A131-K135 WeakPolarHBondContact O-CG 3.27Å; A131-K135 PolarHBondContact O-N 3.25Å; D132-K135 WeakPolarHBondContact O-CB 3.17Å; D132-K135 PolarHBondContact O-N 2.86Å; D132-K135 IonicContact OD1-NZ 2.65Å; D132-K135 PolarHBondContact OD1-NZ 3.41Å; L133-K135 PolarHBondContact O-N 2.79Å; K135-S137 PolarHBondContact O-N 2.85Å; K135-I138 WeakPolarHBondContact O-CB 3.43Å; K135-I138 PolarHBondContact O-N 3.3Å; K135-P139 VanDerWaalsContact O-CD 3.24Å; K135-P139 WeakPolarHBondContact O-CD 3.22Å
136L84.2Confident79.5Confident12 Ų1240 Ų406%0.06323%0.226CC..THydrogen-bonded Turntrans-67.2-19.8171.3-68.1177.1000112.6V12 E117 V120 L133 L134 I138 P139V12-L136 HydrophobicContact CG1-CD2 4.19Å; E117-L136 HydrophobicContact CG-CD1 4.15Å; V120-L136 HydrophobicContact CB-CD1 4.13Å; V120-L136 HydrophobicContact CG2-CD1 3.73Å; V120-L136 HydrophobicContact CG2-CD2 3.96Å; V120-L136 HydrophobicContact CG2-CG 4.06Å; L133-L136 HydrophobicContact CD2-CD1 4.28Å; L133-L136 WeakPolarHBondContact O-CB 3.37Å; L133-L136 PolarHBondContact O-N 2.92Å; L134-L136 PolarHBondContact O-N 3.5Å; L136-I138 PolarHBondContact O-N 3.19Å; L136-P139 WeakPolarHBondContact O-CD 3.38Å
137S80Confident80.8Confident56 Ų5634.3 Ų34.339%0.39220%0.2SC..Hα-helixtrans-70.1-19.5174.876.80000112.9L134 K135 A140 G141L134-S137 VanDerWaalsContact O-CB 3.27Å; L134-S137 WeakPolarHBondContact O-CB 3.22Å; L134-S137 PolarHBondContact O-N 3.37Å; L134-S137 PolarHBondContact O-OG 3.35Å; K135-S137 PolarHBondContact O-N 2.85Å; S137-A140 PolarHBondContact O-N 3.32Å; S137-G141 PolarHBondContact O-N 3.5Å
138I84.4Confident81.7Confident78 Ų7832 Ų3240%0.418%0.176SC..Hα-helixtrans-65.6-55.6177.5-67.4167.7000111K135 L136 A140 G141 A142 F263K135-I138 WeakPolarHBondContact O-CB 3.43Å; K135-I138 PolarHBondContact O-N 3.3Å; L136-I138 PolarHBondContact O-N 3.19Å; I138-A140 VanDerWaalsContact C-N 3.32Å; I138-A140 PolarHBondContact O-N 3.08Å; I138-G141 PolarHBondContact O-N 3.17Å; I138-A142 PolarHBondContact O-N 3.48Å; I138-F263 HydrophobicContact CB-CZ 4.3Å; I138-F263 HydrophobicContact CD1-CE1 4.14Å; I138-F263 HydrophobicContact CG1-CE1 3.8Å; I138-F263 HydrophobicContact CG1-CZ 4.01Å; I138-F263 HydrophobicContact CG2-CE1 4.27Å; I138-F263 HydrophobicContact CG2-CZ 3.75Å
139P86.9Confident82.5Confident14 Ų1433.2 Ų33.29%0.09118%0.18CC..Hα-helixtrans-48.9-48.3169.1-33.636.8000114.3C13 A17 K135 L136 G141 A142 S143C13-P139 HydrophobicContact CB-CG 3.96Å; A17-P139 HydrophobicContact CB-CB 3.83Å; K135-P139 VanDerWaalsContact O-CD 3.24Å; K135-P139 WeakPolarHBondContact O-CD 3.22Å; L136-P139 WeakPolarHBondContact O-CD 3.38Å; P139-G141 PolarHBondContact O-N 3.35Å; P139-A142 PolarHBondContact O-N 2.94Å; P139-S143 WeakPolarHBondContact O-CB 3.17Å; P139-S143 PolarHBondContact O-N 3.03Å
140A85.6Confident84Confident24 Ų2434.4 Ų34.420%0.19819%0.189CC..Hα-helixtrans-62.2-43.4179.500000111.5S137 I138 S143 L144S137-A140 PolarHBondContact O-N 3.32Å; I138-A140 VanDerWaalsContact C-N 3.32Å; I138-A140 PolarHBondContact O-N 3.08Å; A140-S143 PolarHBondContact O-N 2.97Å; A140-S143 PolarHBondContact O-OG 2.83Å; A140-L144 PolarHBondContact O-N 2.82Å
141G80.9Confident85.2Confident3 Ų333.3 Ų33.33%0.03118%0.183CC..Hα-helixtrans-58.2-49.3174.300000112.5S137 I138 P139 S143 L144 L259S137-G141 PolarHBondContact O-N 3.5Å; I138-G141 PolarHBondContact O-N 3.17Å; P139-G141 PolarHBondContact O-N 3.35Å; G141-S143 VanDerWaalsContact C-N 3.29Å; G141-S143 PolarHBondContact O-N 3.39Å; G141-L144 PolarHBondContact O-N 3.42Å; G141-L259 WeakPolarHBondContact O-CD2 3.38Å
142A85.5Confident86.1Confident32 Ų3233.1 Ų33.126%0.26418%0.181SC..Hα-helixtrans-63.2-38.1-179.900000112I138 P139 L144 M145 I146I138-A142 PolarHBondContact O-N 3.48Å; P139-A142 PolarHBondContact O-N 2.94Å; A142-L144 VanDerWaalsContact C-N 3.27Å; A142-L144 PolarHBondContact O-N 2.88Å; A142-M145 PolarHBondContact O-N 3.42Å; A142-I146 HydrophobicContact CB-CD1 4.25Å; A142-I146 WeakPolarHBondContact O-CG1 3.47Å; A142-I146 PolarHBondContact O-N 3.31Å; A142-I146 VanDerWaalsContact O-N 3.09Å
143S90.5Very high86.8Confident1 Ų138.6 Ų38.61%0.00721%0.205CC..Hα-helixtrans-63.7-28.7-179.5780000114.4H20 P139 A140 G141 M145 I146 G147H20-S143 WeakPolarHBondContact CB-OG 3.41Å; P139-S143 WeakPolarHBondContact O-CB 3.17Å; P139-S143 PolarHBondContact O-N 3.03Å; A140-S143 PolarHBondContact O-N 2.97Å; A140-S143 PolarHBondContact O-OG 2.83Å; G141-S143 VanDerWaalsContact C-N 3.29Å; G141-S143 PolarHBondContact O-N 3.39Å; S143-M145 PolarHBondContact O-N 3.34Å; S143-I146 PolarHBondContact O-N 2.88Å; S143-G147 PolarHBondContact O-N 3.27Å
144L83.6Confident87.7Confident39 Ų3938.6 Ų38.620%0.20420%0.204CC..Hα-helixtrans-63.7-25.1178.6-75.8159.2000112.5Q24 A140 G141 A142 P148 I258Q24-L144 HydrophobicContact CG-CD2 3.93Å; Q24-L144 HydrophobicContact CG-CG 4.27Å; A140-L144 PolarHBondContact O-N 2.82Å; G141-L144 PolarHBondContact O-N 3.42Å; A142-L144 VanDerWaalsContact C-N 3.27Å; A142-L144 PolarHBondContact O-N 2.88Å; L144-P148 VanDerWaalsContact O-CD 3.3Å; L144-P148 WeakPolarHBondContact O-CD 3.44Å; L144-P148 WeakPolarHBondContact O-CG 3.46Å; L144-I258 HydrophobicContact CD1-CD1 3.75Å; L144-I258 HydrophobicContact CD1-CG2 4.06Å
145M85.8Confident88.5Confident68 Ų6837.3 Ų37.334%0.33520%0.199SC..Hα-helixtrans-93.5-47.9172.3-174.9-176.470.100111.3A142 S143 F149 L259A142-M145 PolarHBondContact O-N 3.42Å; S143-M145 PolarHBondContact O-N 3.34Å; M145-F149 VanDerWaalsContact O-CB 3.29Å; M145-F149 WeakPolarHBondContact O-CB 3.28Å; M145-F149 PolarHBondContact O-N 3.27Å; M145-L259 HydrophobicContact CB-CD1 4.3Å; M145-L259 HydrophobicContact CE-CD1 4.35Å; M145-L259 HydrophobicContact SD-CD1 4.35Å
146I92.1Very high88.8Confident63 Ų6340.6 Ų40.632%0.32322%0.222SC..Hα-helixtrans-67.5-43-172.3-63.9168.6000111.7I21 A142 S143 F149 L150I21-I146 HydrophobicContact CD1-CB 4.33Å; I21-I146 HydrophobicContact CD1-CG2 3.76Å; I21-I146 HydrophobicContact CG1-CB 4.19Å; I21-I146 HydrophobicContact CG1-CG2 3.98Å; I21-I146 HydrophobicContact CG2-CG2 4.43Å; A142-I146 HydrophobicContact CB-CD1 4.25Å; A142-I146 WeakPolarHBondContact O-CG1 3.47Å; A142-I146 PolarHBondContact O-N 3.31Å; A142-I146 VanDerWaalsContact O-N 3.09Å; S143-I146 PolarHBondContact O-N 2.88Å; I146-F149 PolarHBondContact O-N 3.05Å; I146-L150 HydrophobicContact CG2-CD1 3.68Å; I146-L150 HydrophobicContact CG2-CG 4.12Å; I146-L150 VanDerWaalsContact O-CG 3.3Å; I146-L150 WeakPolarHBondContact O-CG 3.45Å; I146-L150 PolarHBondContact O-N 3.46Å
147G93.5Very high89.2Confident0 Ų046 Ų460%025%0.251CS..Hα-helixtrans-58-59.4-178.700000112.5S143 F149 L150 A151S143-G147 PolarHBondContact O-N 3.27Å; G147-F149 VanDerWaalsContact C-N 3.31Å; G147-F149 PolarHBondContact O-N 3.06Å; G147-L150 PolarHBondContact O-N 3.46Å; G147-A151 WeakPolarHBondContact O-CB 3.4Å; G147-A151 PolarHBondContact O-N 3.27Å
148P91.5Very high89.9Confident0 Ų048.7 Ų48.70%025%0.253CS..Hα-helixtrans-60.9-38.2178.2-27.638.7000112.9Q24 L28 L144 A151 G152 T248 F251Q24-P148 HydrophobicContact CB-CG 4.27Å; L28-P148 HydrophobicContact CB-CB 4.41Å; L28-P148 HydrophobicContact CD2-CB 4.15Å; L28-P148 WeakPolarHBondContact CD2-O 3.3Å; L144-P148 VanDerWaalsContact O-CD 3.3Å; L144-P148 WeakPolarHBondContact O-CD 3.44Å; L144-P148 WeakPolarHBondContact O-CG 3.46Å; P148-A151 PolarHBondContact O-N 2.91Å; P148-G152 PolarHBondContact O-N 3.48Å; P148-T248 VanDerWaalsContact O-CG2 3.32Å; P148-T248 WeakPolarHBondContact O-CG2 3.49Å; P148-F251 HydrophobicContact CB-CB 3.42Å; P148-F251 VanDerWaalsContact CB-CB 3.42Å; P148-F251 HydrophobicContact CB-CD1 4.38Å; P148-F251 HydrophobicContact CB-CG 3.94Å; P148-F251 HydrophobicContact CG-CB 3.72Å; P148-F251 HydrophobicContact CG-CD1 3.88Å; P148-F251 HydrophobicContact CG-CG 3.96Å
149F91.9Very high90.3Very high99 Ų9948.8 Ų48.843%0.43426%0.255SS..Hα-helixtrans-59.1-50.1176.2176.9-97.4000112.4M145 I146 G147 K153M145-F149 VanDerWaalsContact O-CB 3.29Å; M145-F149 WeakPolarHBondContact O-CB 3.28Å; M145-F149 PolarHBondContact O-N 3.27Å; I146-F149 PolarHBondContact O-N 3.05Å; G147-F149 VanDerWaalsContact C-N 3.31Å; G147-F149 PolarHBondContact O-N 3.06Å; F149-K153 HydrophobicContact CE1-CG 4.25Å; F149-K153 HydrophobicContact CE2-CG 4.45Å; F149-K153 HydrophobicContact CZ-CG 4.17Å; F149-K153 WeakPolarHBondContact O-CG 3.33Å; F149-K153 PolarHBondContact O-N 3.27Å; F149-K153 VanDerWaalsContact O-N 3.08Å
150L94.9Very high90.6Very high69 Ų6949.3 Ų49.336%0.36126%0.256SS..Hα-helixtrans-66.2-42179.2-66.7175.8000111.4I21 W25 I146 G147 K153 M154I21-L150 HydrophobicContact CG2-CD1 4.19Å; W25-L150 HydrophobicContact CE3-CB 3.72Å; W25-L150 HydrophobicContact CH2-CB 4.12Å; W25-L150 HydrophobicContact CZ3-CB 3.32Å; W25-L150 HydrophobicContact CZ3-CD1 4.24Å; W25-L150 HydrophobicContact CZ3-CG 4.41Å; I146-L150 HydrophobicContact CG2-CD1 3.68Å; I146-L150 HydrophobicContact CG2-CG 4.12Å; I146-L150 VanDerWaalsContact O-CG 3.3Å; I146-L150 WeakPolarHBondContact O-CG 3.45Å; I146-L150 PolarHBondContact O-N 3.46Å; G147-L150 PolarHBondContact O-N 3.46Å; L150-K153 PolarHBondContact O-N 2.92Å; L150-M154 WeakPolarHBondContact O-CG 3.14Å; L150-M154 PolarHBondContact O-N 3Å
151A94Very high91.1Very high0 Ų049.8 Ų49.80%025%0.253CS..Hα-helixtrans-57-51.8175.800000111.6W25 L28 L29 G147 P148 K153 M154 T155W25-A151 HydrophobicContact CB-CB 4.16Å; W25-A151 HydrophobicContact CD2-CB 3.6Å; W25-A151 HydrophobicContact CE3-CB 4.3Å; W25-A151 HydrophobicContact CG-CB 3.52Å; L28-A151 HydrophobicContact CD2-CB 3.68Å; L29-A151 HydrophobicContact CD1-CB 4.4Å; L29-A151 HydrophobicContact CD2-CB 4.24Å; L29-A151 HydrophobicContact CG-CB 4.17Å; G147-A151 WeakPolarHBondContact O-CB 3.4Å; G147-A151 PolarHBondContact O-N 3.27Å; P148-A151 PolarHBondContact O-N 2.91Å; A151-K153 PolarHBondContact O-N 3.32Å; A151-M154 PolarHBondContact O-N 3.48Å; A151-M154 VanDerWaalsContact O-N 3.12Å; A151-T155 WeakPolarHBondContact O-CG2 3.21Å; A151-T155 PolarHBondContact O-N 3.28Å
152G90.2Very high91.9Very high5 Ų551.8 Ų51.85%0.05227%0.265CS..Hα-helixtrans-57.1-45.3177.100000113P148 M154 T155 V156 T248P148-G152 PolarHBondContact O-N 3.48Å; G152-M154 VanDerWaalsContact C-N 3.33Å; G152-M154 PolarHBondContact O-N 3.38Å; G152-T155 PolarHBondContact O-N 3.17Å; G152-T155 PolarHBondContact O-OG1 3.43Å; G152-V156 WeakPolarHBondContact O-CG2 3.4Å; G152-V156 PolarHBondContact O-N 3.01Å; G152-T248 WeakPolarHBondContact CA-OG1 3.34Å
153K92.7Very high92.4Very high118 Ų11850.3 Ų50.351%0.51325%0.252SS..Hα-helixtrans-61.5-41.2175.9-71.1-64.5-176.7-175.60112.3F149 L150 A151 T155 V156 L157F149-K153 HydrophobicContact CE1-CG 4.25Å; F149-K153 HydrophobicContact CE2-CG 4.45Å; F149-K153 HydrophobicContact CZ-CG 4.17Å; F149-K153 WeakPolarHBondContact O-CG 3.33Å; F149-K153 PolarHBondContact O-N 3.27Å; F149-K153 VanDerWaalsContact O-N 3.08Å; L150-K153 PolarHBondContact O-N 2.92Å; A151-K153 PolarHBondContact O-N 3.32Å; K153-T155 VanDerWaalsContact C-N 3.32Å; K153-T155 PolarHBondContact O-N 3.47Å; K153-V156 PolarHBondContact O-N 3.16Å; K153-L157 WeakPolarHBondContact O-CG 3.42Å; K153-L157 PolarHBondContact O-N 2.9Å; K153-L157 VanDerWaalsContact O-N 3.17Å
154M94.4Very high92.7Very high32 Ų3250.2 Ų50.216%0.15825%0.252CS..Hα-helixtrans-65.8-34.1176.6-70.6-57.6-76.200112.8W25 L150 A151 G152 V156 L157 Y158 A163 F166W25-M154 HydrophobicContact CH2-CB 4.13Å; W25-M154 HydrophobicContact CH2-CG 3.34Å; W25-M154 HydrophobicContact CZ2-CB 3.76Å; W25-M154 HydrophobicContact CZ2-CG 3.49Å; W25-M154 VanDerWaalsContact CZ2-CG 3.49Å; L150-M154 WeakPolarHBondContact O-CG 3.14Å; L150-M154 PolarHBondContact O-N 3Å; A151-M154 PolarHBondContact O-N 3.48Å; A151-M154 VanDerWaalsContact O-N 3.12Å; G152-M154 VanDerWaalsContact C-N 3.33Å; G152-M154 PolarHBondContact O-N 3.38Å; M154-V156 PolarHBondContact O-N 3.32Å; M154-L157 PolarHBondContact O-N 2.9Å; M154-L157 HydrophobicContact SD-CD1 4.44Å; M154-Y158 HydrophobicContact CE-CD2 3.64Å; M154-Y158 HydrophobicContact CE-CE2 3.63Å; M154-Y158 WeakPolarHBondContact O-CA 3.41Å; M154-Y158 PolarHBondContact O-N 3.48Å; M154-Y158 HydrophobicContact SD-CD2 4.32Å; M154-Y158 HydrophobicContact SD-CE2 4.29Å; M154-A163 HydrophobicContact CB-CB 3.64Å; M154-F166 HydrophobicContact CE-CB 3.95Å; M154-F166 HydrophobicContact CE-CD1 4.19Å; M154-F166 HydrophobicContact CE-CD2 3.28Å; M154-F166 HydrophobicContact CE-CE2 3.74Å; M154-F166 HydrophobicContact CE-CG 3.55Å; M154-F166 HydrophobicContact CE-CZ 4.36Å
155T92.5Very high93.4Very high24 Ų2453 Ų5315%0.14726%0.262CS..Hα-helixtrans-72.4-14.2174.660.80000114.7L29 A151 G152 K153 Y158 I160 A163 P244L29-T155 HydrophobicContact CD1-CG2 4.26Å; L29-T155 HydrophobicContact CD2-CG2 3.49Å; L29-T155 VanDerWaalsContact CD2-CG2 3.49Å; A151-T155 WeakPolarHBondContact O-CG2 3.21Å; A151-T155 PolarHBondContact O-N 3.28Å; G152-T155 PolarHBondContact O-N 3.17Å; G152-T155 PolarHBondContact O-OG1 3.43Å; K153-T155 VanDerWaalsContact C-N 3.32Å; K153-T155 PolarHBondContact O-N 3.47Å; T155-Y158 CarbonylContact C-O 3.6Å; T155-Y158 VanDerWaalsContact CA-O 3.31Å; T155-Y158 WeakPolarHBondContact CA-O 3.31Å; T155-I160 HydrophobicContact CG2-CG1 4.1Å; T155-A163 HydrophobicContact CG2-CB 3.88Å; T155-P244 HydrophobicContact CG2-CB 4.22Å; T155-P244 HydrophobicContact CG2-CG 4.48Å
156V90.1Very high94Very high115 Ų11552.8 Ų52.870%0.69726%0.26SS*.Hα-helixtrans-86-36.7171.1174.90000110.4G152 K153 M154G152-V156 WeakPolarHBondContact O-CG2 3.4Å; G152-V156 PolarHBondContact O-N 3.01Å; K153-V156 PolarHBondContact O-N 3.16Å; M154-V156 PolarHBondContact O-N 3.32Å
157L93.3Very high94.3Very high125 Ų12549.9 Ų49.965%0.65425%0.245SC*.Hα-helixtrans-78.9-32.4179.8-65.7175.2000112.9K153 M154K153-L157 WeakPolarHBondContact O-CG 3.42Å; K153-L157 PolarHBondContact O-N 2.9Å; K153-L157 VanDerWaalsContact O-N 3.17Å; M154-L157 PolarHBondContact O-N 2.9Å; M154-L157 HydrophobicContact SD-CD1 4.44Å
158Y94.1Very high94.5Very high114 Ų11450.5 Ų50.545%0.44725%0.249SC..SBendtrans-138.5178-176.8-56.1-81.7000109.6M154 T155 T162 F166M154-Y158 HydrophobicContact CE-CD2 3.64Å; M154-Y158 HydrophobicContact CE-CE2 3.63Å; M154-Y158 WeakPolarHBondContact O-CA 3.41Å; M154-Y158 PolarHBondContact O-N 3.48Å; M154-Y158 HydrophobicContact SD-CD2 4.32Å; M154-Y158 HydrophobicContact SD-CE2 4.29Å; T155-Y158 CarbonylContact C-O 3.6Å; T155-Y158 VanDerWaalsContact CA-O 3.31Å; T155-Y158 WeakPolarHBondContact CA-O 3.31Å; Y158-T162 HydrophobicContact CD1-CG2 4.01Å; Y158-T162 HydrophobicContact CG-CG2 3.96Å; Y158-F166 HydrophobicContact CD2-CE2 4.1Å; Y158-F166 HydrophobicContact CE1-CE2 4.4Å; Y158-F166 AromaticContact CE2-CE2 3.99Å; Y158-F166 HydrophobicContact CE2-CE2 3.99Å; Y158-F166 HydrophobicContact CE2-CZ 4.47Å; Y158-F166 HydrophobicContact CG-CE2 4.36Å
159D93.3Very high94.8Very high80 Ų8056.6 Ų56.643%0.42828%0.276SS..  trans-75.3168.1170.968.388.4000112.9R161 T162 A163D159-R161 VanDerWaalsContact C-N 3.31Å; D159-R161 PolarHBondContact O-N 3.33Å; D159-R161 WeakPolarHBondContact OD1-CA 3.43Å; D159-R161 WeakPolarHBondContact OD1-CB 2.95Å; D159-R161 PolarHBondContact OD1-N 3.35Å; D159-T162 VanDerWaalsContact CG-OG1 3.32Å; D159-T162 PolarHBondContact O-N 2.87Å; D159-T162 PolarHBondContact OD1-N 3.1Å; D159-T162 PolarHBondContact OD1-OG1 3.06Å; D159-T162 WeakPolarHBondContact OD2-CB 3.09Å; D159-T162 PolarHBondContact OD2-OG1 3.21Å; D159-A163 WeakPolarHBondContact O-CB 3.48Å; D159-A163 PolarHBondContact O-N 3.18Å
160I93.1Very high95.1Very high24 Ų2454.6 Ų54.612%0.12327%0.27CS..Hα-helixtrans-60.7-38.9-175.9-61.7164.4000111.9L29 F32 L33 T155 A163 Q164 P244L29-I160 HydrophobicContact CB-CG2 4.33Å; L29-I160 HydrophobicContact CD2-CG2 4.45Å; F32-I160 HydrophobicContact CB-CD1 4.03Å; F32-I160 HydrophobicContact CB-CG2 4.32Å; L33-I160 HydrophobicContact CD2-CG2 3.74Å; L33-I160 HydrophobicContact CG-CG2 3.93Å; T155-I160 HydrophobicContact CG2-CG1 4.1Å; I160-A163 PolarHBondContact O-N 3.4Å; I160-Q164 PolarHBondContact O-N 3.13Å; I160-P244 HydrophobicContact CD1-CG 3.78Å; I160-P244 HydrophobicContact CG1-CG 3.96Å
161R95.7Very high95.2Very high34 Ų3451.4 Ų51.413%0.12825%0.253CS..Hα-helixtrans-73.6-43.2-178.5-64178.6177.5-79.1-6.7111L33 E36 A92 S94 D159 A163 Q164 F165L33-R161 HydrophobicContact CD2-CB 4.4Å; L33-R161 HydrophobicContact CD2-CG 3.57Å; L33-R161 PolarHBondContact O-NH2 2.92Å; E36-R161 IonicContact OE2-CZ 3.37Å; E36-R161 IonicContact OE2-NE 2.75Å; E36-R161 PolarHBondContact OE2-NE 2.88Å; E36-R161 IonicContact OE2-NH2 3.3Å; E36-R161 PolarHBondContact OE2-NH2 3.23Å; A92-R161 WeakPolarHBondContact O-CG 3.45Å; A92-R161 PolarHBondContact O-NH1 3.3Å; S94-R161 PolarHBondContact O-NH1 3.02Å; S94-R161 PolarHBondContact O-NH2 3.3Å; D159-R161 VanDerWaalsContact C-N 3.31Å; D159-R161 PolarHBondContact O-N 3.33Å; D159-R161 WeakPolarHBondContact OD1-CA 3.43Å; D159-R161 WeakPolarHBondContact OD1-CB 2.95Å; D159-R161 PolarHBondContact OD1-N 3.35Å; R161-A163 VanDerWaalsContact C-N 3.31Å; R161-A163 PolarHBondContact O-N 3.13Å; R161-Q164 PolarHBondContact O-N 2.99Å; R161-F165 WeakPolarHBondContact O-CB 3.36Å; R161-F165 PolarHBondContact O-N 2.92Å
162T96.6Very high95.4Very high46 Ų4654.1 Ų54.128%0.28227%0.267SS..Hα-helixtrans-60.8-42.4173.5-630000110.8Y158 D159 Q164 F165 F166Y158-T162 HydrophobicContact CD1-CG2 4.01Å; Y158-T162 HydrophobicContact CG-CG2 3.96Å; D159-T162 VanDerWaalsContact CG-OG1 3.32Å; D159-T162 PolarHBondContact O-N 2.87Å; D159-T162 PolarHBondContact OD1-N 3.1Å; D159-T162 PolarHBondContact OD1-OG1 3.06Å; D159-T162 WeakPolarHBondContact OD2-CB 3.09Å; D159-T162 PolarHBondContact OD2-OG1 3.21Å; T162-Q164 PolarHBondContact O-N 3.01Å; T162-F165 WeakPolarHBondContact O-CB 3.43Å; T162-F165 PolarHBondContact O-N 3.36Å; T162-F166 HydrophobicContact CG2-CD2 3.87Å; T162-F166 HydrophobicContact CG2-CE2 3.62Å; T162-F166 WeakPolarHBondContact O-CD2 3.5Å; T162-F166 PolarHBondContact O-N 2.97Å
163A96.7Very high95.8Very high0 Ų055.8 Ų55.80%028%0.28CS..Hα-helixtrans-59.4-43.2174.100000112.4W25 L29 M154 T155 D159 I160 R161 F166 N167W25-A163 WeakPolarHBondContact CZ2-O 3.34Å; W25-A163 PolarHBondContact NE1-O 3.47Å; L29-A163 HydrophobicContact CD1-CB 3.89Å; M154-A163 HydrophobicContact CB-CB 3.64Å; T155-A163 HydrophobicContact CG2-CB 3.88Å; D159-A163 WeakPolarHBondContact O-CB 3.48Å; D159-A163 PolarHBondContact O-N 3.18Å; I160-A163 PolarHBondContact O-N 3.4Å; R161-A163 VanDerWaalsContact C-N 3.31Å; R161-A163 PolarHBondContact O-N 3.13Å; A163-F166 PolarHBondContact O-N 2.96Å; A163-N167 PolarHBondContact O-N 3.39Å
164Q97.7Very high96Very high0 Ų056.1 Ų56.10%028%0.282CS..Hα-helixtrans-69-34.6175.7-174.659.229.800112.8T26 L29 L33 I91 A92 I160 R161 T162 N167 S168T26-Q164 PolarHBondContact OG1-NE2 3.33Å; L29-Q164 HydrophobicContact CD1-CB 4.18Å; L33-Q164 HydrophobicContact CD1-CB 4.06Å; L33-Q164 HydrophobicContact CD1-CG 3.84Å; I91-Q164 HydrophobicContact CD1-CG 4.18Å; I91-Q164 HydrophobicContact CG1-CG 4.01Å; A92-Q164 HydrophobicContact CB-CB 3.92Å; A92-Q164 HydrophobicContact CB-CG 3.88Å; I160-Q164 PolarHBondContact O-N 3.13Å; R161-Q164 PolarHBondContact O-N 2.99Å; T162-Q164 PolarHBondContact O-N 3.01Å; Q164-N167 WeakPolarHBondContact O-CB 3.18Å; Q164-N167 PolarHBondContact O-N 2.6Å; Q164-S168 PolarHBondContact O-N 3.42Å
165F97.9Very high96.2Very high97 Ų9754.6 Ų54.643%0.42528%0.275SS..Hα-helixtrans-62.9-42.8173.5176.3-95.2000111.4F89 A92 R161 T162 N167 S168 F169F89-F165 AromaticContact CD2-CD2 3.56Å; F89-F165 HydrophobicContact CD2-CD2 3.56Å; F89-F165 AromaticContact CD2-CE2 3.45Å; F89-F165 HydrophobicContact CD2-CE2 3.45Å; F89-F165 VanDerWaalsContact CD2-CE2 3.45Å; F89-F165 AromaticContact CE2-CD2 3.84Å; F89-F165 HydrophobicContact CE2-CD2 3.84Å; F89-F165 AromaticContact CE2-CE2 3.49Å; F89-F165 HydrophobicContact CE2-CE2 3.49Å; F89-F165 VanDerWaalsContact CE2-CE2 3.49Å; A92-F165 HydrophobicContact CB-CB 4.2Å; R161-F165 WeakPolarHBondContact O-CB 3.36Å; R161-F165 PolarHBondContact O-N 2.92Å; T162-F165 WeakPolarHBondContact O-CB 3.43Å; T162-F165 PolarHBondContact O-N 3.36Å; F165-N167 VanDerWaalsContact C-N 3.29Å; F165-N167 PolarHBondContact O-N 3.07Å; F165-S168 WeakPolarHBondContact O-CB 3.36Å; F165-S168 PolarHBondContact O-N 3.41Å; F165-F169 PolarHBondContact O-N 2.82Å
166F98.1Very high96.4Very high63 Ų6355.3 Ų55.328%0.27628%0.277SS..Hα-helixtrans-58.1-41.7172.5-85.5-70.4000112.1M154 Y158 T162 A163 S168 F169 L170M154-F166 HydrophobicContact CE-CB 3.95Å; M154-F166 HydrophobicContact CE-CD1 4.19Å; M154-F166 HydrophobicContact CE-CD2 3.28Å; M154-F166 HydrophobicContact CE-CE2 3.74Å; M154-F166 HydrophobicContact CE-CG 3.55Å; M154-F166 HydrophobicContact CE-CZ 4.36Å; Y158-F166 HydrophobicContact CD2-CE2 4.1Å; Y158-F166 HydrophobicContact CE1-CE2 4.4Å; Y158-F166 AromaticContact CE2-CE2 3.99Å; Y158-F166 HydrophobicContact CE2-CE2 3.99Å; Y158-F166 HydrophobicContact CE2-CZ 4.47Å; Y158-F166 HydrophobicContact CG-CE2 4.36Å; T162-F166 HydrophobicContact CG2-CD2 3.87Å; T162-F166 HydrophobicContact CG2-CE2 3.62Å; T162-F166 WeakPolarHBondContact O-CD2 3.5Å; T162-F166 PolarHBondContact O-N 2.97Å; A163-F166 PolarHBondContact O-N 2.96Å; F166-S168 VanDerWaalsContact C-N 3.3Å; F166-S168 PolarHBondContact O-N 3.36Å; F166-F169 PolarHBondContact O-N 3.15Å; F166-L170 WeakPolarHBondContact O-CB 3.25Å; F166-L170 VanDerWaalsContact O-CG 3.25Å; F166-L170 WeakPolarHBondContact O-CG 3.27Å; F166-L170 PolarHBondContact O-N 2.93Å
167N98.3Very high96.8Very high3 Ų352.4 Ų52.42%0.01626%0.261CS..Hα-helixtrans-58.8-41.1176.8-174.526.9000112.8G22 W25 T26 A163 Q164 F165 T171G22-N167 WeakPolarHBondContact CA-OD1 3.48Å; G22-N167 PolarHBondContact O-ND2 3.05Å; W25-N167 HydrophobicContact CD2-CB 3.95Å; W25-N167 HydrophobicContact CG-CB 3.92Å; W25-N167 HydrophobicContact CZ2-CB 4.38Å; T26-N167 PolarHBondContact OG1-ND2 2.9Å; A163-N167 PolarHBondContact O-N 3.39Å; Q164-N167 WeakPolarHBondContact O-CB 3.18Å; Q164-N167 PolarHBondContact O-N 2.6Å; F165-N167 VanDerWaalsContact C-N 3.29Å; F165-N167 PolarHBondContact O-N 3.07Å; N167-T171 WeakPolarHBondContact O-CB 3.32Å; N167-T171 PolarHBondContact O-N 2.94Å; N167-T171 PolarHBondContact O-OG1 3.15Å; N167-T171 PolarHBondContact OD1-OG1 3.01Å
168S98.2Very high96.9Very high13 Ų1347.7 Ų47.79%0.09124%0.237CC..Hα-helixtrans-56.8-50.7173.9175.40000112S85 Q164 F165 F166 L172S85-S168 WeakPolarHBondContact O-CB 3.28Å; S85-S168 PolarHBondContact O-OG 3.43Å; S85-S168 PolarHBondContact OG-O 3.34Å; Q164-S168 PolarHBondContact O-N 3.42Å; F165-S168 WeakPolarHBondContact O-CB 3.36Å; F165-S168 PolarHBondContact O-N 3.41Å; F166-S168 VanDerWaalsContact C-N 3.3Å; F166-S168 PolarHBondContact O-N 3.36Å; S168-L172 PolarHBondContact O-N 2.77Å; S168-L172 VanDerWaalsContact O-N 3.13Å
169F98Very high97Very high127 Ų12742.2 Ų42.256%0.55722%0.216SC*.Hα-helixtrans-64.5-48.2-179.4-179.9-97.7000112.1F165 F166 T171 L172 A173F165-F169 PolarHBondContact O-N 2.82Å; F166-F169 PolarHBondContact O-N 3.15Å; F169-T171 PolarHBondContact O-N 3.48Å; F169-L172 PolarHBondContact O-N 3.41Å; F169-A173 HydrophobicContact CE1-CB 4.21Å; F169-A173 HydrophobicContact CZ-CB 4.38Å; F169-A173 WeakPolarHBondContact O-CB 2.99Å; F169-A173 PolarHBondContact O-N 3.44Å
170L97.8Very high97.2Very high58 Ų5841.4 Ų41.430%0.30421%0.211SC..Hα-helixtrans-62.4-45.3180-66.8173.3000111.1W25 F166 L172 A173 F174W25-L170 HydrophobicContact CH2-CD1 4.37Å; W25-L170 HydrophobicContact CZ3-CD1 4.46Å; F166-L170 WeakPolarHBondContact O-CB 3.25Å; F166-L170 VanDerWaalsContact O-CG 3.25Å; F166-L170 WeakPolarHBondContact O-CG 3.27Å; F166-L170 PolarHBondContact O-N 2.93Å; L170-L172 VanDerWaalsContact C-N 3.29Å; L170-L172 PolarHBondContact O-N 2.76Å; L170-A173 PolarHBondContact O-N 3.41Å; L170-F174 HydrophobicContact CB-CD2 4.31Å; L170-F174 HydrophobicContact CD2-CD2 4.12Å; L170-F174 HydrophobicContact CD2-CE2 3.65Å; L170-F174 WeakPolarHBondContact O-CB 3.44Å; L170-F174 VanDerWaalsContact O-CD2 3.31Å; L170-F174 WeakPolarHBondContact O-CD2 3.32Å; L170-F174 PolarHBondContact O-N 2.84Å
171T97.3Very high97.4Very high2 Ų249.1 Ų49.11%0.01224%0.24CC..Hα-helixtrans-55.9-46.2176.2-630000110.6T84 Y88 N167 F169 I175T84-T171 HydrophobicContact CG2-CG2 4.34Å; Y88-T171 HydrophobicContact CD2-CG2 4.44Å; Y88-T171 HydrophobicContact CE2-CG2 4.04Å; N167-T171 WeakPolarHBondContact O-CB 3.32Å; N167-T171 PolarHBondContact O-N 2.94Å; N167-T171 PolarHBondContact O-OG1 3.15Å; N167-T171 PolarHBondContact OD1-OG1 3.01Å; F169-T171 PolarHBondContact O-N 3.48Å; T171-I175 HydrophobicContact CG2-CD1 3.62Å; T171-I175 WeakPolarHBondContact O-CB 3.36Å; T171-I175 WeakPolarHBondContact O-CD1 3.24Å; T171-I175 WeakPolarHBondContact O-CG1 3.25Å; T171-I175 PolarHBondContact O-N 3.5Å; T171-I175 VanDerWaalsContact O-N 3.13Å
172L97.8Very high97.3Very high57 Ų5750.8 Ų50.830%0.29825%0.251SS..Hα-helixtrans-68-50179.8-165.961.1000111.7V82 S85 S168 F169 L170 F174 I175 L176V82-L172 HydrophobicContact CG2-CD1 4.06Å; S85-L172 WeakPolarHBondContact OG-CB 3.5Å; S85-L172 PolarHBondContact OG-N 3.39Å; S168-L172 PolarHBondContact O-N 2.77Å; S168-L172 VanDerWaalsContact O-N 3.13Å; F169-L172 PolarHBondContact O-N 3.41Å; L170-L172 VanDerWaalsContact C-N 3.29Å; L170-L172 PolarHBondContact O-N 2.76Å; L172-F174 VanDerWaalsContact C-N 3.31Å; L172-F174 PolarHBondContact O-N 3.37Å; L172-I175 PolarHBondContact O-N 3.38Å; L172-L176 HydrophobicContact CD1-CB 4.31Å; L172-L176 HydrophobicContact CD1-CD2 4.09Å; L172-L176 HydrophobicContact CG-CD2 4.42Å; L172-L176 WeakPolarHBondContact O-CB 3.45Å; L172-L176 PolarHBondContact O-N 2.96Å
173A98Very high97.1Very high40 Ų4048.9 Ų48.933%0.33124%0.239SC..Hα-helixtrans-65.4-32.8-173.700000112.8F169 L170 P177F169-A173 HydrophobicContact CE1-CB 4.21Å; F169-A173 HydrophobicContact CZ-CB 4.38Å; F169-A173 WeakPolarHBondContact O-CB 2.99Å; F169-A173 PolarHBondContact O-N 3.44Å; L170-A173 PolarHBondContact O-N 3.41Å; A173-P177 WeakPolarHBondContact O-CD 3.33Å; A173-P177 VanDerWaalsContact O-CG 3.27Å; A173-P177 WeakPolarHBondContact O-CG 3.38Å
174F97.9Very high96.8Very high125 Ų12551.4 Ų51.455%0.54826%0.256SS..Hα-helixtrans-94.8-20.5-178.7-75.9-79.3000114.2V18 L170 L172 P178V18-F174 HydrophobicContact CG1-CB 3.68Å; V18-F174 HydrophobicContact CG2-CB 4.24Å; L170-F174 HydrophobicContact CB-CD2 4.31Å; L170-F174 HydrophobicContact CD2-CD2 4.12Å; L170-F174 HydrophobicContact CD2-CE2 3.65Å; L170-F174 WeakPolarHBondContact O-CB 3.44Å; L170-F174 VanDerWaalsContact O-CD2 3.31Å; L170-F174 WeakPolarHBondContact O-CD2 3.32Å; L170-F174 PolarHBondContact O-N 2.84Å; L172-F174 VanDerWaalsContact C-N 3.31Å; L172-F174 PolarHBondContact O-N 3.37Å; F174-P178 WeakPolarHBondContact O-CD 3.48Å; F174-P178 WeakPolarHBondContact O-CG 3.31Å
175I98Very high96.2Very high0 Ų054.7 Ų54.70%027%0.271CS..Hα-helixtrans-91-45.7175.8-65.2175000111.6V18 W19 A81 F112 T171 L172 P178 V179V18-I175 HydrophobicContact CB-CG1 4.07Å; V18-I175 HydrophobicContact CG1-CD1 4.22Å; V18-I175 HydrophobicContact CG1-CG1 3.68Å; W19-I175 HydrophobicContact CB-CD1 3.67Å; W19-I175 HydrophobicContact CG-CD1 4.26Å; A81-I175 HydrophobicContact CB-CB 4.41Å; A81-I175 HydrophobicContact CB-CG2 3.7Å; F112-I175 HydrophobicContact CD2-CG2 4.44Å; F112-I175 HydrophobicContact CE1-CG2 4.23Å; F112-I175 HydrophobicContact CE2-CG2 3.49Å; F112-I175 VanDerWaalsContact CE2-CG2 3.49Å; F112-I175 HydrophobicContact CZ-CG2 3.36Å; T171-I175 HydrophobicContact CG2-CD1 3.62Å; T171-I175 WeakPolarHBondContact O-CB 3.36Å; T171-I175 WeakPolarHBondContact O-CD1 3.24Å; T171-I175 WeakPolarHBondContact O-CG1 3.25Å; T171-I175 PolarHBondContact O-N 3.5Å; T171-I175 VanDerWaalsContact O-N 3.13Å; L172-I175 PolarHBondContact O-N 3.38Å; I175-P178 WeakPolarHBondContact O-CD 3.35Å; I175-V179 HydrophobicContact CG2-CG2 3.87Å; I175-V179 VanDerWaalsContact O-CG2 3.26Å; I175-V179 WeakPolarHBondContact O-CG2 3.49Å; I175-V179 PolarHBondContact O-N 2.88Å; I175-V179 VanDerWaalsContact O-N 3.13Å
176L97.4Very high95.1Very high38 Ų3852.4 Ų52.420%0.19927%0.265CS..Hα-helixtrans-65.3-47.2-166.3-17264.7000113.1I78 L172 V179 I180I78-L176 HydrophobicContact CB-CD1 4.26Å; I78-L176 HydrophobicContact CG1-CD1 4.08Å; I78-L176 HydrophobicContact CG2-CD1 3.74Å; L172-L176 HydrophobicContact CD1-CB 4.31Å; L172-L176 HydrophobicContact CD1-CD2 4.09Å; L172-L176 HydrophobicContact CG-CD2 4.42Å; L172-L176 WeakPolarHBondContact O-CB 3.45Å; L172-L176 PolarHBondContact O-N 2.96Å; L176-V179 PolarHBondContact O-N 3.24Å; L176-I180 HydrophobicContact CD1-CD1 3.76Å; L176-I180 HydrophobicContact CD1-CG1 4.08Å; L176-I180 HydrophobicContact CD2-CD1 4.29Å; L176-I180 HydrophobicContact CG-CD1 3.66Å; L176-I180 HydrophobicContact CG-CG1 4.31Å; L176-I180 WeakPolarHBondContact O-CG1 3.35Å; L176-I180 PolarHBondContact O-N 2.97Å
177P97.7Very high93.5Very high55 Ų5551.6 Ų51.636%0.35726%0.262SS..Hα-helixtrans-62.8-46.9179.6-17.830.4000113.2A173 V179 I180 Y181A173-P177 WeakPolarHBondContact O-CD 3.33Å; A173-P177 VanDerWaalsContact O-CG 3.27Å; A173-P177 WeakPolarHBondContact O-CG 3.38Å; P177-V179 VanDerWaalsContact C-N 3.32Å; P177-V179 PolarHBondContact O-N 2.75Å; P177-I180 PolarHBondContact O-N 3.22Å; P177-Y181 HydrophobicContact CB-CD2 4.05Å; P177-Y181 HydrophobicContact CB-CE2 4.22Å; P177-Y181 WeakPolarHBondContact O-CB 3.23Å; P177-Y181 WeakPolarHBondContact O-CD2 3.38Å; P177-Y181 PolarHBondContact O-N 2.95Å
178P96Very high91.3Very high25 Ų2559.1 Ų59.116%0.16229%0.294CS..Hα-helixtrans-57.2-40.9173.6-29.938.2000113.8V15 F174 I175 L182 L183V15-P178 HydrophobicContact CG1-CB 3.61Å; V15-P178 HydrophobicContact CG1-CG 4.28Å; F174-P178 WeakPolarHBondContact O-CD 3.48Å; F174-P178 WeakPolarHBondContact O-CG 3.31Å; I175-P178 WeakPolarHBondContact O-CD 3.35Å; P178-L182 HydrophobicContact CB-CD1 4.09Å; P178-L182 WeakPolarHBondContact O-CA 3.33Å; P178-L182 WeakPolarHBondContact O-CB 3.35Å; P178-L182 PolarHBondContact O-N 3.46Å; P178-L183 PolarHBondContact O-N 3.43Å
179V96.5Very high89.1Confident0 Ų061.3 Ų61.30%031%0.305CS..Hα-helixtrans-65.3-43.8177.6174.40000111.1V15 K74 L77 I78 F112 I175 L176 P177 L183V15-V179 HydrophobicContact CG1-CG2 4.37Å; K74-V179 VanDerWaalsContact CE-O 3.23Å; K74-V179 WeakPolarHBondContact CE-O 3.42Å; K74-V179 HydrophobicContact CG-CG1 4.44Å; L77-V179 HydrophobicContact CB-CG1 3.8Å; I78-V179 HydrophobicContact CD1-CG1 4.49Å; I78-V179 HydrophobicContact CG1-CG1 3.69Å; F112-V179 HydrophobicContact CE2-CG2 4.26Å; F112-V179 HydrophobicContact CZ-CG2 4.07Å; I175-V179 HydrophobicContact CG2-CG2 3.87Å; I175-V179 VanDerWaalsContact O-CG2 3.26Å; I175-V179 WeakPolarHBondContact O-CG2 3.49Å; I175-V179 PolarHBondContact O-N 2.88Å; I175-V179 VanDerWaalsContact O-N 3.13Å; L176-V179 PolarHBondContact O-N 3.24Å; P177-V179 VanDerWaalsContact C-N 3.32Å; P177-V179 PolarHBondContact O-N 2.75Å; V179-L183 HydrophobicContact CB-CD1 4.43Å; V179-L183 HydrophobicContact CG1-CD1 4.47Å; V179-L183 HydrophobicContact CG2-CD1 4.05Å
180I96.8Very high86.6Confident62 Ų6258.3 Ų58.332%0.31830%0.3SS..Hα-helixtrans-69.3-46.4-178.8-68.8175.3000111.6K74 I78 L176 P177K74-I180 WeakPolarHBondContact CE-O 3.36Å; K74-I180 PolarHBondContact NZ-O 3.21Å; I78-I180 HydrophobicContact CD1-CG1 3.83Å; I78-I180 HydrophobicContact CG1-CG1 4.19Å; L176-I180 HydrophobicContact CD1-CD1 3.76Å; L176-I180 HydrophobicContact CD1-CG1 4.08Å; L176-I180 HydrophobicContact CD2-CD1 4.29Å; L176-I180 HydrophobicContact CG-CD1 3.66Å; L176-I180 HydrophobicContact CG-CG1 4.31Å; L176-I180 WeakPolarHBondContact O-CG1 3.35Å; L176-I180 PolarHBondContact O-N 2.97Å; P177-I180 PolarHBondContact O-N 3.22Å
181Y96.3Very high84.1Confident186 Ų18660.5 Ų60.573%0.72932%0.318SS*.Hα-helixtrans-98.7-25.9-168.1-60.2-66.1000114.3P177P177-Y181 HydrophobicContact CB-CD2 4.05Å; P177-Y181 HydrophobicContact CB-CE2 4.22Å; P177-Y181 WeakPolarHBondContact O-CB 3.23Å; P177-Y181 WeakPolarHBondContact O-CD2 3.38Å; P177-Y181 PolarHBondContact O-N 2.95Å
182L94.1Very high81.6Confident70 Ų7065.6 Ų65.637%0.36635%0.348SS..Hα-helixtrans-110-24.8-171.8-51.7178000113.9Y11 P178Y11-L182 HydrophobicContact CD1-CD1 4.07Å; Y11-L182 HydrophobicContact CD2-CB 3.74Å; Y11-L182 HydrophobicContact CD2-CD1 4.3Å; Y11-L182 HydrophobicContact CE1-CD1 3.89Å; Y11-L182 HydrophobicContact CE2-CB 3.83Å; Y11-L182 HydrophobicContact CE2-CD1 4.11Å; Y11-L182 HydrophobicContact CE2-CD2 4.32Å; Y11-L182 HydrophobicContact CE2-CG 4.31Å; Y11-L182 HydrophobicContact CG-CB 4.29Å; Y11-L182 HydrophobicContact CG-CD1 4.28Å; P178-L182 HydrophobicContact CB-CD1 4.09Å; P178-L182 WeakPolarHBondContact O-CA 3.33Å; P178-L182 WeakPolarHBondContact O-CB 3.35Å; P178-L182 PolarHBondContact O-N 3.46Å
183L92.6Very high79Confident5 Ų569.5 Ų69.53%0.02636%0.36CS..  trans-92.4123.1178.4-61.5-175.8000111.6V12 K74 L77 F119 P178 V179V12-L183 HydrophobicContact CG2-CD2 3.91Å; K74-L183 WeakPolarHBondContact CE-O 3.23Å; K74-L183 PolarHBondContact NZ-O 3.08Å; L77-L183 HydrophobicContact CD1-CD1 4.09Å; F119-L183 HydrophobicContact CE1-CD2 4.23Å; F119-L183 HydrophobicContact CE2-CB 4.22Å; F119-L183 HydrophobicContact CE2-CD1 4.47Å; F119-L183 HydrophobicContact CZ-CB 4.23Å; F119-L183 HydrophobicContact CZ-CD2 4.01Å; P178-L183 PolarHBondContact O-N 3.43Å; V179-L183 HydrophobicContact CB-CD1 4.43Å; V179-L183 HydrophobicContact CG1-CD1 4.47Å; V179-L183 HydrophobicContact CG2-CD1 4.05Å
184P91.1Very high76.5Confident54 Ų5469 Ų6935%0.35135%0.353SS..  trans-74.8162172.431.6-35.5000111.2L8 F119 T186L8-P184 HydrophobicContact CD1-CG 3.98Å; L8-P184 HydrophobicContact CD2-CG 3.95Å; F119-P184 HydrophobicContact CZ-CG 4.43Å; P184-T186 HydrophobicContact CG-CG2 4.26Å; P184-T186 PolarHBondContact O-N 2.87Å
185E84.2Confident73.9Confident68 Ų6866.2 Ų66.232%0.31835%0.353SS..  trans-75.6111.6168-166.269.6-122.500108.9G72 L73 K74 K188G72-E185 WeakPolarHBondContact CA-OE1 3.47Å; L73-E185 PolarHBondContact N-OE1 3.08Å; K74-E185 WeakPolarHBondContact CB-OE2 3.14Å; K74-E185 PolarHBondContact N-OE1 3.38Å; E185-K188 HydrophobicContact CG-CD 4.45Å; E185-K188 HydrophobicContact CG-CG 4.05Å
186T75.4Confident71.4Confident49 Ų4971.7 Ų71.730%0.30138%0.377SS..  trans-98.4-21.6-178.358.80000113.3F119 T122 I123 P184F119-T186 HydrophobicContact CE1-CG2 4.26Å; F119-T186 HydrophobicContact CE2-CG2 3.83Å; F119-T186 HydrophobicContact CZ-CG2 3.64Å; T122-T186 WeakPolarHBondContact OG1-CB 3.3Å; T122-T186 PolarHBondContact OG1-OG1 3.31Å; I123-T186 HydrophobicContact CG2-CG2 3.76Å; P184-T186 HydrophobicContact CG-CG2 4.26Å; P184-T186 PolarHBondContact O-N 2.87Å
187H63.2Low69.2Low47 Ų4772.4 Ų72.422%0.21838%0.38CS..  trans-136.990.6-171-164.5-89.9000111.3D69 G72 L73 T122 L189D69-H187 IonicContact OD1-CE1 3.18Å; G72-H187 WeakPolarHBondContact CA-O 3.39Å; L73-H187 HydrophobicContact CB-CB 4.31Å; T122-H187 HydrophobicContact CG2-CB 4.47Å; H187-L189 WeakPolarHBondContact CE1-CD1 3.22Å; H187-L189 WeakPolarHBondContact CE1-CG 3.29Å
188K53Low67.5Low160 Ų16076.5 Ų76.570%0.69639%0.393SS*.  trans-109.297.5152.2-72.8-174.9178.3-178.70106.2E185E185-K188 HydrophobicContact CG-CD 4.45Å; E185-K188 HydrophobicContact CG-CG 4.05Å
189L51.5Low66.1Low59 Ų5981.5 Ų81.531%0.30942%0.417SS..  trans-60.1144.1167.2-82.1167.2000108.1D69 H187 Y193 T194D69-L189 WeakPolarHBondContact OD1-CD1 3.47Å; H187-L189 WeakPolarHBondContact CE1-CD1 3.22Å; H187-L189 WeakPolarHBondContact CE1-CG 3.29Å; L189-Y193 HydrophobicContact CD2-CG 4.35Å; L189-T194 HydrophobicContact CB-CG2 3.91Å
190S46.4Very low65.1Low65 Ų6587.3 Ų87.346%0.45544%0.444SS..  trans-55136.2161.3167.60000108.1V192 Y193S190-V192 PolarHBondContact O-N 2.84Å; S190-Y193 PolarHBondContact O-N 3.25Å
191P45.3Very low63.9Low104 Ų10486.5 Ų86.568%0.67544%0.439SS*.Hα-helixtrans-50.2-18.4177.3-26.832.4000114.5Y193 T194P191-Y193 VanDerWaalsContact C-N 3.33Å; P191-Y193 PolarHBondContact O-N 3.38Å; P191-T194 WeakPolarHBondContact CA-OG1 3.3Å; P191-T194 PolarHBondContact O-OG1 3.42Å
192V43.9Very low62.9Low108 Ų10879.8 Ų79.866%0.65541%0.413SS*.Hα-helixtrans-68.1-29.7176.9-176.40000112.6S190S190-V192 PolarHBondContact O-N 2.84Å
193Y44.3Very low62.2Low139 Ų13984.1 Ų84.155%0.54543%0.425SS..Hα-helixtrans-88.9-29178.4-85.3-85.5000113.3L189 S190 P191 A195 K196L189-Y193 HydrophobicContact CD2-CG 4.35Å; S190-Y193 PolarHBondContact O-N 3.25Å; P191-Y193 VanDerWaalsContact C-N 3.33Å; P191-Y193 PolarHBondContact O-N 3.38Å; Y193-A195 VanDerWaalsContact C-N 3.25Å; Y193-A195 PolarHBondContact O-N 3.09Å; Y193-K196 HydrophobicContact CD1-CD 4.41Å; Y193-K196 VanDerWaalsContact O-CB 3.29Å; Y193-K196 WeakPolarHBondContact O-CB 3.05Å; Y193-K196 PolarHBondContact O-N 3.27Å
194T45.7Very low61.5Low30 Ų3089.5 Ų89.518%0.18445%0.449CS..Hα-helixtrans-64.4-32.1-178.855.90000112.1D69 L189 P191 K196 L197D69-T194 HydrophobicContact CB-CG2 3.33Å; D69-T194 WeakPolarHBondContact O-CG2 3.2Å; D69-T194 WeakPolarHBondContact OD2-CA 3.5Å; L189-T194 HydrophobicContact CB-CG2 3.91Å; P191-T194 WeakPolarHBondContact CA-OG1 3.3Å; P191-T194 PolarHBondContact O-OG1 3.42Å; T194-K196 PolarHBondContact O-N 3.19Å; T194-L197 PolarHBondContact O-N 3.13Å
195A42.6Very low60.9Low67 Ų6787.7 Ų87.755%0.55444%0.437SS*.THydrogen-bonded Turntrans-60.2-10.217100000114.4Y193Y193-A195 VanDerWaalsContact C-N 3.25Å; Y193-A195 PolarHBondContact O-N 3.09Å
196K45.2Very low60.6Low115 Ų11586.5 Ų86.550%0.544%0.438SS..THydrogen-bonded Turntrans-94-9.7-179.6-65.9-173.8177.4177.70114.8Y193 T194 K198 Q201Y193-K196 HydrophobicContact CD1-CD 4.41Å; Y193-K196 VanDerWaalsContact O-CB 3.29Å; Y193-K196 WeakPolarHBondContact O-CB 3.05Å; Y193-K196 PolarHBondContact O-N 3.27Å; T194-K196 PolarHBondContact O-N 3.19Å; K196-K198 PolarHBondContact O-N 3.5Å; K196-Q201 PolarHBondContact O-NE2 3.33Å; K196-Q201 PolarHBondContact O-OE1 2.95Å
197L52Low61Low52 Ų5292.6 Ų92.627%0.27246%0.457SS..  trans-75.257.1171.7-99.7158.6000111D69 T194 Y202D69-L197 WeakPolarHBondContact OD2-CD1 3.27Å; T194-L197 PolarHBondContact O-N 3.13Å; L197-Y202 HydrophobicContact CD2-CE2 4.3Å
198K62.1Low62Low141 Ų14193.5 Ų93.561%0.61346%0.463SS*.  trans-77.3131.6174.2-64.7-174178.6-176.60108.1K196 H200 Q201K196-K198 PolarHBondContact O-N 3.5Å; K198-H200 HydrophobicContact CB-CB 4.4Å; K198-H200 PolarHBondContact O-N 2.93Å; K198-Q201 WeakPolarHBondContact O-CB 3.12Å; K198-Q201 PolarHBondContact O-N 3.26Å
199L66.9Low63.5Low130 Ų13090.3 Ų90.368%0.68145%0.454SS*.THydrogen-bonded Turntrans-47.4-32.2173.9-144.795.6000112F62 Q201 Y202F62-L199 HydrophobicContact CD1-CD1 4.28Å; F62-L199 HydrophobicContact CE1-CD1 4.5Å; L199-Q201 PolarHBondContact O-N 2.93Å; L199-Y202 WeakPolarHBondContact O-CB 3.31Å; L199-Y202 PolarHBondContact O-N 3.38Å
200H75.1Confident65.2Low122 Ų12294.7 Ų94.757%0.56547%0.466SS*.Hα-helixtrans-56.3-29.7175.1-171.868.8000114.6K198 Y202 W203 Q204K198-H200 HydrophobicContact CB-CB 4.4Å; K198-H200 PolarHBondContact O-N 2.93Å; H200-Y202 VanDerWaalsContact C-N 3.28Å; H200-Y202 PolarHBondContact O-N 3.36Å; H200-W203 WeakPolarHBondContact O-CA 3.36Å; H200-W203 WeakPolarHBondContact O-CB 3.5Å; H200-W203 PolarHBondContact O-N 2.82Å; H200-W203 VanDerWaalsContact O-N 3.09Å; H200-Q204 PolarHBondContact O-N 3.4Å
201Q71.3Confident67Low45 Ų4591.7 Ų91.721%0.2145%0.445CS..Hα-helixtrans-70.6-25.3176.5-67.9-177-7.600112.6K196 K198 L199 W203 Q204 M205K196-Q201 PolarHBondContact O-NE2 3.33Å; K196-Q201 PolarHBondContact O-OE1 2.95Å; K198-Q201 WeakPolarHBondContact O-CB 3.12Å; K198-Q201 PolarHBondContact O-N 3.26Å; L199-Q201 PolarHBondContact O-N 2.93Å; Q201-W203 VanDerWaalsContact C-N 3.27Å; Q201-Q204 PolarHBondContact O-N 3.03Å; Q201-M205 PolarHBondContact O-N 2.82Å
202Y74.6Confident69.1Low46 Ų4689.9 Ų89.918%0.1843%0.429CS..Hα-helixtrans-67.9-33.6169.6-66.8-91.9000110.8L197 L199 H200 Q204 M205 A206 K335 L339L197-Y202 HydrophobicContact CD2-CE2 4.3Å; L199-Y202 WeakPolarHBondContact O-CB 3.31Å; L199-Y202 PolarHBondContact O-N 3.38Å; H200-Y202 VanDerWaalsContact C-N 3.28Å; H200-Y202 PolarHBondContact O-N 3.36Å; Y202-Q204 VanDerWaalsContact C-N 3.3Å; Y202-Q204 PolarHBondContact O-N 2.8Å; Y202-M205 WeakPolarHBondContact O-CB 3.32Å; Y202-M205 PolarHBondContact O-N 3.31Å; Y202-M205 VanDerWaalsContact O-N 3.16Å; Y202-A206 PolarHBondContact O-N 3.36Å; Y202-K335 HydrophobicContact CE1-CB 4.09Å; Y202-K335 HydrophobicContact CE1-CG 4.5Å; Y202-L339 HydrophobicContact CD1-CB 4.25Å
203W79.1Confident71.2Confident161 Ų16187.1 Ų87.161%0.6141%0.408SS*.Hα-helixtrans-64.2-37.1173.6-156.3-99.8000111.9H200 Q201 M205 A206 Y207H200-W203 WeakPolarHBondContact O-CA 3.36Å; H200-W203 WeakPolarHBondContact O-CB 3.5Å; H200-W203 PolarHBondContact O-N 2.82Å; H200-W203 VanDerWaalsContact O-N 3.09Å; Q201-W203 VanDerWaalsContact C-N 3.27Å; W203-M205 VanDerWaalsContact C-N 3.27Å; W203-M205 PolarHBondContact O-N 3.36Å; W203-A206 WeakPolarHBondContact O-CB 3.39Å; W203-A206 PolarHBondContact O-N 3.48Å; W203-A206 VanDerWaalsContact O-N 3.1Å; W203-Y207 AromaticContact CD1-CE2 3.76Å; W203-Y207 VanDerWaalsContact O-CD2 3.26Å; W203-Y207 WeakPolarHBondContact O-CD2 3.2Å; W203-Y207 WeakPolarHBondContact O-CE2 3.48Å
204Q79.5Confident73.2Confident117 Ų11780.6 Ų80.655%0.54738%0.383SS..Hα-helixtrans-62.6-36173.9-68.1-178.9-1800112.1H200 Q201 Y202 A206 Y207H200-Q204 PolarHBondContact O-N 3.4Å; Q201-Q204 PolarHBondContact O-N 3.03Å; Y202-Q204 VanDerWaalsContact C-N 3.3Å; Y202-Q204 PolarHBondContact O-N 2.8Å; Q204-A206 VanDerWaalsContact C-N 3.26Å; Q204-A206 PolarHBondContact O-N 3.3Å; Q204-Y207 PolarHBondContact O-N 2.86Å
205M77.1Confident75.3Confident17 Ų1779.7 Ų79.78%0.08438%0.377CS..Hα-helixtrans-68.1-26.6174.7-67.3-171.3171.300113Q201 Y202 W203 Y207 N208 L211 H332 K335Q201-M205 PolarHBondContact O-N 2.82Å; Y202-M205 WeakPolarHBondContact O-CB 3.32Å; Y202-M205 PolarHBondContact O-N 3.31Å; Y202-M205 VanDerWaalsContact O-N 3.16Å; W203-M205 VanDerWaalsContact C-N 3.27Å; W203-M205 PolarHBondContact O-N 3.36Å; M205-Y207 PolarHBondContact O-N 3.49Å; M205-N208 PolarHBondContact O-N 2.95Å; M205-N208 VanDerWaalsContact O-N 3.08Å; M205-L211 HydrophobicContact CB-CD2 3.95Å; M205-H332 HydrophobicContact CE-CB 3.45Å; M205-H332 VanDerWaalsContact CE-CB 3.45Å; M205-H332 VanDerWaalsContact CE-CG 3.47Å; M205-K335 HydrophobicContact CE-CB 3.49Å; M205-K335 VanDerWaalsContact CE-CB 3.49Å; M205-K335 HydrophobicContact CE-CD 3.37Å; M205-K335 HydrophobicContact CE-CG 4.08Å; M205-K335 HydrophobicContact SD-CB 3.45Å; M205-K335 WeakPolarHBondContact SD-CB 3.18Å; M205-K335 HydrophobicContact SD-CD 4.22Å; M205-K335 HydrophobicContact SD-CG 4.5Å
206A79.5Confident77.7Confident42 Ų4278 Ų7835%0.34737%0.366SS..THydrogen-bonded Turntrans-67.4-14.2176.500000113.5Y202 W203 Q204 I212Y202-A206 PolarHBondContact O-N 3.36Å; W203-A206 WeakPolarHBondContact O-CB 3.39Å; W203-A206 PolarHBondContact O-N 3.48Å; W203-A206 VanDerWaalsContact O-N 3.1Å; Q204-A206 VanDerWaalsContact C-N 3.26Å; Q204-A206 PolarHBondContact O-N 3.3Å; A206-I212 HydrophobicContact CB-CD1 4.16Å; A206-I212 VanDerWaalsContact O-CG1 3.25Å; A206-I212 WeakPolarHBondContact O-CG1 3.47Å
207Y83.2Confident79.9Confident178 Ų17873 Ų7370%0.69835%0.345SS*.THydrogen-bonded Turntrans-82.5-12.7172.5-66.1-80000113.6W203 Q204 M205 D209W203-Y207 AromaticContact CD1-CE2 3.76Å; W203-Y207 VanDerWaalsContact O-CD2 3.26Å; W203-Y207 WeakPolarHBondContact O-CD2 3.2Å; W203-Y207 WeakPolarHBondContact O-CE2 3.48Å; Q204-Y207 PolarHBondContact O-N 2.86Å; M205-Y207 PolarHBondContact O-N 3.49Å; Y207-D209 PolarHBondContact O-N 2.94Å; Y207-D209 VanDerWaalsContact O-N 3.14Å
208N83.5Confident81.8Confident65 Ų6571.4 Ų71.435%0.34834%0.336SS..  trans-79.299.8174.6-176.5-16.8000109.5M205 R210 L211 I212M205-N208 PolarHBondContact O-N 2.95Å; M205-N208 VanDerWaalsContact O-N 3.08Å; N208-R210 VanDerWaalsContact C-N 3.26Å; N208-R210 PolarHBondContact O-N 3.48Å; N208-R210 PolarHBondContact OD1-N 3.1Å; N208-R210 VanDerWaalsContact OD1-N 3.16Å; N208-L211 HydrophobicContact CB-CB 3.93Å; N208-L211 WeakPolarHBondContact O-CB 3.46Å; N208-L211 PolarHBondContact O-N 3.23Å; N208-L211 VanDerWaalsContact O-N 3.09Å; N208-L211 PolarHBondContact OD1-N 3.44Å; N208-I212 PolarHBondContact O-N 3.33Å
209D85.8Confident83.3Confident94 Ų9465.6 Ų65.650%0.50331%0.314SS..Hα-helixtrans-54.9-38.5-177.9-17853.4000112.9Y207 K213Y207-D209 PolarHBondContact O-N 2.94Å; Y207-D209 VanDerWaalsContact O-N 3.14Å; D209-K213 WeakPolarHBondContact O-CB 3.4Å; D209-K213 VanDerWaalsContact O-CG 3.25Å; D209-K213 WeakPolarHBondContact O-CG 3.4Å; D209-K213 PolarHBondContact O-N 3.12Å; D209-K213 VanDerWaalsContact OD1-CE 3.25Å; D209-K213 WeakPolarHBondContact OD1-CE 3.33Å; D209-K213 IonicContact OD1-NZ 2.7Å; D209-K213 PolarHBondContact OD1-NZ 3.16Å; D209-K213 VanDerWaalsContact OD2-CE 3.32Å; D209-K213 WeakPolarHBondContact OD2-CE 3.47Å; D209-K213 IonicContact OD2-NZ 2.7Å; D209-K213 PolarHBondContact OD2-NZ 3.46Å
210R85.2Confident84.7Confident150 Ų15061.2 Ų61.257%0.56629%0.291SS*.Hα-helixtrans-66.1-44.8177.4-67.5-174.2-177.7-178.50.8111.7N208 K213 C214 T327N208-R210 VanDerWaalsContact C-N 3.26Å; N208-R210 PolarHBondContact O-N 3.48Å; N208-R210 PolarHBondContact OD1-N 3.1Å; N208-R210 VanDerWaalsContact OD1-N 3.16Å; R210-K213 PolarHBondContact O-N 2.78Å; R210-C214 PolarHBondContact O-N 2.66Å; R210-C214 PolarHBondContact O-SG 2.81Å; R210-T327 HydrophobicContact CB-CG2 4.23Å
211L85.3Confident85.6Confident2 Ų255.6 Ų55.61%0.0127%0.265CS..Hα-helixtrans-63.3-46.1178.3175.456.1000111M205 N208 K213 C214 I215 L324 V328 A336M205-L211 HydrophobicContact CB-CD2 3.95Å; N208-L211 HydrophobicContact CB-CB 3.93Å; N208-L211 WeakPolarHBondContact O-CB 3.46Å; N208-L211 PolarHBondContact O-N 3.23Å; N208-L211 VanDerWaalsContact O-N 3.09Å; N208-L211 PolarHBondContact OD1-N 3.44Å; L211-K213 VanDerWaalsContact C-N 3.3Å; L211-K213 PolarHBondContact O-N 3.34Å; L211-C214 PolarHBondContact O-N 3.49Å; L211-I215 HydrophobicContact CD1-CD1 3.68Å; L211-I215 HydrophobicContact CD1-CG1 3.98Å; L211-I215 HydrophobicContact CG-CD1 3.8Å; L211-I215 HydrophobicContact CG-CG1 4.47Å; L211-I215 WeakPolarHBondContact O-CB 3.29Å; L211-I215 VanDerWaalsContact O-CG1 3.32Å; L211-I215 WeakPolarHBondContact O-CG1 3.31Å; L211-I215 PolarHBondContact O-N 2.95Å; L211-L324 HydrophobicContact CD1-CD1 3.43Å; L211-L324 VanDerWaalsContact CD1-CD1 3.43Å; L211-V328 HydrophobicContact CB-CG2 4.4Å; L211-V328 HydrophobicContact CD1-CG2 3.57Å; L211-V328 HydrophobicContact CD2-CG2 4.01Å; L211-V328 HydrophobicContact CG-CG2 4.2Å; L211-A336 HydrophobicContact CD1-CB 4.06Å; L211-A336 HydrophobicContact CD2-CB 4.24Å
212I88.4Confident86.6Confident67 Ų6754.4 Ų54.434%0.34426%0.261SS..Hα-helixtrans-60.7-41.2177.3-71.7-54.9000111.3A206 N208 I215 G216A206-I212 HydrophobicContact CB-CD1 4.16Å; A206-I212 VanDerWaalsContact O-CG1 3.25Å; A206-I212 WeakPolarHBondContact O-CG1 3.47Å; N208-I212 PolarHBondContact O-N 3.33Å; I212-I215 PolarHBondContact O-N 2.82Å; I212-G216 PolarHBondContact O-N 2.89Å
213K88.5Confident87.5Confident50 Ų5052.4 Ų52.422%0.21725%0.254CS..Hα-helixtrans-63.1-44.5174.8-75.6168.9176169.10112.5D209 R210 L211 I215 G216 L217 Y385D209-K213 WeakPolarHBondContact O-CB 3.4Å; D209-K213 VanDerWaalsContact O-CG 3.25Å; D209-K213 WeakPolarHBondContact O-CG 3.4Å; D209-K213 PolarHBondContact O-N 3.12Å; D209-K213 VanDerWaalsContact OD1-CE 3.25Å; D209-K213 WeakPolarHBondContact OD1-CE 3.33Å; D209-K213 IonicContact OD1-NZ 2.7Å; D209-K213 PolarHBondContact OD1-NZ 3.16Å; D209-K213 VanDerWaalsContact OD2-CE 3.32Å; D209-K213 WeakPolarHBondContact OD2-CE 3.47Å; D209-K213 IonicContact OD2-NZ 2.7Å; D209-K213 PolarHBondContact OD2-NZ 3.46Å; R210-K213 PolarHBondContact O-N 2.78Å; L211-K213 VanDerWaalsContact C-N 3.3Å; L211-K213 PolarHBondContact O-N 3.34Å; K213-I215 PolarHBondContact O-N 3.32Å; K213-G216 PolarHBondContact O-N 2.88Å; K213-L217 WeakPolarHBondContact O-CB 3.29Å; K213-L217 PolarHBondContact O-N 3.45Å; K213-Y385 HydrophobicContact CD-CG 4.41Å
214C87.4Confident88.1Confident1 Ų144.7 Ų44.71%0.00723%0.225CC..Hα-helixtrans-62.5-41.9175-73.50000112.3R210 L211 L217 K218 L324R210-C214 PolarHBondContact O-N 2.66Å; R210-C214 PolarHBondContact O-SG 2.81Å; L211-C214 PolarHBondContact O-N 3.49Å; C214-L217 PolarHBondContact O-N 2.85Å; C214-K218 WeakPolarHBondContact O-CB 3.39Å; C214-K218 PolarHBondContact O-N 3.48Å; C214-L324 HydrophobicContact CB-CB 4.36Å; C214-L324 HydrophobicContact CB-CD1 3.76Å
215I89.9Confident88.7Confident11 Ų1140 Ų406%0.05620%0.204CC..Hα-helixtrans-66-42.5176.1-69.1170.9000110.5L211 I212 K213 K218 A219 L324 L339 A340 T343L211-I215 HydrophobicContact CD1-CD1 3.68Å; L211-I215 HydrophobicContact CD1-CG1 3.98Å; L211-I215 HydrophobicContact CG-CD1 3.8Å; L211-I215 HydrophobicContact CG-CG1 4.47Å; L211-I215 WeakPolarHBondContact O-CB 3.29Å; L211-I215 VanDerWaalsContact O-CG1 3.32Å; L211-I215 WeakPolarHBondContact O-CG1 3.31Å; L211-I215 PolarHBondContact O-N 2.95Å; I212-I215 PolarHBondContact O-N 2.82Å; K213-I215 PolarHBondContact O-N 3.32Å; I215-K218 PolarHBondContact O-N 2.85Å; I215-A219 WeakPolarHBondContact O-CB 3.35Å; I215-A219 PolarHBondContact O-N 3.28Å; I215-L324 HydrophobicContact CG1-CD1 3.9Å; I215-L339 HydrophobicContact CD1-CB 4.37Å; I215-L339 HydrophobicContact CD1-CD2 3.6Å; I215-L339 HydrophobicContact CD1-CG 3.88Å; I215-A340 HydrophobicContact CG1-CB 4.35Å; I215-T343 HydrophobicContact CG2-CG2 4.16Å
216G92.1Very high89.3Confident32 Ų3239.5 Ų39.533%0.3320%0.202SC..Hα-helixtrans-61.8-44176.100000112I212 K213 A219 L220I212-G216 PolarHBondContact O-N 2.89Å; K213-G216 PolarHBondContact O-N 2.88Å; G216-A219 WeakPolarHBondContact O-CB 3.05Å; G216-A219 PolarHBondContact O-N 3.15Å; G216-L220 WeakPolarHBondContact O-CG 3.3Å; G216-L220 PolarHBondContact O-N 2.88Å
217L91.6Very high89.7Confident9 Ų937.7 Ų37.75%0.04719%0.186CC..Hα-helixtrans-63.6-45.9175.4-177.760.2000111.6K213 C214 A219 L220 L221 V320 A378 I382 F388K213-L217 WeakPolarHBondContact O-CB 3.29Å; K213-L217 PolarHBondContact O-N 3.45Å; C214-L217 PolarHBondContact O-N 2.85Å; L217-A219 VanDerWaalsContact C-N 3.28Å; L217-A219 PolarHBondContact O-N 3.27Å; L217-L220 PolarHBondContact O-N 3.38Å; L217-L221 PolarHBondContact O-N 3.4Å; L217-V320 HydrophobicContact CD2-CG1 4.47Å; L217-V320 HydrophobicContact CD2-CG2 3.74Å; L217-V320 HydrophobicContact CG-CG1 4.39Å; L217-V320 HydrophobicContact CG-CG2 3.97Å; L217-A378 HydrophobicContact CD1-CB 3.66Å; L217-I382 HydrophobicContact CD1-CD1 3.95Å; L217-I382 HydrophobicContact CD1-CG1 3.84Å; L217-I382 HydrophobicContact CD2-CD1 3.86Å; L217-I382 HydrophobicContact CD2-CG1 3.79Å; L217-I382 HydrophobicContact CG-CG1 4.5Å; L217-F388 HydrophobicContact CD2-CZ 4.25Å
218K91.4Very high89.7Confident20 Ų2030.3 Ų30.39%0.08716%0.157CC..Hα-helixtrans-59.8-40.2173.8-175-177.9174.9-175.80111.3C214 I215 L221 T222 V320 L324 A340C214-K218 WeakPolarHBondContact O-CB 3.39Å; C214-K218 PolarHBondContact O-N 3.48Å; I215-K218 PolarHBondContact O-N 2.85Å; K218-L221 PolarHBondContact O-N 2.79Å; K218-T222 VanDerWaalsContact O-CB 3.29Å; K218-T222 WeakPolarHBondContact O-CB 3.46Å; K218-T222 PolarHBondContact O-N 3.35Å; K218-T222 PolarHBondContact O-OG1 3.4Å; K218-V320 HydrophobicContact CB-CG1 3.83Å; K218-V320 HydrophobicContact CG-CG1 4.49Å; K218-L324 HydrophobicContact CD-CD2 4.34Å; K218-A340 HydrophobicContact CD-CB 4.19Å
219A94.1Very high89.5Confident19 Ų1931.8 Ų31.816%0.15716%0.162CC..Hα-helixtrans-63.1-46.3178.300000111.3I215 G216 L217 T222 A223 T343 L347I215-A219 WeakPolarHBondContact O-CB 3.35Å; I215-A219 PolarHBondContact O-N 3.28Å; G216-A219 WeakPolarHBondContact O-CB 3.05Å; G216-A219 PolarHBondContact O-N 3.15Å; L217-A219 VanDerWaalsContact C-N 3.28Å; L217-A219 PolarHBondContact O-N 3.27Å; A219-T222 PolarHBondContact O-N 3.43Å; A219-A223 VanDerWaalsContact O-CB 3.28Å; A219-A223 WeakPolarHBondContact O-CB 3.11Å; A219-A223 PolarHBondContact O-N 2.97Å; A219-T343 HydrophobicContact CB-CG2 3.83Å; A219-L347 HydrophobicContact CB-CD1 3.81Å; A219-L347 WeakPolarHBondContact O-CD1 3.38Å
220L95.5Very high88.9Confident37 Ų3728.2 Ų28.219%0.19414%0.143CC..Hα-helixtrans-62-43.8176.1-70.3169.8000112.1G216 L217 A223 S224 F374 L377 A378 E381G216-L220 WeakPolarHBondContact O-CG 3.3Å; G216-L220 PolarHBondContact O-N 2.88Å; L217-L220 PolarHBondContact O-N 3.38Å; L220-A223 PolarHBondContact O-N 2.72Å; L220-S224 PolarHBondContact O-N 3.47Å; L220-F374 HydrophobicContact CD2-CD1 3.93Å; L220-L377 HydrophobicContact CD1-CB 4.29Å; L220-L377 HydrophobicContact CD2-CB 4.26Å; L220-L377 HydrophobicContact CD2-CD1 4.49Å; L220-A378 HydrophobicContact CB-CB 3.97Å; L220-A378 HydrophobicContact CD1-CB 4.25Å; L220-E381 HydrophobicContact CD1-CG 4.42Å
221L93.6Very high88.1Confident4 Ų421.3 Ų21.32%0.02112%0.117CC..Hα-helixtrans-64.7-42.2175.8-177.264.4000111.8L217 K218 A223 S224 V225 L283 L286 A316 T317 V320L217-L221 PolarHBondContact O-N 3.4Å; K218-L221 PolarHBondContact O-N 2.79Å; L221-A223 VanDerWaalsContact C-N 3.33Å; L221-A223 PolarHBondContact O-N 3.14Å; L221-S224 PolarHBondContact O-N 3.41Å; L221-S224 PolarHBondContact O-OG 3.06Å; L221-V225 VanDerWaalsContact O-CG2 3.29Å; L221-V225 WeakPolarHBondContact O-CG2 3.41Å; L221-V225 PolarHBondContact O-N 2.91Å; L221-V225 VanDerWaalsContact O-N 3.17Å; L221-L283 HydrophobicContact CD1-CD2 4.05Å; L221-L286 HydrophobicContact CD1-CD1 3.78Å; L221-A316 HydrophobicContact CD1-CB 3.92Å; L221-A316 HydrophobicContact CD2-CB 3.75Å; L221-T317 WeakPolarHBondContact CD2-OG1 3.26Å; L221-V320 HydrophobicContact CD2-CG2 4.5Å
222T92.3Very high87Confident20 Ų2021.4 Ų21.412%0.12312%0.118CC..Hα-helixtrans-65.6-41177.1-53.50000110.2K218 A219 S224 V225 I226 Q344 L347K218-T222 VanDerWaalsContact O-CB 3.29Å; K218-T222 WeakPolarHBondContact O-CB 3.46Å; K218-T222 PolarHBondContact O-N 3.35Å; K218-T222 PolarHBondContact O-OG1 3.4Å; A219-T222 PolarHBondContact O-N 3.43Å; T222-S224 PolarHBondContact O-N 3.21Å; T222-V225 PolarHBondContact O-N 3.42Å; T222-I226 HydrophobicContact CG2-CD1 3.66Å; T222-I226 HydrophobicContact CG2-CG1 4.24Å; T222-I226 WeakPolarHBondContact O-CD1 3.16Å; T222-I226 WeakPolarHBondContact O-CG1 3.37Å; T222-I226 PolarHBondContact O-N 2.88Å; T222-Q344 HydrophobicContact CG2-CB 4.4Å; T222-Q344 HydrophobicContact CG2-CG 3.86Å; T222-L347 HydrophobicContact CG2-CD1 4.44Å
223A94Very high86Confident4 Ų421 Ų213%0.03311%0.112CC..Hα-helixtrans-61.2-43178.100000112A219 L220 L221 V225 I226 C227 L347 I351 F374A219-A223 VanDerWaalsContact O-CB 3.28Å; A219-A223 WeakPolarHBondContact O-CB 3.11Å; A219-A223 PolarHBondContact O-N 2.97Å; L220-A223 PolarHBondContact O-N 2.72Å; L221-A223 VanDerWaalsContact C-N 3.33Å; L221-A223 PolarHBondContact O-N 3.14Å; A223-V225 VanDerWaalsContact C-N 3.34Å; A223-V225 PolarHBondContact O-N 3.04Å; A223-I226 PolarHBondContact O-N 3.27Å; A223-C227 WeakPolarHBondContact O-CB 3.32Å; A223-C227 PolarHBondContact O-N 3.38Å; A223-C227 PolarHBondContact O-SG 3.39Å; A223-C227 VanDerWaalsContact O-SG 3.37Å; A223-L347 HydrophobicContact CB-CD1 4.42Å; A223-I351 HydrophobicContact CB-CD1 3.57Å; A223-F374 HydrophobicContact CB-CD1 4.41Å; A223-F374 HydrophobicContact CB-CD2 3.93Å; A223-F374 HydrophobicContact CB-CE2 4.17Å; A223-F374 HydrophobicContact CB-CG 4.07Å
224S93.1Very high84.9Confident0 Ų020 Ų200%011%0.108CC..Hα-helixtrans-62.4-42.6176.669.10000111.9L220 L221 T222 C227 Y228 A371L220-S224 PolarHBondContact O-N 3.47Å; L221-S224 PolarHBondContact O-N 3.41Å; L221-S224 PolarHBondContact O-OG 3.06Å; T222-S224 PolarHBondContact O-N 3.21Å; S224-C227 PolarHBondContact O-N 3.25Å; S224-Y228 WeakPolarHBondContact O-CB 3.46Å; S224-Y228 PolarHBondContact O-N 3.26Å; S224-A371 VanDerWaalsContact CB-O 3.3Å; S224-A371 WeakPolarHBondContact CB-O 2.7Å; S224-A371 WeakPolarHBondContact O-CB 3.35Å
225V90.8Very high83.8Confident18 Ų1821.2 Ų21.211%0.10911%0.114CC..Hα-helixtrans-63.6-45176.5174.80000111.7L221 T222 A223 Y228 E229 N313L221-V225 VanDerWaalsContact O-CG2 3.29Å; L221-V225 WeakPolarHBondContact O-CG2 3.41Å; L221-V225 PolarHBondContact O-N 2.91Å; L221-V225 VanDerWaalsContact O-N 3.17Å; T222-V225 PolarHBondContact O-N 3.42Å; A223-V225 VanDerWaalsContact C-N 3.34Å; A223-V225 PolarHBondContact O-N 3.04Å; V225-Y228 CarbonylContact O-C 3.59Å; V225-Y228 WeakPolarHBondContact O-CA 3.36Å; V225-Y228 VanDerWaalsContact O-CB 3.31Å; V225-Y228 WeakPolarHBondContact O-CB 3.42Å; V225-Y228 PolarHBondContact O-N 3.45Å; V225-Y228 VanDerWaalsContact O-N 3.16Å; V225-E229 HydrophobicContact CG1-CG 4.22Å; V225-E229 WeakPolarHBondContact O-CG 3.39Å; V225-E229 PolarHBondContact O-N 2.92Å; V225-N313 HydrophobicContact CG2-CB 4.28Å; V225-N313 WeakPolarHBondContact CG2-ND2 3.41Å; V225-N313 WeakPolarHBondContact CG2-OD1 3.15Å
226I89.6Confident82.7Confident7 Ų720.8 Ų20.84%0.03611%0.111CC..Hα-helixtrans-65.2-43.8-179.7-63.3158.2000110.6T222 A223 Y228 E229 I230 L347 Q348 I351 P352T222-I226 HydrophobicContact CG2-CD1 3.66Å; T222-I226 HydrophobicContact CG2-CG1 4.24Å; T222-I226 WeakPolarHBondContact O-CD1 3.16Å; T222-I226 WeakPolarHBondContact O-CG1 3.37Å; T222-I226 PolarHBondContact O-N 2.88Å; A223-I226 PolarHBondContact O-N 3.27Å; I226-Y228 PolarHBondContact O-N 2.94Å; I226-E229 PolarHBondContact O-N 2.9Å; I226-I230 HydrophobicContact CG2-CD1 3.96Å; I226-I230 WeakPolarHBondContact O-CD1 3.35Å; I226-I230 VanDerWaalsContact O-CG1 3.31Å; I226-I230 WeakPolarHBondContact O-CG1 3.23Å; I226-I230 PolarHBondContact O-N 2.83Å; I226-I230 VanDerWaalsContact O-N 3.1Å; I226-L347 HydrophobicContact CD1-CB 3.83Å; I226-Q348 HydrophobicContact CD1-CB 4.25Å; I226-Q348 HydrophobicContact CD1-CG 3.41Å; I226-Q348 VanDerWaalsContact CD1-CG 3.41Å; I226-Q348 HydrophobicContact CG1-CG 3.89Å; I226-I351 HydrophobicContact CB-CD1 4.31Å; I226-I351 HydrophobicContact CB-CG2 4.27Å; I226-I351 HydrophobicContact CD1-CD1 4.19Å; I226-I351 HydrophobicContact CG2-CB 3.85Å; I226-I351 HydrophobicContact CG2-CG2 3.66Å; I226-P352 HydrophobicContact CG2-CG 4.22Å
227C88Confident81.5Confident3 Ų319.5 Ų19.52%0.0210%0.097CC..Hα-helixtrans-56.8-40.8174.1-74.20000111.3A223 S224 V231 I351 A371A223-C227 WeakPolarHBondContact O-CB 3.32Å; A223-C227 PolarHBondContact O-N 3.38Å; A223-C227 PolarHBondContact O-SG 3.39Å; A223-C227 VanDerWaalsContact O-SG 3.37Å; S224-C227 PolarHBondContact O-N 3.25Å; C227-V231 VanDerWaalsContact O-CG2 3.25Å; C227-V231 WeakPolarHBondContact O-CG2 3.48Å; C227-V231 PolarHBondContact O-N 3.38Å; C227-I351 VanDerWaalsContact SG-CG2 3.59Å; C227-A371 HydrophobicContact CB-CB 3.82Å
228Y83.5Confident80.4Confident24 Ų2423.9 Ų23.99%0.09411%0.113CC..Hα-helixtrans-65.8-47.2174.5157.7-97.8000113.6S224 V225 I226 I230 V231 T232 Y290 L293 M306S224-Y228 WeakPolarHBondContact O-CB 3.46Å; S224-Y228 PolarHBondContact O-N 3.26Å; V225-Y228 CarbonylContact O-C 3.59Å; V225-Y228 WeakPolarHBondContact O-CA 3.36Å; V225-Y228 VanDerWaalsContact O-CB 3.31Å; V225-Y228 WeakPolarHBondContact O-CB 3.42Å; V225-Y228 PolarHBondContact O-N 3.45Å; V225-Y228 VanDerWaalsContact O-N 3.16Å; I226-Y228 PolarHBondContact O-N 2.94Å; Y228-I230 VanDerWaalsContact C-N 3.28Å; Y228-I230 PolarHBondContact O-N 3.28Å; Y228-V231 PolarHBondContact O-N 2.94Å; Y228-V231 VanDerWaalsContact O-N 3.12Å; Y228-T232 HydrophobicContact CD2-CG2 4.35Å; Y228-T232 WeakPolarHBondContact CD2-OG1 3.26Å; Y228-T232 HydrophobicContact CE2-CG2 3.51Å; Y228-T232 WeakPolarHBondContact CE2-OG1 3.49Å; Y228-T232 WeakPolarHBondContact O-CB 3.17Å; Y228-T232 PolarHBondContact O-N 3.41Å; Y228-T232 PolarHBondContact O-OG1 3.22Å; Y228-Y290 HydrophobicContact CD2-CD1 4.16Å; Y228-Y290 AromaticContact CD2-CE1 3.56Å; Y228-Y290 HydrophobicContact CD2-CE1 3.56Å; Y228-Y290 HydrophobicContact CG-CD1 4.5Å; Y228-Y290 AromaticContact CG-CE1 3.58Å; Y228-Y290 HydrophobicContact CG-CE1 3.58Å; Y228-L293 HydrophobicContact CD2-CD1 4.2Å; Y228-L293 HydrophobicContact CE2-CD1 4.29Å; Y228-M306 HydrophobicContact CE2-CG 4.44Å; Y228-M306 WeakPolarHBondContact OH-CE 3.37Å; Y228-M306 WeakPolarHBondContact OH-CG 3.31Å
229E79.4Confident79.4Confident95 Ų9530.3 Ų30.344%0.44414%0.137SC..Iπ-helixtrans-59.6-41.7-177.9-77.8-178.5165.100110.6V225 I226 W233V225-E229 HydrophobicContact CG1-CG 4.22Å; V225-E229 WeakPolarHBondContact O-CG 3.39Å; V225-E229 PolarHBondContact O-N 2.92Å; I226-E229 PolarHBondContact O-N 2.9Å; E229-W233 WeakPolarHBondContact O-CB 3.37Å; E229-W233 PolarHBondContact O-N 3.38Å
230I74.3Confident78.3Confident20 Ų2032.6 Ų32.610%0.10314%0.144CC..Iπ-helixtrans-63.3-43.9176.2-61160000111I226 Y228 Q234 I351 P352 I359 L367I226-I230 HydrophobicContact CG2-CD1 3.96Å; I226-I230 WeakPolarHBondContact O-CD1 3.35Å; I226-I230 VanDerWaalsContact O-CG1 3.31Å; I226-I230 WeakPolarHBondContact O-CG1 3.23Å; I226-I230 PolarHBondContact O-N 2.83Å; I226-I230 VanDerWaalsContact O-N 3.1Å; Y228-I230 VanDerWaalsContact C-N 3.28Å; Y228-I230 PolarHBondContact O-N 3.28Å; I230-Q234 VanDerWaalsContact O-CB 3.27Å; I230-Q234 WeakPolarHBondContact O-CB 3.38Å; I230-Q234 WeakPolarHBondContact O-CG 3.49Å; I230-I351 HydrophobicContact CD1-CG2 3.94Å; I230-P352 HydrophobicContact CD1-CB 4.14Å; I230-P352 HydrophobicContact CD1-CG 4.03Å; I230-I359 HydrophobicContact CG2-CD1 3.59Å; I230-L367 HydrophobicContact CG2-CD1 4.2Å
231V66.3Low77Confident4 Ų430.9 Ų30.92%0.02414%0.135CC..Iπ-helixtrans-72.9-58.6-176.3169.20000112.1C227 Y228 Q234 H235 Y364 L367 C368C227-V231 VanDerWaalsContact O-CG2 3.25Å; C227-V231 WeakPolarHBondContact O-CG2 3.48Å; C227-V231 PolarHBondContact O-N 3.38Å; Y228-V231 PolarHBondContact O-N 2.94Å; Y228-V231 VanDerWaalsContact O-N 3.12Å; V231-Q234 PolarHBondContact O-N 3.35Å; V231-H235 WeakPolarHBondContact O-CB 3.37Å; V231-H235 PolarHBondContact O-N 3.35Å; V231-Y364 HydrophobicContact CG1-CD2 3.64Å; V231-Y364 HydrophobicContact CG1-CG 4.19Å; V231-L367 HydrophobicContact CG2-CB 3.13Å; V231-L367 HydrophobicContact CG2-CD1 3.56Å; V231-L367 HydrophobicContact CG2-CG 3.99Å; V231-C368 VanDerWaalsContact CG1-SG 3.53Å
232T63.4Low75.8Confident4 Ų439.3 Ų39.33%0.02517%0.174CC..Iπ-helixtrans-71.9-40.7-166-58.10000110.6Y228 I236 M306Y228-T232 HydrophobicContact CD2-CG2 4.35Å; Y228-T232 WeakPolarHBondContact CD2-OG1 3.26Å; Y228-T232 HydrophobicContact CE2-CG2 3.51Å; Y228-T232 WeakPolarHBondContact CE2-OG1 3.49Å; Y228-T232 WeakPolarHBondContact O-CB 3.17Å; Y228-T232 PolarHBondContact O-N 3.41Å; Y228-T232 PolarHBondContact O-OG1 3.22Å; T232-I236 HydrophobicContact CG2-CD1 3.44Å; T232-I236 VanDerWaalsContact CG2-CD1 3.44Å; T232-I236 HydrophobicContact CG2-CG1 4.19Å; T232-I236 VanDerWaalsContact O-CB 3.26Å; T232-I236 WeakPolarHBondContact O-CB 3.45Å; T232-I236 VanDerWaalsContact O-CG1 3.25Å; T232-I236 WeakPolarHBondContact O-CG1 3.47Å; T232-I236 PolarHBondContact O-N 3Å; T232-M306 HydrophobicContact CG2-CE 3.55Å; T232-M306 HydrophobicContact CG2-CG 3.61Å; T232-M306 HydrophobicContact CG2-SD 3.7Å
233W67Low75.2Confident59 Ų5941.4 Ų41.422%0.22319%0.187CC..Iπ-helixtrans-61.3-56.2175.5-166.6-40.6000110.2N27 P31 E229 H235 I236 V237 F251N27-W233 VanDerWaalsContact C-CH2 3.4Å; N27-W233 HydrophobicContact CB-CH2 3.99Å; N27-W233 WeakPolarHBondContact O-CH2 3.45Å; N27-W233 WeakPolarHBondContact O-CZ2 3.47Å; P31-W233 HydrophobicContact CG-CD2 4.48Å; P31-W233 HydrophobicContact CG-CZ2 3.66Å; E229-W233 WeakPolarHBondContact O-CB 3.37Å; E229-W233 PolarHBondContact O-N 3.38Å; W233-H235 VanDerWaalsContact C-N 3.26Å; W233-H235 PolarHBondContact O-N 3.48Å; W233-I236 PolarHBondContact O-N 3.44Å; W233-V237 HydrophobicContact CG-CG2 4.3Å; W233-V237 WeakPolarHBondContact O-CB 3.38Å; W233-V237 VanDerWaalsContact O-CG2 3.31Å; W233-V237 WeakPolarHBondContact O-CG2 3.34Å; W233-V237 PolarHBondContact O-N 2.61Å; W233-F251 HydrophobicContact CD2-CZ 4.45Å; W233-F251 HydrophobicContact CE3-CZ 4.29Å; W233-F251 HydrophobicContact CH2-CE1 4.15Å; W233-F251 HydrophobicContact CH2-CE2 4.28Å; W233-F251 AromaticContact CH2-CZ 3.42Å; W233-F251 HydrophobicContact CH2-CZ 3.42Å; W233-F251 VanDerWaalsContact CH2-CZ 3.42Å; W233-F251 HydrophobicContact CZ2-CE2 4.05Å; W233-F251 AromaticContact CZ2-CZ 3.62Å; W233-F251 HydrophobicContact CZ2-CZ 3.62Å; W233-F251 HydrophobicContact CZ3-CE1 4.38Å; W233-F251 AromaticContact CZ3-CZ 3.81Å; W233-F251 HydrophobicContact CZ3-CZ 3.81Å
234Q65.2Low74.3Confident29 Ų2942 Ų4214%0.13619%0.191CC..Hα-helixtrans-62.4-38.3-176.4-68.1-172.94.400111.5I230 V231 R238I230-Q234 VanDerWaalsContact O-CB 3.27Å; I230-Q234 WeakPolarHBondContact O-CB 3.38Å; I230-Q234 WeakPolarHBondContact O-CG 3.49Å; V231-Q234 PolarHBondContact O-N 3.35Å; Q234-R238 WeakPolarHBondContact O-CB 3.22Å; Q234-R238 WeakPolarHBondContact O-CG 3.42Å; Q234-R238 PolarHBondContact O-N 2.95Å
235H65.5Low73.6Confident27 Ų2743.2 Ų43.213%0.12520%0.203CC..Hα-helixtrans-68.1-48179.7-170.484.3000112.5V231 W233 R239 Y364V231-H235 WeakPolarHBondContact O-CB 3.37Å; V231-H235 PolarHBondContact O-N 3.35Å; W233-H235 VanDerWaalsContact C-N 3.26Å; W233-H235 PolarHBondContact O-N 3.48Å; H235-R239 PolarHBondContact CE1-NH1 3.3Å; H235-R239 PolarHBondContact NE2-NH1 3.43Å; H235-R239 VanDerWaalsContact O-CB 3.3Å; H235-R239 WeakPolarHBondContact O-CB 3.38Å; H235-R239 PolarHBondContact O-N 3.17Å; H235-R239 VanDerWaalsContact O-N 3.11Å; H235-Y364 AromaticContact CE1-CE1 3.33Å; H235-Y364 WeakPolarHBondContact CE1-CE1 3.3Å; H235-Y364 AromaticContact CE1-CE2 3.94Å; H235-Y364 AromaticContact CE1-CZ 3.25Å; H235-Y364 PolarHBondContact CE1-OH 3.49Å; H235-Y364 VanDerWaalsContact CE1-OH 3.27Å; H235-Y364 AromaticContact ND1-CD1 3.63Å; H235-Y364 AromaticContact ND1-CE1 3.38Å; H235-Y364 WeakPolarHBondContact ND1-CE1 3.32Å; H235-Y364 AromaticContact ND1-CE2 3.91Å; H235-Y364 AromaticContact ND1-CZ 3.53Å
236I66.7Low73.1Confident1 Ų145.7 Ų45.71%0.00522%0.216CC..Hα-helixtrans-73.6-49-175.6-67.7175.8000110.9T232 W233 R238 R239 H240 S241 L250 Y299 T302 M306T232-I236 HydrophobicContact CG2-CD1 3.44Å; T232-I236 VanDerWaalsContact CG2-CD1 3.44Å; T232-I236 HydrophobicContact CG2-CG1 4.19Å; T232-I236 VanDerWaalsContact O-CB 3.26Å; T232-I236 WeakPolarHBondContact O-CB 3.45Å; T232-I236 VanDerWaalsContact O-CG1 3.25Å; T232-I236 WeakPolarHBondContact O-CG1 3.47Å; T232-I236 PolarHBondContact O-N 3Å; W233-I236 PolarHBondContact O-N 3.44Å; I236-R238 VanDerWaalsContact C-N 3.28Å; I236-R238 PolarHBondContact O-N 2.97Å; I236-R239 PolarHBondContact O-N 3.38Å; I236-H240 HydrophobicContact CG2-CB 4.49Å; I236-H240 WeakPolarHBondContact O-CA 3.44Å; I236-H240 WeakPolarHBondContact O-CB 3.16Å; I236-H240 PolarHBondContact O-N 3.42Å; I236-S241 PolarHBondContact O-N 3.35Å; I236-L250 HydrophobicContact CD1-CD2 4.46Å; I236-L250 HydrophobicContact CG2-CD2 3.79Å; I236-Y299 HydrophobicContact CG2-CE2 3.81Å; I236-T302 HydrophobicContact CD1-CG2 3.47Å; I236-T302 VanDerWaalsContact CD1-CG2 3.47Å; I236-T302 HydrophobicContact CG1-CG2 3.8Å; I236-M306 HydrophobicContact CD1-CE 3.92Å; I236-M306 HydrophobicContact CD1-CG 4.06Å; I236-M306 HydrophobicContact CD1-SD 3.02Å; I236-M306 WeakPolarHBondContact CD1-SD 3.48Å
237V66.6Low72.7Confident5 Ų545.4 Ų45.43%0.0321%0.214CC..Hα-helixtrans-64.7-39.3-175.8-1730000109.5F32 W35 W233 S241F32-V237 HydrophobicContact CE1-CG1 3.8Å; F32-V237 HydrophobicContact CE2-CG1 4.17Å; F32-V237 HydrophobicContact CZ-CG1 3.45Å; F32-V237 VanDerWaalsContact CZ-CG1 3.45Å; W35-V237 HydrophobicContact CH2-CB 3.84Å; W35-V237 HydrophobicContact CH2-CG1 3.24Å; W35-V237 HydrophobicContact CZ2-CG1 4.18Å; W35-V237 HydrophobicContact CZ3-CG1 3.69Å; W233-V237 HydrophobicContact CG-CG2 4.3Å; W233-V237 WeakPolarHBondContact O-CB 3.38Å; W233-V237 VanDerWaalsContact O-CG2 3.31Å; W233-V237 WeakPolarHBondContact O-CG2 3.34Å; W233-V237 PolarHBondContact O-N 2.61Å; V237-S241 CarbonylContact O-C 3.53Å; V237-S241 PolarHBondContact O-N 2.91Å; V237-S241 VanDerWaalsContact O-N 3.11Å
238R67.5Low72.6Confident102 Ų10245.9 Ų45.939%0.38522%0.217SC..Hα-helixtrans-69.9-33.7176.1-71.6-174.4177.4137.713.8115.2W35 M43 Q234 I236W35-R238 HydrophobicContact CH2-CG 3.9Å; W35-R238 HydrophobicContact CZ2-CG 3.59Å; M43-R238 PolarHBondContact SD-NH1 3.22Å; M43-R238 PolarHBondContact SD-NH2 3.14Å; Q234-R238 WeakPolarHBondContact O-CB 3.22Å; Q234-R238 WeakPolarHBondContact O-CG 3.42Å; Q234-R238 PolarHBondContact O-N 2.95Å; I236-R238 VanDerWaalsContact C-N 3.28Å; I236-R238 PolarHBondContact O-N 2.97Å
239R71.7Confident72.7Confident155 Ų15549 Ų4959%0.58524%0.238SC*.Hα-helixtrans-88.7-30.2-177.2-80.4-167.9171.4174.9-5.1113.9H235 I236H235-R239 PolarHBondContact CE1-NH1 3.3Å; H235-R239 PolarHBondContact NE2-NH1 3.43Å; H235-R239 VanDerWaalsContact O-CB 3.3Å; H235-R239 WeakPolarHBondContact O-CB 3.38Å; H235-R239 PolarHBondContact O-N 3.17Å; H235-R239 VanDerWaalsContact O-N 3.11Å; I236-R239 PolarHBondContact O-N 3.38Å
240H70.2Confident73Confident67 Ų6744.7 Ų44.731%0.3122%0.218SC..Hα-helixtrans-133.3-15.4-164.6-56.298.2000114.3I236 Y299I236-H240 HydrophobicContact CG2-CB 4.49Å; I236-H240 WeakPolarHBondContact O-CA 3.44Å; I236-H240 WeakPolarHBondContact O-CB 3.16Å; I236-H240 PolarHBondContact O-N 3.42Å; H240-Y299 HydrophobicContact CB-CD2 3.57Å; H240-Y299 HydrophobicContact CB-CE2 3.63Å; H240-Y299 HydrophobicContact CB-CG 4.38Å; H240-Y299 AromaticContact CD2-CD2 3.58Å; H240-Y299 AromaticContact CD2-CG 3.81Å; H240-Y299 AromaticContact CG-CD2 3.34Å; H240-Y299 AromaticContact CG-CE2 3.93Å; H240-Y299 AromaticContact ND1-CD2 3.67Å
241S68.5Low73.4Confident1 Ų145.2 Ų45.21%0.00722%0.22CC..  trans-11481177.9-49.90000109.7I236 V237 T243I236-S241 PolarHBondContact O-N 3.35Å; V237-S241 CarbonylContact O-C 3.53Å; V237-S241 PolarHBondContact O-N 2.91Å; V237-S241 VanDerWaalsContact O-N 3.11Å; S241-T243 PolarHBondContact O-N 2.99Å
242E68.8Low74.3Confident181 Ų18146.3 Ų46.385%0.84623%0.228SC*.SBendtrans-61.4-31.2172.5-64.5-176177.500110.7
243T78.5Confident75.6Confident64 Ų6449.6 Ų49.639%0.39324%0.244SC..SBendtrans-118.9152.6-177.973.10000112.6S241 G245 D246S241-T243 PolarHBondContact O-N 2.99Å; T243-G245 PolarHBondContact O-N 2.93Å; T243-G245 VanDerWaalsContact O-N 3.14Å; T243-G245 PolarHBondContact OG1-N 3.47Å; T243-D246 PolarHBondContact N-OD2 3.25Å; T243-D246 PolarHBondContact O-N 2.93Å; T243-D246 PolarHBondContact OG1-N 3.33Å; T243-D246 PolarHBondContact OG1-OD2 3.16Å
244P75.3Confident76.5Confident16 Ų1647.5 Ų47.510%0.10424%0.237CC..Hα-helixtrans-56.2-24.9168.3-24.233000113.5F32 T155 I160 T248F32-P244 HydrophobicContact CD1-CG 4.01Å; F32-P244 HydrophobicContact CD2-CB 4.38Å; F32-P244 HydrophobicContact CD2-CG 4.21Å; F32-P244 HydrophobicContact CE1-CG 4.15Å; F32-P244 HydrophobicContact CE2-CB 4.19Å; F32-P244 HydrophobicContact CE2-CG 4.35Å; F32-P244 HydrophobicContact CG-CG 4.04Å; F32-P244 HydrophobicContact CZ-CB 4.32Å; F32-P244 HydrophobicContact CZ-CG 4.31Å; T155-P244 HydrophobicContact CG2-CB 4.22Å; T155-P244 HydrophobicContact CG2-CG 4.48Å; I160-P244 HydrophobicContact CD1-CG 3.78Å; I160-P244 HydrophobicContact CG1-CG 3.96Å; P244-T248 WeakPolarHBondContact O-CB 3.34Å; P244-T248 PolarHBondContact O-N 3.43Å; P244-T248 PolarHBondContact O-OG1 3.36Å
245G78.7Confident77.4Confident25 Ų2546.2 Ų46.226%0.25823%0.232SC..Hα-helixtrans-63.6-42.9176.700000112.9T243 T248 V249T243-G245 PolarHBondContact O-N 2.93Å; T243-G245 VanDerWaalsContact O-N 3.14Å; T243-G245 PolarHBondContact OG1-N 3.47Å; G245-T248 VanDerWaalsContact O-CB 3.28Å; G245-T248 WeakPolarHBondContact O-CB 3.24Å; G245-T248 PolarHBondContact O-N 2.91Å; G245-V249 PolarHBondContact O-N 2.87Å
246D80Confident78.6Confident71 Ų7147.7 Ų47.738%0.3825%0.245SC..Hα-helixtrans-67.9-41.8178.9-57.3-47000111.2T243 T248 V249 L250T243-D246 PolarHBondContact N-OD2 3.25Å; T243-D246 PolarHBondContact O-N 2.93Å; T243-D246 PolarHBondContact OG1-N 3.33Å; T243-D246 PolarHBondContact OG1-OD2 3.16Å; D246-T248 VanDerWaalsContact C-N 3.29Å; D246-T248 PolarHBondContact O-N 3.22Å; D246-V249 PolarHBondContact O-N 3.49Å; D246-L250 PolarHBondContact O-N 3.4Å
247A82.5Confident79.6Confident0 Ų048.4 Ų48.40%025%0.251CS..Hα-helixtrans-60.5-41.4173.400000110.7L28 F32 V249 L250 F251L28-A247 HydrophobicContact CD1-CB 3.66Å; F32-A247 HydrophobicContact CE2-CB 4.04Å; F32-A247 HydrophobicContact CZ-CB 3.85Å; A247-V249 VanDerWaalsContact C-N 3.3Å; A247-V249 PolarHBondContact O-N 3.31Å; A247-L250 WeakPolarHBondContact O-CB 3.42Å; A247-L250 PolarHBondContact O-N 3.23Å; A247-L250 VanDerWaalsContact O-N 3.08Å; A247-F251 VanDerWaalsContact O-CD2 3.24Å; A247-F251 WeakPolarHBondContact O-CD2 3.35Å; A247-F251 PolarHBondContact O-N 3.44Å
248T84.8Confident80.5Confident13 Ų1349.5 Ų49.58%0.0826%0.256CS..Hα-helixtrans-54.6-44.7177.6-59.20000112.3L28 P148 G152 P244 G245 D246 L250 F251 C252L28-T248 WeakPolarHBondContact CD2-OG1 3.26Å; P148-T248 VanDerWaalsContact O-CG2 3.32Å; P148-T248 WeakPolarHBondContact O-CG2 3.49Å; G152-T248 WeakPolarHBondContact CA-OG1 3.34Å; P244-T248 WeakPolarHBondContact O-CB 3.34Å; P244-T248 PolarHBondContact O-N 3.43Å; P244-T248 PolarHBondContact O-OG1 3.36Å; G245-T248 VanDerWaalsContact O-CB 3.28Å; G245-T248 WeakPolarHBondContact O-CB 3.24Å; G245-T248 PolarHBondContact O-N 2.91Å; D246-T248 VanDerWaalsContact C-N 3.29Å; D246-T248 PolarHBondContact O-N 3.22Å; T248-L250 VanDerWaalsContact C-N 3.34Å; T248-L250 PolarHBondContact O-N 2.68Å; T248-F251 PolarHBondContact O-N 3.04Å; T248-C252 PolarHBondContact O-N 3.34Å; T248-C252 PolarHBondContact O-SG 2.97Å
249V86.1Confident81.3Confident89 Ų8946 Ų4654%0.53925%0.245SC..Hα-helixtrans-61.4-44.9178.4176.50000110.8G245 D246 A247 F251 C252 I253G245-V249 PolarHBondContact O-N 2.87Å; D246-V249 PolarHBondContact O-N 3.49Å; A247-V249 VanDerWaalsContact C-N 3.3Å; A247-V249 PolarHBondContact O-N 3.31Å; V249-F251 PolarHBondContact O-N 2.87Å; V249-C252 PolarHBondContact O-N 3.25Å; V249-I253 HydrophobicContact CG1-CD1 4.02Å; V249-I253 WeakPolarHBondContact O-CG1 3.38Å; V249-I253 PolarHBondContact O-N 3.28Å
250L84.9Confident82.1Confident6 Ų644.3 Ų44.33%0.03124%0.242CC..Hα-helixtrans-59.1-47.5176.4178.360000111.6I236 D246 A247 T248 C252 I253 L254 V303 M306I236-L250 HydrophobicContact CD1-CD2 4.46Å; I236-L250 HydrophobicContact CG2-CD2 3.79Å; D246-L250 PolarHBondContact O-N 3.4Å; A247-L250 WeakPolarHBondContact O-CB 3.42Å; A247-L250 PolarHBondContact O-N 3.23Å; A247-L250 VanDerWaalsContact O-N 3.08Å; T248-L250 VanDerWaalsContact C-N 3.34Å; T248-L250 PolarHBondContact O-N 2.68Å; L250-C252 VanDerWaalsContact C-N 3.32Å; L250-C252 PolarHBondContact O-N 3.13Å; L250-I253 WeakPolarHBondContact O-CB 3.39Å; L250-I253 PolarHBondContact O-N 3.35Å; L250-I253 VanDerWaalsContact O-N 3.15Å; L250-L254 HydrophobicContact CD1-CD1 4.06Å; L250-L254 HydrophobicContact CD1-CG 4.15Å; L250-L254 HydrophobicContact CG-CD1 3.99Å; L250-L254 HydrophobicContact CG-CG 4.47Å; L250-L254 WeakPolarHBondContact O-CG 3.34Å; L250-L254 PolarHBondContact O-N 2.95Å; L250-V303 HydrophobicContact CD1-CB 4.42Å; L250-V303 HydrophobicContact CD1-CG1 3.93Å; L250-V303 HydrophobicContact CD1-CG2 3.84Å; L250-M306 HydrophobicContact CD1-CE 4.47Å; L250-M306 HydrophobicContact CD1-SD 3.97Å; L250-M306 HydrophobicContact CD2-CE 4.06Å; L250-M306 HydrophobicContact CD2-SD 4.05Å; L250-M306 HydrophobicContact CG-CE 4.47Å; L250-M306 HydrophobicContact CG-SD 4.47Å
251F82.3Confident82.9Confident31 Ų3141.9 Ų41.914%0.13623%0.231CC..Hα-helixtrans-62.5-38177.5-85.3-86.4000112.6L28 P148 W233 A247 T248 V249 I253 L254 G255L28-F251 HydrophobicContact CD1-CD2 3.38Å; L28-F251 HydrophobicContact CD1-CE2 3.6Å; L28-F251 HydrophobicContact CD1-CG 4.22Å; P148-F251 HydrophobicContact CB-CB 3.42Å; P148-F251 VanDerWaalsContact CB-CB 3.42Å; P148-F251 HydrophobicContact CB-CD1 4.38Å; P148-F251 HydrophobicContact CB-CG 3.94Å; P148-F251 HydrophobicContact CG-CB 3.72Å; P148-F251 HydrophobicContact CG-CD1 3.88Å; P148-F251 HydrophobicContact CG-CG 3.96Å; W233-F251 HydrophobicContact CD2-CZ 4.45Å; W233-F251 HydrophobicContact CE3-CZ 4.29Å; W233-F251 HydrophobicContact CH2-CE1 4.15Å; W233-F251 HydrophobicContact CH2-CE2 4.28Å; W233-F251 AromaticContact CH2-CZ 3.42Å; W233-F251 HydrophobicContact CH2-CZ 3.42Å; W233-F251 VanDerWaalsContact CH2-CZ 3.42Å; W233-F251 HydrophobicContact CZ2-CE2 4.05Å; W233-F251 AromaticContact CZ2-CZ 3.62Å; W233-F251 HydrophobicContact CZ2-CZ 3.62Å; W233-F251 HydrophobicContact CZ3-CE1 4.38Å; W233-F251 AromaticContact CZ3-CZ 3.81Å; W233-F251 HydrophobicContact CZ3-CZ 3.81Å; A247-F251 VanDerWaalsContact O-CD2 3.24Å; A247-F251 WeakPolarHBondContact O-CD2 3.35Å; A247-F251 PolarHBondContact O-N 3.44Å; T248-F251 PolarHBondContact O-N 3.04Å; V249-F251 PolarHBondContact O-N 2.87Å; F251-I253 VanDerWaalsContact C-N 3.34Å; F251-I253 PolarHBondContact O-N 3.49Å; F251-L254 PolarHBondContact O-N 3.37Å; F251-G255 WeakPolarHBondContact O-CA 3.36Å; F251-G255 PolarHBondContact O-N 2.93Å
252C86.5Confident83.5Confident27 Ų2744.1 Ų44.118%0.18224%0.243CC..Hα-helixtrans-62.6-40.8173.9-72.90000111.9T248 V249 L250 S256T248-C252 PolarHBondContact O-N 3.34Å; T248-C252 PolarHBondContact O-SG 2.97Å; V249-C252 PolarHBondContact O-N 3.25Å; L250-C252 VanDerWaalsContact C-N 3.32Å; L250-C252 PolarHBondContact O-N 3.13Å; C252-S256 VanDerWaalsContact O-CB 3.24Å; C252-S256 WeakPolarHBondContact O-CB 3.4Å; C252-S256 PolarHBondContact O-N 3.23Å; C252-S256 PolarHBondContact O-OG 3.44Å
253I89.9Confident84.2Confident72 Ų7239.9 Ų39.937%0.36922%0.222SC..Hα-helixtrans-64.4-49.7176.8-68.5166.7000110.3V249 L250 F251 S256 A257 I307V249-I253 HydrophobicContact CG1-CD1 4.02Å; V249-I253 WeakPolarHBondContact O-CG1 3.38Å; V249-I253 PolarHBondContact O-N 3.28Å; L250-I253 WeakPolarHBondContact O-CB 3.39Å; L250-I253 PolarHBondContact O-N 3.35Å; L250-I253 VanDerWaalsContact O-N 3.15Å; F251-I253 VanDerWaalsContact C-N 3.34Å; F251-I253 PolarHBondContact O-N 3.49Å; I253-S256 PolarHBondContact O-N 3.21Å; I253-A257 PolarHBondContact O-N 3.2Å; I253-I307 HydrophobicContact CG2-CD1 3.61Å; I253-I307 HydrophobicContact CG2-CG1 3.96Å
254L87.2Confident84.5Confident16 Ų1642.5 Ų42.58%0.08423%0.226CC..Hα-helixtrans-65.6-44.1-179.7-61.6174000111.7L250 F251 S256 A257 I258 M306 I307L250-L254 HydrophobicContact CD1-CD1 4.06Å; L250-L254 HydrophobicContact CD1-CG 4.15Å; L250-L254 HydrophobicContact CG-CD1 3.99Å; L250-L254 HydrophobicContact CG-CG 4.47Å; L250-L254 WeakPolarHBondContact O-CG 3.34Å; L250-L254 PolarHBondContact O-N 2.95Å; F251-L254 PolarHBondContact O-N 3.37Å; L254-S256 VanDerWaalsContact C-N 3.33Å; L254-S256 PolarHBondContact O-N 2.83Å; L254-A257 WeakPolarHBondContact O-CB 3.36Å; L254-A257 PolarHBondContact O-N 3.09Å; L254-I258 WeakPolarHBondContact O-CG1 3.19Å; L254-I258 PolarHBondContact O-N 2.96Å; L254-M306 HydrophobicContact CD1-CE 3.48Å; L254-M306 VanDerWaalsContact CD1-CE 3.48Å; L254-M306 HydrophobicContact CD1-SD 4.42Å; L254-M306 HydrophobicContact CD2-CB 3.73Å; L254-I307 HydrophobicContact CD2-CG1 3.91Å
255G84Confident85.1Confident2 Ų242 Ų422%0.02122%0.224CC..Hα-helixtrans-59.7-42.2175.100000112.1F251 A257 I258 L259F251-G255 WeakPolarHBondContact O-CA 3.36Å; F251-G255 PolarHBondContact O-N 2.93Å; G255-A257 VanDerWaalsContact C-N 3.35Å; G255-A257 PolarHBondContact O-N 3.37Å; G255-I258 PolarHBondContact O-N 3.23Å; G255-L259 WeakPolarHBondContact O-CB 3.48Å; G255-L259 WeakPolarHBondContact O-CG 3.18Å; G255-L259 PolarHBondContact O-N 2.95Å
256S88.9Confident85.4Confident57 Ų5741.7 Ų41.740%0.39922%0.216SC..Hα-helixtrans-62.8-40.5174.6-60.90000112.1C252 I253 L254 L259 F260C252-S256 VanDerWaalsContact O-CB 3.24Å; C252-S256 WeakPolarHBondContact O-CB 3.4Å; C252-S256 PolarHBondContact O-N 3.23Å; C252-S256 PolarHBondContact O-OG 3.44Å; I253-S256 PolarHBondContact O-N 3.21Å; L254-S256 VanDerWaalsContact C-N 3.33Å; L254-S256 PolarHBondContact O-N 2.83Å; S256-L259 PolarHBondContact O-N 3.16Å; S256-F260 WeakPolarHBondContact O-CB 3.33Å; S256-F260 PolarHBondContact O-N 2.84Å
257A89.5Confident85.6Confident16 Ų1642.5 Ų42.513%0.13221%0.214CC..Hα-helixtrans-64.7-42.5176.600000112.2I253 L254 G255 F260 M261 I307 V311I253-A257 PolarHBondContact O-N 3.2Å; L254-A257 WeakPolarHBondContact O-CB 3.36Å; L254-A257 PolarHBondContact O-N 3.09Å; G255-A257 VanDerWaalsContact C-N 3.35Å; G255-A257 PolarHBondContact O-N 3.37Å; A257-F260 PolarHBondContact O-N 3.47Å; A257-M261 WeakPolarHBondContact O-CB 3.49Å; A257-M261 WeakPolarHBondContact O-CG 3.36Å; A257-M261 PolarHBondContact O-N 3.23Å; A257-I307 HydrophobicContact CB-CG2 3.91Å; A257-V311 HydrophobicContact CB-CG2 4.11Å
258I84.9Confident85.9Confident28 Ų2848 Ų4814%0.14424%0.237CC..Hα-helixtrans-60.8-47.9174.6-65.9169.5000110.4L144 L254 G255 F260 M261 N262 T310L144-I258 HydrophobicContact CD1-CD1 3.75Å; L144-I258 HydrophobicContact CD1-CG2 4.06Å; L254-I258 WeakPolarHBondContact O-CG1 3.19Å; L254-I258 PolarHBondContact O-N 2.96Å; G255-I258 PolarHBondContact O-N 3.23Å; I258-F260 PolarHBondContact O-N 2.95Å; I258-M261 PolarHBondContact O-N 3.02Å; I258-N262 WeakPolarHBondContact CG2-ND2 3.38Å; I258-N262 WeakPolarHBondContact O-CB 3.43Å; I258-N262 PolarHBondContact O-N 3.18Å; I258-T310 HydrophobicContact CD1-CG2 3.36Å; I258-T310 HydrophobicContact CG1-CG2 3.09Å
259L85Confident86.2Confident29 Ų2950 Ų5015%0.15225%0.247CC..Hα-helixtrans-58.4-49.3179.1-78.8179.6000111.6G141 M145 G255 S256 M261 N262 F263G141-L259 WeakPolarHBondContact O-CD2 3.38Å; M145-L259 HydrophobicContact CB-CD1 4.3Å; M145-L259 HydrophobicContact CE-CD1 4.35Å; M145-L259 HydrophobicContact SD-CD1 4.35Å; G255-L259 WeakPolarHBondContact O-CB 3.48Å; G255-L259 WeakPolarHBondContact O-CG 3.18Å; G255-L259 PolarHBondContact O-N 2.95Å; S256-L259 PolarHBondContact O-N 3.16Å; L259-M261 VanDerWaalsContact C-N 3.29Å; L259-M261 PolarHBondContact O-N 3.46Å; L259-N262 PolarHBondContact O-N 3.36Å; L259-F263 HydrophobicContact CD2-CD2 4.23Å; L259-F263 HydrophobicContact CD2-CE2 3.76Å; L259-F263 WeakPolarHBondContact O-CB 3.49Å; L259-F263 VanDerWaalsContact O-CD2 3.25Å; L259-F263 WeakPolarHBondContact O-CD2 3.34Å; L259-F263 PolarHBondContact O-N 2.77Å
260F88.6Confident86.1Confident120 Ų12049 Ų4953%0.52624%0.236SC..Hα-helixtrans-56.8-44.3176.2176.4-99.6000111.6S256 A257 I258 Y264 G265S256-F260 WeakPolarHBondContact O-CB 3.33Å; S256-F260 PolarHBondContact O-N 2.84Å; A257-F260 PolarHBondContact O-N 3.47Å; I258-F260 PolarHBondContact O-N 2.95Å; F260-Y264 HydrophobicContact CE1-CD1 4.14Å; F260-Y264 AromaticContact CE2-CD1 3.59Å; F260-Y264 HydrophobicContact CE2-CD1 3.59Å; F260-Y264 HydrophobicContact CE2-CE1 4.29Å; F260-Y264 HydrophobicContact CE2-CG 4.13Å; F260-Y264 AromaticContact CZ-CD1 3.38Å; F260-Y264 HydrophobicContact CZ-CD1 3.38Å; F260-Y264 AromaticContact CZ-CE1 3.9Å; F260-Y264 HydrophobicContact CZ-CE1 3.9Å; F260-Y264 HydrophobicContact CZ-CG 4.33Å; F260-Y264 WeakPolarHBondContact O-CA 3.41Å; F260-Y264 WeakPolarHBondContact O-CB 3.46Å; F260-Y264 PolarHBondContact O-N 3.37Å; F260-G265 PolarHBondContact O-N 3.01Å
261M86.6Confident86.3Confident15 Ų1556.4 Ų56.47%0.07427%0.27CS..Iπ-helixtrans-67.6-44.9178.5-74.7-54.9-5500113.3A257 I258 L259 F263 G265 I266 L269 V311 V315A257-M261 WeakPolarHBondContact O-CB 3.49Å; A257-M261 WeakPolarHBondContact O-CG 3.36Å; A257-M261 PolarHBondContact O-N 3.23Å; I258-M261 PolarHBondContact O-N 3.02Å; L259-M261 VanDerWaalsContact C-N 3.29Å; L259-M261 PolarHBondContact O-N 3.46Å; M261-F263 VanDerWaalsContact C-N 3.33Å; M261-F263 PolarHBondContact O-N 3.32Å; M261-G265 CarbonylContact O-C 3.57Å; M261-G265 WeakPolarHBondContact O-CA 3.35Å; M261-G265 PolarHBondContact O-N 2.78Å; M261-G265 VanDerWaalsContact O-N 3.14Å; M261-I266 WeakPolarHBondContact O-CG1 3.32Å; M261-I266 PolarHBondContact O-N 3.4Å; M261-L269 HydrophobicContact CE-CD1 3.78Å; M261-V311 HydrophobicContact CE-CG1 3.82Å; M261-V311 HydrophobicContact CG-CB 3.86Å; M261-V311 HydrophobicContact CG-CG1 3.49Å; M261-V311 VanDerWaalsContact CG-CG1 3.49Å; M261-V311 HydrophobicContact CG-CG2 3.47Å; M261-V311 VanDerWaalsContact CG-CG2 3.47Å; M261-V311 HydrophobicContact SD-CG1 3.58Å; M261-V311 VanDerWaalsContact SD-CG1 3.58Å; M261-V311 HydrophobicContact SD-CG2 4.37Å; M261-V315 HydrophobicContact CE-CG2 3.59Å
262N81.1Confident86.8Confident48 Ų4859.7 Ų59.726%0.25729%0.289SS..Iπ-helixtrans-64.6-38.6-179.3-73.9-10.9000112I258 L259I258-N262 WeakPolarHBondContact CG2-ND2 3.38Å; I258-N262 WeakPolarHBondContact O-CB 3.43Å; I258-N262 PolarHBondContact O-N 3.18Å; L259-N262 PolarHBondContact O-N 3.36Å
263F82.5Confident87Confident92 Ų9262.4 Ų62.440%0.40430%0.298SS..Iπ-helixtrans-86.6-43.4-177.3-74.7-61.8000114.2I138 L259 M261 R267I138-F263 HydrophobicContact CB-CZ 4.3Å; I138-F263 HydrophobicContact CD1-CE1 4.14Å; I138-F263 HydrophobicContact CG1-CE1 3.8Å; I138-F263 HydrophobicContact CG1-CZ 4.01Å; I138-F263 HydrophobicContact CG2-CE1 4.27Å; I138-F263 HydrophobicContact CG2-CZ 3.75Å; L259-F263 HydrophobicContact CD2-CD2 4.23Å; L259-F263 HydrophobicContact CD2-CE2 3.76Å; L259-F263 WeakPolarHBondContact O-CB 3.49Å; L259-F263 VanDerWaalsContact O-CD2 3.25Å; L259-F263 WeakPolarHBondContact O-CD2 3.34Å; L259-F263 PolarHBondContact O-N 2.77Å; M261-F263 VanDerWaalsContact C-N 3.33Å; M261-F263 PolarHBondContact O-N 3.32Å; F263-R267 VanDerWaalsContact O-CD 3.3Å; F263-R267 WeakPolarHBondContact O-CD 3.45Å; F263-R267 PolarHBondContact O-NE 3.46Å
264Y86.4Confident87Confident119 Ų11962.2 Ų62.247%0.46730%0.297SS..Iπ-helixtrans-113.4-48.4-172.8179.3-97.6000112.2F260 R267 K268F260-Y264 HydrophobicContact CE1-CD1 4.14Å; F260-Y264 AromaticContact CE2-CD1 3.59Å; F260-Y264 HydrophobicContact CE2-CD1 3.59Å; F260-Y264 HydrophobicContact CE2-CE1 4.29Å; F260-Y264 HydrophobicContact CE2-CG 4.13Å; F260-Y264 AromaticContact CZ-CD1 3.38Å; F260-Y264 HydrophobicContact CZ-CD1 3.38Å; F260-Y264 AromaticContact CZ-CE1 3.9Å; F260-Y264 HydrophobicContact CZ-CE1 3.9Å; F260-Y264 HydrophobicContact CZ-CG 4.33Å; F260-Y264 WeakPolarHBondContact O-CA 3.41Å; F260-Y264 WeakPolarHBondContact O-CB 3.46Å; F260-Y264 PolarHBondContact O-N 3.37Å; Y264-R267 PolarHBondContact O-N 2.96Å; Y264-K268 HydrophobicContact CE1-CD 3.81Å; Y264-K268 PolarHBondContact O-N 3.45Å; Y264-K268 PolarHBondContact OH-NZ 3.27Å
265G86.6Confident87Confident6 Ų662.7 Ų62.76%0.06230%0.302CS..Iπ-helixtrans-61-51.3-171.700000114F260 M261 R267 K268 L269F260-G265 PolarHBondContact O-N 3.01Å; M261-G265 CarbonylContact O-C 3.57Å; M261-G265 WeakPolarHBondContact O-CA 3.35Å; M261-G265 PolarHBondContact O-N 2.78Å; M261-G265 VanDerWaalsContact O-N 3.14Å; G265-R267 VanDerWaalsContact C-N 3.33Å; G265-R267 PolarHBondContact O-N 2.91Å; G265-K268 PolarHBondContact O-N 2.78Å; G265-L269 WeakPolarHBondContact O-CB 3.46Å; G265-L269 VanDerWaalsContact O-CG 3.27Å; G265-L269 WeakPolarHBondContact O-CG 3.34Å; G265-L269 PolarHBondContact O-N 3.38Å
266I85.6Confident87.3Confident19 Ų1963.1 Ų63.110%0.09730%0.304CS..Hα-helixtrans-61.2-42.6-179.9-69.5174.7000110.5M261 K268 L269 K270 V315 A318M261-I266 WeakPolarHBondContact O-CG1 3.32Å; M261-I266 PolarHBondContact O-N 3.4Å; I266-K268 PolarHBondContact O-N 2.91Å; I266-L269 PolarHBondContact O-N 3.45Å; I266-K270 HydrophobicContact CG2-CD 3.98Å; I266-K270 HydrophobicContact CG2-CG 4.24Å; I266-K270 WeakPolarHBondContact O-CB 3.47Å; I266-K270 VanDerWaalsContact O-CG 3.31Å; I266-K270 WeakPolarHBondContact O-CG 3.35Å; I266-K270 PolarHBondContact O-N 2.96Å; I266-V315 HydrophobicContact CG1-CG2 4.09Å; I266-A318 HydrophobicContact CD1-CB 3.88Å
267R83.7Confident87.4Confident88 Ų8862.6 Ų62.633%0.33230%0.298SS..Hα-helixtrans-59.4-50177.6-64-172.7-173-154.22111.5F263 Y264 G265 L269 K270 H271 L399 L400 S402F263-R267 VanDerWaalsContact O-CD 3.3Å; F263-R267 WeakPolarHBondContact O-CD 3.45Å; F263-R267 PolarHBondContact O-NE 3.46Å; Y264-R267 PolarHBondContact O-N 2.96Å; G265-R267 VanDerWaalsContact C-N 3.33Å; G265-R267 PolarHBondContact O-N 2.91Å; R267-L269 VanDerWaalsContact C-N 3.32Å; R267-L269 PolarHBondContact O-N 2.84Å; R267-K270 PolarHBondContact O-N 3.49Å; R267-H271 PolarHBondContact O-N 3.25Å; R267-L399 PolarHBondContact NH1-O 2.8Å; R267-L399 PolarHBondContact NH2-O 3.31Å; R267-L400 HydrophobicContact CG-CD2 4.38Å; R267-S402 PolarHBondContact NH1-OXT 3.04Å
268K89.5Confident87.5Confident114 Ų11462 Ų6250%0.49629%0.293SS..Hα-helixtrans-64-38.2-179.6-173.6175.3-174.41740112.2Y264 G265 I266 N272Y264-K268 HydrophobicContact CE1-CD 3.81Å; Y264-K268 PolarHBondContact O-N 3.45Å; Y264-K268 PolarHBondContact OH-NZ 3.27Å; G265-K268 PolarHBondContact O-N 2.78Å; I266-K268 PolarHBondContact O-N 2.91Å; K268-N272 PolarHBondContact O-ND2 3.27Å
269L90Very high87.8Confident55 Ų5560.8 Ų60.829%0.28829%0.287SS..Hα-helixtrans-70-42.8178-70.6171.7000111.5M261 G265 I266 R267 H271 N272 F273 L278 V315M261-L269 HydrophobicContact CE-CD1 3.78Å; G265-L269 WeakPolarHBondContact O-CB 3.46Å; G265-L269 VanDerWaalsContact O-CG 3.27Å; G265-L269 WeakPolarHBondContact O-CG 3.34Å; G265-L269 PolarHBondContact O-N 3.38Å; I266-L269 PolarHBondContact O-N 3.45Å; R267-L269 VanDerWaalsContact C-N 3.32Å; R267-L269 PolarHBondContact O-N 2.84Å; L269-H271 PolarHBondContact O-N 2.91Å; L269-N272 PolarHBondContact O-N 2.89Å; L269-F273 HydrophobicContact CD2-CD2 4.15Å; L269-F273 HydrophobicContact CD2-CE2 4.06Å; L269-F273 WeakPolarHBondContact O-CD2 3.35Å; L269-F273 PolarHBondContact O-N 3.36Å; L269-L278 HydrophobicContact CB-CD1 3.66Å; L269-L278 HydrophobicContact CB-CD2 4.48Å; L269-L278 HydrophobicContact CD1-CD1 3.94Å; L269-L278 HydrophobicContact CG-CD1 4.26Å; L269-V315 HydrophobicContact CD1-CG2 4.27Å
270K85.3Confident88.3Confident69 Ų6962.3 Ų62.330%0.329%0.293SS..Hα-helixtrans-62.5-27.4177.5-77.9-171.1175.7-166.20114.6I266 R267 N272 L278 E319I266-K270 HydrophobicContact CG2-CD 3.98Å; I266-K270 HydrophobicContact CG2-CG 4.24Å; I266-K270 WeakPolarHBondContact O-CB 3.47Å; I266-K270 VanDerWaalsContact O-CG 3.31Å; I266-K270 WeakPolarHBondContact O-CG 3.35Å; I266-K270 PolarHBondContact O-N 2.96Å; R267-K270 PolarHBondContact O-N 3.49Å; K270-N272 PolarHBondContact O-N 3.33Å; K270-L278 HydrophobicContact CG-CD2 4.05Å; K270-E319 WeakPolarHBondContact CE-OE1 3.45Å; K270-E319 WeakPolarHBondContact CE-OE2 3.46Å; K270-E319 VanDerWaalsContact NZ-CD 3.34Å; K270-E319 IonicContact NZ-OE1 3.94Å; K270-E319 PolarHBondContact NZ-OE1 2.85Å; K270-E319 IonicContact NZ-OE2 3.77Å; K270-E319 PolarHBondContact NZ-OE2 3.46Å
271H88.3Confident88.7Confident161 Ų16160.5 Ų60.575%0.74529%0.288SS*.THydrogen-bonded Turntrans-66.2-27.1174.6-173.9-82.3000112.4R267 L269R267-H271 PolarHBondContact O-N 3.25Å; L269-H271 PolarHBondContact O-N 2.91Å
272N92.1Very high89.1Confident101 Ų10160 Ų6054%0.5429%0.287SS..THydrogen-bonded Turntrans-112-17.9-171.1-58.6-48.7000113.8K268 L269 K270K268-N272 PolarHBondContact O-ND2 3.27Å; L269-N272 PolarHBondContact O-N 2.89Å; K270-N272 PolarHBondContact O-N 3.33Å
273F91.7Very high89.8Confident83 Ų8357.9 Ų57.936%0.36428%0.275SS..SBendtrans-131.4140.5-174.4-59.8-74.1000111L269 T277 L278 I281L269-F273 HydrophobicContact CD2-CD2 4.15Å; L269-F273 HydrophobicContact CD2-CE2 4.06Å; L269-F273 WeakPolarHBondContact O-CD2 3.35Å; L269-F273 PolarHBondContact O-N 3.36Å; F273-T277 HydrophobicContact CD1-CG2 3.88Å; F273-L278 HydrophobicContact CB-CB 4.41Å; F273-I281 HydrophobicContact CD1-CD1 4.1Å; F273-I281 HydrophobicContact CE1-CD1 4.03Å; F273-I281 HydrophobicContact CZ-CD1 4.4Å
274D89.4Confident90.6Very high68 Ų6856.1 Ų56.136%0.36427%0.272SS..  trans-67.9157.916864.3-74.7000111T276 T277 L278D274-T276 PolarHBondContact O-N 3.32Å; D274-T276 VanDerWaalsContact OD2-CB 3.3Å; D274-T276 WeakPolarHBondContact OD2-CB 3.42Å; D274-T276 PolarHBondContact OD2-N 2.91Å; D274-T277 VanDerWaalsContact CG-OG1 3.26Å; D274-T277 PolarHBondContact O-N 3.41Å; D274-T277 WeakPolarHBondContact OD1-CB 3.5Å; D274-T277 PolarHBondContact OD1-OG1 3.45Å; D274-T277 PolarHBondContact OD2-N 2.93Å; D274-T277 PolarHBondContact OD2-OG1 3.39Å; D274-L278 WeakPolarHBondContact O-CB 3.25Å; D274-L278 PolarHBondContact O-N 2.97Å
275P87.1Confident91.1Very high27 Ų2752 Ų5218%0.17526%0.26CS..Hα-helixtrans-56.5-35.1-177.7-2735.4000113.9V279P275-V279 WeakPolarHBondContact O-CG2 3.34Å; P275-V279 PolarHBondContact O-N 3.11Å; P275-V279 VanDerWaalsContact O-N 3.16Å
276T90.2Very high91.5Very high11 Ų1151.7 Ų51.77%0.06726%0.257CS..Hα-helixtrans-68.2-54.7-179-53.90000110.3D274 L278 V279 E280 I382 G386 L389 N390D274-T276 PolarHBondContact O-N 3.32Å; D274-T276 VanDerWaalsContact OD2-CB 3.3Å; D274-T276 WeakPolarHBondContact OD2-CB 3.42Å; D274-T276 PolarHBondContact OD2-N 2.91Å; T276-L278 PolarHBondContact O-N 2.9Å; T276-V279 PolarHBondContact O-N 3.39Å; T276-V279 VanDerWaalsContact O-N 3.15Å; T276-E280 WeakPolarHBondContact O-CG 3.47Å; T276-E280 PolarHBondContact O-N 3.45Å; T276-I382 HydrophobicContact CG2-CG2 3.84Å; T276-G386 PolarHBondContact OG1-O 3.21Å; T276-L389 HydrophobicContact CG2-CD1 4.24Å; T276-L389 WeakPolarHBondContact OG1-CB 3.44Å; T276-N390 PolarHBondContact OG1-OD1 2.83Å
277T92.1Very high92.1Very high46 Ų4653.4 Ų53.428%0.28227%0.265SS..Hα-helixtrans-57.2-38.3176.8-59.20000111.6F273 D274 V279 E280 I281F273-T277 HydrophobicContact CD1-CG2 3.88Å; D274-T277 VanDerWaalsContact CG-OG1 3.26Å; D274-T277 PolarHBondContact O-N 3.41Å; D274-T277 WeakPolarHBondContact OD1-CB 3.5Å; D274-T277 PolarHBondContact OD1-OG1 3.45Å; D274-T277 PolarHBondContact OD2-N 2.93Å; D274-T277 PolarHBondContact OD2-OG1 3.39Å; T277-V279 PolarHBondContact O-N 2.99Å; T277-E280 PolarHBondContact O-N 2.88Å; T277-I281 HydrophobicContact CG2-CD1 3.78Å; T277-I281 HydrophobicContact CG2-CG1 4.31Å; T277-I281 WeakPolarHBondContact O-CB 3.34Å; T277-I281 VanDerWaalsContact O-CG1 3.26Å; T277-I281 WeakPolarHBondContact O-CG1 3.41Å; T277-I281 PolarHBondContact O-N 2.95Å
278L91.2Very high92.7Very high4 Ų453.2 Ų53.22%0.02127%0.27CS..Hα-helixtrans-62.8-43.3179-174.359.2000112.4L269 K270 F273 D274 T276 A282 V315 E319L269-L278 HydrophobicContact CB-CD1 3.66Å; L269-L278 HydrophobicContact CB-CD2 4.48Å; L269-L278 HydrophobicContact CD1-CD1 3.94Å; L269-L278 HydrophobicContact CG-CD1 4.26Å; K270-L278 HydrophobicContact CG-CD2 4.05Å; F273-L278 HydrophobicContact CB-CB 4.41Å; D274-L278 WeakPolarHBondContact O-CB 3.25Å; D274-L278 PolarHBondContact O-N 2.97Å; T276-L278 PolarHBondContact O-N 2.9Å; L278-A282 WeakPolarHBondContact O-CB 3.14Å; L278-A282 PolarHBondContact O-N 3.44Å; L278-A282 VanDerWaalsContact O-N 3.09Å; L278-V315 HydrophobicContact CD1-CG1 3.72Å; L278-V315 HydrophobicContact CD2-CG1 3.99Å; L278-V315 HydrophobicContact CG-CG1 3.56Å; L278-E319 HydrophobicContact CD2-CG 3.87Å; L278-E319 HydrophobicContact CG-CG 4.34Å
279V91.8Very high93Very high2 Ų247.8 Ų47.81%0.01225%0.246CC..Hα-helixtrans-70-39.8176.2-178.30000111.2P275 T276 T277 I281 A282 L283 E319 V320 I382P275-V279 WeakPolarHBondContact O-CG2 3.34Å; P275-V279 PolarHBondContact O-N 3.11Å; P275-V279 VanDerWaalsContact O-N 3.16Å; T276-V279 PolarHBondContact O-N 3.39Å; T276-V279 VanDerWaalsContact O-N 3.15Å; T277-V279 PolarHBondContact O-N 2.99Å; V279-I281 PolarHBondContact O-N 2.96Å; V279-A282 PolarHBondContact O-N 3.29Å; V279-L283 HydrophobicContact CG1-CD1 3.91Å; V279-L283 HydrophobicContact CG1-CG 4.12Å; V279-L283 WeakPolarHBondContact O-CB 3.23Å; V279-L283 WeakPolarHBondContact O-CG 3.41Å; V279-L283 PolarHBondContact O-N 2.94Å; V279-E319 HydrophobicContact CG2-CB 3.31Å; V279-E319 HydrophobicContact CG2-CG 3.87Å; V279-V320 HydrophobicContact CG1-CG2 4.42Å; V279-I382 HydrophobicContact CB-CD1 3.98Å; V279-I382 HydrophobicContact CG1-CD1 3.23Å
280E95.1Very high93.2Very high60 Ų6045.2 Ų45.228%0.2823%0.233SC..Hα-helixtrans-59.3-48.1176.5-70.9-179.3170.400111.6T276 T277 A282 L283 V284 L379 I382T276-E280 WeakPolarHBondContact O-CG 3.47Å; T276-E280 PolarHBondContact O-N 3.45Å; T277-E280 PolarHBondContact O-N 2.88Å; E280-A282 VanDerWaalsContact C-N 3.31Å; E280-A282 PolarHBondContact O-N 3.43Å; E280-L283 PolarHBondContact O-N 2.8Å; E280-V284 VanDerWaalsContact O-CG2 3.32Å; E280-V284 WeakPolarHBondContact O-CG2 3.45Å; E280-V284 PolarHBondContact O-N 2.9Å; E280-L379 HydrophobicContact CB-CD1 3.91Å; E280-L379 HydrophobicContact CG-CD1 3.9Å; E280-I382 HydrophobicContact CG-CG2 3.77Å
281I95.7Very high93.7Very high83 Ų8345.6 Ų45.643%0.42624%0.238SC..Hα-helixtrans-58.7-45.5175.7-68.9168.5000110.4F273 T277 V279 L283 V284 C285F273-I281 HydrophobicContact CD1-CD1 4.1Å; F273-I281 HydrophobicContact CE1-CD1 4.03Å; F273-I281 HydrophobicContact CZ-CD1 4.4Å; T277-I281 HydrophobicContact CG2-CD1 3.78Å; T277-I281 HydrophobicContact CG2-CG1 4.31Å; T277-I281 WeakPolarHBondContact O-CB 3.34Å; T277-I281 VanDerWaalsContact O-CG1 3.26Å; T277-I281 WeakPolarHBondContact O-CG1 3.41Å; T277-I281 PolarHBondContact O-N 2.95Å; V279-I281 PolarHBondContact O-N 2.96Å; I281-L283 PolarHBondContact O-N 3.27Å; I281-V284 PolarHBondContact O-N 3.45Å; I281-C285 VanDerWaalsContact O-CB 3.25Å; I281-C285 WeakPolarHBondContact O-CB 3.37Å; I281-C285 PolarHBondContact O-N 3.12Å
282A95.6Very high94Very high5 Ų541 Ų414%0.04122%0.218CC..Hα-helixtrans-62.3-42.7179.100000112.2L278 V279 E280 C285 L286 S312 V315 A316L278-A282 WeakPolarHBondContact O-CB 3.14Å; L278-A282 PolarHBondContact O-N 3.44Å; L278-A282 VanDerWaalsContact O-N 3.09Å; V279-A282 PolarHBondContact O-N 3.29Å; E280-A282 VanDerWaalsContact C-N 3.31Å; E280-A282 PolarHBondContact O-N 3.43Å; A282-C285 WeakPolarHBondContact O-CB 3.32Å; A282-C285 PolarHBondContact O-N 2.87Å; A282-L286 WeakPolarHBondContact O-CG 3.13Å; A282-L286 PolarHBondContact O-N 3.35Å; A282-S312 WeakPolarHBondContact CB-O 3.36Å; A282-S312 WeakPolarHBondContact O-CB 3.21Å; A282-V315 HydrophobicContact CB-CB 4.27Å; A282-V315 HydrophobicContact CB-CG1 4.08Å; A282-A316 HydrophobicContact CB-CB 3.97Å
283L96.6Very high93.9Very high2 Ų236.8 Ų36.81%0.0120%0.195CC..Hα-helixtrans-69-40.5178.3-72.5175000112.7L221 V279 E280 I281 C285 L286 M287 A375 A378 L379 I382L221-L283 HydrophobicContact CD1-CD2 4.05Å; V279-L283 HydrophobicContact CG1-CD1 3.91Å; V279-L283 HydrophobicContact CG1-CG 4.12Å; V279-L283 WeakPolarHBondContact O-CB 3.23Å; V279-L283 WeakPolarHBondContact O-CG 3.41Å; V279-L283 PolarHBondContact O-N 2.94Å; E280-L283 PolarHBondContact O-N 2.8Å; I281-L283 PolarHBondContact O-N 3.27Å; L283-C285 VanDerWaalsContact C-N 3.28Å; L283-C285 PolarHBondContact O-N 2.95Å; L283-L286 HydrophobicContact CD2-CD1 4.29Å; L283-L286 PolarHBondContact O-N 3.26Å; L283-M287 WeakPolarHBondContact O-CB 3.43Å; L283-M287 PolarHBondContact O-N 3.47Å; L283-A375 HydrophobicContact CD2-CB 4.49Å; L283-A378 HydrophobicContact CD1-CB 3.86Å; L283-A378 HydrophobicContact CD2-CB 4Å; L283-L379 HydrophobicContact CB-CB 4.32Å; L283-L379 HydrophobicContact CB-CD1 4.32Å; L283-L379 HydrophobicContact CD1-CB 4.23Å; L283-I382 HydrophobicContact CD1-CD1 3.54Å
284V98Very high93.8Very high56 Ų5634.7 Ų34.734%0.33919%0.19SC..Hα-helixtrans-60.1-43.9173.2170.10000110.1E280 I281 M287 I288 L379E280-V284 VanDerWaalsContact O-CG2 3.32Å; E280-V284 WeakPolarHBondContact O-CG2 3.45Å; E280-V284 PolarHBondContact O-N 2.9Å; I281-V284 PolarHBondContact O-N 3.45Å; V284-M287 PolarHBondContact O-N 3.21Å; V284-I288 HydrophobicContact CG1-CD1 3.8Å; V284-I288 HydrophobicContact CG1-CG1 4.49Å; V284-I288 WeakPolarHBondContact O-CG1 3.42Å; V284-I288 PolarHBondContact O-N 2.99Å; V284-L379 HydrophobicContact CG2-CD1 4.26Å; V284-L379 HydrophobicContact CG2-CD2 3.61Å
285C97.7Very high93.9Very high31 Ų3136.1 Ų36.121%0.20920%0.201CC..Hα-helixtrans-64.5-41.1178-162.20000112.5I281 A282 L283 S289 L308 S312I281-C285 VanDerWaalsContact O-CB 3.25Å; I281-C285 WeakPolarHBondContact O-CB 3.37Å; I281-C285 PolarHBondContact O-N 3.12Å; A282-C285 WeakPolarHBondContact O-CB 3.32Å; A282-C285 PolarHBondContact O-N 2.87Å; L283-C285 VanDerWaalsContact C-N 3.28Å; L283-C285 PolarHBondContact O-N 2.95Å; C285-S289 VanDerWaalsContact O-CB 3.3Å; C285-S289 WeakPolarHBondContact O-CB 3.37Å; C285-S289 PolarHBondContact O-N 3.39Å; C285-S289 PolarHBondContact O-OG 3.4Å; C285-L308 WeakPolarHBondContact SG-CD1 3.49Å; C285-L308 WeakPolarHBondContact SG-CG 3.38Å; C285-S312 WeakPolarHBondContact CB-OG 3.45Å; C285-S312 PolarHBondContact SG-OG 2.67Å
286L95.8Very high94Very high0 Ų035.2 Ų35.20%020%0.195CC..Hα-helixtrans-60.5-47.2171.7-78.2167.9000111.9L221 A282 L283 I288 S289 Y290 Q309 N313 A375L221-L286 HydrophobicContact CD1-CD1 3.78Å; A282-L286 WeakPolarHBondContact O-CG 3.13Å; A282-L286 PolarHBondContact O-N 3.35Å; L283-L286 HydrophobicContact CD2-CD1 4.29Å; L283-L286 PolarHBondContact O-N 3.26Å; L286-I288 PolarHBondContact O-N 3.34Å; L286-S289 WeakPolarHBondContact CA-OG 3.25Å; L286-S289 PolarHBondContact O-N 2.81Å; L286-S289 PolarHBondContact O-OG 2.82Å; L286-Y290 HydrophobicContact CB-CD2 4.39Å; L286-Y290 HydrophobicContact CB-CE2 4.04Å; L286-Y290 HydrophobicContact CD2-CE2 4.04Å; L286-Y290 WeakPolarHBondContact O-CB 3.41Å; L286-Y290 WeakPolarHBondContact O-CD2 3.38Å; L286-Y290 VanDerWaalsContact O-CG 3.28Å; L286-Y290 PolarHBondContact O-N 3.2Å; L286-Q309 HydrophobicContact CD2-CB 4.26Å; L286-Q309 HydrophobicContact CD2-CG 4.43Å; L286-Q309 WeakPolarHBondContact CD2-O 3.46Å; L286-N313 HydrophobicContact CD2-CB 4.17Å; L286-A375 HydrophobicContact CB-CB 4.35Å
287M96.7Very high93.9Very high56 Ų5644 Ų4428%0.27623%0.232SC..Hα-helixtrans-61-48.1-179.7-172.3178.766.300111.4L283 V284 Y290 L291 A372 A375L283-M287 WeakPolarHBondContact O-CB 3.43Å; L283-M287 PolarHBondContact O-N 3.47Å; V284-M287 PolarHBondContact O-N 3.21Å; M287-Y290 PolarHBondContact O-N 3.47Å; M287-L291 HydrophobicContact CG-CD1 4.37Å; M287-L291 WeakPolarHBondContact O-CG 3.38Å; M287-L291 PolarHBondContact O-N 2.96Å; M287-A372 HydrophobicContact CG-CB 4.13Å; M287-A375 HydrophobicContact CB-CB 4.41Å
288I97.7Very high93.8Very high83 Ų8344.8 Ų44.843%0.42624%0.24SC..Hα-helixtrans-61.5-47.1177.7-68.5169000110.5V284 L286 Y290 L291 L292V284-I288 HydrophobicContact CG1-CD1 3.8Å; V284-I288 HydrophobicContact CG1-CG1 4.49Å; V284-I288 WeakPolarHBondContact O-CG1 3.42Å; V284-I288 PolarHBondContact O-N 2.99Å; L286-I288 PolarHBondContact O-N 3.34Å; I288-Y290 PolarHBondContact O-N 3.37Å; I288-L291 PolarHBondContact O-N 3.45Å; I288-L292 HydrophobicContact CG2-CD1 3.74Å; I288-L292 HydrophobicContact CG2-CG 4.19Å; I288-L292 WeakPolarHBondContact O-CB 3.46Å; I288-L292 VanDerWaalsContact O-CG 3.31Å; I288-L292 WeakPolarHBondContact O-CG 3.35Å; I288-L292 PolarHBondContact O-N 3.18Å
289S95.2Very high93.5Very high0 Ų048.2 Ų48.20%025%0.253CS..Hα-helixtrans-65.8-39.1-177.955.90000112.8C285 L286 L292 L293 Q309C285-S289 VanDerWaalsContact O-CB 3.3Å; C285-S289 WeakPolarHBondContact O-CB 3.37Å; C285-S289 PolarHBondContact O-N 3.39Å; C285-S289 PolarHBondContact O-OG 3.4Å; L286-S289 WeakPolarHBondContact CA-OG 3.25Å; L286-S289 PolarHBondContact O-N 2.81Å; L286-S289 PolarHBondContact O-OG 2.82Å; S289-L292 PolarHBondContact O-N 2.94Å; S289-L293 PolarHBondContact O-N 3.46Å; S289-L293 VanDerWaalsContact O-N 3.1Å; S289-Q309 VanDerWaalsContact C-NE2 3.32Å; S289-Q309 PolarHBondContact O-NE2 3.49Å; S289-Q309 WeakPolarHBondContact OG-CG 3.46Å
290Y94.2Very high93.4Very high2 Ų252.8 Ų52.81%0.00828%0.28CS..Hα-helixtrans-63.4-41.3172.8-68.9-39.3000112.6Y228 L286 M287 I288 L293 Q309 C368 A371Y228-Y290 HydrophobicContact CD2-CD1 4.16Å; Y228-Y290 AromaticContact CD2-CE1 3.56Å; Y228-Y290 HydrophobicContact CD2-CE1 3.56Å; Y228-Y290 HydrophobicContact CG-CD1 4.5Å; Y228-Y290 AromaticContact CG-CE1 3.58Å; Y228-Y290 HydrophobicContact CG-CE1 3.58Å; L286-Y290 HydrophobicContact CB-CD2 4.39Å; L286-Y290 HydrophobicContact CB-CE2 4.04Å; L286-Y290 HydrophobicContact CD2-CE2 4.04Å; L286-Y290 WeakPolarHBondContact O-CB 3.41Å; L286-Y290 WeakPolarHBondContact O-CD2 3.38Å; L286-Y290 VanDerWaalsContact O-CG 3.28Å; L286-Y290 PolarHBondContact O-N 3.2Å; M287-Y290 PolarHBondContact O-N 3.47Å; I288-Y290 PolarHBondContact O-N 3.37Å; Y290-L293 PolarHBondContact O-N 3.48Å; Y290-Q309 HydrophobicContact CD1-CG 4.22Å; Y290-Q309 HydrophobicContact CE1-CG 3.86Å; Y290-C368 WeakPolarHBondContact O-CB 3.16Å; Y290-A371 HydrophobicContact CD1-CB 4.16Å; Y290-A371 HydrophobicContact CD2-CB 3.77Å; Y290-A371 HydrophobicContact CE1-CB 4.46Å; Y290-A371 HydrophobicContact CE2-CB 4Å; Y290-A371 HydrophobicContact CG-CB 3.86Å
291L94.9Very high93.3Very high77 Ų7753.7 Ų53.740%0.40328%0.284SS..Hα-helixtrans-66.1-43175.8-69.7172.6000111.7M287 I288 L293 T294 A372M287-L291 HydrophobicContact CG-CD1 4.37Å; M287-L291 WeakPolarHBondContact O-CG 3.38Å; M287-L291 PolarHBondContact O-N 2.96Å; I288-L291 PolarHBondContact O-N 3.45Å; L291-L293 VanDerWaalsContact C-N 3.25Å; L291-L293 PolarHBondContact O-N 2.92Å; L291-T294 WeakPolarHBondContact O-CB 3.41Å; L291-T294 WeakPolarHBondContact O-CG2 3.14Å; L291-T294 PolarHBondContact O-N 3.4Å; L291-T294 VanDerWaalsContact O-N 3.07Å; L291-T294 PolarHBondContact O-OG1 2.96Å; L291-A372 HydrophobicContact CD2-CB 3.88Å; L291-A372 HydrophobicContact CG-CB 3.82Å
292L94.7Very high93Very high65 Ų6550 Ų5034%0.3427%0.265SS..Hα-helixtrans-64.3-28.2178.8-72.1176.7000113I288 S289 T294 V295 A296 L305I288-L292 HydrophobicContact CG2-CD1 3.74Å; I288-L292 HydrophobicContact CG2-CG 4.19Å; I288-L292 WeakPolarHBondContact O-CB 3.46Å; I288-L292 VanDerWaalsContact O-CG 3.31Å; I288-L292 WeakPolarHBondContact O-CG 3.35Å; I288-L292 PolarHBondContact O-N 3.18Å; S289-L292 PolarHBondContact O-N 2.94Å; L292-T294 PolarHBondContact O-N 3.32Å; L292-V295 VanDerWaalsContact O-CG2 3.29Å; L292-V295 WeakPolarHBondContact O-CG2 3.31Å; L292-V295 PolarHBondContact O-N 3.38Å; L292-A296 PolarHBondContact O-N 2.89Å; L292-A296 VanDerWaalsContact O-N 3.1Å; L292-L305 HydrophobicContact CB-CD1 3.78Å; L292-L305 HydrophobicContact CB-CD2 3.87Å; L292-L305 HydrophobicContact CD1-CD2 3.91Å
293L90.3Very high92.7Very high11 Ų1150.6 Ų50.66%0.05827%0.268CS..Hα-helixtrans-61.5-26.6173.4-81.2-178.9000113.1Y228 S289 Y290 L291 V295 A296 T302 L305Y228-L293 HydrophobicContact CD2-CD1 4.2Å; Y228-L293 HydrophobicContact CE2-CD1 4.29Å; S289-L293 PolarHBondContact O-N 3.46Å; S289-L293 VanDerWaalsContact O-N 3.1Å; Y290-L293 PolarHBondContact O-N 3.48Å; L291-L293 VanDerWaalsContact C-N 3.25Å; L291-L293 PolarHBondContact O-N 2.92Å; L293-V295 PolarHBondContact O-N 2.84Å; L293-A296 HydrophobicContact CD2-CB 4.49Å; L293-A296 PolarHBondContact O-N 3.44Å; L293-T302 HydrophobicContact CD2-CG2 3.78Å; L293-L305 HydrophobicContact CD2-CB 3.98Å; L293-L305 HydrophobicContact CD2-CD1 3.83Å; L293-L305 HydrophobicContact CG-CB 4.33Å; L293-L305 HydrophobicContact CG-CD1 4.12Å
294T90Very high92.5Very high40 Ų4055.4 Ų55.425%0.24529%0.293CS..THydrogen-bonded Turntrans-66.8-23.9179.367.30000113L291 L292 C368 I369L291-T294 WeakPolarHBondContact O-CB 3.41Å; L291-T294 WeakPolarHBondContact O-CG2 3.14Å; L291-T294 PolarHBondContact O-N 3.4Å; L291-T294 VanDerWaalsContact O-N 3.07Å; L291-T294 PolarHBondContact O-OG1 2.96Å; L292-T294 PolarHBondContact O-N 3.32Å; T294-C368 HydrophobicContact CG2-CB 3.6Å; T294-I369 HydrophobicContact CG2-CG1 4.2Å
295V91.6Very high92.3Very high98 Ų9853 Ų5359%0.59428%0.279SS*.THydrogen-bonded Turntrans-113.7-1.6-179-62.70000112.8L292 L293 K297L292-V295 VanDerWaalsContact O-CG2 3.29Å; L292-V295 WeakPolarHBondContact O-CG2 3.31Å; L292-V295 PolarHBondContact O-N 3.38Å; L293-V295 PolarHBondContact O-N 2.84Å; V295-K297 PolarHBondContact O-N 3Å
296A88.8Confident92Very high7 Ų752.1 Ų52.16%0.05827%0.271CS..  trans-67.3115.5179.900000110.7L292 L293 F301 L305L292-A296 PolarHBondContact O-N 2.89Å; L292-A296 VanDerWaalsContact O-N 3.1Å; L293-A296 HydrophobicContact CD2-CB 4.49Å; L293-A296 PolarHBondContact O-N 3.44Å; A296-F301 HydrophobicContact CB-CD1 3.7Å; A296-F301 HydrophobicContact CB-CE1 4.04Å; A296-L305 HydrophobicContact CB-CD1 4.08Å
297K87.8Confident91.8Very high196 Ų19654.3 Ų54.385%0.85228%0.283SS*.  trans-104.5-23.6177.4-63.3-177.1-176.9179.60113.7V295V295-K297 PolarHBondContact O-N 3Å
298S90Very high91.7Very high62 Ų6254.8 Ų54.843%0.43429%0.286SS..  trans-93.7136.3-178.31710000110.9V300 F301 T302S298-V300 PolarHBondContact O-N 3.26Å; S298-V300 PolarHBondContact OG-N 2.92Å; S298-F301 PolarHBondContact O-N 3.37Å; S298-T302 PolarHBondContact O-N 2.98Å; S298-T302 PolarHBondContact O-OG1 3.28Å
299Y85.8Confident91.5Very high77 Ų7751 Ų5130%0.30227%0.266SS..Hα-helixtrans-56.1-50.3173.5178.5-115.6000111.6I236 H240 F301 T302 V303I236-Y299 HydrophobicContact CG2-CE2 3.81Å; H240-Y299 HydrophobicContact CB-CD2 3.57Å; H240-Y299 HydrophobicContact CB-CE2 3.63Å; H240-Y299 HydrophobicContact CB-CG 4.38Å; H240-Y299 AromaticContact CD2-CD2 3.58Å; H240-Y299 AromaticContact CD2-CG 3.81Å; H240-Y299 AromaticContact CG-CD2 3.34Å; H240-Y299 AromaticContact CG-CE2 3.93Å; H240-Y299 AromaticContact ND1-CD2 3.67Å; Y299-F301 VanDerWaalsContact C-N 3.28Å; Y299-F301 PolarHBondContact O-N 2.93Å; Y299-T302 WeakPolarHBondContact O-CA 3.24Å; Y299-T302 WeakPolarHBondContact O-CB 3.11Å; Y299-T302 PolarHBondContact O-N 2.73Å; Y299-V303 HydrophobicContact CD1-CG2 4.4Å; Y299-V303 HydrophobicContact CD2-CG2 4.25Å; Y299-V303 HydrophobicContact CE1-CG2 3.99Å; Y299-V303 HydrophobicContact CE2-CG2 3.82Å; Y299-V303 WeakPolarHBondContact O-CG2 3.45Å; Y299-V303 PolarHBondContact O-N 3.22Å
300V89.9Confident91.2Very high97 Ų9751.9 Ų51.959%0.58827%0.272SS*.Hα-helixtrans-58.4-43.6-179.8178.70000110.7S298 T302 V303 L304S298-V300 PolarHBondContact O-N 3.26Å; S298-V300 PolarHBondContact OG-N 2.92Å; V300-T302 VanDerWaalsContact C-N 3.33Å; V300-T302 PolarHBondContact O-N 3.25Å; V300-V303 PolarHBondContact O-N 3.08Å; V300-L304 HydrophobicContact CG1-CD1 4.36Å; V300-L304 WeakPolarHBondContact O-CG 3.23Å; V300-L304 PolarHBondContact O-N 2.97Å
301F92.3Very high91.1Very high80 Ų8053.1 Ų53.135%0.35128%0.28SS..Hα-helixtrans-64.5-39.3177.6-174.4-124.9000112.1A296 S298 Y299 L304 L305A296-F301 HydrophobicContact CB-CD1 3.7Å; A296-F301 HydrophobicContact CB-CE1 4.04Å; S298-F301 PolarHBondContact O-N 3.37Å; Y299-F301 VanDerWaalsContact C-N 3.28Å; Y299-F301 PolarHBondContact O-N 2.93Å; F301-L304 PolarHBondContact O-N 3.24Å; F301-L305 HydrophobicContact CD1-CD1 4.08Å; F301-L305 HydrophobicContact CE1-CD1 3.72Å; F301-L305 HydrophobicContact CE1-CG 4.42Å; F301-L305 HydrophobicContact CE2-CD1 4.45Å; F301-L305 HydrophobicContact CE2-CD2 4.35Å; F301-L305 HydrophobicContact CE2-CG 4.29Å; F301-L305 HydrophobicContact CZ-CD1 3.92Å; F301-L305 HydrophobicContact CZ-CD2 4.23Å; F301-L305 HydrophobicContact CZ-CG 4.21Å; F301-L305 WeakPolarHBondContact O-CG 3.35Å; F301-L305 PolarHBondContact O-N 3.21Å
302T89.1Confident91.1Very high6 Ų649.8 Ų49.84%0.03726%0.263CS..Hα-helixtrans-61.6-46.8175.3-52.20000110.9I236 L293 S298 Y299 V300 L304 L305 M306I236-T302 HydrophobicContact CD1-CG2 3.47Å; I236-T302 VanDerWaalsContact CD1-CG2 3.47Å; I236-T302 HydrophobicContact CG1-CG2 3.8Å; L293-T302 HydrophobicContact CD2-CG2 3.78Å; S298-T302 PolarHBondContact O-N 2.98Å; S298-T302 PolarHBondContact O-OG1 3.28Å; Y299-T302 WeakPolarHBondContact O-CA 3.24Å; Y299-T302 WeakPolarHBondContact O-CB 3.11Å; Y299-T302 PolarHBondContact O-N 2.73Å; V300-T302 VanDerWaalsContact C-N 3.33Å; V300-T302 PolarHBondContact O-N 3.25Å; T302-L304 VanDerWaalsContact C-N 3.34Å; T302-L304 PolarHBondContact O-N 2.88Å; T302-L305 PolarHBondContact O-N 2.99Å; T302-M306 WeakPolarHBondContact O-CG 3.48Å; T302-M306 PolarHBondContact O-N 3.34Å
303V89.7Confident91Very high16 Ų1648.4 Ų48.410%0.09726%0.256CS..Hα-helixtrans-60.9-41.4176.8175.20000111.6L250 Y299 V300 L305 M306 I307L250-V303 HydrophobicContact CD1-CB 4.42Å; L250-V303 HydrophobicContact CD1-CG1 3.93Å; L250-V303 HydrophobicContact CD1-CG2 3.84Å; Y299-V303 HydrophobicContact CD1-CG2 4.4Å; Y299-V303 HydrophobicContact CD2-CG2 4.25Å; Y299-V303 HydrophobicContact CE1-CG2 3.99Å; Y299-V303 HydrophobicContact CE2-CG2 3.82Å; Y299-V303 WeakPolarHBondContact O-CG2 3.45Å; Y299-V303 PolarHBondContact O-N 3.22Å; V300-V303 PolarHBondContact O-N 3.08Å; V303-L305 VanDerWaalsContact C-N 3.35Å; V303-L305 PolarHBondContact O-N 2.97Å; V303-M306 WeakPolarHBondContact O-CB 3.2Å; V303-M306 PolarHBondContact O-N 3.49Å; V303-I307 HydrophobicContact CG1-CD1 4.21Å; V303-I307 WeakPolarHBondContact O-CG1 3.36Å; V303-I307 PolarHBondContact O-N 3.45Å
304L93.3Very high90.8Very high103 Ų10348.6 Ų48.654%0.53926%0.259SS..Hα-helixtrans-61.1-42.7175.2-70.9173.1000112.1V300 F301 T302 M306 I307 L308V300-L304 HydrophobicContact CG1-CD1 4.36Å; V300-L304 WeakPolarHBondContact O-CG 3.23Å; V300-L304 PolarHBondContact O-N 2.97Å; F301-L304 PolarHBondContact O-N 3.24Å; T302-L304 VanDerWaalsContact C-N 3.34Å; T302-L304 PolarHBondContact O-N 2.88Å; L304-M306 VanDerWaalsContact C-N 3.34Å; L304-I307 PolarHBondContact O-N 3.44Å; L304-L308 PolarHBondContact O-N 3.42Å
305L93Very high90.9Very high7 Ų746.9 Ų46.94%0.03725%0.248CC..Hα-helixtrans-64.9-37.1175.4-68174.6000112.1L292 L293 A296 F301 T302 V303 L308 Q309L292-L305 HydrophobicContact CB-CD1 3.78Å; L292-L305 HydrophobicContact CB-CD2 3.87Å; L292-L305 HydrophobicContact CD1-CD2 3.91Å; L293-L305 HydrophobicContact CD2-CB 3.98Å; L293-L305 HydrophobicContact CD2-CD1 3.83Å; L293-L305 HydrophobicContact CG-CB 4.33Å; L293-L305 HydrophobicContact CG-CD1 4.12Å; A296-L305 HydrophobicContact CB-CD1 4.08Å; F301-L305 HydrophobicContact CD1-CD1 4.08Å; F301-L305 HydrophobicContact CE1-CD1 3.72Å; F301-L305 HydrophobicContact CE1-CG 4.42Å; F301-L305 HydrophobicContact CE2-CD1 4.45Å; F301-L305 HydrophobicContact CE2-CD2 4.35Å; F301-L305 HydrophobicContact CE2-CG 4.29Å; F301-L305 HydrophobicContact CZ-CD1 3.92Å; F301-L305 HydrophobicContact CZ-CD2 4.23Å; F301-L305 HydrophobicContact CZ-CG 4.21Å; F301-L305 WeakPolarHBondContact O-CG 3.35Å; F301-L305 PolarHBondContact O-N 3.21Å; T302-L305 PolarHBondContact O-N 2.99Å; V303-L305 VanDerWaalsContact C-N 3.35Å; V303-L305 PolarHBondContact O-N 2.97Å; L305-L308 WeakPolarHBondContact O-CB 3.46Å; L305-L308 PolarHBondContact O-N 3.34Å; L305-Q309 VanDerWaalsContact O-CG 3.25Å; L305-Q309 WeakPolarHBondContact O-CG 3.46Å; L305-Q309 PolarHBondContact O-N 3.03Å; L305-Q309 PolarHBondContact O-OE1 3.42Å
306M90.6Very high90.9Very high11 Ų1142.2 Ų42.25%0.05422%0.22CC..Hα-helixtrans-64.9-42.7174.9-69.2-179.983.800113Y228 T232 I236 L250 L254 T302 V303 L304 L308 Q309 T310Y228-M306 HydrophobicContact CE2-CG 4.44Å; Y228-M306 WeakPolarHBondContact OH-CE 3.37Å; Y228-M306 WeakPolarHBondContact OH-CG 3.31Å; T232-M306 HydrophobicContact CG2-CE 3.55Å; T232-M306 HydrophobicContact CG2-CG 3.61Å; T232-M306 HydrophobicContact CG2-SD 3.7Å; I236-M306 HydrophobicContact CD1-CE 3.92Å; I236-M306 HydrophobicContact CD1-CG 4.06Å; I236-M306 HydrophobicContact CD1-SD 3.02Å; I236-M306 WeakPolarHBondContact CD1-SD 3.48Å; L250-M306 HydrophobicContact CD1-CE 4.47Å; L250-M306 HydrophobicContact CD1-SD 3.97Å; L250-M306 HydrophobicContact CD2-CE 4.06Å; L250-M306 HydrophobicContact CD2-SD 4.05Å; L250-M306 HydrophobicContact CG-CE 4.47Å; L250-M306 HydrophobicContact CG-SD 4.47Å; L254-M306 HydrophobicContact CD1-CE 3.48Å; L254-M306 VanDerWaalsContact CD1-CE 3.48Å; L254-M306 HydrophobicContact CD1-SD 4.42Å; L254-M306 HydrophobicContact CD2-CB 3.73Å; T302-M306 WeakPolarHBondContact O-CG 3.48Å; T302-M306 PolarHBondContact O-N 3.34Å; V303-M306 WeakPolarHBondContact O-CB 3.2Å; V303-M306 PolarHBondContact O-N 3.49Å; L304-M306 VanDerWaalsContact C-N 3.34Å; M306-L308 VanDerWaalsContact C-N 3.27Å; M306-L308 PolarHBondContact O-N 3.36Å; M306-Q309 PolarHBondContact O-N 3.32Å; M306-T310 WeakPolarHBondContact O-CB 3.23Å; M306-T310 PolarHBondContact O-N 3.34Å; M306-T310 PolarHBondContact O-OG1 2.88Å
307I92.4Very high90.8Very high47 Ų4744.6 Ų44.624%0.24123%0.234CC..Hα-helixtrans-57.8-48.8174.5-68.8165.7000108.3I253 L254 A257 V303 L304 Q309 T310 V311I253-I307 HydrophobicContact CG2-CD1 3.61Å; I253-I307 HydrophobicContact CG2-CG1 3.96Å; L254-I307 HydrophobicContact CD2-CG1 3.91Å; A257-I307 HydrophobicContact CB-CG2 3.91Å; V303-I307 HydrophobicContact CG1-CD1 4.21Å; V303-I307 WeakPolarHBondContact O-CG1 3.36Å; V303-I307 PolarHBondContact O-N 3.45Å; L304-I307 PolarHBondContact O-N 3.44Å; I307-Q309 PolarHBondContact O-N 3.25Å; I307-T310 PolarHBondContact O-N 3.24Å; I307-V311 HydrophobicContact CG2-CG2 4.28Å; I307-V311 WeakPolarHBondContact O-CB 3.26Å; I307-V311 VanDerWaalsContact O-CG2 3.23Å; I307-V311 WeakPolarHBondContact O-CG2 3.25Å; I307-V311 PolarHBondContact O-N 3.46Å
308L94.6Very high90.6Very high66 Ų6636.9 Ų36.935%0.34621%0.207SC..Hα-helixtrans-57.9-48.3179-169.560.8000111.8C285 L304 L305 M306 T310 V311 S312C285-L308 WeakPolarHBondContact SG-CD1 3.49Å; C285-L308 WeakPolarHBondContact SG-CG 3.38Å; L304-L308 PolarHBondContact O-N 3.42Å; L305-L308 WeakPolarHBondContact O-CB 3.46Å; L305-L308 PolarHBondContact O-N 3.34Å; M306-L308 VanDerWaalsContact C-N 3.27Å; M306-L308 PolarHBondContact O-N 3.36Å; L308-T310 PolarHBondContact O-N 3.34Å; L308-V311 PolarHBondContact O-N 3.1Å; L308-S312 WeakPolarHBondContact O-CB 3.25Å; L308-S312 PolarHBondContact O-N 3.4Å; L308-S312 PolarHBondContact O-OG 3.28Å
309Q92.7Very high90.5Very high2 Ų234.1 Ų34.11%0.00919%0.187CC..Hα-helixtrans-59.5-46.7177.1-75.1158.3-21.800112.4L286 S289 Y290 L305 M306 I307 V311 S312 N313L286-Q309 HydrophobicContact CD2-CB 4.26Å; L286-Q309 HydrophobicContact CD2-CG 4.43Å; L286-Q309 WeakPolarHBondContact CD2-O 3.46Å; S289-Q309 VanDerWaalsContact C-NE2 3.32Å; S289-Q309 PolarHBondContact O-NE2 3.49Å; S289-Q309 WeakPolarHBondContact OG-CG 3.46Å; Y290-Q309 HydrophobicContact CD1-CG 4.22Å; Y290-Q309 HydrophobicContact CE1-CG 3.86Å; L305-Q309 VanDerWaalsContact O-CG 3.25Å; L305-Q309 WeakPolarHBondContact O-CG 3.46Å; L305-Q309 PolarHBondContact O-N 3.03Å; L305-Q309 PolarHBondContact O-OE1 3.42Å; M306-Q309 PolarHBondContact O-N 3.32Å; I307-Q309 PolarHBondContact O-N 3.25Å; Q309-V311 VanDerWaalsContact C-N 3.34Å; Q309-V311 PolarHBondContact O-N 2.95Å; Q309-S312 PolarHBondContact O-N 3.09Å; Q309-N313 WeakPolarHBondContact O-CB 3.29Å; Q309-N313 PolarHBondContact O-N 2.86Å
310T89.7Confident90.5Very high19 Ų1930.6 Ų30.612%0.11717%0.174CC..Hα-helixtrans-62.9-44.7-177.9-63.60000110.7I258 M306 I307 L308 A314I258-T310 HydrophobicContact CD1-CG2 3.36Å; I258-T310 HydrophobicContact CG1-CG2 3.09Å; M306-T310 WeakPolarHBondContact O-CB 3.23Å; M306-T310 PolarHBondContact O-N 3.34Å; M306-T310 PolarHBondContact O-OG1 2.88Å; I307-T310 PolarHBondContact O-N 3.24Å; L308-T310 PolarHBondContact O-N 3.34Å; T310-A314 WeakPolarHBondContact O-CB 3.25Å; T310-A314 PolarHBondContact O-N 3.34Å
311V92Very high90.1Very high29 Ų2928.1 Ų28.118%0.17616%0.156CC..Hα-helixtrans-62.6-51.2175.7161.20000111.2A257 M261 I307 L308 Q309 N313 A314 V315A257-V311 HydrophobicContact CB-CG2 4.11Å; M261-V311 HydrophobicContact CE-CG1 3.82Å; M261-V311 HydrophobicContact CG-CB 3.86Å; M261-V311 HydrophobicContact CG-CG1 3.49Å; M261-V311 VanDerWaalsContact CG-CG1 3.49Å; M261-V311 HydrophobicContact CG-CG2 3.47Å; M261-V311 VanDerWaalsContact CG-CG2 3.47Å; M261-V311 HydrophobicContact SD-CG1 3.58Å; M261-V311 VanDerWaalsContact SD-CG1 3.58Å; M261-V311 HydrophobicContact SD-CG2 4.37Å; I307-V311 HydrophobicContact CG2-CG2 4.28Å; I307-V311 WeakPolarHBondContact O-CB 3.26Å; I307-V311 VanDerWaalsContact O-CG2 3.23Å; I307-V311 WeakPolarHBondContact O-CG2 3.25Å; I307-V311 PolarHBondContact O-N 3.46Å; L308-V311 PolarHBondContact O-N 3.1Å; Q309-V311 VanDerWaalsContact C-N 3.34Å; Q309-V311 PolarHBondContact O-N 2.95Å; V311-N313 VanDerWaalsContact C-N 3.34Å; V311-N313 PolarHBondContact O-N 2.95Å; V311-A314 PolarHBondContact O-N 3.41Å; V311-V315 WeakPolarHBondContact O-CG2 3.4Å; V311-V315 PolarHBondContact O-N 3.01Å; V311-V315 VanDerWaalsContact O-N 3.11Å
312S95Very high89.5Confident7 Ų725 Ų255%0.04915%0.146CC..Hα-helixtrans-63.9-39.9-179.7-600000112A282 C285 L308 Q309 V315 A316A282-S312 WeakPolarHBondContact CB-O 3.36Å; A282-S312 WeakPolarHBondContact O-CB 3.21Å; C285-S312 WeakPolarHBondContact CB-OG 3.45Å; C285-S312 PolarHBondContact SG-OG 2.67Å; L308-S312 WeakPolarHBondContact O-CB 3.25Å; L308-S312 PolarHBondContact O-N 3.4Å; L308-S312 PolarHBondContact O-OG 3.28Å; Q309-S312 PolarHBondContact O-N 3.09Å; S312-V315 PolarHBondContact O-N 2.9Å; S312-A316 WeakPolarHBondContact O-CB 3.44Å; S312-A316 PolarHBondContact O-N 3.31Å
313N91.9Very high89.1Confident35 Ų3525 Ų2519%0.18715%0.145CC..Hα-helixtrans-65.2-41.4175.7-178.347.5000112.4V225 L286 Q309 V311 V315 A316 T317V225-N313 HydrophobicContact CG2-CB 4.28Å; V225-N313 WeakPolarHBondContact CG2-ND2 3.41Å; V225-N313 WeakPolarHBondContact CG2-OD1 3.15Å; L286-N313 HydrophobicContact CD2-CB 4.17Å; Q309-N313 WeakPolarHBondContact O-CB 3.29Å; Q309-N313 PolarHBondContact O-N 2.86Å; V311-N313 VanDerWaalsContact C-N 3.34Å; V311-N313 PolarHBondContact O-N 2.95Å; N313-V315 VanDerWaalsContact C-N 3.32Å; N313-V315 PolarHBondContact O-N 2.91Å; N313-A316 PolarHBondContact O-N 3.37Å; N313-T317 WeakPolarHBondContact O-CB 3.49Å; N313-T317 PolarHBondContact O-N 2.94Å; N313-T317 PolarHBondContact O-OG1 3.5Å; N313-T317 PolarHBondContact OD1-OG1 2.97Å
314A87.8Confident88.8Confident15 Ų1524.4 Ų24.412%0.12414%0.141CC..Hα-helixtrans-59.2-45.1176.400000111.2T310 V311 A318T310-A314 WeakPolarHBondContact O-CB 3.25Å; T310-A314 PolarHBondContact O-N 3.34Å; V311-A314 PolarHBondContact O-N 3.41Å; A314-A318 VanDerWaalsContact O-CB 3.23Å; A314-A318 WeakPolarHBondContact O-CB 3.32Å; A314-A318 PolarHBondContact O-N 3.27Å
315V90.4Very high88Confident4 Ų420.4 Ų20.42%0.02412%0.12CC..Hα-helixtrans-62.4-53.3176.1174.60000111.2M261 I266 L269 L278 A282 V311 S312 N313 T317 A318 E319M261-V315 HydrophobicContact CE-CG2 3.59Å; I266-V315 HydrophobicContact CG1-CG2 4.09Å; L269-V315 HydrophobicContact CD1-CG2 4.27Å; L278-V315 HydrophobicContact CD1-CG1 3.72Å; L278-V315 HydrophobicContact CD2-CG1 3.99Å; L278-V315 HydrophobicContact CG-CG1 3.56Å; A282-V315 HydrophobicContact CB-CB 4.27Å; A282-V315 HydrophobicContact CB-CG1 4.08Å; V311-V315 WeakPolarHBondContact O-CG2 3.4Å; V311-V315 PolarHBondContact O-N 3.01Å; V311-V315 VanDerWaalsContact O-N 3.11Å; S312-V315 PolarHBondContact O-N 2.9Å; N313-V315 VanDerWaalsContact C-N 3.32Å; N313-V315 PolarHBondContact O-N 2.91Å; V315-T317 VanDerWaalsContact C-N 3.34Å; V315-T317 PolarHBondContact O-N 3.23Å; V315-A318 PolarHBondContact O-N 3.16Å; V315-E319 PolarHBondContact O-N 3.49Å; V315-E319 VanDerWaalsContact O-N 3.12Å
316A91.5Very high87.2Confident0 Ų022.1 Ų22.10%014%0.139CC..Hα-helixtrans-60.3-43.8-178.600000111.9L221 A282 S312 N313 E319 V320L221-A316 HydrophobicContact CD1-CB 3.92Å; L221-A316 HydrophobicContact CD2-CB 3.75Å; A282-A316 HydrophobicContact CB-CB 3.97Å; S312-A316 WeakPolarHBondContact O-CB 3.44Å; S312-A316 PolarHBondContact O-N 3.31Å; N313-A316 PolarHBondContact O-N 3.37Å; A316-E319 PolarHBondContact O-N 3.09Å; A316-V320 WeakPolarHBondContact O-CB 3.21Å; A316-V320 WeakPolarHBondContact O-CG2 3.38Å; A316-V320 PolarHBondContact O-N 3.09Å
317T87.6Confident86.6Confident58 Ų5822.8 Ų22.836%0.35614%0.144SC..Hα-helixtrans-67.5-42.1-179.2-61.20000111.3L221 N313 V315 E319 M321L221-T317 WeakPolarHBondContact CD2-OG1 3.26Å; N313-T317 WeakPolarHBondContact O-CB 3.49Å; N313-T317 PolarHBondContact O-N 2.94Å; N313-T317 PolarHBondContact O-OG1 3.5Å; N313-T317 PolarHBondContact OD1-OG1 2.97Å; V315-T317 VanDerWaalsContact C-N 3.34Å; V315-T317 PolarHBondContact O-N 3.23Å; T317-E319 PolarHBondContact O-N 2.93Å; T317-M321 WeakPolarHBondContact O-CB 3.35Å; T317-M321 PolarHBondContact O-N 3.38Å
318A84.5Confident85.8Confident33 Ų3321.3 Ų21.327%0.27314%0.137SC..Hα-helixtrans-60.8-45.3178.300000111.6I266 A314 V315 A322I266-A318 HydrophobicContact CD1-CB 3.88Å; A314-A318 VanDerWaalsContact O-CB 3.23Å; A314-A318 WeakPolarHBondContact O-CB 3.32Å; A314-A318 PolarHBondContact O-N 3.27Å; V315-A318 PolarHBondContact O-N 3.16Å; A318-A322 WeakPolarHBondContact O-CB 3.32Å; A318-A322 PolarHBondContact O-N 2.97Å
319E85.9Confident84.6Confident5 Ų524.8 Ų24.82%0.02315%0.152CC..Hα-helixtrans-69.1-46.8178.1-67.3-40.7110.600112.4K270 L278 V279 V315 A316 T317 M321 A322 Q323K270-E319 WeakPolarHBondContact CE-OE1 3.45Å; K270-E319 WeakPolarHBondContact CE-OE2 3.46Å; K270-E319 VanDerWaalsContact NZ-CD 3.34Å; K270-E319 IonicContact NZ-OE1 3.94Å; K270-E319 PolarHBondContact NZ-OE1 2.85Å; K270-E319 IonicContact NZ-OE2 3.77Å; K270-E319 PolarHBondContact NZ-OE2 3.46Å; L278-E319 HydrophobicContact CD2-CG 3.87Å; L278-E319 HydrophobicContact CG-CG 4.34Å; V279-E319 HydrophobicContact CG2-CB 3.31Å; V279-E319 HydrophobicContact CG2-CG 3.87Å; V315-E319 PolarHBondContact O-N 3.49Å; V315-E319 VanDerWaalsContact O-N 3.12Å; A316-E319 PolarHBondContact O-N 3.09Å; T317-E319 PolarHBondContact O-N 2.93Å; E319-M321 PolarHBondContact O-N 3.03Å; E319-A322 WeakPolarHBondContact O-CB 3.41Å; E319-A322 PolarHBondContact O-N 3.35Å; E319-A322 VanDerWaalsContact O-N 3.17Å; E319-Q323 WeakPolarHBondContact O-CG 3.39Å; E319-Q323 PolarHBondContact O-N 2.94Å
320V86.3Confident83.3Confident3 Ų329.1 Ų29.12%0.01817%0.168CC..Hα-helixtrans-60.6-38.2178.1171.80000111L217 K218 L221 V279 A316 Q323 L324L217-V320 HydrophobicContact CD2-CG1 4.47Å; L217-V320 HydrophobicContact CD2-CG2 3.74Å; L217-V320 HydrophobicContact CG-CG1 4.39Å; L217-V320 HydrophobicContact CG-CG2 3.97Å; K218-V320 HydrophobicContact CB-CG1 3.83Å; K218-V320 HydrophobicContact CG-CG1 4.49Å; L221-V320 HydrophobicContact CD2-CG2 4.5Å; V279-V320 HydrophobicContact CG1-CG2 4.42Å; A316-V320 WeakPolarHBondContact O-CB 3.21Å; A316-V320 WeakPolarHBondContact O-CG2 3.38Å; A316-V320 PolarHBondContact O-N 3.09Å; V320-Q323 PolarHBondContact O-N 2.85Å; V320-L324 WeakPolarHBondContact O-CB 3.48Å; V320-L324 PolarHBondContact O-N 3.5Å
321M82.3Confident82.2Confident44 Ų4432.3 Ų32.322%0.21719%0.191CC..Hα-helixtrans-68.3-42.1176.4-169.165.7-166.100112T317 E319 Q323 L324 I325T317-M321 WeakPolarHBondContact O-CB 3.35Å; T317-M321 PolarHBondContact O-N 3.38Å; E319-M321 PolarHBondContact O-N 3.03Å; M321-Q323 PolarHBondContact O-N 3.21Å; M321-L324 HydrophobicContact CE-CD2 4.39Å; M321-L324 PolarHBondContact O-N 3.12Å; M321-L324 HydrophobicContact SD-CD2 3.95Å; M321-I325 HydrophobicContact CE-CD1 3.97Å; M321-I325 HydrophobicContact CE-CG1 4.02Å; M321-I325 HydrophobicContact CG-CD1 4.17Å; M321-I325 VanDerWaalsContact O-CG1 3.29Å; M321-I325 WeakPolarHBondContact O-CG1 3.26Å; M321-I325 PolarHBondContact O-N 3.17Å
322A79.2Confident81.1Confident16 Ų1634.5 Ų34.513%0.13220%0.199CC..Hα-helixtrans-56.5-42.7173.500000111A318 E319 I325 G326 M393A318-A322 WeakPolarHBondContact O-CB 3.32Å; A318-A322 PolarHBondContact O-N 2.97Å; E319-A322 WeakPolarHBondContact O-CB 3.41Å; E319-A322 PolarHBondContact O-N 3.35Å; E319-A322 VanDerWaalsContact O-N 3.17Å; A322-I325 PolarHBondContact O-N 3.34Å; A322-G326 PolarHBondContact O-N 3.5Å; A322-M393 WeakPolarHBondContact O-CE 3.44Å
323Q81.7Confident79.8Confident4 Ų435.2 Ų35.22%0.01920%0.202CC..Hα-helixtrans-70.7-38.7-179.5-62.5-73.3-14.200112.5E319 V320 M321 I325 G326 T327 L389 T391E319-Q323 WeakPolarHBondContact O-CG 3.39Å; E319-Q323 PolarHBondContact O-N 2.94Å; V320-Q323 PolarHBondContact O-N 2.85Å; M321-Q323 PolarHBondContact O-N 3.21Å; Q323-I325 VanDerWaalsContact C-N 3.28Å; Q323-I325 PolarHBondContact O-N 3.01Å; Q323-G326 PolarHBondContact O-N 3.3Å; Q323-T327 VanDerWaalsContact O-CG2 3.27Å; Q323-T327 WeakPolarHBondContact O-CG2 3.5Å; Q323-T327 PolarHBondContact O-N 2.9Å; Q323-T327 PolarHBondContact O-OG1 2.83Å; Q323-L389 HydrophobicContact CB-CD2 3.85Å; Q323-L389 HydrophobicContact CG-CD2 3.5Å; Q323-L389 VanDerWaalsContact CG-CD2 3.5Å; Q323-L389 PolarHBondContact NE2-O 2.9Å; Q323-L389 PolarHBondContact OE1-O 2.98Å; Q323-T391 PolarHBondContact OE1-OG1 3.49Å
324L81.6Confident78.4Confident5 Ų536 Ų363%0.02622%0.218CC..Hα-helixtrans-59-41.2172-178.168.8000111.6L211 C214 I215 K218 V320 M321 T327 A340L211-L324 HydrophobicContact CD1-CD1 3.43Å; L211-L324 VanDerWaalsContact CD1-CD1 3.43Å; C214-L324 HydrophobicContact CB-CB 4.36Å; C214-L324 HydrophobicContact CB-CD1 3.76Å; I215-L324 HydrophobicContact CG1-CD1 3.9Å; K218-L324 HydrophobicContact CD-CD2 4.34Å; V320-L324 WeakPolarHBondContact O-CB 3.48Å; V320-L324 PolarHBondContact O-N 3.5Å; M321-L324 HydrophobicContact CE-CD2 4.39Å; M321-L324 PolarHBondContact O-N 3.12Å; M321-L324 HydrophobicContact SD-CD2 3.95Å; L324-T327 PolarHBondContact O-OG1 2.79Å; L324-T327 VanDerWaalsContact O-OG1 3.05Å; L324-A340 HydrophobicContact CD2-CB 3.62Å
325I76.6Confident77.7Confident19 Ų1937.2 Ų37.210%0.09722%0.221CC..Hα-helixtrans-68.9-38.6177.2-65.7167.8000110.9T130 M321 A322 Q323 L333T130-I325 HydrophobicContact CG2-CG2 4.04Å; M321-I325 HydrophobicContact CE-CD1 3.97Å; M321-I325 HydrophobicContact CE-CG1 4.02Å; M321-I325 HydrophobicContact CG-CD1 4.17Å; M321-I325 VanDerWaalsContact O-CG1 3.29Å; M321-I325 WeakPolarHBondContact O-CG1 3.26Å; M321-I325 PolarHBondContact O-N 3.17Å; A322-I325 PolarHBondContact O-N 3.34Å; Q323-I325 VanDerWaalsContact C-N 3.28Å; Q323-I325 PolarHBondContact O-N 3.01Å; I325-L333 HydrophobicContact CB-CD1 4.17Å; I325-L333 HydrophobicContact CG1-CD1 4.11Å; I325-L333 HydrophobicContact CG2-CD1 3.91Å
326G77Confident76.9Confident42 Ų4237.1 Ų37.143%0.43322%0.22SC..Hα-helixtrans-73.1-21.7-179.600000115.2A322 Q323A322-G326 PolarHBondContact O-N 3.5Å; Q323-G326 PolarHBondContact O-N 3.3Å
327T78.7Confident75.9Confident25 Ų2537.8 Ų37.815%0.15323%0.225CC..THydrogen-bonded Turntrans-86.4-11.6-175.746.50000114.6R210 Q323 L324R210-T327 HydrophobicContact CB-CG2 4.23Å; Q323-T327 VanDerWaalsContact O-CG2 3.27Å; Q323-T327 WeakPolarHBondContact O-CG2 3.5Å; Q323-T327 PolarHBondContact O-N 2.9Å; Q323-T327 PolarHBondContact O-OG1 2.83Å; L324-T327 PolarHBondContact O-OG1 2.79Å; L324-T327 VanDerWaalsContact O-OG1 3.05Å
328V75Confident75.2Confident17 Ų1735.8 Ų35.810%0.10322%0.216CC..SBendtrans-116.4136.6-174.5-177.20000109.8L211 H332 A336L211-V328 HydrophobicContact CB-CG2 4.4Å; L211-V328 HydrophobicContact CD1-CG2 3.57Å; L211-V328 HydrophobicContact CD2-CG2 4.01Å; L211-V328 HydrophobicContact CG-CG2 4.2Å; V328-H332 HydrophobicContact CG1-CB 3.44Å; V328-H332 VanDerWaalsContact CG1-CB 3.44Å; V328-A336 HydrophobicContact CB-CB 4.23Å; V328-A336 HydrophobicContact CG1-CB 3.93Å; V328-A336 HydrophobicContact CG2-CB 3.74Å
329E69.7Low75Confident138 Ų13836 Ų3665%0.64521%0.212SC*.  trans-55.8145.2172.5-69.4-177-175.600111.3S331 H332 L333E329-S331 PolarHBondContact O-N 3.43Å; E329-H332 PolarHBondContact O-N 2.64Å; E329-L333 PolarHBondContact O-N 2.9Å
330R64.1Low74.8Confident94 Ų9435.8 Ų35.836%0.35521%0.212SC..THydrogen-bonded Turntrans-57.3-25.5-176.1-63.9-176.1177.1166.3-3.2113.3E126 H332 E395E126-R330 VanDerWaalsContact C-NH1 3.33Å; E126-R330 VanDerWaalsContact O-CZ 3.24Å; E126-R330 PolarHBondContact O-NE 3.14Å; E126-R330 PolarHBondContact O-NH1 3.43Å; R330-H332 VanDerWaalsContact C-N 3.3Å; R330-H332 PolarHBondContact O-N 3.06Å; R330-E395 IonicContact NH2-OE1 3.77Å; R330-E395 IonicContact NH2-OE2 3.04Å; R330-E395 PolarHBondContact NH2-OE2 2.97Å
331S66.5Low74.5Confident86 Ų8637.8 Ų37.860%0.60122%0.219SC*.THydrogen-bonded Turntrans-69.9-21.2174.961.80000114E329E329-S331 PolarHBondContact O-N 3.43Å
332H70Confident74.5Confident75 Ų7536.1 Ų36.135%0.34721%0.212SC..THydrogen-bonded Turntrans-114.7-6.1-171.9-73.4-31.5000113.6M205 V328 E329 R330 G334 K335 A336M205-H332 HydrophobicContact CE-CB 3.45Å; M205-H332 VanDerWaalsContact CE-CB 3.45Å; M205-H332 VanDerWaalsContact CE-CG 3.47Å; V328-H332 HydrophobicContact CG1-CB 3.44Å; V328-H332 VanDerWaalsContact CG1-CB 3.44Å; E329-H332 PolarHBondContact O-N 2.64Å; R330-H332 VanDerWaalsContact C-N 3.3Å; R330-H332 PolarHBondContact O-N 3.06Å; H332-G334 VanDerWaalsContact C-N 3.3Å; H332-G334 PolarHBondContact O-N 3.34Å; H332-K335 PolarHBondContact O-N 3.49Å; H332-K335 VanDerWaalsContact O-N 3.09Å; H332-A336 PolarHBondContact O-N 3.01Å
333L66.5Low74.8Confident22 Ų2237 Ų3712%0.11522%0.216CC..Hα-helixtrans-52.5-42.7-177.2-172.967.3000113.6L133 I325 E329 K335 A336 S337L133-L333 HydrophobicContact CD1-CD2 4.3Å; I325-L333 HydrophobicContact CB-CD1 4.17Å; I325-L333 HydrophobicContact CG1-CD1 4.11Å; I325-L333 HydrophobicContact CG2-CD1 3.91Å; E329-L333 PolarHBondContact O-N 2.9Å; L333-K335 PolarHBondContact O-N 3.42Å; L333-A336 PolarHBondContact O-N 3.41Å; L333-S337 WeakPolarHBondContact O-CB 3.29Å; L333-S337 PolarHBondContact O-N 3.3Å
334G64.3Low75.2Confident51 Ų5138.5 Ų38.553%0.52622%0.223SC..Hα-helixtrans-62.5-41.6179.800000113H332 G338H332-G334 VanDerWaalsContact C-N 3.3Å; H332-G334 PolarHBondContact O-N 3.34Å; G334-G338 PolarHBondContact O-N 3.04Å
335K71.8Confident75.5Confident41 Ų4139.3 Ų39.318%0.17823%0.226CC..Hα-helixtrans-71.1-40177.6-67.1169.5175.9170.20111.8Y202 M205 H332 L333 G338 L339Y202-K335 HydrophobicContact CE1-CB 4.09Å; Y202-K335 HydrophobicContact CE1-CG 4.5Å; M205-K335 HydrophobicContact CE-CB 3.49Å; M205-K335 VanDerWaalsContact CE-CB 3.49Å; M205-K335 HydrophobicContact CE-CD 3.37Å; M205-K335 HydrophobicContact CE-CG 4.08Å; M205-K335 HydrophobicContact SD-CB 3.45Å; M205-K335 WeakPolarHBondContact SD-CB 3.18Å; M205-K335 HydrophobicContact SD-CD 4.22Å; M205-K335 HydrophobicContact SD-CG 4.5Å; H332-K335 PolarHBondContact O-N 3.49Å; H332-K335 VanDerWaalsContact O-N 3.09Å; L333-K335 PolarHBondContact O-N 3.42Å; K335-G338 PolarHBondContact O-N 3.33Å; K335-L339 WeakPolarHBondContact O-CB 3.18Å; K335-L339 PolarHBondContact O-N 3.05Å
336A73.6Confident76.1Confident1 Ų143 Ų431%0.00825%0.245CC..Hα-helixtrans-64.1-43.2175.300000112L211 V328 H332 L333 L339 A340L211-A336 HydrophobicContact CD1-CB 4.06Å; L211-A336 HydrophobicContact CD2-CB 4.24Å; V328-A336 HydrophobicContact CB-CB 4.23Å; V328-A336 HydrophobicContact CG1-CB 3.93Å; V328-A336 HydrophobicContact CG2-CB 3.74Å; H332-A336 PolarHBondContact O-N 3.01Å; L333-A336 PolarHBondContact O-N 3.41Å; A336-L339 PolarHBondContact O-N 3.33Å; A336-A340 WeakPolarHBondContact O-CB 3.29Å; A336-A340 PolarHBondContact O-N 2.88Å
337S70.6Confident76.8Confident14 Ų1442.5 Ų42.510%0.09823%0.232CC..Hα-helixtrans-60.6-46.2172.5-173.40000110.9L333 L339 A340 R341L333-S337 WeakPolarHBondContact O-CB 3.29Å; L333-S337 PolarHBondContact O-N 3.3Å; S337-L339 PolarHBondContact O-N 3.17Å; S337-A340 PolarHBondContact O-N 3.34Å; S337-R341 WeakPolarHBondContact O-CB 3.45Å; S337-R341 VanDerWaalsContact O-CG 3.26Å; S337-R341 WeakPolarHBondContact O-CG 3.29Å; S337-R341 PolarHBondContact O-N 2.99Å
338G72.8Confident77.3Confident16 Ų1642.9 Ų42.917%0.16523%0.233CC..Hα-helixtrans-58.1-45.6175.600000113.2G334 K335 R341 A342G334-G338 PolarHBondContact O-N 3.04Å; K335-G338 PolarHBondContact O-N 3.33Å; G338-R341 PolarHBondContact O-N 3.34Å; G338-A342 WeakPolarHBondContact O-CB 3.22Å; G338-A342 PolarHBondContact O-N 3.21Å
339L80.5Confident78Confident37 Ų3743.1 Ų43.119%0.19424%0.235CC..Hα-helixtrans-63.2-46176.2-175.660.8000111.4Y202 I215 K335 A336 S337 R341 A342 T343Y202-L339 HydrophobicContact CD1-CB 4.25Å; I215-L339 HydrophobicContact CD1-CB 4.37Å; I215-L339 HydrophobicContact CD1-CD2 3.6Å; I215-L339 HydrophobicContact CD1-CG 3.88Å; K335-L339 WeakPolarHBondContact O-CB 3.18Å; K335-L339 PolarHBondContact O-N 3.05Å; A336-L339 PolarHBondContact O-N 3.33Å; S337-L339 PolarHBondContact O-N 3.17Å; L339-R341 VanDerWaalsContact C-N 3.25Å; L339-R341 PolarHBondContact O-N 2.61Å; L339-A342 PolarHBondContact O-N 3.45Å; L339-T343 PolarHBondContact O-N 2.96Å; L339-T343 PolarHBondContact O-OG1 3.02Å; L339-T343 VanDerWaalsContact O-OG1 3.1Å
340A81.8Confident78.9Confident2 Ų238.9 Ų38.92%0.01722%0.22CC..Hα-helixtrans-61.5-34.4177.100000112.4I215 K218 L324 A336 S337 Q344I215-A340 HydrophobicContact CG1-CB 4.35Å; K218-A340 HydrophobicContact CD-CB 4.19Å; L324-A340 HydrophobicContact CD2-CB 3.62Å; A336-A340 WeakPolarHBondContact O-CB 3.29Å; A336-A340 PolarHBondContact O-N 2.88Å; S337-A340 PolarHBondContact O-N 3.34Å; A340-Q344 WeakPolarHBondContact O-CB 3.48Å; A340-Q344 PolarHBondContact O-N 3.03Å; A340-Q344 VanDerWaalsContact O-N 3.12Å
341R80Confident80.2Confident44 Ų4435.4 Ų35.417%0.16621%0.208CC..Hα-helixtrans-73.8-41.1174.6-70-69.5-175.1141.84111.9D113 E117 S337 G338 L339 T343 Q344 W345D113-R341 IonicContact OD2-CZ 3.92Å; D113-R341 IonicContact OD2-NH1 3.67Å; D113-R341 PolarHBondContact OD2-NH1 2.68Å; D113-R341 IonicContact OD2-NH2 2.67Å; E117-R341 IonicContact OE1-CZ 3.98Å; E117-R341 IonicContact OE1-NH2 3.49Å; E117-R341 PolarHBondContact OE1-NH2 3.19Å; E117-R341 IonicContact OE2-NH2 3.69Å; S337-R341 WeakPolarHBondContact O-CB 3.45Å; S337-R341 VanDerWaalsContact O-CG 3.26Å; S337-R341 WeakPolarHBondContact O-CG 3.29Å; S337-R341 PolarHBondContact O-N 2.99Å; G338-R341 PolarHBondContact O-N 3.34Å; L339-R341 VanDerWaalsContact C-N 3.25Å; L339-R341 PolarHBondContact O-N 2.61Å; R341-T343 VanDerWaalsContact C-N 3.33Å; R341-T343 PolarHBondContact O-N 3.43Å; R341-Q344 WeakPolarHBondContact O-CB 3.46Å; R341-Q344 PolarHBondContact O-N 2.93Å; R341-Q344 VanDerWaalsContact O-N 3.16Å; R341-W345 PolarHBondContact O-N 3.4Å
342A81.8Confident81.1Confident9 Ų931.8 Ų31.87%0.07418%0.183CC..Hα-helixtrans-59.6-44.6174.400000111.3F62 G338 L339 Q344 W345 L346F62-A342 HydrophobicContact CE1-CB 4.49Å; F62-A342 HydrophobicContact CE2-CB 4.3Å; F62-A342 HydrophobicContact CZ-CB 3.82Å; G338-A342 WeakPolarHBondContact O-CB 3.22Å; G338-A342 PolarHBondContact O-N 3.21Å; L339-A342 PolarHBondContact O-N 3.45Å; A342-Q344 VanDerWaalsContact C-N 3.34Å; A342-Q344 PolarHBondContact O-N 3.41Å; A342-W345 PolarHBondContact O-N 3.19Å; A342-L346 WeakPolarHBondContact O-CB 3.4Å; A342-L346 PolarHBondContact O-N 3.43Å
343T86.6Confident81.9Confident36 Ų3631.8 Ų31.822%0.22119%0.185CC..Hα-helixtrans-59.5-44.1173.3-580000111.6I215 A219 L339 R341 L346 L347I215-T343 HydrophobicContact CG2-CG2 4.16Å; A219-T343 HydrophobicContact CB-CG2 3.83Å; L339-T343 PolarHBondContact O-N 2.96Å; L339-T343 PolarHBondContact O-OG1 3.02Å; L339-T343 VanDerWaalsContact O-OG1 3.1Å; R341-T343 VanDerWaalsContact C-N 3.33Å; R341-T343 PolarHBondContact O-N 3.43Å; T343-L346 PolarHBondContact O-N 3.14Å; T343-L347 WeakPolarHBondContact O-CG 3.43Å; T343-L347 PolarHBondContact O-N 2.67Å
344Q89.1Confident82.9Confident35 Ų3535.1 Ų35.116%0.16421%0.206CC..Hα-helixtrans-59.4-47175.5170.6177.6-16.500111.9T222 A340 R341 A342 L346 L347 Q348T222-Q344 HydrophobicContact CG2-CB 4.4Å; T222-Q344 HydrophobicContact CG2-CG 3.86Å; A340-Q344 WeakPolarHBondContact O-CB 3.48Å; A340-Q344 PolarHBondContact O-N 3.03Å; A340-Q344 VanDerWaalsContact O-N 3.12Å; R341-Q344 WeakPolarHBondContact O-CB 3.46Å; R341-Q344 PolarHBondContact O-N 2.93Å; R341-Q344 VanDerWaalsContact O-N 3.16Å; A342-Q344 VanDerWaalsContact C-N 3.34Å; A342-Q344 PolarHBondContact O-N 3.41Å; Q344-L346 VanDerWaalsContact C-N 3.34Å; Q344-L346 PolarHBondContact O-N 2.67Å; Q344-L347 PolarHBondContact O-N 2.74Å; Q344-Q348 WeakPolarHBondContact O-CG 3.41Å; Q344-Q348 PolarHBondContact O-N 3.33Å
345W87.9Confident84Confident22 Ų2232.7 Ų32.78%0.08318%0.181CC..Hα-helixtrans-65.4-36178-66.5125.1000112.8N57 M58 R341 A342 L347 Q348 C349N57-W345 HydrophobicContact CB-CD2 3.63Å; N57-W345 HydrophobicContact CB-CE3 3.7Å; N57-W345 HydrophobicContact CB-CG 4.11Å; N57-W345 HydrophobicContact CB-CH2 4.36Å; N57-W345 HydrophobicContact CB-CZ2 4.24Å; N57-W345 HydrophobicContact CB-CZ3 4.08Å; N57-W345 WeakPolarHBondContact ND2-CH2 3.42Å; N57-W345 WeakPolarHBondContact ND2-CZ2 3.45Å; N57-W345 WeakPolarHBondContact ND2-CZ3 3.48Å; M58-W345 HydrophobicContact CB-CB 3.87Å; M58-W345 HydrophobicContact CG-CB 4.36Å; R341-W345 PolarHBondContact O-N 3.4Å; A342-W345 PolarHBondContact O-N 3.19Å; W345-L347 VanDerWaalsContact C-N 3.33Å; W345-L347 PolarHBondContact O-N 2.88Å; W345-Q348 HydrophobicContact CE3-CB 4.42Å; W345-Q348 VanDerWaalsContact CE3-OE1 3.23Å; W345-Q348 CarbonylContact O-C 3.55Å; W345-Q348 PolarHBondContact O-N 2.91Å; W345-C349 WeakPolarHBondContact O-CB 3.3Å; W345-C349 PolarHBondContact O-N 3.16Å
346L89Confident84.6Confident95 Ų9530.9 Ų30.950%0.49717%0.174SC..Hα-helixtrans-61.5-42.1174.5-178.165.1000111.6M58 A342 T343 Q344 C349 S350M58-L346 HydrophobicContact SD-CB 4.24Å; M58-L346 HydrophobicContact SD-CD1 4.11Å; A342-L346 WeakPolarHBondContact O-CB 3.4Å; A342-L346 PolarHBondContact O-N 3.43Å; T343-L346 PolarHBondContact O-N 3.14Å; Q344-L346 VanDerWaalsContact C-N 3.34Å; Q344-L346 PolarHBondContact O-N 2.67Å; L346-C349 PolarHBondContact O-N 3Å; L346-S350 WeakPolarHBondContact O-CB 3.41Å; L346-S350 PolarHBondContact O-N 2.85Å; L346-S350 PolarHBondContact O-OG 2.58Å
347L92.2Very high85.3Confident32 Ų3237.1 Ų37.117%0.16820%0.198CC..Hα-helixtrans-66.2-43.8173.9-67.3173.3000111.6A219 T222 A223 I226 T343 Q344 W345 C349 S350 I351A219-L347 HydrophobicContact CB-CD1 3.81Å; A219-L347 WeakPolarHBondContact O-CD1 3.38Å; T222-L347 HydrophobicContact CG2-CD1 4.44Å; A223-L347 HydrophobicContact CB-CD1 4.42Å; I226-L347 HydrophobicContact CD1-CB 3.83Å; T343-L347 WeakPolarHBondContact O-CG 3.43Å; T343-L347 PolarHBondContact O-N 2.67Å; Q344-L347 PolarHBondContact O-N 2.74Å; W345-L347 VanDerWaalsContact C-N 3.33Å; W345-L347 PolarHBondContact O-N 2.88Å; L347-C349 PolarHBondContact O-N 3.05Å; L347-S350 PolarHBondContact O-N 3.15Å; L347-S350 PolarHBondContact O-OG 3.24Å; L347-I351 HydrophobicContact CB-CD1 4.16Å; L347-I351 HydrophobicContact CD2-CD1 4.25Å; L347-I351 WeakPolarHBondContact O-CB 3.46Å; L347-I351 WeakPolarHBondContact O-CG1 3.44Å; L347-I351 PolarHBondContact O-N 3.05Å
348Q90.2Very high86.1Confident34 Ų3436.8 Ų36.816%0.15920%0.195CC..Hα-helixtrans-65.7-20.3175.4-69.9-167.93.500112.7N54 I226 Q344 W345 P352N54-Q348 HydrophobicContact CB-CB 4.08Å; N54-Q348 WeakPolarHBondContact ND2-CB 3.33Å; N54-Q348 PolarHBondContact ND2-O 3.18Å; I226-Q348 HydrophobicContact CD1-CB 4.25Å; I226-Q348 HydrophobicContact CD1-CG 3.41Å; I226-Q348 VanDerWaalsContact CD1-CG 3.41Å; I226-Q348 HydrophobicContact CG1-CG 3.89Å; Q344-Q348 WeakPolarHBondContact O-CG 3.41Å; Q344-Q348 PolarHBondContact O-N 3.33Å; W345-Q348 HydrophobicContact CE3-CB 4.42Å; W345-Q348 VanDerWaalsContact CE3-OE1 3.23Å; W345-Q348 CarbonylContact O-C 3.55Å; W345-Q348 PolarHBondContact O-N 2.91Å; Q348-P352 WeakPolarHBondContact O-CD 3.33Å; Q348-P352 WeakPolarHBondContact O-CG 3.43Å
349C88.4Confident86.6Confident22 Ų2237.5 Ų37.515%0.14920%0.195CC..Hα-helixtrans-80.8-51.5171.6179.10000111.3A51 N54 W345 L346 L347A51-C349 WeakPolarHBondContact CB-O 3.42Å; A51-C349 PolarHBondContact O-SG 3.45Å; N54-C349 HydrophobicContact CB-CB 4.1Å; W345-C349 WeakPolarHBondContact O-CB 3.3Å; W345-C349 PolarHBondContact O-N 3.16Å; L346-C349 PolarHBondContact O-N 3Å; L347-C349 PolarHBondContact O-N 3.05Å
350S89.9Confident86.8Confident49 Ų4940.8 Ų40.834%0.34321%0.209SC..Hα-helixtrans-73.5-43-172.151.40000113.9L346 L347 L353 V354L346-S350 WeakPolarHBondContact O-CB 3.41Å; L346-S350 PolarHBondContact O-N 2.85Å; L346-S350 PolarHBondContact O-OG 2.58Å; L347-S350 PolarHBondContact O-N 3.15Å; L347-S350 PolarHBondContact O-OG 3.24Å; S350-L353 PolarHBondContact O-N 3.25Å; S350-V354 WeakPolarHBondContact O-CG2 3.27Å; S350-V354 PolarHBondContact O-N 3.41Å
351I90.4Very high87.1Confident20 Ų2044.6 Ų44.610%0.10323%0.23CC..Hα-helixtrans-68.6-44.1-173-64.2174.3000112.1A223 I226 C227 I230 L347 L353 V354 G355A223-I351 HydrophobicContact CB-CD1 3.57Å; I226-I351 HydrophobicContact CB-CD1 4.31Å; I226-I351 HydrophobicContact CB-CG2 4.27Å; I226-I351 HydrophobicContact CD1-CD1 4.19Å; I226-I351 HydrophobicContact CG2-CB 3.85Å; I226-I351 HydrophobicContact CG2-CG2 3.66Å; C227-I351 VanDerWaalsContact SG-CG2 3.59Å; I230-I351 HydrophobicContact CD1-CG2 3.94Å; L347-I351 HydrophobicContact CB-CD1 4.16Å; L347-I351 HydrophobicContact CD2-CD1 4.25Å; L347-I351 WeakPolarHBondContact O-CB 3.46Å; L347-I351 WeakPolarHBondContact O-CG1 3.44Å; L347-I351 PolarHBondContact O-N 3.05Å; I351-L353 VanDerWaalsContact C-N 3.32Å; I351-L353 PolarHBondContact O-N 3.16Å; I351-V354 PolarHBondContact O-N 3.21Å; I351-G355 WeakPolarHBondContact O-CA 3.43Å; I351-G355 PolarHBondContact O-N 3.39Å
352P85.7Confident87.5Confident11 Ų1150.8 Ų50.87%0.07125%0.253CS..Hα-helixtrans-60-36.5175.7-27.938.2000114.3H50 I226 I230 Q348 G355 S356H50-P352 HydrophobicContact CB-CB 4.36Å; I226-P352 HydrophobicContact CG2-CG 4.22Å; I230-P352 HydrophobicContact CD1-CB 4.14Å; I230-P352 HydrophobicContact CD1-CG 4.03Å; Q348-P352 WeakPolarHBondContact O-CD 3.33Å; Q348-P352 WeakPolarHBondContact O-CG 3.43Å; P352-G355 PolarHBondContact O-N 2.77Å; P352-S356 VanDerWaalsContact O-CB 3.25Å; P352-S356 WeakPolarHBondContact O-CB 3.4Å; P352-S356 PolarHBondContact O-N 2.99Å; P352-S356 PolarHBondContact O-OG 3Å
353L87.4Confident87.7Confident75 Ų7552.6 Ų52.639%0.39327%0.265SS..Hα-helixtrans-61-52.4175.1-69.4172.9000111.3V48 A51 S350 I351 Y357V48-L353 HydrophobicContact CB-CD2 4.46Å; V48-L353 HydrophobicContact CG2-CD2 3.9Å; A51-L353 HydrophobicContact CB-CD1 3.8Å; A51-L353 HydrophobicContact CB-CD2 3.49Å; A51-L353 VanDerWaalsContact CB-CD2 3.49Å; A51-L353 HydrophobicContact CB-CG 3.37Å; S350-L353 PolarHBondContact O-N 3.25Å; I351-L353 VanDerWaalsContact C-N 3.32Å; I351-L353 PolarHBondContact O-N 3.16Å; L353-Y357 PolarHBondContact O-N 2.98Å
354V87.8Confident87.6Confident91 Ų9153.4 Ų53.455%0.55226%0.264SS*.Hα-helixtrans-66.5-42.2-179.9177.90000110.4S350 I351 Y357 V358S350-V354 WeakPolarHBondContact O-CG2 3.27Å; S350-V354 PolarHBondContact O-N 3.41Å; I351-V354 PolarHBondContact O-N 3.21Å; V354-Y357 PolarHBondContact O-N 3.2Å; V354-V358 HydrophobicContact CG1-CG2 4.13Å; V354-V358 WeakPolarHBondContact O-CB 3.37Å; V354-V358 WeakPolarHBondContact O-CG2 2.84Å; V354-V358 PolarHBondContact O-N 2.84Å
355G86.4Confident87.6Confident1 Ų153.1 Ų53.11%0.0127%0.266CS..Hα-helixtrans-67.9-41.6-176.200000113.2I351 P352 Y357 V358 I359I351-G355 WeakPolarHBondContact O-CA 3.43Å; I351-G355 PolarHBondContact O-N 3.39Å; P352-G355 PolarHBondContact O-N 2.77Å; G355-Y357 VanDerWaalsContact C-N 3.32Å; G355-Y357 PolarHBondContact O-N 3.23Å; G355-V358 PolarHBondContact O-N 3Å; G355-I359 WeakPolarHBondContact O-CG1 3.48Å; G355-I359 PolarHBondContact O-N 3.24Å
356S85.1Confident87.8Confident2 Ų254.4 Ų54.41%0.01428%0.276CS..Hα-helixtrans-61.5-41.1172.5-77.40000112M43 G47 P352 I359 Q360M43-S356 WeakPolarHBondContact O-CB 3.48Å; M43-S356 PolarHBondContact O-OG 3.03Å; G47-S356 VanDerWaalsContact CA-OG 3.26Å; G47-S356 WeakPolarHBondContact CA-OG 3.43Å; G47-S356 PolarHBondContact N-OG 3.35Å; P352-S356 VanDerWaalsContact O-CB 3.25Å; P352-S356 WeakPolarHBondContact O-CB 3.4Å; P352-S356 PolarHBondContact O-N 2.99Å; P352-S356 PolarHBondContact O-OG 3Å; S356-I359 PolarHBondContact O-N 2.94Å; S356-Q360 WeakPolarHBondContact O-CB 3.1Å; S356-Q360 PolarHBondContact O-N 3.28Å; S356-Q360 VanDerWaalsContact O-N 3.09Å
357Y87.1Confident87.8Confident133 Ų13350 Ų5052%0.52225%0.254SS..Hα-helixtrans-65.5-41.5175.3-175.8-93.4000112.3L353 V354 G355 Q360 N361L353-Y357 PolarHBondContact O-N 2.98Å; V354-Y357 PolarHBondContact O-N 3.2Å; G355-Y357 VanDerWaalsContact C-N 3.32Å; G355-Y357 PolarHBondContact O-N 3.23Å; Y357-Q360 PolarHBondContact O-N 2.97Å; Y357-N361 WeakPolarHBondContact CD2-ND2 3.38Å; Y357-N361 WeakPolarHBondContact CE1-ND2 3.36Å; Y357-N361 VanDerWaalsContact CE2-ND2 3.26Å; Y357-N361 WeakPolarHBondContact CE2-ND2 3.43Å; Y357-N361 VanDerWaalsContact CZ-ND2 3.26Å; Y357-N361 PolarHBondContact O-N 3.49Å; Y357-N361 PolarHBondContact O-ND2 3.38Å
358V87.5Confident87.8Confident7 Ų748.6 Ų48.64%0.04225%0.246CC..Hα-helixtrans-61.4-46.4176.1164.50000111.2V354 G355 Q360 N361 W362 V366 L367V354-V358 HydrophobicContact CG1-CG2 4.13Å; V354-V358 WeakPolarHBondContact O-CB 3.37Å; V354-V358 WeakPolarHBondContact O-CG2 2.84Å; V354-V358 PolarHBondContact O-N 2.84Å; G355-V358 PolarHBondContact O-N 3Å; V358-Q360 VanDerWaalsContact C-N 3.33Å; V358-Q360 PolarHBondContact O-N 3.18Å; V358-N361 PolarHBondContact O-N 2.7Å; V358-W362 HydrophobicContact CB-CE3 4.02Å; V358-W362 HydrophobicContact CB-CZ3 4.3Å; V358-W362 HydrophobicContact CG1-CE3 3.95Å; V358-W362 HydrophobicContact CG2-CE3 3.92Å; V358-W362 HydrophobicContact CG2-CZ3 3.7Å; V358-W362 WeakPolarHBondContact O-CB 3.06Å; V358-W362 PolarHBondContact O-N 2.89Å; V358-V366 HydrophobicContact CG1-CB 3.88Å; V358-V366 HydrophobicContact CG1-CG1 3.86Å; V358-L367 HydrophobicContact CB-CD2 4.37Å; V358-L367 HydrophobicContact CB-CG 4.4Å; V358-L367 HydrophobicContact CG1-CD2 4.06Å; V358-L367 HydrophobicContact CG1-CG 3.8Å
359I84Confident87.9Confident31 Ų3151.4 Ų51.416%0.15926%0.261CS..Hα-helixtrans-63.1-41.6179.2-73.8171.6000110.9M43 I230 G355 S356 L367M43-I359 HydrophobicContact CG-CG2 4.5Å; I230-I359 HydrophobicContact CG2-CD1 3.59Å; G355-I359 WeakPolarHBondContact O-CG1 3.48Å; G355-I359 PolarHBondContact O-N 3.24Å; S356-I359 PolarHBondContact O-N 2.94Å; I359-L367 HydrophobicContact CD1-CD1 3.57Å; I359-L367 HydrophobicContact CG1-CD1 3.56Å; I359-L367 HydrophobicContact CG1-CG 4.49Å
360Q84.6Confident88.2Confident105 Ų10553.6 Ų53.649%0.49127%0.271SS..Hα-helixtrans-67.5-37.5-177.3-177.1167.3-7.100112.9S356 Y357 V358S356-Q360 WeakPolarHBondContact O-CB 3.1Å; S356-Q360 PolarHBondContact O-N 3.28Å; S356-Q360 VanDerWaalsContact O-N 3.09Å; Y357-Q360 PolarHBondContact O-N 2.97Å; V358-Q360 VanDerWaalsContact C-N 3.33Å; V358-Q360 PolarHBondContact O-N 3.18Å
361N88.9Confident88.3Confident83 Ų8351.2 Ų51.244%0.44426%0.255SS..Hα-helixtrans-98.4-23.9-173.4-66.7-68.6000114.5Y357 V358Y357-N361 WeakPolarHBondContact CD2-ND2 3.38Å; Y357-N361 WeakPolarHBondContact CE1-ND2 3.36Å; Y357-N361 VanDerWaalsContact CE2-ND2 3.26Å; Y357-N361 WeakPolarHBondContact CE2-ND2 3.43Å; Y357-N361 VanDerWaalsContact CZ-ND2 3.26Å; Y357-N361 PolarHBondContact O-N 3.49Å; Y357-N361 PolarHBondContact O-ND2 3.38Å; V358-N361 PolarHBondContact O-N 2.7Å
362W87.9Confident88.6Confident174 Ų17450.5 Ų50.566%0.65925%0.251SS*.SBendtrans-123.4-101.2-176.5-61.6-52.6000110.7V358 V366V358-W362 HydrophobicContact CB-CE3 4.02Å; V358-W362 HydrophobicContact CB-CZ3 4.3Å; V358-W362 HydrophobicContact CG1-CE3 3.95Å; V358-W362 HydrophobicContact CG2-CE3 3.92Å; V358-W362 HydrophobicContact CG2-CZ3 3.7Å; V358-W362 WeakPolarHBondContact O-CB 3.06Å; V358-W362 PolarHBondContact O-N 2.89Å; W362-V366 HydrophobicContact CB-CG2 4.1Å
363S85.7Confident89.1Confident46 Ų4652.2 Ų52.232%0.32227%0.267SS..  trans-162.1160.5178.265.10000110.5S365 V366S363-S365 PolarHBondContact O-N 2.96Å; S363-V366 PolarHBondContact O-N 3.02Å
364Y85.3Confident89.5Confident54 Ų5451.4 Ų51.421%0.21226%0.26CS..Hα-helixtrans-63.4-24.817472.2-91.5000112.8V231 H235 V366 L367 C368V231-Y364 HydrophobicContact CG1-CD2 3.64Å; V231-Y364 HydrophobicContact CG1-CG 4.19Å; H235-Y364 AromaticContact CE1-CE1 3.33Å; H235-Y364 WeakPolarHBondContact CE1-CE1 3.3Å; H235-Y364 AromaticContact CE1-CE2 3.94Å; H235-Y364 AromaticContact CE1-CZ 3.25Å; H235-Y364 PolarHBondContact CE1-OH 3.49Å; H235-Y364 VanDerWaalsContact CE1-OH 3.27Å; H235-Y364 AromaticContact ND1-CD1 3.63Å; H235-Y364 AromaticContact ND1-CE1 3.38Å; H235-Y364 WeakPolarHBondContact ND1-CE1 3.32Å; H235-Y364 AromaticContact ND1-CE2 3.91Å; H235-Y364 AromaticContact ND1-CZ 3.53Å; Y364-V366 PolarHBondContact O-N 3.36Å; Y364-L367 PolarHBondContact O-N 3.27Å; Y364-L367 VanDerWaalsContact O-N 3.11Å; Y364-C368 PolarHBondContact O-N 3.17Å
365S89.3Confident89.9Confident28 Ų2847.1 Ų47.120%0.19623%0.234CC..Hα-helixtrans-61-31.8178-57.50000112.5S363 L367 C368 I369S363-S365 PolarHBondContact O-N 2.96Å; S365-L367 VanDerWaalsContact C-N 3.3Å; S365-L367 PolarHBondContact O-N 3.44Å; S365-C368 WeakPolarHBondContact O-CB 3.37Å; S365-C368 PolarHBondContact O-N 3.29Å; S365-I369 WeakPolarHBondContact O-CG1 3.12Å; S365-I369 PolarHBondContact O-N 3.06Å
366V90.8Very high90.4Very high50 Ų5047.8 Ų47.830%0.30324%0.241SC..Hα-helixtrans-61.7-41.3176.2179.50000110.7V358 W362 S363 Y364 I369 L370V358-V366 HydrophobicContact CG1-CB 3.88Å; V358-V366 HydrophobicContact CG1-CG1 3.86Å; W362-V366 HydrophobicContact CB-CG2 4.1Å; S363-V366 PolarHBondContact O-N 3.02Å; Y364-V366 PolarHBondContact O-N 3.36Å; V366-I369 PolarHBondContact O-N 2.92Å; V366-L370 HydrophobicContact CG1-CD1 4.26Å; V366-L370 WeakPolarHBondContact O-CG 2.91Å; V366-L370 PolarHBondContact O-N 3.37Å
367L90.2Very high91Very high3 Ų352.1 Ų52.12%0.01626%0.264CS..Hα-helixtrans-71-33.5177.7-75.8-178.4000112.9I230 V231 V358 I359 Y364 S365 I369 L370 A371I230-L367 HydrophobicContact CG2-CD1 4.2Å; V231-L367 HydrophobicContact CG2-CB 3.13Å; V231-L367 HydrophobicContact CG2-CD1 3.56Å; V231-L367 HydrophobicContact CG2-CG 3.99Å; V358-L367 HydrophobicContact CB-CD2 4.37Å; V358-L367 HydrophobicContact CB-CG 4.4Å; V358-L367 HydrophobicContact CG1-CD2 4.06Å; V358-L367 HydrophobicContact CG1-CG 3.8Å; I359-L367 HydrophobicContact CD1-CD1 3.57Å; I359-L367 HydrophobicContact CG1-CD1 3.56Å; I359-L367 HydrophobicContact CG1-CG 4.49Å; Y364-L367 PolarHBondContact O-N 3.27Å; Y364-L367 VanDerWaalsContact O-N 3.11Å; S365-L367 VanDerWaalsContact C-N 3.3Å; S365-L367 PolarHBondContact O-N 3.44Å; L367-I369 VanDerWaalsContact C-N 3.33Å; L367-L370 HydrophobicContact CD2-CD1 4.08Å; L367-L370 PolarHBondContact O-N 3.42Å; L367-A371 WeakPolarHBondContact O-CB 3.27Å; L367-A371 PolarHBondContact O-N 3.49Å
368C91.3Very high91.4Very high1 Ų145.8 Ų45.81%0.00724%0.239CC..Hα-helixtrans-61.7-42.6169.9-730000111.7V231 Y290 T294 Y364 S365 L370 A371 A372V231-C368 VanDerWaalsContact CG1-SG 3.53Å; Y290-C368 WeakPolarHBondContact O-CB 3.16Å; T294-C368 HydrophobicContact CG2-CB 3.6Å; Y364-C368 PolarHBondContact O-N 3.17Å; S365-C368 WeakPolarHBondContact O-CB 3.37Å; S365-C368 PolarHBondContact O-N 3.29Å; C368-L370 VanDerWaalsContact C-N 3.35Å; C368-A371 PolarHBondContact O-N 3.06Å; C368-A372 WeakPolarHBondContact O-CB 3.31Å; C368-A372 PolarHBondContact O-N 2.66Å
369I93.4Very high91.7Very high93 Ų9347.1 Ų47.148%0.47725%0.246SC..Hα-helixtrans-64.6-41.2176.3-66.2165.4000110.3T294 S365 V366 L367 A372 A373T294-I369 HydrophobicContact CG2-CG1 4.2Å; S365-I369 WeakPolarHBondContact O-CG1 3.12Å; S365-I369 PolarHBondContact O-N 3.06Å; V366-I369 PolarHBondContact O-N 2.92Å; L367-I369 VanDerWaalsContact C-N 3.33Å; I369-A372 PolarHBondContact O-N 3.41Å; I369-A373 WeakPolarHBondContact O-CB 3.38Å; I369-A373 PolarHBondContact O-N 3.27Å
370L93Very high92.2Very high68 Ų6848.6 Ų48.636%0.35626%0.256SS..Hα-helixtrans-64.3-41.3174.9-73.2169.8000112.2V366 L367 C368 A372 A373 F374V366-L370 HydrophobicContact CG1-CD1 4.26Å; V366-L370 WeakPolarHBondContact O-CG 2.91Å; V366-L370 PolarHBondContact O-N 3.37Å; L367-L370 HydrophobicContact CD2-CD1 4.08Å; L367-L370 PolarHBondContact O-N 3.42Å; C368-L370 VanDerWaalsContact C-N 3.35Å; L370-A372 VanDerWaalsContact C-N 3.34Å; L370-A372 PolarHBondContact O-N 3.05Å; L370-A373 WeakPolarHBondContact O-CB 3.27Å; L370-A373 PolarHBondContact O-N 2.85Å; L370-F374 WeakPolarHBondContact O-CD2 3.29Å; L370-F374 PolarHBondContact O-N 2.9Å
371A93.5Very high92.6Very high0 Ų046.7 Ų46.70%025%0.247CC..Hα-helixtrans-60.6-44.5174.500000111.4S224 C227 Y290 L367 C368 A373 F374 A375S224-A371 VanDerWaalsContact CB-O 3.3Å; S224-A371 WeakPolarHBondContact CB-O 2.7Å; S224-A371 WeakPolarHBondContact O-CB 3.35Å; C227-A371 HydrophobicContact CB-CB 3.82Å; Y290-A371 HydrophobicContact CD1-CB 4.16Å; Y290-A371 HydrophobicContact CD2-CB 3.77Å; Y290-A371 HydrophobicContact CE1-CB 4.46Å; Y290-A371 HydrophobicContact CE2-CB 4Å; Y290-A371 HydrophobicContact CG-CB 3.86Å; L367-A371 WeakPolarHBondContact O-CB 3.27Å; L367-A371 PolarHBondContact O-N 3.49Å; C368-A371 PolarHBondContact O-N 3.06Å; A371-A373 VanDerWaalsContact C-N 3.34Å; A371-A373 PolarHBondContact O-N 3.42Å; A371-F374 PolarHBondContact O-N 3.2Å; A371-A375 PolarHBondContact O-N 3.48Å
372A95.2Very high92.6Very high4 Ų442.7 Ų42.73%0.03323%0.226CC..Hα-helixtrans-62.2-40.3173.500000111.9M287 L291 C368 I369 L370 A375 G376M287-A372 HydrophobicContact CG-CB 4.13Å; L291-A372 HydrophobicContact CD2-CB 3.88Å; L291-A372 HydrophobicContact CG-CB 3.82Å; C368-A372 WeakPolarHBondContact O-CB 3.31Å; C368-A372 PolarHBondContact O-N 2.66Å; I369-A372 PolarHBondContact O-N 3.41Å; L370-A372 VanDerWaalsContact C-N 3.34Å; L370-A372 PolarHBondContact O-N 3.05Å; A372-A375 PolarHBondContact O-N 2.97Å; A372-G376 PolarHBondContact O-N 3.45Å
373A96.3Very high92.6Very high48 Ų4837.9 Ų37.940%0.39722%0.223SC..Hα-helixtrans-64.1-43.2176.900000111.8I369 L370 A371 G376 L377I369-A373 WeakPolarHBondContact O-CB 3.38Å; I369-A373 PolarHBondContact O-N 3.27Å; L370-A373 WeakPolarHBondContact O-CB 3.27Å; L370-A373 PolarHBondContact O-N 2.85Å; A371-A373 VanDerWaalsContact C-N 3.34Å; A371-A373 PolarHBondContact O-N 3.42Å; A373-G376 PolarHBondContact O-N 3.26Å; A373-L377 WeakPolarHBondContact O-CB 3.37Å; A373-L377 VanDerWaalsContact O-CG 3.32Å; A373-L377 WeakPolarHBondContact O-CG 3.28Å; A373-L377 PolarHBondContact O-N 3.36Å
374F96.5Very high92.7Very high58 Ų5844 Ų4425%0.25424%0.239SC..Hα-helixtrans-63.7-41.3174.8-71-51.9000112.4L220 A223 L370 A371 G376 L377 A378L220-F374 HydrophobicContact CD2-CD1 3.93Å; A223-F374 HydrophobicContact CB-CD1 4.41Å; A223-F374 HydrophobicContact CB-CD2 3.93Å; A223-F374 HydrophobicContact CB-CE2 4.17Å; A223-F374 HydrophobicContact CB-CG 4.07Å; L370-F374 WeakPolarHBondContact O-CD2 3.29Å; L370-F374 PolarHBondContact O-N 2.9Å; A371-F374 PolarHBondContact O-N 3.2Å; F374-G376 VanDerWaalsContact C-N 3.35Å; F374-L377 HydrophobicContact CD1-CD1 4.47Å; F374-L377 PolarHBondContact O-N 3.17Å; F374-A378 WeakPolarHBondContact O-CB 3.43Å; F374-A378 PolarHBondContact O-N 2.75Å
375A96Very high92.4Very high0 Ų045.9 Ų45.90%025%0.246CC..Hα-helixtrans-63.7-40173.500000112L283 L286 M287 A371 A372 A378 L379L283-A375 HydrophobicContact CD2-CB 4.49Å; L286-A375 HydrophobicContact CB-CB 4.35Å; M287-A375 HydrophobicContact CB-CB 4.41Å; A371-A375 PolarHBondContact O-N 3.48Å; A372-A375 PolarHBondContact O-N 2.97Å; A375-A378 WeakPolarHBondContact O-CB 3.08Å; A375-A378 PolarHBondContact O-N 3.4Å; A375-L379 PolarHBondContact O-N 2.94Å
376G97.6Very high91.3Very high16 Ų1645.1 Ų45.117%0.16524%0.243CC..Hα-helixtrans-65.6-40.6175.100000112.9A372 A373 F374 L379 V380A372-G376 PolarHBondContact O-N 3.45Å; A373-G376 PolarHBondContact O-N 3.26Å; F374-G376 VanDerWaalsContact C-N 3.35Å; G376-L379 WeakPolarHBondContact O-CB 3.5Å; G376-L379 PolarHBondContact O-N 3.45Å; G376-V380 WeakPolarHBondContact O-CG2 3.47Å; G376-V380 PolarHBondContact O-N 3.29Å
377L96.8Very high90Very high92 Ų9253.9 Ų53.948%0.48227%0.27SS..Hα-helixtrans-63-43.7173.1-72.6173.9000111.2L220 A373 F374 L379 V380 E381L220-L377 HydrophobicContact CD1-CB 4.29Å; L220-L377 HydrophobicContact CD2-CB 4.26Å; L220-L377 HydrophobicContact CD2-CD1 4.49Å; A373-L377 WeakPolarHBondContact O-CB 3.37Å; A373-L377 VanDerWaalsContact O-CG 3.32Å; A373-L377 WeakPolarHBondContact O-CG 3.28Å; A373-L377 PolarHBondContact O-N 3.36Å; F374-L377 HydrophobicContact CD1-CD1 4.47Å; F374-L377 PolarHBondContact O-N 3.17Å; L377-L379 VanDerWaalsContact C-N 3.27Å; L377-L379 PolarHBondContact O-N 3.14Å; L377-V380 PolarHBondContact O-N 2.7Å; L377-E381 WeakPolarHBondContact O-CG 3.41Å; L377-E381 PolarHBondContact O-N 2.71Å
378A94.9Very high88.9Confident0 Ų055.2 Ų55.20%028%0.276CS..Hα-helixtrans-57.7-42.1173.700000111.5L217 L220 L283 F374 A375 E381 I382L217-A378 HydrophobicContact CD1-CB 3.66Å; L220-A378 HydrophobicContact CB-CB 3.97Å; L220-A378 HydrophobicContact CD1-CB 4.25Å; L283-A378 HydrophobicContact CD1-CB 3.86Å; L283-A378 HydrophobicContact CD2-CB 4Å; F374-A378 WeakPolarHBondContact O-CB 3.43Å; F374-A378 PolarHBondContact O-N 2.75Å; A375-A378 WeakPolarHBondContact O-CB 3.08Å; A375-A378 PolarHBondContact O-N 3.4Å; A378-E381 PolarHBondContact O-N 3.06Å; A378-I382 WeakPolarHBondContact O-CG1 3.47Å; A378-I382 PolarHBondContact O-N 3.45Å
379L94.8Very high87.5Confident36 Ų3655.3 Ų55.319%0.18828%0.276CS..Hα-helixtrans-63.9-43.1177.6-177.565.3000111.9E280 L283 V284 A375 G376 L377 E381 I382 A383E280-L379 HydrophobicContact CB-CD1 3.91Å; E280-L379 HydrophobicContact CG-CD1 3.9Å; L283-L379 HydrophobicContact CB-CB 4.32Å; L283-L379 HydrophobicContact CB-CD1 4.32Å; L283-L379 HydrophobicContact CD1-CB 4.23Å; V284-L379 HydrophobicContact CG2-CD1 4.26Å; V284-L379 HydrophobicContact CG2-CD2 3.61Å; A375-L379 PolarHBondContact O-N 2.94Å; G376-L379 WeakPolarHBondContact O-CB 3.5Å; G376-L379 PolarHBondContact O-N 3.45Å; L377-L379 VanDerWaalsContact C-N 3.27Å; L377-L379 PolarHBondContact O-N 3.14Å; L379-E381 VanDerWaalsContact C-N 3.34Å; L379-E381 PolarHBondContact O-N 3.03Å; L379-I382 PolarHBondContact O-N 3.24Å; L379-A383 WeakPolarHBondContact O-CB 3.3Å; L379-A383 PolarHBondContact O-N 3.04Å
380V95.1Very high85.8Confident61 Ų6155 Ų5537%0.3728%0.276SS..Hα-helixtrans-62.5-41.6176170.40000111.4G376 L377 A383 R384G376-V380 WeakPolarHBondContact O-CG2 3.47Å; G376-V380 PolarHBondContact O-N 3.29Å; L377-V380 PolarHBondContact O-N 2.7Å; V380-A383 PolarHBondContact O-N 2.9Å; V380-R384 WeakPolarHBondContact O-CB 3.07Å; V380-R384 VanDerWaalsContact O-CG 3.31Å; V380-R384 WeakPolarHBondContact O-CG 3.19Å; V380-R384 PolarHBondContact O-N 3.08Å
381E91.4Very high84Confident65 Ų6555 Ų5530%0.30428%0.279SS..Hα-helixtrans-66.2-38.8178-69.8-60.8120.600111.8L220 L377 A378 L379 R384 Y385L220-E381 HydrophobicContact CD1-CG 4.42Å; L377-E381 WeakPolarHBondContact O-CG 3.41Å; L377-E381 PolarHBondContact O-N 2.71Å; A378-E381 PolarHBondContact O-N 3.06Å; L379-E381 VanDerWaalsContact C-N 3.34Å; L379-E381 PolarHBondContact O-N 3.03Å; E381-R384 PolarHBondContact O-N 3.14Å; E381-R384 IonicContact OE1-NH1 3.93Å; E381-R384 PolarHBondContact OE1-NH1 3.39Å; E381-Y385 VanDerWaalsContact O-CD2 3.29Å; E381-Y385 WeakPolarHBondContact O-CD2 3.42Å; E381-Y385 PolarHBondContact O-N 3.44Å; E381-Y385 VanDerWaalsContact OE2-CE2 3.23Å; E381-Y385 WeakPolarHBondContact OE2-CE2 3.43Å
382I89.5Confident81.8Confident0 Ų060 Ų600%031%0.31CS..Hα-helixtrans-64.9-47.3172.1-67.7179.9000110.9L217 T276 V279 E280 L283 A378 L379 R384 Y385 G386 L389L217-I382 HydrophobicContact CD1-CD1 3.95Å; L217-I382 HydrophobicContact CD1-CG1 3.84Å; L217-I382 HydrophobicContact CD2-CD1 3.86Å; L217-I382 HydrophobicContact CD2-CG1 3.79Å; L217-I382 HydrophobicContact CG-CG1 4.5Å; T276-I382 HydrophobicContact CG2-CG2 3.84Å; V279-I382 HydrophobicContact CB-CD1 3.98Å; V279-I382 HydrophobicContact CG1-CD1 3.23Å; E280-I382 HydrophobicContact CG-CG2 3.77Å; L283-I382 HydrophobicContact CD1-CD1 3.54Å; A378-I382 WeakPolarHBondContact O-CG1 3.47Å; A378-I382 PolarHBondContact O-N 3.45Å; L379-I382 PolarHBondContact O-N 3.24Å; I382-R384 PolarHBondContact O-N 3.03Å; I382-Y385 PolarHBondContact O-N 2.98Å; I382-G386 WeakPolarHBondContact O-CA 3.42Å; I382-G386 PolarHBondContact O-N 3.49Å; I382-L389 HydrophobicContact CD1-CD1 4.2Å; I382-L389 HydrophobicContact CG1-CD1 4.09Å; I382-L389 HydrophobicContact CG2-CD1 3.83Å
383A88.9Confident79.6Confident73 Ų7362.3 Ų62.360%0.60332%0.32SS*.Hα-helixtrans-59.5-34.9179.500000112.2L379 V380L379-A383 WeakPolarHBondContact O-CB 3.3Å; L379-A383 PolarHBondContact O-N 3.04Å; V380-A383 PolarHBondContact O-N 2.9Å
384R87.6Confident77.1Confident173 Ų17366.6 Ų66.665%0.65334%0.336SS*.Hα-helixtrans-73.4-38.5177.3-75.2174.7176.1175.9-2.5113.4V380 E381 I382V380-R384 WeakPolarHBondContact O-CB 3.07Å; V380-R384 VanDerWaalsContact O-CG 3.31Å; V380-R384 WeakPolarHBondContact O-CG 3.19Å; V380-R384 PolarHBondContact O-N 3.08Å; E381-R384 PolarHBondContact O-N 3.14Å; E381-R384 IonicContact OE1-NH1 3.93Å; E381-R384 PolarHBondContact OE1-NH1 3.39Å; I382-R384 PolarHBondContact O-N 3.03Å
385Y77.6Confident74.5Confident95 Ų9569.2 Ų69.237%0.37335%0.349SS..Hα-helixtrans-115.9-0.2-169.1-60.3-68.2000114.5K213 E381 I382 R387 F388K213-Y385 HydrophobicContact CD-CG 4.41Å; E381-Y385 VanDerWaalsContact O-CD2 3.29Å; E381-Y385 WeakPolarHBondContact O-CD2 3.42Å; E381-Y385 PolarHBondContact O-N 3.44Å; E381-Y385 VanDerWaalsContact OE2-CE2 3.23Å; E381-Y385 WeakPolarHBondContact OE2-CE2 3.43Å; I382-Y385 PolarHBondContact O-N 2.98Å; Y385-R387 PolarHBondContact O-N 3.38Å; Y385-F388 WeakPolarHBondContact O-CD1 3.34Å; Y385-F388 PolarHBondContact O-N 3.38Å
386G67.4Low72.1Confident11 Ų1171.4 Ų71.411%0.11336%0.361CS..G310 helixtrans-51.1-20.1-162.900000116.6T276 I382 F388 L389T276-G386 PolarHBondContact OG1-O 3.21Å; I382-G386 WeakPolarHBondContact O-CA 3.42Å; I382-G386 PolarHBondContact O-N 3.49Å; G386-F388 PolarHBondContact O-N 3.16Å; G386-L389 PolarHBondContact O-N 3.09Å
387R63.5Low69.4Low234 Ų23471.3 Ų71.388%0.88336%0.357SS*.G310 helixtrans-53.7-23.7167-63.1-171.4-167.8-175.14.2113.9Y385Y385-R387 PolarHBondContact O-N 3.38Å
388F67Low66.7Low31 Ų3175.6 Ų75.614%0.13637%0.367CS..G310 helixtrans-75.4-24176.683.1-98.7000113.8L217 Y385 G386 N390L217-F388 HydrophobicContact CD2-CZ 4.25Å; Y385-F388 WeakPolarHBondContact O-CD1 3.34Å; Y385-F388 PolarHBondContact O-N 3.38Å; G386-F388 PolarHBondContact O-N 3.16Å; F388-N390 VanDerWaalsContact C-N 3.31Å
389L61.1Low63.9Low3 Ų379.3 Ų79.32%0.01639%0.387CS..THydrogen-bonded Turntrans-82.7-10.2-179-65.9169.5000112.4T276 Q323 I382 G386 T391T276-L389 HydrophobicContact CG2-CD1 4.24Å; T276-L389 WeakPolarHBondContact OG1-CB 3.44Å; Q323-L389 HydrophobicContact CB-CD2 3.85Å; Q323-L389 HydrophobicContact CG-CD2 3.5Å; Q323-L389 VanDerWaalsContact CG-CD2 3.5Å; Q323-L389 PolarHBondContact NE2-O 2.9Å; Q323-L389 PolarHBondContact OE1-O 2.98Å; I382-L389 HydrophobicContact CD1-CD1 4.2Å; I382-L389 HydrophobicContact CG1-CD1 4.09Å; I382-L389 HydrophobicContact CG2-CD1 3.83Å; G386-L389 PolarHBondContact O-N 3.09Å; L389-T391 PolarHBondContact O-N 2.97Å; L389-T391 VanDerWaalsContact O-N 3.14Å
390N58.6Low61.4Low88 Ų8880.9 Ų80.947%0.47140%0.395SS..THydrogen-bonded Turntrans-78.812.9-176.7-74-7.2000114.5T276 F388 T392T276-N390 PolarHBondContact OG1-OD1 2.83Å; F388-N390 VanDerWaalsContact C-N 3.31Å; N390-T392 VanDerWaalsContact C-N 3.29Å; N390-T392 PolarHBondContact O-N 3.22Å
391T53.8Low58.7Low68 Ų6884.7 Ų84.742%0.41741%0.409SS..  trans-69.492.4165.437.60000109Q323 L389 M393Q323-T391 PolarHBondContact OE1-OG1 3.49Å; L389-T391 PolarHBondContact O-N 2.97Å; L389-T391 VanDerWaalsContact O-N 3.14Å; T391-M393 PolarHBondContact O-N 2.78Å; T391-M393 VanDerWaalsContact O-N 3.08Å
392T48.9Very low55.9Low105 Ų10587 Ų8764%0.64443%0.432SS*.  trans-58108.4170.1200000108.8N390 D394N390-T392 VanDerWaalsContact C-N 3.29Å; N390-T392 PolarHBondContact O-N 3.22Å; T392-D394 VanDerWaalsContact C-N 3.3Å; T392-D394 PolarHBondContact O-N 3.39Å
393M48.4Very low54.2Low51 Ų5191.4 Ų91.425%0.25145%0.454SS..  trans-76.683.1170.5-75.1-115.1-149.100109A322 T391 E395A322-M393 WeakPolarHBondContact O-CE 3.44Å; T391-M393 PolarHBondContact O-N 2.78Å; T391-M393 VanDerWaalsContact O-N 3.08Å; M393-E395 PolarHBondContact O-N 2.98Å
394D43.4Very low52.4Low138 Ų13892.4 Ų92.474%0.73845%0.446SS*.THydrogen-bonded Turntrans-64.32.8165.3-73-29.6000112.5T392T392-D394 VanDerWaalsContact C-N 3.3Å; T392-D394 PolarHBondContact O-N 3.39Å
395E42.2Very low50.5Low113 Ų11387.9 Ų87.953%0.52844%0.435SS..THydrogen-bonded Turntrans-102.321.3-180-60.4-165.9160.400114.8R330 M393R330-E395 IonicContact NH2-OE1 3.77Å; R330-E395 IonicContact NH2-OE2 3.04Å; R330-E395 PolarHBondContact NH2-OE2 2.97Å; M393-E395 PolarHBondContact O-N 2.98Å
396L44.9Very low48.9Very low47 Ų4787.5 Ų87.525%0.24644%0.438CS..SBendtrans-70.2143.4170.2-85.4153.1000110.8L134 W398 L400L134-L396 HydrophobicContact CD1-CD2 3.55Å; L396-W398 PolarHBondContact O-N 2.73Å; L396-L400 HydrophobicContact CD2-CD1 3.85Å
397P41.8Very low47.7Very low14 Ų1492.3 Ų92.39%0.09146%0.459CS..  trans-57136.4-176.612.7-19.5000111.7A131 L399 L400A131-P397 HydrophobicContact CB-CB 3.58Å; A131-P397 HydrophobicContact CB-CG 3.5Å; P397-L399 PolarHBondContact O-N 2.65Å; P397-L400 HydrophobicContact CG-CD1 4.05Å; P397-L400 HydrophobicContact CG-CG 4.33Å; P397-L400 WeakPolarHBondContact O-CB 3.4Å; P397-L400 PolarHBondContact O-N 3.28Å
398W39.5Very low46.7Very low181 Ų18182.8 Ų82.869%0.68643%0.43SS*.G310 helixtrans-48.5-27.8174.359.6-87.8000114.3L396 L400 Q401 S402L396-W398 PolarHBondContact O-N 2.73Å; W398-L400 PolarHBondContact O-N 3.22Å; W398-Q401 PolarHBondContact O-N 3.05Å; W398-S402 PolarHBondContact O-N 2.99Å
399L37Very low45.2Very low79 Ų7986.5 Ų86.541%0.41445%0.451SS..G310 helixtrans-66-13.5173.1-85.7160.6000114.4R267 P397R267-L399 PolarHBondContact NH1-O 2.8Å; R267-L399 PolarHBondContact NH2-O 3.31Å; P397-L399 PolarHBondContact O-N 2.65Å
400L41.4Very low44Very low68 Ų6892.9 Ų92.936%0.35649%0.485SS..G310 helixtrans-97.6-13.7168.9-66.2175.2000112.8R267 L396 P397 W398R267-L400 HydrophobicContact CG-CD2 4.38Å; L396-L400 HydrophobicContact CD2-CD1 3.85Å; P397-L400 HydrophobicContact CG-CD1 4.05Å; P397-L400 HydrophobicContact CG-CG 4.33Å; P397-L400 WeakPolarHBondContact O-CB 3.4Å; P397-L400 PolarHBondContact O-N 3.28Å; W398-L400 PolarHBondContact O-N 3.22Å
401Q38.9Very low42.8Very low141 Ų14193.3 Ų93.366%0.65949%0.486SS*.THydrogen-bonded Turntrans-94.4-23.3177.3-71.6-178.7-16.400113W398W398-Q401 PolarHBondContact O-N 3.05Å
402S33.3Very low41.8Very low115 Ų11595.6 Ų95.680%0.80449%0.492SS*.  trans-81.50163.966.50000110.9R267 W398R267-S402 PolarHBondContact NH1-OXT 3.04Å; W398-S402 PolarHBondContact O-N 2.99Å

Retrieved 402 of 402 residues in 1200.5 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).