A0A087YS41_POEFO Loading...

Lysophosphatidic acid receptor 6a

AlphaFold DB , UniProt , Accession A0A087YS41, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 350 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
1M36.1Very low40.3Very low236 Ų236147 Ų147100%1.16382%0.821SS**  095.70-80.5167.3165.700107N3M1-N3 PolarHBondContact O-N 2.75Å
2N32.7Very low41.3Very low156 Ų156148.2 Ų148.283%0.83482%0.824SS**  trans-80.7107.2179.8-74.1-4.2000108.3T4N2-T4 VanDerWaalsContact C-N 3.34Å; N2-T4 PolarHBondContact O-N 3.18Å; N2-T4 VanDerWaalsContact O-N 3.14Å
3N38.3Very low42.9Very low154 Ų154139.8 Ų139.882%0.82478%0.782SS**  trans-76.689.8164.7-89.7-5.9000108.2M1 T5M1-N3 PolarHBondContact O-N 2.75Å; N3-T5 VanDerWaalsContact C-N 3.31Å; N3-T5 PolarHBondContact O-N 2.99Å
4T38Very low44.1Very low140 Ų140137.4 Ų137.486%0.85978%0.778SS**  trans-6892.2160.319.80000108.4N2 S6N2-T4 VanDerWaalsContact C-N 3.34Å; N2-T4 PolarHBondContact O-N 3.18Å; N2-T4 VanDerWaalsContact O-N 3.14Å; T4-S6 PolarHBondContact O-N 3.38Å
5T40.8Very low45.6Very low128 Ų128137.4 Ų137.479%0.78577%0.767SS**  trans-62.5114.5162.842.50000108.9N3N3-T5 VanDerWaalsContact C-N 3.31Å; N3-T5 PolarHBondContact O-N 2.99Å
6S37Very low47Very low91 Ų91135.5 Ų135.564%0.63675%0.754SS**  trans-59.2131.417545.60000111.5T4 L8T4-S6 PolarHBondContact O-N 3.38Å; S6-L8 VanDerWaalsContact C-N 3.27Å; S6-L8 PolarHBondContact O-N 2.87Å
7P40Very low48.7Very low134 Ų134130.6 Ų130.687%0.8773%0.726SS**SBendtrans-86.155.5-17835.6-34.8000111.8
8L44.3Very low50.5Low133 Ų133130.4 Ų130.470%0.69672%0.721SS**  trans-119.418.2-174.8-148.185.8000115.3S6S6-L8 VanDerWaalsContact C-N 3.27Å; S6-L8 PolarHBondContact O-N 2.87Å
9D42.3Very low52.5Low148 Ų148127.2 Ų127.279%0.79170%0.699SS**SBendtrans-108.57.1-174.1-75.9-22.6000115.7
10N42.8Very low54.3Low165 Ų165122.2 Ų122.288%0.88267%0.67SS**  trans-13138.8178-79.8-39.1000114.3N12N10-N12 PolarHBondContact O-N 3.21Å; N10-N12 VanDerWaalsContact O-N 3.12Å
11L51.4Low55.9Low132 Ų132118.4 Ų118.469%0.69165%0.646SS**  trans-76.296.4160.6-107.485000108.8C13L11-C13 PolarHBondContact O-N 3.16Å
12N51.4Low58.6Low161 Ų161110.8 Ų110.886%0.86161%0.614SS**  trans-51.1106157.8-114.8-14.8000107.3N10 S14N10-N12 PolarHBondContact O-N 3.21Å; N10-N12 VanDerWaalsContact O-N 3.12Å; N12-S14 PolarHBondContact O-N 3.03Å
13C62.8Low61.5Low40 Ų40105.8 Ų105.827%0.2759%0.587SS.*  trans-62.5102.1179.8-63.50000108.8L11 K15 C267L11-C13 PolarHBondContact O-N 3.16Å; C13-K15 VanDerWaalsContact O-CG 3.32Å; C13-K15 WeakPolarHBondContact O-CG 3.34Å; C13-K15 PolarHBondContact O-N 3.25Å; C13-K15 VanDerWaalsContact O-N 3.12Å; C13-C267 WeakPolarHBondContact CA-SG 3.34Å; C13-C267 HydrophobicContact CB-CB 4.47Å; C13-C267 WeakPolarHBondContact CB-SG 3.48Å; C13-C267 WeakPolarHBondContact SG-CA 2.91Å; C13-C267 WeakPolarHBondContact SG-CB 3.35Å; C13-C267 CovalentContact SG-SG 2.03Å; C13-C267 PolarHBondContact SG-SG 3.46Å
14S59.8Low64.2Low105 Ų10599.1 Ų99.173%0.73455%0.55SS**  trans-61.1116.4178.9-1800000109.4N12 N16N12-S14 PolarHBondContact O-N 3.03Å; S14-N16 PolarHBondContact O-N 3.24Å
15K66Low66.8Low138 Ų13893.2 Ų93.260%0.652%0.515SS*.  trans-92.281.9-176.3-57.6-177.1168.2179.40109C13 D17 R274C13-K15 VanDerWaalsContact O-CG 3.32Å; C13-K15 WeakPolarHBondContact O-CG 3.34Å; C13-K15 PolarHBondContact O-N 3.25Å; C13-K15 VanDerWaalsContact O-N 3.12Å; K15-D17 PolarHBondContact O-N 3.45Å; K15-R274 VanDerWaalsContact CE-NH1 3.28Å
16N68.3Low69.5Low107 Ų10791 Ų9157%0.57250%0.502SS*.  trans-88.682.2177.2-168.311.6000112S14 M18S14-N16 PolarHBondContact O-N 3.24Å; N16-M18 VanDerWaalsContact C-N 3.33Å; N16-M18 WeakPolarHBondContact OD1-CB 3.49Å; N16-M18 PolarHBondContact OD1-N 2.9Å
17D75.4Confident72.3Confident52 Ų5288.1 Ų88.128%0.27848%0.48SS..  trans-895.1177.9-71.4-4.6000113K15 F19 K20 R274K15-D17 PolarHBondContact O-N 3.45Å; D17-F19 VanDerWaalsContact C-N 3.3Å; D17-F19 PolarHBondContact O-N 3Å; D17-K20 HydrophobicContact CB-CD 4.11Å; D17-K20 WeakPolarHBondContact O-CD 3.49Å; D17-K20 VanDerWaalsContact O-CE 3.28Å; D17-K20 WeakPolarHBondContact O-CE 3.38Å; D17-K20 WeakPolarHBondContact O-CG 3.45Å; D17-K20 PolarHBondContact O-N 2.81Å; D17-K20 IonicContact OD2-NZ 3.98Å; D17-R274 IonicContact OD1-CZ 2.96Å; D17-R274 IonicContact OD1-NE 3.43Å; D17-R274 IonicContact OD1-NH2 3.77Å; D17-R274 PolarHBondContact OD1-NH2 3.28Å; D17-R274 IonicContact OD2-CZ 2.72Å; D17-R274 IonicContact OD2-NH2 3.63Å; D17-R274 PolarHBondContact OD2-NH2 2.94Å
18M81.6Confident75Confident128 Ų12881.8 Ų81.863%0.63144%0.439SS*.THydrogen-bonded Turntrans-63.8-32.6-173.2-74.3-87.5-163.600113N16 K20 P22N16-M18 VanDerWaalsContact C-N 3.33Å; N16-M18 WeakPolarHBondContact OD1-CB 3.49Å; N16-M18 PolarHBondContact OD1-N 2.9Å; M18-K20 PolarHBondContact O-N 3.21Å; M18-P22 WeakPolarHBondContact O-CD 3.45Å
19F88.7Confident77.5Confident68 Ų6877.6 Ų77.630%0.29842%0.421SS..THydrogen-bonded Turntrans-67.1-22.4-175.181.3-87.8000113.5D17 Y21 P22 L23 T275 P278 I279D17-F19 VanDerWaalsContact C-N 3.3Å; D17-F19 PolarHBondContact O-N 3Å; F19-Y21 VanDerWaalsContact C-N 3.31Å; F19-Y21 PolarHBondContact O-N 3.11Å; F19-P22 WeakPolarHBondContact O-CD 3.44Å; F19-P22 WeakPolarHBondContact O-CG 3.34Å; F19-L23 HydrophobicContact CD2-CD2 4.35Å; F19-L23 HydrophobicContact CE2-CD2 4.11Å; F19-L23 WeakPolarHBondContact O-CB 3.48Å; F19-L23 PolarHBondContact O-N 3.12Å; F19-T275 HydrophobicContact CE1-CG2 4.26Å; F19-T275 HydrophobicContact CZ-CG2 4.03Å; F19-T275 WeakPolarHBondContact CZ-O 3.41Å; F19-P278 HydrophobicContact CE2-CB 4.16Å; F19-P278 HydrophobicContact CE2-CG 4.29Å; F19-P278 HydrophobicContact CZ-CB 4.29Å; F19-P278 HydrophobicContact CZ-CG 3.92Å; F19-I279 HydrophobicContact CE2-CG1 4.47Å
20K87.8Confident80.1Confident28 Ų2875.3 Ų75.312%0.12241%0.407CS..Hα-helixtrans-66.4-32.5-176.478.1-164.8163.7171.40112.7D17 M18 L23 Y24 E173 P278D17-K20 HydrophobicContact CB-CD 4.11Å; D17-K20 WeakPolarHBondContact O-CD 3.49Å; D17-K20 VanDerWaalsContact O-CE 3.28Å; D17-K20 WeakPolarHBondContact O-CE 3.38Å; D17-K20 WeakPolarHBondContact O-CG 3.45Å; D17-K20 PolarHBondContact O-N 2.81Å; D17-K20 IonicContact OD2-NZ 3.98Å; M18-K20 PolarHBondContact O-N 3.21Å; K20-L23 PolarHBondContact O-N 3.36Å; K20-Y24 HydrophobicContact CB-CD2 4.22Å; K20-Y24 HydrophobicContact CB-CE2 3.86Å; K20-Y24 HydrophobicContact CD-CE2 4.39Å; K20-Y24 HydrophobicContact CG-CD2 4.33Å; K20-Y24 HydrophobicContact CG-CE2 4.02Å; K20-Y24 WeakPolarHBondContact O-CB 3.11Å; K20-Y24 WeakPolarHBondContact O-CD2 3.09Å; K20-Y24 PolarHBondContact O-N 3.04Å; K20-E173 WeakPolarHBondContact CE-OE1 3.2Å; K20-E173 IonicContact NZ-OE1 3.87Å; K20-E173 PolarHBondContact NZ-OE1 2.71Å; K20-P278 HydrophobicContact CB-CB 3.99Å; K20-P278 HydrophobicContact CB-CG 3.82Å
21Y88.6Confident82.6Confident42 Ų4267.6 Ų67.617%0.16537%0.366CS..Hα-helixtrans-64.1-56.9-177.5-64.4-90.5000112.6F19 L23 Y24 S25 F81 K84 E173F19-Y21 VanDerWaalsContact C-N 3.31Å; F19-Y21 PolarHBondContact O-N 3.11Å; Y21-L23 VanDerWaalsContact C-N 3.29Å; Y21-L23 PolarHBondContact O-N 3.32Å; Y21-Y24 PolarHBondContact O-N 3.42Å; Y21-S25 WeakPolarHBondContact O-CB 3.24Å; Y21-S25 PolarHBondContact O-N 2.84Å; Y21-F81 HydrophobicContact CD1-CD1 4.02Å; Y21-K84 HydrophobicContact CD1-CG 4.17Å; Y21-K84 HydrophobicContact CE1-CD 4.41Å; Y21-K84 HydrophobicContact CE1-CG 4.05Å; Y21-E173 PolarHBondContact OH-OE1 2.93Å; Y21-E173 PolarHBondContact OH-OE2 3.36Å
22P92.9Very high84.8Confident77 Ų7764 Ų6450%0.535%0.345SS..Hα-helixtrans-64.7-33.9176.925.5-34.4000112.2M18 F19 T26M18-P22 WeakPolarHBondContact O-CD 3.45Å; F19-P22 WeakPolarHBondContact O-CD 3.44Å; F19-P22 WeakPolarHBondContact O-CG 3.34Å; P22-T26 VanDerWaalsContact O-CB 3.3Å; P22-T26 WeakPolarHBondContact O-CB 3.31Å; P22-T26 PolarHBondContact O-N 3.05Å; P22-T26 PolarHBondContact O-OG1 3.14Å
23L93.8Very high87Confident50 Ų5060 Ų6026%0.26233%0.326SS..Hα-helixtrans-61.1-53.6176178.366000111.5F19 K20 Y21 T26 V27 P278 I279F19-L23 HydrophobicContact CD2-CD2 4.35Å; F19-L23 HydrophobicContact CE2-CD2 4.11Å; F19-L23 WeakPolarHBondContact O-CB 3.48Å; F19-L23 PolarHBondContact O-N 3.12Å; K20-L23 PolarHBondContact O-N 3.36Å; Y21-L23 VanDerWaalsContact C-N 3.29Å; Y21-L23 PolarHBondContact O-N 3.32Å; L23-T26 PolarHBondContact O-N 3.35Å; L23-V27 HydrophobicContact CD1-CG2 3.98Å; L23-V27 WeakPolarHBondContact O-CB 3.44Å; L23-V27 WeakPolarHBondContact O-CG2 3.33Å; L23-V27 PolarHBondContact O-N 3.26Å; L23-P278 HydrophobicContact CD2-CB 4.08Å; L23-I279 HydrophobicContact CD2-CG1 4.18Å
24Y93.8Very high88.5Confident14 Ų1460.8 Ų60.86%0.05533%0.33CS..Hα-helixtrans-62.4-45.9179.8-68.1-32.4000111.9K20 Y21 T26 F28 F81 P278 L281K20-Y24 HydrophobicContact CB-CD2 4.22Å; K20-Y24 HydrophobicContact CB-CE2 3.86Å; K20-Y24 HydrophobicContact CD-CE2 4.39Å; K20-Y24 HydrophobicContact CG-CD2 4.33Å; K20-Y24 HydrophobicContact CG-CE2 4.02Å; K20-Y24 WeakPolarHBondContact O-CB 3.11Å; K20-Y24 WeakPolarHBondContact O-CD2 3.09Å; K20-Y24 PolarHBondContact O-N 3.04Å; Y21-Y24 PolarHBondContact O-N 3.42Å; Y24-T26 VanDerWaalsContact C-N 3.31Å; Y24-T26 PolarHBondContact O-N 3.22Å; Y24-F28 HydrophobicContact CD1-CE1 4.37Å; Y24-F28 HydrophobicContact CD1-CE2 4.5Å; Y24-F28 AromaticContact CD1-CZ 3.99Å; Y24-F28 HydrophobicContact CD1-CZ 3.99Å; Y24-F28 HydrophobicContact CG-CE2 4.38Å; Y24-F28 HydrophobicContact CG-CZ 4.32Å; Y24-F28 WeakPolarHBondContact O-CB 3.42Å; Y24-F28 WeakPolarHBondContact O-CG 3.31Å; Y24-F28 PolarHBondContact O-N 2.89Å; Y24-F81 AromaticContact CD2-CD1 3.71Å; Y24-F81 HydrophobicContact CD2-CD1 3.71Å; Y24-F81 HydrophobicContact CD2-CD2 4.35Å; Y24-F81 AromaticContact CD2-CE1 3.37Å; Y24-F81 HydrophobicContact CD2-CE1 3.37Å; Y24-F81 HydrophobicContact CD2-CE2 4.09Å; Y24-F81 HydrophobicContact CD2-CG 4.2Å; Y24-F81 AromaticContact CD2-CZ 3.59Å; Y24-F81 HydrophobicContact CD2-CZ 3.59Å; Y24-F81 AromaticContact CE2-CE1 3.94Å; Y24-F81 HydrophobicContact CE2-CE1 3.94Å; Y24-F81 HydrophobicContact CE2-CZ 4.12Å; Y24-F81 HydrophobicContact CG-CD1 4.45Å; Y24-F81 HydrophobicContact CG-CD2 4.43Å; Y24-F81 HydrophobicContact CG-CE1 4.32Å; Y24-F81 HydrophobicContact CG-CE2 4.34Å; Y24-F81 HydrophobicContact CG-CZ 4.27Å; Y24-P278 HydrophobicContact CE1-CB 3.69Å; Y24-P278 VanDerWaalsContact OH-CA 3.24Å; Y24-P278 WeakPolarHBondContact OH-CA 3.11Å; Y24-P278 WeakPolarHBondContact OH-CB 3.41Å; Y24-L281 HydrophobicContact CE1-CB 4.46Å; Y24-L281 HydrophobicContact CE1-CD2 3.78Å; Y24-L281 HydrophobicContact CE1-CG 4.39Å
25S94.4Very high90.2Very high17 Ų1755.8 Ų55.812%0.11930%0.295CS..Hα-helixtrans-56.8-46.4177.7-178.60000111.7Y21 S29 I82Y21-S25 WeakPolarHBondContact O-CB 3.24Å; Y21-S25 PolarHBondContact O-N 2.84Å; S25-S29 VanDerWaalsContact O-CB 3.32Å; S25-S29 WeakPolarHBondContact O-CB 3.34Å; S25-S29 PolarHBondContact O-N 3.43Å; S25-S29 VanDerWaalsContact O-N 3.15Å; S25-S29 PolarHBondContact O-OG 3.5Å; S25-I82 WeakPolarHBondContact OG-CD1 3.33Å; S25-I82 WeakPolarHBondContact OG-CG1 3.24Å
26T95.8Very high91.6Very high82 Ų8251.1 Ų51.150%0.50328%0.276SS..Hα-helixtrans-67.8-52.4-178.1-54.80000111.5P22 L23 Y24 S29 I30P22-T26 VanDerWaalsContact O-CB 3.3Å; P22-T26 WeakPolarHBondContact O-CB 3.31Å; P22-T26 PolarHBondContact O-N 3.05Å; P22-T26 PolarHBondContact O-OG1 3.14Å; L23-T26 PolarHBondContact O-N 3.35Å; Y24-T26 VanDerWaalsContact C-N 3.31Å; Y24-T26 PolarHBondContact O-N 3.22Å; T26-S29 PolarHBondContact O-N 3.46Å; T26-I30 HydrophobicContact CG2-CD1 4.12Å; T26-I30 WeakPolarHBondContact O-CG1 3.37Å; T26-I30 PolarHBondContact O-N 3.23Å; T26-I30 VanDerWaalsContact O-N 3.11Å
27V96.4Very high92.9Very high30 Ų3051 Ų5118%0.18228%0.275CS..Hα-helixtrans-65.3-44.9-177.11750000110.9L23 S29 I30 V31 C282L23-V27 HydrophobicContact CD1-CG2 3.98Å; L23-V27 WeakPolarHBondContact O-CB 3.44Å; L23-V27 WeakPolarHBondContact O-CG2 3.33Å; L23-V27 PolarHBondContact O-N 3.26Å; V27-S29 VanDerWaalsContact C-N 3.28Å; V27-S29 PolarHBondContact O-N 3.47Å; V27-I30 PolarHBondContact O-N 2.88Å; V27-V31 HydrophobicContact CG1-CG2 3.99Å; V27-V31 WeakPolarHBondContact O-CB 3.29Å; V27-V31 VanDerWaalsContact O-CG2 3.25Å; V27-V31 WeakPolarHBondContact O-CG2 3.4Å; V27-V31 PolarHBondContact O-N 3.29Å; V27-C282 HydrophobicContact CB-CB 4.31Å; V27-C282 HydrophobicContact CG1-CB 3.89Å; V27-C282 HydrophobicContact CG2-CB 4.2Å
28F96.3Very high93.7Very high1 Ų150.5 Ų50.50%0.00427%0.273CS..Hα-helixtrans-66.7-31.2-179-66-4.7000112.2Y24 F32 L74 R77 V78 F81 V285Y24-F28 HydrophobicContact CD1-CE1 4.37Å; Y24-F28 HydrophobicContact CD1-CE2 4.5Å; Y24-F28 AromaticContact CD1-CZ 3.99Å; Y24-F28 HydrophobicContact CD1-CZ 3.99Å; Y24-F28 HydrophobicContact CG-CE2 4.38Å; Y24-F28 HydrophobicContact CG-CZ 4.32Å; Y24-F28 WeakPolarHBondContact O-CB 3.42Å; Y24-F28 WeakPolarHBondContact O-CG 3.31Å; Y24-F28 PolarHBondContact O-N 2.89Å; F28-F32 VanDerWaalsContact O-CB 3.23Å; F28-F32 WeakPolarHBondContact O-CB 3.43Å; F28-F32 PolarHBondContact O-N 3.28Å; F28-L74 HydrophobicContact CB-CD2 4.16Å; F28-L74 HydrophobicContact CD1-CD2 4.46Å; F28-L74 HydrophobicContact CD2-CD2 4.32Å; F28-L74 HydrophobicContact CG-CD2 4.07Å; F28-R77 HydrophobicContact CD2-CB 3.94Å; F28-R77 HydrophobicContact CE2-CB 4.31Å; F28-V78 HydrophobicContact CB-CG2 3.67Å; F28-F81 HydrophobicContact CD2-CD2 4.23Å; F28-F81 HydrophobicContact CD2-CE2 4.16Å; F28-F81 HydrophobicContact CE2-CD2 4.19Å; F28-F81 AromaticContact CE2-CE2 3.7Å; F28-F81 HydrophobicContact CE2-CE2 3.7Å; F28-V285 HydrophobicContact CD1-CG1 3.82Å; F28-V285 HydrophobicContact CE1-CB 4.08Å; F28-V285 HydrophobicContact CE1-CG1 3.79Å; F28-V285 HydrophobicContact CE1-CG2 3.91Å; F28-V285 HydrophobicContact CZ-CG2 4.37Å
29S96.9Very high94.2Very high45 Ų4544.4 Ų44.432%0.31524%0.243SC..Hα-helixtrans-66.3-44.9172.5-60.30000111.8S25 T26 V27 F32 V33 V78S25-S29 VanDerWaalsContact O-CB 3.32Å; S25-S29 WeakPolarHBondContact O-CB 3.34Å; S25-S29 PolarHBondContact O-N 3.43Å; S25-S29 VanDerWaalsContact O-N 3.15Å; S25-S29 PolarHBondContact O-OG 3.5Å; T26-S29 PolarHBondContact O-N 3.46Å; V27-S29 VanDerWaalsContact C-N 3.28Å; V27-S29 PolarHBondContact O-N 3.47Å; S29-F32 PolarHBondContact O-N 3.31Å; S29-V33 WeakPolarHBondContact O-CG2 3.4Å; S29-V33 PolarHBondContact O-N 2.85Å; S29-V33 VanDerWaalsContact O-N 3.13Å; S29-V78 WeakPolarHBondContact OG-CG1 3.44Å
30I96.8Very high94.5Very high100 Ų10044.5 Ų44.551%0.51325%0.249SC..Hα-helixtrans-62.7-47.7176.4-66.7167.2000110.3T26 V27 F32 V33 V34T26-I30 HydrophobicContact CG2-CD1 4.12Å; T26-I30 WeakPolarHBondContact O-CG1 3.37Å; T26-I30 PolarHBondContact O-N 3.23Å; T26-I30 VanDerWaalsContact O-N 3.11Å; V27-I30 PolarHBondContact O-N 2.88Å; I30-F32 VanDerWaalsContact C-N 3.28Å; I30-F32 PolarHBondContact O-N 3.46Å; I30-V33 PolarHBondContact O-N 3.29Å; I30-V34 HydrophobicContact CG2-CG2 4.21Å; I30-V34 WeakPolarHBondContact O-CB 3.48Å; I30-V34 WeakPolarHBondContact O-CG2 3.26Å; I30-V34 PolarHBondContact O-N 2.92Å
31V96.6Very high94.6Very high3 Ų346 Ų462%0.01826%0.26CS..Hα-helixtrans-63.2-36.9179.3173.80000111V27 G35 L74 V285 C288V27-V31 HydrophobicContact CG1-CG2 3.99Å; V27-V31 WeakPolarHBondContact O-CB 3.29Å; V27-V31 VanDerWaalsContact O-CG2 3.25Å; V27-V31 WeakPolarHBondContact O-CG2 3.4Å; V27-V31 PolarHBondContact O-N 3.29Å; V31-G35 WeakPolarHBondContact O-CA 3.29Å; V31-G35 PolarHBondContact O-N 3.48Å; V31-L74 HydrophobicContact CB-CD1 4.12Å; V31-L74 HydrophobicContact CG1-CD1 3.7Å; V31-V285 HydrophobicContact CB-CG1 4.37Å; V31-V285 HydrophobicContact CG1-CG1 3.92Å; V31-V285 HydrophobicContact CG2-CG1 4.29Å; V31-C288 WeakPolarHBondContact CG1-SG 2.88Å
32F97.2Very high94.6Very high57 Ų5744.2 Ų44.225%0.2526%0.255CS..Hα-helixtrans-58.8-53.8174171.4-110000111.4F28 S29 I30 L36 V71 L74 P75F28-F32 VanDerWaalsContact O-CB 3.23Å; F28-F32 WeakPolarHBondContact O-CB 3.43Å; F28-F32 PolarHBondContact O-N 3.28Å; S29-F32 PolarHBondContact O-N 3.31Å; I30-F32 VanDerWaalsContact C-N 3.28Å; I30-F32 PolarHBondContact O-N 3.46Å; F32-L36 HydrophobicContact CE2-CD2 4.09Å; F32-L36 HydrophobicContact CZ-CD2 3.96Å; F32-L36 WeakPolarHBondContact O-CB 3.22Å; F32-L36 PolarHBondContact O-N 2.92Å; F32-V71 HydrophobicContact CD2-CG1 3.73Å; F32-V71 WeakPolarHBondContact CD2-O 3.39Å; F32-V71 HydrophobicContact CE2-CG1 4.28Å; F32-L74 HydrophobicContact CB-CB 4.09Å; F32-L74 HydrophobicContact CB-CD1 4.13Å; F32-L74 HydrophobicContact CD2-CB 4.46Å; F32-P75 HydrophobicContact CD1-CG 4.38Å; F32-P75 HydrophobicContact CD2-CG 3.72Å; F32-P75 HydrophobicContact CE1-CG 4.23Å; F32-P75 HydrophobicContact CE2-CG 3.54Å; F32-P75 HydrophobicContact CG-CG 4.14Å; F32-P75 HydrophobicContact CZ-CG 3.81Å
33V96.8Very high94.5Very high75 Ų7543.1 Ų43.146%0.45524%0.244SC..Hα-helixtrans-64.4-52.7-177.4175.90000111.2S29 I30 I37S29-V33 WeakPolarHBondContact O-CG2 3.4Å; S29-V33 PolarHBondContact O-N 2.85Å; S29-V33 VanDerWaalsContact O-N 3.13Å; I30-V33 PolarHBondContact O-N 3.29Å; V33-I37 HydrophobicContact CG1-CD1 3.89Å; V33-I37 WeakPolarHBondContact O-CD1 3.29Å; V33-I37 VanDerWaalsContact O-CG1 3.27Å; V33-I37 WeakPolarHBondContact O-CG1 3.14Å; V33-I37 PolarHBondContact O-N 2.9Å; V33-I37 VanDerWaalsContact O-N 3.16Å
34V95.9Very high94.3Very high58 Ų5847.8 Ų47.835%0.35226%0.26SS..Hα-helixtrans-67.6-47.3-176.6176.90000110.8I30 L36 T38 C289I30-V34 HydrophobicContact CG2-CG2 4.21Å; I30-V34 WeakPolarHBondContact O-CB 3.48Å; I30-V34 WeakPolarHBondContact O-CG2 3.26Å; I30-V34 PolarHBondContact O-N 2.92Å; V34-L36 PolarHBondContact O-N 3.45Å; V34-T38 HydrophobicContact CG1-CG2 4.24Å; V34-T38 WeakPolarHBondContact O-CB 3.16Å; V34-T38 VanDerWaalsContact O-CG2 3.24Å; V34-T38 WeakPolarHBondContact O-CG2 3.23Å; V34-T38 PolarHBondContact O-N 3.13Å; V34-T38 PolarHBondContact O-OG1 3.17Å; V34-C289 HydrophobicContact CG1-CB 3.97Å
35G95.1Very high93.9Very high0 Ų047.9 Ų47.90%026%0.261CS..Hα-helixtrans-61.6-4318000000111.9V31 T38 N39V31-G35 WeakPolarHBondContact O-CA 3.29Å; V31-G35 PolarHBondContact O-N 3.48Å; G35-T38 PolarHBondContact O-OG1 3.18Å; G35-N39 WeakPolarHBondContact O-CB 3.15Å; G35-N39 PolarHBondContact O-N 3.31Å; G35-N39 PolarHBondContact O-ND2 3.22Å
36L95.7Very high93.4Very high40 Ų4047 Ų4721%0.20926%0.255CS..Hα-helixtrans-64.7-54.3179.4-174.966.5000111.2F32 V34 T38 N39 V40 L68 V71 F72F32-L36 HydrophobicContact CE2-CD2 4.09Å; F32-L36 HydrophobicContact CZ-CD2 3.96Å; F32-L36 WeakPolarHBondContact O-CB 3.22Å; F32-L36 PolarHBondContact O-N 2.92Å; V34-L36 PolarHBondContact O-N 3.45Å; L36-T38 VanDerWaalsContact C-N 3.34Å; L36-T38 PolarHBondContact O-N 3.45Å; L36-N39 PolarHBondContact O-N 3.11Å; L36-V40 HydrophobicContact CD1-CG2 4Å; L36-V40 HydrophobicContact CG-CG2 4.37Å; L36-V40 VanDerWaalsContact O-CB 3.31Å; L36-V40 WeakPolarHBondContact O-CB 3.45Å; L36-V40 WeakPolarHBondContact O-CG2 3.36Å; L36-V40 PolarHBondContact O-N 3.34Å; L36-L68 HydrophobicContact CD1-CD2 4.07Å; L36-V71 HydrophobicContact CB-CG1 3.8Å; L36-V71 HydrophobicContact CD1-CG1 4.28Å; L36-F72 HydrophobicContact CD1-CE1 3.82Å; L36-F72 HydrophobicContact CD1-CE2 4.48Å; L36-F72 HydrophobicContact CD1-CZ 3.8Å
37I94.4Very high92.8Very high105 Ų10546.5 Ų46.554%0.53825%0.252SS..Hα-helixtrans-57.4-50.8-177.8-67.7168.9000110V33 V41V33-I37 HydrophobicContact CG1-CD1 3.89Å; V33-I37 WeakPolarHBondContact O-CD1 3.29Å; V33-I37 VanDerWaalsContact O-CG1 3.27Å; V33-I37 WeakPolarHBondContact O-CG1 3.14Å; V33-I37 PolarHBondContact O-N 2.9Å; V33-I37 VanDerWaalsContact O-N 3.16Å; I37-V41 WeakPolarHBondContact O-CB 3.48Å; I37-V41 VanDerWaalsContact O-CG2 3.23Å; I37-V41 WeakPolarHBondContact O-CG2 3.21Å; I37-V41 PolarHBondContact O-N 2.87Å
38T91.8Very high92Very high40 Ų4049 Ų4925%0.24527%0.27CS..Hα-helixtrans-69.8-39.7-173.258.50000112.8V34 G35 L36 A42 P292V34-T38 HydrophobicContact CG1-CG2 4.24Å; V34-T38 WeakPolarHBondContact O-CB 3.16Å; V34-T38 VanDerWaalsContact O-CG2 3.24Å; V34-T38 WeakPolarHBondContact O-CG2 3.23Å; V34-T38 PolarHBondContact O-N 3.13Å; V34-T38 PolarHBondContact O-OG1 3.17Å; G35-T38 PolarHBondContact O-OG1 3.18Å; L36-T38 VanDerWaalsContact C-N 3.34Å; L36-T38 PolarHBondContact O-N 3.45Å; T38-A42 WeakPolarHBondContact O-CB 3Å; T38-A42 PolarHBondContact O-N 3.32Å; T38-P292 HydrophobicContact CG2-CG 4.13Å; T38-P292 WeakPolarHBondContact OG1-CG 3.17Å
39N93.8Very high90.7Very high0 Ų051 Ų510%028%0.283CS..Hα-helixtrans-75.8-33.5179.1-74.4-68.3000112.9G35 L36 A42 L43 V64 L68 C288G35-N39 WeakPolarHBondContact O-CB 3.15Å; G35-N39 PolarHBondContact O-N 3.31Å; G35-N39 PolarHBondContact O-ND2 3.22Å; L36-N39 PolarHBondContact O-N 3.11Å; N39-A42 PolarHBondContact O-N 3.35Å; N39-L43 WeakPolarHBondContact O-CB 3.46Å; N39-L43 PolarHBondContact O-N 3.07Å; N39-V64 HydrophobicContact CB-CG1 4.2Å; N39-V64 WeakPolarHBondContact O-CG1 3.37Å; N39-L68 HydrophobicContact CB-CD2 3.68Å; N39-L68 HydrophobicContact CB-CG 3.89Å; N39-C288 PolarHBondContact ND2-O 2.84Å
40V93.6Very high89.5Confident71 Ų7149.9 Ų49.943%0.4327%0.274SS..Hα-helixtrans-63.8-44.8171.61700000110.6L36 A42 L43 Y44 L68L36-V40 HydrophobicContact CD1-CG2 4Å; L36-V40 HydrophobicContact CG-CG2 4.37Å; L36-V40 VanDerWaalsContact O-CB 3.31Å; L36-V40 WeakPolarHBondContact O-CB 3.45Å; L36-V40 WeakPolarHBondContact O-CG2 3.36Å; L36-V40 PolarHBondContact O-N 3.34Å; V40-A42 VanDerWaalsContact C-N 3.34Å; V40-A42 PolarHBondContact O-N 2.71Å; V40-L43 PolarHBondContact O-N 3.37Å; V40-Y44 WeakPolarHBondContact O-CB 3.5Å; V40-Y44 PolarHBondContact O-N 2.99Å; V40-L68 HydrophobicContact CG2-CD2 3.8Å
41V90.1Very high87.6Confident58 Ų5855.1 Ų55.135%0.35229%0.293SS..Hα-helixtrans-61.5-43.3175.3170.30000111I37 Y44 I45I37-V41 WeakPolarHBondContact O-CB 3.48Å; I37-V41 VanDerWaalsContact O-CG2 3.23Å; I37-V41 WeakPolarHBondContact O-CG2 3.21Å; I37-V41 PolarHBondContact O-N 2.87Å; V41-Y44 PolarHBondContact O-N 2.84Å; V41-I45 HydrophobicContact CG1-CD1 3.89Å; V41-I45 WeakPolarHBondContact O-CG1 3.37Å; V41-I45 PolarHBondContact O-N 3.2Å
42A89.4Confident85.7Confident6 Ų660.9 Ų60.95%0.0532%0.323CS..Hα-helixtrans-60.8-4717600000111.4T38 N39 V40 Y44 I45 F46 V64 Y295T38-A42 WeakPolarHBondContact O-CB 3Å; T38-A42 PolarHBondContact O-N 3.32Å; N39-A42 PolarHBondContact O-N 3.35Å; V40-A42 VanDerWaalsContact C-N 3.34Å; V40-A42 PolarHBondContact O-N 2.71Å; A42-Y44 VanDerWaalsContact C-N 3.32Å; A42-Y44 PolarHBondContact O-N 3.34Å; A42-I45 PolarHBondContact O-N 3.28Å; A42-F46 HydrophobicContact CB-CD2 4.35Å; A42-F46 HydrophobicContact CB-CE2 4.18Å; A42-F46 WeakPolarHBondContact O-CB 3.43Å; A42-F46 WeakPolarHBondContact O-CD2 3.46Å; A42-F46 WeakPolarHBondContact O-CG 3.46Å; A42-F46 PolarHBondContact O-N 3.47Å; A42-V64 HydrophobicContact CB-CG2 4Å; A42-Y295 HydrophobicContact CB-CD2 3.8Å; A42-Y295 HydrophobicContact CB-CE2 3.97Å
43L90.7Very high84.4Confident54 Ų5463.4 Ų63.428%0.28333%0.331SS..Hα-helixtrans-57.5-45.1177.1-172.561.3000111.5N39 V40 F46 T47 V64 L68N39-L43 WeakPolarHBondContact O-CB 3.46Å; N39-L43 PolarHBondContact O-N 3.07Å; V40-L43 PolarHBondContact O-N 3.37Å; L43-F46 PolarHBondContact O-N 3.48Å; L43-T47 HydrophobicContact CD1-CG2 4.08Å; L43-T47 HydrophobicContact CG-CG2 4.42Å; L43-T47 WeakPolarHBondContact O-CB 3.46Å; L43-T47 WeakPolarHBondContact O-CG2 3.49Å; L43-T47 PolarHBondContact O-N 3.39Å; L43-T47 PolarHBondContact O-OG1 2.99Å; L43-V64 HydrophobicContact CB-CG1 3.76Å; L43-V64 HydrophobicContact CD1-CG1 4.15Å; L43-V64 HydrophobicContact CG-CG1 4.45Å; L43-L68 HydrophobicContact CB-CD1 4.49Å; L43-L68 HydrophobicContact CD2-CD1 3.81Å
44Y88.5Confident83.4Confident148 Ų14863.6 Ų63.658%0.5833%0.329SS*.Hα-helixtrans-61.8-46.7177.3176.7-99.7000112.2V40 V41 A42 F46 T47 C48V40-Y44 WeakPolarHBondContact O-CB 3.5Å; V40-Y44 PolarHBondContact O-N 2.99Å; V41-Y44 PolarHBondContact O-N 2.84Å; A42-Y44 VanDerWaalsContact C-N 3.32Å; A42-Y44 PolarHBondContact O-N 3.34Å; Y44-F46 VanDerWaalsContact C-N 3.29Å; Y44-F46 PolarHBondContact O-N 2.8Å; Y44-T47 PolarHBondContact O-N 3.43Å; Y44-T47 PolarHBondContact O-OG1 3.15Å; Y44-C48 HydrophobicContact CD2-CB 4.17Å; Y44-C48 HydrophobicContact CE2-CB 3.87Å; Y44-C48 VanDerWaalsContact O-CB 3.31Å; Y44-C48 WeakPolarHBondContact O-CB 3.42Å; Y44-C48 PolarHBondContact O-N 3.46Å
45I85.1Confident82.8Confident15 Ų1562 Ų628%0.07732%0.318CS..Iπ-helixtrans-62.1-43.2177.2-66.1165.8000110.3V41 A42 S49 L50 I302V41-I45 HydrophobicContact CG1-CD1 3.89Å; V41-I45 WeakPolarHBondContact O-CG1 3.37Å; V41-I45 PolarHBondContact O-N 3.2Å; A42-I45 PolarHBondContact O-N 3.28Å; I45-S49 WeakPolarHBondContact O-CA 3.37Å; I45-S49 VanDerWaalsContact O-CB 3.29Å; I45-S49 WeakPolarHBondContact O-CB 3.36Å; I45-S49 PolarHBondContact O-N 2.97Å; I45-L50 PolarHBondContact O-N 2.96Å; I45-I302 HydrophobicContact CG2-CG1 3.84Å
46F84.8Confident82.2Confident0 Ų062.4 Ų62.40%032%0.321CS..Iπ-helixtrans-63.3-39.8179.5-78.5-25.6000113.3A42 L43 Y44 L50 T57 M60 M61 V64 Y295 I302A42-F46 HydrophobicContact CB-CD2 4.35Å; A42-F46 HydrophobicContact CB-CE2 4.18Å; A42-F46 WeakPolarHBondContact O-CB 3.43Å; A42-F46 WeakPolarHBondContact O-CD2 3.46Å; A42-F46 WeakPolarHBondContact O-CG 3.46Å; A42-F46 PolarHBondContact O-N 3.47Å; L43-F46 PolarHBondContact O-N 3.48Å; Y44-F46 VanDerWaalsContact C-N 3.29Å; Y44-F46 PolarHBondContact O-N 2.8Å; F46-L50 HydrophobicContact CD1-CD1 3.5Å; F46-L50 HydrophobicContact CE1-CD1 4.24Å; F46-L50 HydrophobicContact CG-CD1 4.48Å; F46-T57 HydrophobicContact CD1-CG2 4.04Å; F46-T57 HydrophobicContact CE1-CG2 4.41Å; F46-M60 HydrophobicContact CE1-CB 4.48Å; F46-M60 HydrophobicContact CE1-SD 3.86Å; F46-M60 HydrophobicContact CE2-CB 3.8Å; F46-M60 HydrophobicContact CZ-CB 3.71Å; F46-M60 HydrophobicContact CZ-CG 4.22Å; F46-M60 HydrophobicContact CZ-SD 3.54Å; F46-M60 VanDerWaalsContact CZ-SD 3.54Å; F46-M61 HydrophobicContact CB-CE 3.43Å; F46-M61 VanDerWaalsContact CB-CE 3.43Å; F46-M61 HydrophobicContact CB-CG 3.96Å; F46-M61 HydrophobicContact CD2-CG 4.21Å; F46-M61 HydrophobicContact CG-CE 4.21Å; F46-M61 HydrophobicContact CG-CG 4.2Å; F46-M61 WeakPolarHBondContact O-CE 3.39Å; F46-V64 HydrophobicContact CD2-CG2 4.02Å; F46-V64 HydrophobicContact CE2-CG2 3.79Å; F46-Y295 HydrophobicContact CE2-CD1 4.18Å; F46-Y295 HydrophobicContact CE2-CD2 4.08Å; F46-Y295 HydrophobicContact CE2-CE1 4.37Å; F46-Y295 HydrophobicContact CE2-CE2 4.34Å; F46-Y295 HydrophobicContact CE2-CG 4.06Å; F46-Y295 AromaticContact CZ-CD1 3.94Å; F46-Y295 HydrophobicContact CZ-CD1 3.94Å; F46-Y295 HydrophobicContact CZ-CD2 4.23Å; F46-Y295 AromaticContact CZ-CG 3.79Å; F46-Y295 HydrophobicContact CZ-CG 3.79Å; F46-I302 HydrophobicContact CD1-CD1 4.24Å; F46-I302 HydrophobicContact CE1-CD1 3.37Å; F46-I302 HydrophobicContact CE1-CG1 4.22Å; F46-I302 HydrophobicContact CZ-CD1 3.54Å
47T83.3Confident81.8Confident71 Ų7161 Ų6144%0.43631%0.314SS..Iπ-helixtrans-88-43.1-176.750.80000112.9L43 Y44L43-T47 HydrophobicContact CD1-CG2 4.08Å; L43-T47 HydrophobicContact CG-CG2 4.42Å; L43-T47 WeakPolarHBondContact O-CB 3.46Å; L43-T47 WeakPolarHBondContact O-CG2 3.49Å; L43-T47 PolarHBondContact O-N 3.39Å; L43-T47 PolarHBondContact O-OG1 2.99Å; Y44-T47 PolarHBondContact O-N 3.43Å; Y44-T47 PolarHBondContact O-OG1 3.15Å
48C79.2Confident81.6Confident83 Ų8356.8 Ų56.856%0.56129%0.293SS*.Iπ-helixtrans-99.2-30.5-170.3-58.70000113.8Y44Y44-C48 HydrophobicContact CD2-CB 4.17Å; Y44-C48 HydrophobicContact CE2-CB 3.87Å; Y44-C48 VanDerWaalsContact O-CB 3.31Å; Y44-C48 WeakPolarHBondContact O-CB 3.42Å; Y44-C48 PolarHBondContact O-N 3.46Å
49S69.3Low81.6Confident41 Ų4155.9 Ų55.929%0.28729%0.285SS..Iπ-helixtrans-97.3-20.7-174.1-58.90000114.1I45 K51I45-S49 WeakPolarHBondContact O-CA 3.37Å; I45-S49 VanDerWaalsContact O-CB 3.29Å; I45-S49 WeakPolarHBondContact O-CB 3.36Å; I45-S49 PolarHBondContact O-N 2.97Å; S49-K51 PolarHBondContact O-N 3.37Å
50L70.6Confident81.5Confident23 Ų2356 Ų5612%0.1229%0.285CS..  trans-89.796.1-178.2-93145.6000111.6I45 F46 L52 T57 T301I45-L50 PolarHBondContact O-N 2.96Å; F46-L50 HydrophobicContact CD1-CD1 3.5Å; F46-L50 HydrophobicContact CE1-CD1 4.24Å; F46-L50 HydrophobicContact CG-CD1 4.48Å; L50-L52 VanDerWaalsContact C-N 3.26Å; L50-L52 WeakPolarHBondContact CD2-O 3.37Å; L50-L52 PolarHBondContact O-N 3.26Å; L50-T57 HydrophobicContact CD1-CG2 4.03Å; L50-T301 HydrophobicContact CD1-CG2 4.47Å; L50-T301 HydrophobicContact CD2-CG2 4.04Å; L50-T301 WeakPolarHBondContact CD2-OG1 3.47Å; L50-T301 HydrophobicContact CG-CG2 3.8Å
51K57.1Low81.4Confident210 Ų21053.2 Ų53.291%0.91327%0.268SS*.SBendtrans-61.8-29.8173.9-72.6-176.2176.1-177.20113.3S49S49-K51 PolarHBondContact O-N 3.37Å
52L58.5Low81.6Confident123 Ų12352.1 Ų52.164%0.64426%0.26SS*.SBendtrans-122.6113.4171.8-90.489.8000110.8L50L50-L52 VanDerWaalsContact C-N 3.26Å; L50-L52 WeakPolarHBondContact CD2-O 3.37Å; L50-L52 PolarHBondContact O-N 3.26Å
53R68.8Low81.9Confident111 Ų11151.8 Ų51.842%0.41926%0.258SS..  trans-74.8119.7165.8-83.7173.8154153.5-2.2109.8M61 K134R53-M61 HydrophobicContact CG-CE 3.91Å; R53-M61 HydrophobicContact CG-SD 4.39Å; R53-M61 PolarHBondContact NE-SD 2.92Å; R53-M61 PolarHBondContact NH2-SD 3.32Å; R53-K134 WeakPolarHBondContact O-CD 3.38Å; R53-K134 WeakPolarHBondContact O-CE 3.44Å; R53-K134 PolarHBondContact O-NZ 3.44Å
54N75.5Confident82.1Confident79 Ų7949.2 Ų49.242%0.42224%0.244SC..  trans-95.9175.7171.1-69.71.5000110.9T57 T58N54-T57 PolarHBondContact O-N 3.32Å; N54-T58 PolarHBondContact O-N 2.89Å; N54-T58 PolarHBondContact O-OG1 3.45Å
55E82.9Confident82.4Confident25 Ų2545 Ų4512%0.11723%0.233CC..Hα-helixtrans-62-48.2-177.7-57.479.3-142.500111.3T57 T58 Y59 R132 A137E55-T57 VanDerWaalsContact C-N 3.27Å; E55-T57 PolarHBondContact O-N 3.49Å; E55-T58 VanDerWaalsContact O-CB 3.24Å; E55-T58 WeakPolarHBondContact O-CB 3.29Å; E55-T58 PolarHBondContact O-N 3.45Å; E55-Y59 PolarHBondContact O-N 2.94Å; E55-R132 HydrophobicContact CB-CG 3.9Å; E55-R132 VanDerWaalsContact CD-O 3.26Å; E55-R132 HydrophobicContact CG-CG 3.81Å; E55-R132 WeakPolarHBondContact CG-O 3.49Å; E55-R132 IonicContact OE2-CZ 2.68Å; E55-R132 IonicContact OE2-NE 2.63Å; E55-R132 PolarHBondContact OE2-NE 3.36Å; E55-R132 VanDerWaalsContact OE2-NE 3.13Å; E55-R132 IonicContact OE2-NH2 3.17Å; E55-A137 HydrophobicContact CB-CB 4.15Å
56T83.5Confident82.9Confident8 Ų844.4 Ų44.45%0.04923%0.231CC..Hα-helixtrans-58.5-37.5177.4-30.40000112.7T58 Y59 M60 I114 D117 T298T56-T58 PolarHBondContact O-N 2.9Å; T56-Y59 PolarHBondContact O-N 3.2Å; T56-M60 HydrophobicContact CG2-CE 4Å; T56-M60 WeakPolarHBondContact O-CG 3.33Å; T56-M60 PolarHBondContact O-N 3.31Å; T56-M60 VanDerWaalsContact O-N 3.15Å; T56-I114 HydrophobicContact CG2-CG1 4.34Å; T56-I114 HydrophobicContact CG2-CG2 3.93Å; T56-D117 PolarHBondContact OG1-OD2 2.92Å; T56-T298 HydrophobicContact CG2-CG2 3.85Å
57T86.3Confident83.5Confident11 Ų1144.4 Ų44.47%0.06723%0.231CC..Hα-helixtrans-65.8-29177.1-50.30000111.9F46 L50 N54 E55 M60 M61F46-T57 HydrophobicContact CD1-CG2 4.04Å; F46-T57 HydrophobicContact CE1-CG2 4.41Å; L50-T57 HydrophobicContact CD1-CG2 4.03Å; N54-T57 PolarHBondContact O-N 3.32Å; E55-T57 VanDerWaalsContact C-N 3.27Å; E55-T57 PolarHBondContact O-N 3.49Å; T57-M60 PolarHBondContact O-N 3.46Å; T57-M61 HydrophobicContact CG2-CE 3.63Å; T57-M61 HydrophobicContact CG2-CG 4.5Å; T57-M61 HydrophobicContact CG2-SD 4.17Å; T57-M61 VanDerWaalsContact O-CG 3.29Å; T57-M61 WeakPolarHBondContact O-CG 3.34Å; T57-M61 PolarHBondContact O-N 2.66Å
58T91.1Very high84.1Confident15 Ų1541.6 Ų41.69%0.09221%0.213CC..Hα-helixtrans-66.3-43.9176.5-55.40000110.5N54 E55 T56 M61 N62 A137 R138N54-T58 PolarHBondContact O-N 2.89Å; N54-T58 PolarHBondContact O-OG1 3.45Å; E55-T58 VanDerWaalsContact O-CB 3.24Å; E55-T58 WeakPolarHBondContact O-CB 3.29Å; E55-T58 PolarHBondContact O-N 3.45Å; T56-T58 PolarHBondContact O-N 2.9Å; T58-M61 PolarHBondContact O-N 3.18Å; T58-N62 PolarHBondContact O-N 2.86Å; T58-N62 PolarHBondContact O-ND2 3.32Å; T58-A137 HydrophobicContact CG2-CB 4.4Å; T58-R138 HydrophobicContact CG2-CG 4.11Å
59Y92.3Very high84.9Confident21 Ų2141.1 Ų41.18%0.08221%0.205CC..Hα-helixtrans-63.3-44.4174.7-59.1-56.3000111.9E55 T56 M61 N62 L63 F110 C113 I114 D117 A137 V140 C141E55-Y59 PolarHBondContact O-N 2.94Å; T56-Y59 PolarHBondContact O-N 3.2Å; Y59-M61 VanDerWaalsContact C-N 3.34Å; Y59-M61 PolarHBondContact O-N 2.75Å; Y59-N62 PolarHBondContact O-N 3.09Å; Y59-L63 PolarHBondContact O-N 3.12Å; Y59-F110 HydrophobicContact CD1-CD1 4.47Å; Y59-C113 HydrophobicContact CD1-CB 3.72Å; Y59-C113 HydrophobicContact CD2-CB 4.24Å; Y59-C113 HydrophobicContact CE1-CB 3.79Å; Y59-C113 HydrophobicContact CE2-CB 4.29Å; Y59-C113 HydrophobicContact CG-CB 3.97Å; Y59-I114 HydrophobicContact CD2-CG1 4.47Å; Y59-I114 HydrophobicContact CG-CG1 4.47Å; Y59-D117 HydrophobicContact CE2-CB 4.14Å; Y59-A137 HydrophobicContact CE1-CB 4.24Å; Y59-A137 HydrophobicContact CE2-CB 4.28Å; Y59-A137 WeakPolarHBondContact OH-CA 3.36Å; Y59-V140 HydrophobicContact CE1-CB 4.07Å; Y59-V140 HydrophobicContact CE1-CG1 3.82Å; Y59-C141 WeakPolarHBondContact CD1-SG 3.5Å
60M91.2Very high86.2Confident2 Ų239.2 Ų39.21%0.0119%0.191CC..Hα-helixtrans-60.9-39.8177.5-67172.4-177.900113.4F46 T56 T57 N62 L63 V64 I114 Y295 T298F46-M60 HydrophobicContact CE1-CB 4.48Å; F46-M60 HydrophobicContact CE1-SD 3.86Å; F46-M60 HydrophobicContact CE2-CB 3.8Å; F46-M60 HydrophobicContact CZ-CB 3.71Å; F46-M60 HydrophobicContact CZ-CG 4.22Å; F46-M60 HydrophobicContact CZ-SD 3.54Å; F46-M60 VanDerWaalsContact CZ-SD 3.54Å; T56-M60 HydrophobicContact CG2-CE 4Å; T56-M60 WeakPolarHBondContact O-CG 3.33Å; T56-M60 PolarHBondContact O-N 3.31Å; T56-M60 VanDerWaalsContact O-N 3.15Å; T57-M60 PolarHBondContact O-N 3.46Å; M60-N62 VanDerWaalsContact C-N 3.31Å; M60-N62 PolarHBondContact O-N 3.38Å; M60-L63 WeakPolarHBondContact O-CB 3.27Å; M60-L63 PolarHBondContact O-N 3.07Å; M60-V64 WeakPolarHBondContact O-CG2 3.33Å; M60-V64 PolarHBondContact O-N 2.86Å; M60-I114 HydrophobicContact CG-CD1 4.05Å; M60-Y295 HydrophobicContact CB-CD1 4.06Å; M60-Y295 HydrophobicContact CB-CE1 3.91Å; M60-Y295 HydrophobicContact CG-CD1 3.82Å; M60-Y295 HydrophobicContact CG-CE1 3.98Å; M60-Y295 HydrophobicContact SD-CD1 4.05Å; M60-T298 HydrophobicContact CE-CG2 2.98Å
61M91.6Very high87.4Confident14 Ų1438.1 Ų38.17%0.06919%0.185CC..Hα-helixtrans-64.2-38.9177.7-76.5165.7173.900111.8F46 R53 T57 T58 Y59 L63 V64 V65F46-M61 HydrophobicContact CB-CE 3.43Å; F46-M61 VanDerWaalsContact CB-CE 3.43Å; F46-M61 HydrophobicContact CB-CG 3.96Å; F46-M61 HydrophobicContact CD2-CG 4.21Å; F46-M61 HydrophobicContact CG-CE 4.21Å; F46-M61 HydrophobicContact CG-CG 4.2Å; F46-M61 WeakPolarHBondContact O-CE 3.39Å; R53-M61 HydrophobicContact CG-CE 3.91Å; R53-M61 HydrophobicContact CG-SD 4.39Å; R53-M61 PolarHBondContact NE-SD 2.92Å; R53-M61 PolarHBondContact NH2-SD 3.32Å; T57-M61 HydrophobicContact CG2-CE 3.63Å; T57-M61 HydrophobicContact CG2-CG 4.5Å; T57-M61 HydrophobicContact CG2-SD 4.17Å; T57-M61 VanDerWaalsContact O-CG 3.29Å; T57-M61 WeakPolarHBondContact O-CG 3.34Å; T57-M61 PolarHBondContact O-N 2.66Å; T58-M61 PolarHBondContact O-N 3.18Å; Y59-M61 VanDerWaalsContact C-N 3.34Å; Y59-M61 PolarHBondContact O-N 2.75Å; M61-L63 VanDerWaalsContact C-N 3.34Å; M61-V64 PolarHBondContact O-N 3.13Å; M61-V65 VanDerWaalsContact O-CG2 3.26Å; M61-V65 WeakPolarHBondContact O-CG2 3.19Å; M61-V65 PolarHBondContact O-N 3.46Å
62N94.9Very high89.3Confident34 Ų3434 Ų3418%0.18217%0.168CC..Hα-helixtrans-68.8-35.6175.7-74.8-89.2000111.7T58 Y59 M60 V65 S66 F110 C141 W145T58-N62 PolarHBondContact O-N 2.86Å; T58-N62 PolarHBondContact O-ND2 3.32Å; Y59-N62 PolarHBondContact O-N 3.09Å; M60-N62 VanDerWaalsContact C-N 3.31Å; M60-N62 PolarHBondContact O-N 3.38Å; N62-V65 PolarHBondContact O-N 3.23Å; N62-S66 WeakPolarHBondContact O-CB 3.46Å; N62-S66 PolarHBondContact O-N 3.34Å; N62-F110 HydrophobicContact CB-CD1 4.1Å; N62-F110 HydrophobicContact CB-CD2 4.38Å; N62-F110 HydrophobicContact CB-CE1 3.54Å; N62-F110 HydrophobicContact CB-CE2 3.86Å; N62-F110 HydrophobicContact CB-CZ 3.43Å; N62-F110 VanDerWaalsContact CB-CZ 3.43Å; N62-C141 PolarHBondContact ND2-SG 3.41Å; N62-W145 PolarHBondContact OD1-NE1 3.2Å
63L93.8Very high91Very high0 Ų028.6 Ų28.60%014%0.14CC..Hα-helixtrans-59.6-52.6171.8-173.157000111.2Y59 M60 M61 V65 S66 D67 S107 F110 L111 D291 Y295Y59-L63 PolarHBondContact O-N 3.12Å; M60-L63 WeakPolarHBondContact O-CB 3.27Å; M60-L63 PolarHBondContact O-N 3.07Å; M61-L63 VanDerWaalsContact C-N 3.34Å; L63-V65 VanDerWaalsContact C-N 3.31Å; L63-V65 PolarHBondContact O-N 3.35Å; L63-S66 WeakPolarHBondContact O-CA 3.19Å; L63-S66 VanDerWaalsContact O-CB 3.31Å; L63-S66 WeakPolarHBondContact O-CB 3.42Å; L63-S66 PolarHBondContact O-N 3.28Å; L63-D67 VanDerWaalsContact O-CG 3.29Å; L63-D67 PolarHBondContact O-N 2.73Å; L63-S107 VanDerWaalsContact CD1-CA 3.45Å; L63-S107 VanDerWaalsContact CD1-OG 3.24Å; L63-S107 WeakPolarHBondContact CD1-OG 3.29Å; L63-F110 HydrophobicContact CB-CB 4.21Å; L63-F110 HydrophobicContact CB-CD2 4.48Å; L63-F110 HydrophobicContact CD1-CB 4.19Å; L63-F110 HydrophobicContact CD1-CD2 4.43Å; L63-L111 HydrophobicContact CD2-CD2 3.95Å; L63-L111 HydrophobicContact CD2-CG 4.25Å; L63-D291 HydrophobicContact CD2-CB 4.45Å; L63-Y295 HydrophobicContact CD2-CE1 3.99Å; L63-Y295 VanDerWaalsContact CG-OH 3.31Å; L63-Y295 WeakPolarHBondContact CG-OH 3.47Å
64V94.8Very high92.2Very high0 Ų023.3 Ų23.30%012%0.12CC..Hα-helixtrans-55.8-43175.61710000112.4N39 A42 L43 F46 M60 M61 D67 L68 Y295N39-V64 HydrophobicContact CB-CG1 4.2Å; N39-V64 WeakPolarHBondContact O-CG1 3.37Å; A42-V64 HydrophobicContact CB-CG2 4Å; L43-V64 HydrophobicContact CB-CG1 3.76Å; L43-V64 HydrophobicContact CD1-CG1 4.15Å; L43-V64 HydrophobicContact CG-CG1 4.45Å; F46-V64 HydrophobicContact CD2-CG2 4.02Å; F46-V64 HydrophobicContact CE2-CG2 3.79Å; M60-V64 WeakPolarHBondContact O-CG2 3.33Å; M60-V64 PolarHBondContact O-N 2.86Å; M61-V64 PolarHBondContact O-N 3.13Å; V64-D67 PolarHBondContact O-N 2.9Å; V64-L68 HydrophobicContact CG1-CD1 3.91Å; V64-L68 HydrophobicContact CG1-CG 4.38Å; V64-L68 WeakPolarHBondContact O-CB 3.22Å; V64-L68 VanDerWaalsContact O-CG 3.29Å; V64-L68 WeakPolarHBondContact O-CG 3.23Å; V64-L68 PolarHBondContact O-N 3.2Å; V64-Y295 HydrophobicContact CG2-CD2 4.38Å; V64-Y295 HydrophobicContact CG2-CE1 4.36Å; V64-Y295 HydrophobicContact CG2-CE2 3.45Å; V64-Y295 VanDerWaalsContact CG2-CE2 3.45Å; V64-Y295 VanDerWaalsContact CG2-CZ 3.44Å; V64-Y295 VanDerWaalsContact CG2-OH 3.23Å; V64-Y295 WeakPolarHBondContact CG2-OH 3.19Å; V64-Y295 PolarHBondContact N-OH 3.17Å
65V95.7Very high93.2Very high58 Ų5822.2 Ų22.235%0.35212%0.117SC..Hα-helixtrans-63.3-44.8177.6168.30000110.8M61 N62 L63 D67 L68 L69 W145M61-V65 VanDerWaalsContact O-CG2 3.26Å; M61-V65 WeakPolarHBondContact O-CG2 3.19Å; M61-V65 PolarHBondContact O-N 3.46Å; N62-V65 PolarHBondContact O-N 3.23Å; L63-V65 VanDerWaalsContact C-N 3.31Å; L63-V65 PolarHBondContact O-N 3.35Å; V65-D67 VanDerWaalsContact C-N 3.34Å; V65-D67 PolarHBondContact O-N 3.37Å; V65-L68 PolarHBondContact O-N 2.86Å; V65-L69 HydrophobicContact CG1-CD1 4.08Å; V65-L69 HydrophobicContact CG1-CG 4.47Å; V65-L69 VanDerWaalsContact O-CG 3.27Å; V65-L69 WeakPolarHBondContact O-CG 3.45Å; V65-L69 PolarHBondContact O-N 3.41Å; V65-W145 HydrophobicContact CG1-CH2 4.49Å; V65-W145 HydrophobicContact CG1-CZ2 4.16Å
66S96.4Very high93.7Very high3 Ų323 Ų232%0.02112%0.122CC..Hα-helixtrans-59.3-43.6175.7-178.40000112.2N62 L63 F70 N103N62-S66 WeakPolarHBondContact O-CB 3.46Å; N62-S66 PolarHBondContact O-N 3.34Å; L63-S66 WeakPolarHBondContact O-CA 3.19Å; L63-S66 VanDerWaalsContact O-CB 3.31Å; L63-S66 WeakPolarHBondContact O-CB 3.42Å; L63-S66 PolarHBondContact O-N 3.28Å; S66-F70 PolarHBondContact O-N 3.4Å; S66-N103 VanDerWaalsContact C-ND2 3.3Å; S66-N103 PolarHBondContact O-ND2 3.25Å; S66-N103 VanDerWaalsContact O-ND2 3.15Å; S66-N103 WeakPolarHBondContact OG-CA 3.45Å; S66-N103 PolarHBondContact OG-ND2 3Å
67D95.9Very high94.2Very high0 Ų023.2 Ų23.20%012%0.122CC..Hα-helixtrans-65.3-45.7178.3-64.2-33000111.9L63 V64 V65 L69 F70 V71 N103 S107 C288 D291L63-D67 VanDerWaalsContact O-CG 3.29Å; L63-D67 PolarHBondContact O-N 2.73Å; V64-D67 PolarHBondContact O-N 2.9Å; V65-D67 VanDerWaalsContact C-N 3.34Å; V65-D67 PolarHBondContact O-N 3.37Å; D67-L69 PolarHBondContact O-N 3.37Å; D67-F70 PolarHBondContact O-N 2.93Å; D67-V71 WeakPolarHBondContact O-CB 3.35Å; D67-V71 VanDerWaalsContact O-CG2 3.22Å; D67-V71 WeakPolarHBondContact O-CG2 3.26Å; D67-V71 PolarHBondContact O-N 3.27Å; D67-N103 VanDerWaalsContact CA-ND2 3.31Å; D67-N103 WeakPolarHBondContact CA-ND2 3.34Å; D67-N103 PolarHBondContact N-ND2 2.95Å; D67-N103 PolarHBondContact OD1-ND2 2.74Å; D67-S107 PolarHBondContact OD1-OG 3.26Å; D67-C288 HydrophobicContact CB-CB 3.88Å; D67-D291 VanDerWaalsContact OD2-OD2 3.11Å
68L96.4Very high94.6Very high13 Ų1323.5 Ų23.57%0.06812%0.124CC..Hα-helixtrans-61.5-46.5177.9-72.5172.2000111.8L36 N39 V40 L43 V64 V65 F70 V71 F72L36-L68 HydrophobicContact CD1-CD2 4.07Å; N39-L68 HydrophobicContact CB-CD2 3.68Å; N39-L68 HydrophobicContact CB-CG 3.89Å; V40-L68 HydrophobicContact CG2-CD2 3.8Å; L43-L68 HydrophobicContact CB-CD1 4.49Å; L43-L68 HydrophobicContact CD2-CD1 3.81Å; V64-L68 HydrophobicContact CG1-CD1 3.91Å; V64-L68 HydrophobicContact CG1-CG 4.38Å; V64-L68 WeakPolarHBondContact O-CB 3.22Å; V64-L68 VanDerWaalsContact O-CG 3.29Å; V64-L68 WeakPolarHBondContact O-CG 3.23Å; V64-L68 PolarHBondContact O-N 3.2Å; V65-L68 PolarHBondContact O-N 2.86Å; L68-F70 VanDerWaalsContact C-N 3.25Å; L68-F70 PolarHBondContact O-N 3.34Å; L68-V71 PolarHBondContact O-N 3.35Å; L68-F72 HydrophobicContact CB-CD2 4.47Å; L68-F72 HydrophobicContact CB-CE2 4.21Å; L68-F72 WeakPolarHBondContact O-CD2 3.38Å; L68-F72 PolarHBondContact O-N 3.01Å
69L96.2Very high94.8Very high73 Ų7326.8 Ų26.838%0.38214%0.136SC..Hα-helixtrans-55.8-42.9177.9-73.7173.1000111.5V65 D67 L99 W145V65-L69 HydrophobicContact CG1-CD1 4.08Å; V65-L69 HydrophobicContact CG1-CG 4.47Å; V65-L69 VanDerWaalsContact O-CG 3.27Å; V65-L69 WeakPolarHBondContact O-CG 3.45Å; V65-L69 PolarHBondContact O-N 3.41Å; D67-L69 PolarHBondContact O-N 3.37Å; L69-L99 HydrophobicContact CB-CD2 4.2Å; L69-W145 HydrophobicContact CD1-CH2 4.07Å
70F96.1Very high94.7Very high0 Ų025.8 Ų25.80%013%0.133CC..Hα-helixtrans-70.8-46.5176.9165.8-116000112.9S66 D67 L68 F72 T73 L74 F100 N103 V285S66-F70 PolarHBondContact O-N 3.4Å; D67-F70 PolarHBondContact O-N 2.93Å; L68-F70 VanDerWaalsContact C-N 3.25Å; L68-F70 PolarHBondContact O-N 3.34Å; F70-F72 PolarHBondContact O-N 3.5Å; F70-T73 WeakPolarHBondContact O-CA 3.31Å; F70-T73 WeakPolarHBondContact O-CB 3.41Å; F70-T73 PolarHBondContact O-N 3.42Å; F70-T73 PolarHBondContact O-OG1 3.48Å; F70-L74 HydrophobicContact CE1-CD1 4.39Å; F70-L74 HydrophobicContact CE1-CD2 4.11Å; F70-L74 HydrophobicContact CE1-CG 4.47Å; F70-L74 HydrophobicContact CE2-CD2 3.77Å; F70-L74 HydrophobicContact CZ-CD2 3.48Å; F70-L74 VanDerWaalsContact CZ-CD2 3.48Å; F70-L74 HydrophobicContact CZ-CG 4.26Å; F70-L74 PolarHBondContact O-N 2.76Å; F70-F100 HydrophobicContact CD2-CB 4.08Å; F70-F100 HydrophobicContact CD2-CD2 4.43Å; F70-F100 HydrophobicContact CE2-CB 3.92Å; F70-F100 AromaticContact CE2-CD2 3.66Å; F70-F100 HydrophobicContact CE2-CD2 3.66Å; F70-F100 HydrophobicContact CE2-CG 4.29Å; F70-F100 AromaticContact CZ-CD2 3.99Å; F70-F100 HydrophobicContact CZ-CD2 3.99Å; F70-N103 HydrophobicContact CB-CB 3.5Å; F70-N103 HydrophobicContact CD1-CB 4.32Å; F70-N103 HydrophobicContact CG-CB 3.89Å; F70-V285 HydrophobicContact CE1-CB 4.47Å; F70-V285 HydrophobicContact CE1-CG1 3.8Å; F70-V285 HydrophobicContact CE1-CG2 4.44Å; F70-V285 HydrophobicContact CZ-CB 4.3Å; F70-V285 HydrophobicContact CZ-CG1 3.7Å; F70-V285 HydrophobicContact CZ-CG2 3.87Å
71V96.4Very high94.7Very high0 Ų026.3 Ų26.30%014%0.135CC..Hα-helixtrans-55.9-40.2179.1164.70000111.1F32 L36 D67 L68 T73 L74 C288F32-V71 HydrophobicContact CD2-CG1 3.73Å; F32-V71 WeakPolarHBondContact CD2-O 3.39Å; F32-V71 HydrophobicContact CE2-CG1 4.28Å; L36-V71 HydrophobicContact CB-CG1 3.8Å; L36-V71 HydrophobicContact CD1-CG1 4.28Å; D67-V71 WeakPolarHBondContact O-CB 3.35Å; D67-V71 VanDerWaalsContact O-CG2 3.22Å; D67-V71 WeakPolarHBondContact O-CG2 3.26Å; D67-V71 PolarHBondContact O-N 3.27Å; L68-V71 PolarHBondContact O-N 3.35Å; V71-T73 PolarHBondContact O-N 2.95Å; V71-T73 VanDerWaalsContact O-N 3.15Å; V71-L74 HydrophobicContact CG2-CD1 4.33Å; V71-L74 WeakPolarHBondContact O-CB 3.48Å; V71-L74 PolarHBondContact O-N 3.43Å; V71-C288 HydrophobicContact CG2-CB 4.46Å
72F96Very high94.7Very high124 Ų12430.3 Ų30.354%0.54416%0.156SC..THydrogen-bonded Turntrans-61.5-22175.4-77.5-59.4000114.3L36 L68 F70 P75L36-F72 HydrophobicContact CD1-CE1 3.82Å; L36-F72 HydrophobicContact CD1-CE2 4.48Å; L36-F72 HydrophobicContact CD1-CZ 3.8Å; L68-F72 HydrophobicContact CB-CD2 4.47Å; L68-F72 HydrophobicContact CB-CE2 4.21Å; L68-F72 WeakPolarHBondContact O-CD2 3.38Å; L68-F72 PolarHBondContact O-N 3.01Å; F70-F72 PolarHBondContact O-N 3.5Å; F72-P75 WeakPolarHBondContact O-CD 3.31Å
73T94.9Very high94.5Very high10 Ų1032.7 Ų32.76%0.06117%0.168CC..THydrogen-bonded Turntrans-86-15.3175.873.20000113.8F70 V71 L76 R77 L99F70-T73 WeakPolarHBondContact O-CA 3.31Å; F70-T73 WeakPolarHBondContact O-CB 3.41Å; F70-T73 PolarHBondContact O-N 3.42Å; F70-T73 PolarHBondContact O-OG1 3.48Å; V71-T73 PolarHBondContact O-N 2.95Å; V71-T73 VanDerWaalsContact O-N 3.15Å; T73-L76 WeakPolarHBondContact O-CB 3.46Å; T73-L76 PolarHBondContact O-N 3.38Å; T73-R77 PolarHBondContact O-N 2.88Å; T73-L99 HydrophobicContact CG2-CB 4.11Å; T73-L99 HydrophobicContact CG2-CD1 3.53Å; T73-L99 HydrophobicContact CG2-CG 4.44Å
74L95Very high94.1Very high0 Ų037.1 Ų37.10%019%0.187CC..Hα-helixtrans-61.1-39.2-176.1-68.2178.9000114F28 V31 F32 F70 V71 L76 R77 V78F28-L74 HydrophobicContact CB-CD2 4.16Å; F28-L74 HydrophobicContact CD1-CD2 4.46Å; F28-L74 HydrophobicContact CD2-CD2 4.32Å; F28-L74 HydrophobicContact CG-CD2 4.07Å; V31-L74 HydrophobicContact CB-CD1 4.12Å; V31-L74 HydrophobicContact CG1-CD1 3.7Å; F32-L74 HydrophobicContact CB-CB 4.09Å; F32-L74 HydrophobicContact CB-CD1 4.13Å; F32-L74 HydrophobicContact CD2-CB 4.46Å; F70-L74 HydrophobicContact CE1-CD1 4.39Å; F70-L74 HydrophobicContact CE1-CD2 4.11Å; F70-L74 HydrophobicContact CE1-CG 4.47Å; F70-L74 HydrophobicContact CE2-CD2 3.77Å; F70-L74 HydrophobicContact CZ-CD2 3.48Å; F70-L74 VanDerWaalsContact CZ-CD2 3.48Å; F70-L74 HydrophobicContact CZ-CG 4.26Å; F70-L74 PolarHBondContact O-N 2.76Å; V71-L74 HydrophobicContact CG2-CD1 4.33Å; V71-L74 WeakPolarHBondContact O-CB 3.48Å; V71-L74 PolarHBondContact O-N 3.43Å; L74-L76 VanDerWaalsContact C-N 3.26Å; L74-L76 PolarHBondContact O-N 2.84Å; L74-R77 WeakPolarHBondContact O-CA 3.43Å; L74-R77 WeakPolarHBondContact O-CB 3.35Å; L74-R77 PolarHBondContact O-N 3.47Å; L74-V78 WeakPolarHBondContact O-CG2 3.15Å; L74-V78 PolarHBondContact O-N 3.28Å
75P95.7Very high93.8Very high55 Ų5539.3 Ų39.336%0.35720%0.199SC..Hα-helixtrans-57.7-37.6177.1-27.736.8000113.4F32 F72 R77 V78 F79F32-P75 HydrophobicContact CD1-CG 4.38Å; F32-P75 HydrophobicContact CD2-CG 3.72Å; F32-P75 HydrophobicContact CE1-CG 4.23Å; F32-P75 HydrophobicContact CE2-CG 3.54Å; F32-P75 HydrophobicContact CG-CG 4.14Å; F32-P75 HydrophobicContact CZ-CG 3.81Å; F72-P75 WeakPolarHBondContact O-CD 3.31Å; P75-R77 VanDerWaalsContact C-N 3.32Å; P75-R77 PolarHBondContact O-N 3.39Å; P75-V78 PolarHBondContact O-N 2.94Å; P75-F79 PolarHBondContact O-N 2.94Å
76L93.9Very high93.4Very high42 Ų4236.7 Ų36.722%0.2218%0.183CC..Hα-helixtrans-64-40176.5-54.3177.7000111.1T73 L74 Y80 W86 F88 F92T73-L76 WeakPolarHBondContact O-CB 3.46Å; T73-L76 PolarHBondContact O-N 3.38Å; L74-L76 VanDerWaalsContact C-N 3.26Å; L74-L76 PolarHBondContact O-N 2.84Å; L76-Y80 PolarHBondContact O-N 2.69Å; L76-Y80 VanDerWaalsContact O-N 3.11Å; L76-W86 HydrophobicContact CB-CH2 3.61Å; L76-W86 HydrophobicContact CB-CZ3 3.9Å; L76-W86 HydrophobicContact CD1-CH2 4.2Å; L76-W86 HydrophobicContact CG-CH2 4.5Å; L76-W86 WeakPolarHBondContact O-CZ3 3.18Å; L76-F88 HydrophobicContact CB-CD2 4.41Å; L76-F88 HydrophobicContact CB-CE2 4.3Å; L76-F88 HydrophobicContact CD2-CD1 4.01Å; L76-F88 HydrophobicContact CD2-CD2 4.1Å; L76-F88 HydrophobicContact CD2-CE1 3.9Å; L76-F88 HydrophobicContact CD2-CE2 4Å; L76-F88 HydrophobicContact CD2-CG 4.11Å; L76-F88 HydrophobicContact CD2-CZ 3.9Å; L76-F92 HydrophobicContact CD1-CD1 4.27Å
77R92.9Very high93.1Very high12 Ų1240.1 Ų40.15%0.04521%0.205CC..Hα-helixtrans-66.8-45175.6-67.4-177.6172.2-150.4-7.2111.6F28 T73 L74 P75 F79 Y80 F81 S96 F172F28-R77 HydrophobicContact CD2-CB 3.94Å; F28-R77 HydrophobicContact CE2-CB 4.31Å; T73-R77 PolarHBondContact O-N 2.88Å; L74-R77 WeakPolarHBondContact O-CA 3.43Å; L74-R77 WeakPolarHBondContact O-CB 3.35Å; L74-R77 PolarHBondContact O-N 3.47Å; P75-R77 VanDerWaalsContact C-N 3.32Å; P75-R77 PolarHBondContact O-N 3.39Å; R77-F79 VanDerWaalsContact C-N 3.33Å; R77-F79 PolarHBondContact O-N 3.28Å; R77-Y80 WeakPolarHBondContact O-CB 3.17Å; R77-Y80 PolarHBondContact O-N 3.45Å; R77-Y80 VanDerWaalsContact O-N 3.15Å; R77-F81 HydrophobicContact CB-CD2 4.32Å; R77-F81 HydrophobicContact CB-CE2 4.13Å; R77-F81 WeakPolarHBondContact O-CD2 3.29Å; R77-F81 PolarHBondContact O-N 2.85Å; R77-S96 PolarHBondContact NE-OG 3.48Å; R77-S96 PolarHBondContact NH2-O 2.95Å; R77-F172 HydrophobicContact CB-CE2 4.5Å; R77-F172 HydrophobicContact CG-CE1 4.3Å; R77-F172 HydrophobicContact CG-CE2 3.87Å; R77-F172 HydrophobicContact CG-CZ 3.59Å
78V95.1Very high92.6Very high18 Ų1843.5 Ų43.511%0.10922%0.22CC..Hα-helixtrans-57.6-48.1176.6171.10000110.1F28 S29 L74 P75 Y80 F81 I82F28-V78 HydrophobicContact CB-CG2 3.67Å; S29-V78 WeakPolarHBondContact OG-CG1 3.44Å; L74-V78 WeakPolarHBondContact O-CG2 3.15Å; L74-V78 PolarHBondContact O-N 3.28Å; P75-V78 PolarHBondContact O-N 2.94Å; V78-Y80 VanDerWaalsContact C-N 3.28Å; V78-Y80 PolarHBondContact O-N 3.43Å; V78-F81 PolarHBondContact O-N 3.27Å; V78-I82 HydrophobicContact CG1-CD1 3.74Å; V78-I82 HydrophobicContact CG1-CG1 4.47Å; V78-I82 WeakPolarHBondContact O-CG1 3.39Å; V78-I82 PolarHBondContact O-N 3.49Å
79F94.6Very high92.2Very high83 Ų8344.6 Ų44.636%0.36423%0.234SC..Hα-helixtrans-54.8-45.9175.7-176.1-81.9000111.8P75 R77 I82 N83 P87 F88P75-F79 PolarHBondContact O-N 2.94Å; R77-F79 VanDerWaalsContact C-N 3.33Å; R77-F79 PolarHBondContact O-N 3.28Å; F79-I82 PolarHBondContact O-N 2.93Å; F79-N83 HydrophobicContact CD1-CB 4.47Å; F79-N83 WeakPolarHBondContact CD2-ND2 3.01Å; F79-N83 HydrophobicContact CE1-CB 4.08Å; F79-N83 WeakPolarHBondContact CE1-ND2 3.4Å; F79-N83 VanDerWaalsContact CE2-ND2 3.25Å; F79-N83 WeakPolarHBondContact CE2-ND2 3.41Å; F79-N83 HydrophobicContact CZ-CB 4.42Å; F79-N83 VanDerWaalsContact CZ-ND2 3.3Å; F79-N83 WeakPolarHBondContact CZ-ND2 3.47Å; F79-N83 WeakPolarHBondContact O-CB 3.27Å; F79-N83 PolarHBondContact O-N 3.18Å; F79-N83 PolarHBondContact O-ND2 2.91Å; F79-P87 HydrophobicContact CD1-CG 4.26Å; F79-P87 HydrophobicContact CE1-CG 3.58Å; F79-P87 HydrophobicContact CZ-CG 4.14Å; F79-F88 HydrophobicContact CB-CE2 4.15Å; F79-F88 HydrophobicContact CB-CZ 4.09Å; F79-F88 AromaticContact CD1-CE2 3.7Å; F79-F88 HydrophobicContact CD1-CE2 3.7Å; F79-F88 AromaticContact CD1-CZ 3.74Å; F79-F88 HydrophobicContact CD1-CZ 3.74Å; F79-F88 HydrophobicContact CD2-CZ 4.35Å; F79-F88 HydrophobicContact CE1-CE2 4.42Å; F79-F88 HydrophobicContact CE1-CZ 4.3Å; F79-F88 HydrophobicContact CG-CE2 4.05Å; F79-F88 AromaticContact CG-CZ 3.78Å; F79-F88 HydrophobicContact CG-CZ 3.78Å
80Y91.4Very high91.6Very high0 Ų042.1 Ų42.10%023%0.226CC..Hα-helixtrans-61.9-45.8177.5171.9-94.8000112.9L76 R77 V78 I82 K84 W86 F170 F172 E173L76-Y80 PolarHBondContact O-N 2.69Å; L76-Y80 VanDerWaalsContact O-N 3.11Å; R77-Y80 WeakPolarHBondContact O-CB 3.17Å; R77-Y80 PolarHBondContact O-N 3.45Å; R77-Y80 VanDerWaalsContact O-N 3.15Å; V78-Y80 VanDerWaalsContact C-N 3.28Å; V78-Y80 PolarHBondContact O-N 3.43Å; Y80-I82 VanDerWaalsContact C-N 3.28Å; Y80-I82 PolarHBondContact O-N 3.38Å; Y80-K84 WeakPolarHBondContact O-CA 3.28Å; Y80-K84 PolarHBondContact O-N 3.07Å; Y80-W86 HydrophobicContact CD2-CB 3.96Å; Y80-W86 HydrophobicContact CD2-CE3 4.22Å; Y80-W86 HydrophobicContact CE2-CB 4.41Å; Y80-W86 HydrophobicContact CG-CE3 4.29Å; Y80-F170 HydrophobicContact CE2-CD1 4.43Å; Y80-F170 WeakPolarHBondContact OH-CD1 3.44Å; Y80-F172 AromaticContact CD1-CD2 3.54Å; Y80-F172 HydrophobicContact CD1-CD2 3.54Å; Y80-F172 HydrophobicContact CD1-CE2 4.13Å; Y80-F172 HydrophobicContact CE1-CB 4.29Å; Y80-F172 AromaticContact CE1-CD2 3.78Å; Y80-F172 HydrophobicContact CE1-CD2 3.78Å; Y80-F172 AromaticContact CG-CD2 3.96Å; Y80-F172 HydrophobicContact CG-CD2 3.96Å; Y80-F172 HydrophobicContact CG-CE2 4.17Å; Y80-E173 PolarHBondContact OH-OE2 3.39Å
81F90.7Very high91.2Very high13 Ų1347.8 Ų47.86%0.05726%0.256CS..Hα-helixtrans-71.8-22.6-177-71-62.6000113.5Y21 Y24 F28 R77 V78 F172Y21-F81 HydrophobicContact CD1-CD1 4.02Å; Y24-F81 AromaticContact CD2-CD1 3.71Å; Y24-F81 HydrophobicContact CD2-CD1 3.71Å; Y24-F81 HydrophobicContact CD2-CD2 4.35Å; Y24-F81 AromaticContact CD2-CE1 3.37Å; Y24-F81 HydrophobicContact CD2-CE1 3.37Å; Y24-F81 HydrophobicContact CD2-CE2 4.09Å; Y24-F81 HydrophobicContact CD2-CG 4.2Å; Y24-F81 AromaticContact CD2-CZ 3.59Å; Y24-F81 HydrophobicContact CD2-CZ 3.59Å; Y24-F81 AromaticContact CE2-CE1 3.94Å; Y24-F81 HydrophobicContact CE2-CE1 3.94Å; Y24-F81 HydrophobicContact CE2-CZ 4.12Å; Y24-F81 HydrophobicContact CG-CD1 4.45Å; Y24-F81 HydrophobicContact CG-CD2 4.43Å; Y24-F81 HydrophobicContact CG-CE1 4.32Å; Y24-F81 HydrophobicContact CG-CE2 4.34Å; Y24-F81 HydrophobicContact CG-CZ 4.27Å; F28-F81 HydrophobicContact CD2-CD2 4.23Å; F28-F81 HydrophobicContact CD2-CE2 4.16Å; F28-F81 HydrophobicContact CE2-CD2 4.19Å; F28-F81 AromaticContact CE2-CE2 3.7Å; F28-F81 HydrophobicContact CE2-CE2 3.7Å; R77-F81 HydrophobicContact CB-CD2 4.32Å; R77-F81 HydrophobicContact CB-CE2 4.13Å; R77-F81 WeakPolarHBondContact O-CD2 3.29Å; R77-F81 PolarHBondContact O-N 2.85Å; V78-F81 PolarHBondContact O-N 3.27Å; F81-F172 HydrophobicContact CZ-CB 4.43Å; F81-F172 HydrophobicContact CZ-CD2 4.28Å
82I92.1Very high90.8Very high99 Ų9953.2 Ų53.251%0.50828%0.279SS..Hα-helixtrans-78.7-53.9171.6-65.1170.5000110.6S25 V78 F79 Y80S25-I82 WeakPolarHBondContact OG-CD1 3.33Å; S25-I82 WeakPolarHBondContact OG-CG1 3.24Å; V78-I82 HydrophobicContact CG1-CD1 3.74Å; V78-I82 HydrophobicContact CG1-CG1 4.47Å; V78-I82 WeakPolarHBondContact O-CG1 3.39Å; V78-I82 PolarHBondContact O-N 3.49Å; F79-I82 PolarHBondContact O-N 2.93Å; Y80-I82 VanDerWaalsContact C-N 3.28Å; Y80-I82 PolarHBondContact O-N 3.38Å
83N89.7Confident90.4Very high83 Ų8347.3 Ų47.344%0.44425%0.253SS..Hα-helixtrans-89.4-9.5-169-63.3-60.3000113.9F79 N85F79-N83 HydrophobicContact CD1-CB 4.47Å; F79-N83 WeakPolarHBondContact CD2-ND2 3.01Å; F79-N83 HydrophobicContact CE1-CB 4.08Å; F79-N83 WeakPolarHBondContact CE1-ND2 3.4Å; F79-N83 VanDerWaalsContact CE2-ND2 3.25Å; F79-N83 WeakPolarHBondContact CE2-ND2 3.41Å; F79-N83 HydrophobicContact CZ-CB 4.42Å; F79-N83 VanDerWaalsContact CZ-ND2 3.3Å; F79-N83 WeakPolarHBondContact CZ-ND2 3.47Å; F79-N83 WeakPolarHBondContact O-CB 3.27Å; F79-N83 PolarHBondContact O-N 3.18Å; F79-N83 PolarHBondContact O-ND2 2.91Å; N83-N85 PolarHBondContact O-N 2.94Å; N83-N85 VanDerWaalsContact O-N 3.1Å
84K86.6Confident90.1Very high93 Ų9348.3 Ų48.340%0.40426%0.257SS..SBendtrans52.429.1-174.5-57.2179.5-178.7174.50113.1Y21 Y80Y21-K84 HydrophobicContact CD1-CG 4.17Å; Y21-K84 HydrophobicContact CE1-CD 4.41Å; Y21-K84 HydrophobicContact CE1-CG 4.05Å; Y80-K84 WeakPolarHBondContact O-CA 3.28Å; Y80-K84 PolarHBondContact O-N 3.07Å
85N87Confident89.8Confident47 Ų4752 Ų5225%0.25128%0.276SS..  trans-144141.3-179-173.936.3000110.5N83 P87 T169N83-N85 PolarHBondContact O-N 2.94Å; N83-N85 VanDerWaalsContact O-N 3.1Å; N85-P87 WeakPolarHBondContact O-CD 3.36Å; N85-T169 PolarHBondContact OD1-N 2.88Å
86W88.7Confident89.6Confident2 Ų249.3 Ų49.31%0.00826%0.259CS..  trans-111.992.9178.1-175.7-91.3000111.3L76 Y80 F88 G89 F92 C93 T169 C171 F172L76-W86 HydrophobicContact CB-CH2 3.61Å; L76-W86 HydrophobicContact CB-CZ3 3.9Å; L76-W86 HydrophobicContact CD1-CH2 4.2Å; L76-W86 HydrophobicContact CG-CH2 4.5Å; L76-W86 WeakPolarHBondContact O-CZ3 3.18Å; Y80-W86 HydrophobicContact CD2-CB 3.96Å; Y80-W86 HydrophobicContact CD2-CE3 4.22Å; Y80-W86 HydrophobicContact CE2-CB 4.41Å; Y80-W86 HydrophobicContact CG-CE3 4.29Å; W86-F88 AromaticContact CD2-CD2 3.88Å; W86-F88 HydrophobicContact CD2-CD2 3.88Å; W86-F88 AromaticContact CE2-CD2 3.84Å; W86-F88 AromaticContact CE3-CD2 3.95Å; W86-F88 HydrophobicContact CE3-CD2 3.95Å; W86-F88 HydrophobicContact CE3-CE2 4.46Å; W86-F88 AromaticContact CH2-CD2 3.96Å; W86-F88 HydrophobicContact CH2-CD2 3.96Å; W86-F88 HydrophobicContact CZ2-CB 3.9Å; W86-F88 AromaticContact CZ2-CD2 3.87Å; W86-F88 HydrophobicContact CZ2-CD2 3.87Å; W86-F88 HydrophobicContact CZ2-CG 4.33Å; W86-F88 AromaticContact CZ3-CD2 3.98Å; W86-F88 HydrophobicContact CZ3-CD2 3.98Å; W86-F88 HydrophobicContact CZ3-CE2 4.43Å; W86-G89 PolarHBondContact NE1-O 3.42Å; W86-F92 HydrophobicContact CZ2-CB 3.82Å; W86-C93 HydrophobicContact CZ2-CB 4.17Å; W86-T169 HydrophobicContact CB-CG2 4.31Å; W86-T169 WeakPolarHBondContact CB-O 3.38Å; W86-T169 PolarHBondContact N-O 3.26Å; W86-T169 WeakPolarHBondContact O-CB 3.47Å; W86-C171 HydrophobicContact CB-CB 4.12Å; W86-C171 HydrophobicContact CD2-CB 3.69Å; W86-C171 HydrophobicContact CE3-CB 3.95Å; W86-C171 HydrophobicContact CG-CB 3.75Å; W86-F172 AromaticContact CE3-CE2 3.86Å; W86-F172 HydrophobicContact CE3-CE2 3.86Å; W86-F172 HydrophobicContact CE3-CZ 4.39Å; W86-F172 HydrophobicContact CH2-CE2 4.37Å; W86-F172 HydrophobicContact CH2-CZ 4.15Å; W86-F172 AromaticContact CZ3-CE2 3.54Å; W86-F172 HydrophobicContact CZ3-CE2 3.54Å; W86-F172 AromaticContact CZ3-CZ 3.76Å; W86-F172 HydrophobicContact CZ3-CZ 3.76Å
87P88.8Confident89.3Confident75 Ų7547.6 Ų47.649%0.48725%0.25SS..THydrogen-bonded Turntrans-84-8.1-178.533.9-36.9000113.9F79 N85 G89F79-P87 HydrophobicContact CD1-CG 4.26Å; F79-P87 HydrophobicContact CE1-CG 3.58Å; F79-P87 HydrophobicContact CZ-CG 4.14Å; N85-P87 WeakPolarHBondContact O-CD 3.36Å; P87-G89 VanDerWaalsContact C-N 3.26Å; P87-G89 PolarHBondContact O-N 2.91Å
88F87.3Confident89.2Confident72 Ų7247.3 Ų47.332%0.31625%0.25SC..THydrogen-bonded Turntrans-80.4-0.8-169.8-48.3-72.2000114.1L76 F79 W86 F92L76-F88 HydrophobicContact CB-CD2 4.41Å; L76-F88 HydrophobicContact CB-CE2 4.3Å; L76-F88 HydrophobicContact CD2-CD1 4.01Å; L76-F88 HydrophobicContact CD2-CD2 4.1Å; L76-F88 HydrophobicContact CD2-CE1 3.9Å; L76-F88 HydrophobicContact CD2-CE2 4Å; L76-F88 HydrophobicContact CD2-CG 4.11Å; L76-F88 HydrophobicContact CD2-CZ 3.9Å; F79-F88 HydrophobicContact CB-CE2 4.15Å; F79-F88 HydrophobicContact CB-CZ 4.09Å; F79-F88 AromaticContact CD1-CE2 3.7Å; F79-F88 HydrophobicContact CD1-CE2 3.7Å; F79-F88 AromaticContact CD1-CZ 3.74Å; F79-F88 HydrophobicContact CD1-CZ 3.74Å; F79-F88 HydrophobicContact CD2-CZ 4.35Å; F79-F88 HydrophobicContact CE1-CE2 4.42Å; F79-F88 HydrophobicContact CE1-CZ 4.3Å; F79-F88 HydrophobicContact CG-CE2 4.05Å; F79-F88 AromaticContact CG-CZ 3.78Å; F79-F88 HydrophobicContact CG-CZ 3.78Å; W86-F88 AromaticContact CD2-CD2 3.88Å; W86-F88 HydrophobicContact CD2-CD2 3.88Å; W86-F88 AromaticContact CE2-CD2 3.84Å; W86-F88 AromaticContact CE3-CD2 3.95Å; W86-F88 HydrophobicContact CE3-CD2 3.95Å; W86-F88 HydrophobicContact CE3-CE2 4.46Å; W86-F88 AromaticContact CH2-CD2 3.96Å; W86-F88 HydrophobicContact CH2-CD2 3.96Å; W86-F88 HydrophobicContact CZ2-CB 3.9Å; W86-F88 AromaticContact CZ2-CD2 3.87Å; W86-F88 HydrophobicContact CZ2-CD2 3.87Å; W86-F88 HydrophobicContact CZ2-CG 4.33Å; W86-F88 AromaticContact CZ3-CD2 3.98Å; W86-F88 HydrophobicContact CZ3-CD2 3.98Å; W86-F88 HydrophobicContact CZ3-CE2 4.43Å; F88-F92 HydrophobicContact CB-CB 3.95Å; F88-F92 HydrophobicContact CB-CD2 4.43Å; F88-F92 HydrophobicContact CB-CG 4.33Å; F88-F92 WeakPolarHBondContact O-CD2 3.46Å
89G86.4Confident89.1Confident35 Ų3548.1 Ų48.136%0.36125%0.253SS..Hα-helixtrans78.9167.5-179.200000114.7W86 P87 I91 C93W86-G89 PolarHBondContact NE1-O 3.42Å; P87-G89 VanDerWaalsContact C-N 3.26Å; P87-G89 PolarHBondContact O-N 2.91Å; G89-I91 PolarHBondContact O-N 3.33Å; G89-C93 PolarHBondContact O-N 2.85Å
90G84.4Confident88.9Confident21 Ų2144.8 Ų44.822%0.21624%0.239CC..Hα-helixtrans-65.1-35.1-17100000114.7F92 C93 Q94 S161G90-F92 PolarHBondContact O-N 3.06Å; G90-C93 VanDerWaalsContact O-CB 3.26Å; G90-C93 WeakPolarHBondContact O-CB 3.4Å; G90-C93 PolarHBondContact O-N 3.02Å; G90-C93 VanDerWaalsContact O-N 3.13Å; G90-Q94 WeakPolarHBondContact O-CG 3.44Å; G90-Q94 PolarHBondContact O-N 2.68Å; G90-S161 WeakPolarHBondContact CA-OG 3.23Å
91I86.8Confident88.7Confident120 Ų12046.3 Ų46.362%0.61525%0.245SC*.Hα-helixtrans-61.3-48-179.1-65.5165.6000111G89 C93 Q94 I95G89-I91 PolarHBondContact O-N 3.33Å; I91-C93 PolarHBondContact O-N 3.5Å; I91-Q94 PolarHBondContact O-N 2.92Å; I91-I95 HydrophobicContact CG2-CD1 3.79Å; I91-I95 HydrophobicContact CG2-CG1 4.46Å; I91-I95 WeakPolarHBondContact O-CG1 3.32Å; I91-I95 PolarHBondContact O-N 3.45Å
92F89.1Confident88.8Confident113 Ų11345.8 Ų45.850%0.49624%0.243SC..Hα-helixtrans-66.3-29.8178.1-75.3-82.2000112.2L76 W86 F88 G90 S96L76-F92 HydrophobicContact CD1-CD1 4.27Å; W86-F92 HydrophobicContact CZ2-CB 3.82Å; F88-F92 HydrophobicContact CB-CB 3.95Å; F88-F92 HydrophobicContact CB-CD2 4.43Å; F88-F92 HydrophobicContact CB-CG 4.33Å; F88-F92 WeakPolarHBondContact O-CD2 3.46Å; G90-F92 PolarHBondContact O-N 3.06Å; F92-S96 VanDerWaalsContact O-CB 3.3Å; F92-S96 WeakPolarHBondContact O-CB 3.42Å; F92-S96 PolarHBondContact O-N 3.49Å
93C87.8Confident88.9Confident0 Ų041.4 Ų41.40%022%0.22CC..Hα-helixtrans-62.8-52.2173.4177.90000110.7W86 G89 G90 I91 I95 S96 V97 C171W86-C93 HydrophobicContact CZ2-CB 4.17Å; G89-C93 PolarHBondContact O-N 2.85Å; G90-C93 VanDerWaalsContact O-CB 3.26Å; G90-C93 WeakPolarHBondContact O-CB 3.4Å; G90-C93 PolarHBondContact O-N 3.02Å; G90-C93 VanDerWaalsContact O-N 3.13Å; I91-C93 PolarHBondContact O-N 3.5Å; C93-I95 PolarHBondContact O-N 3.16Å; C93-S96 PolarHBondContact O-N 3.28Å; C93-V97 WeakPolarHBondContact O-CG2 3.48Å; C93-V97 PolarHBondContact O-N 2.91Å; C93-C171 WeakPolarHBondContact CA-SG 3.2Å; C93-C171 HydrophobicContact CB-CB 3.82Å; C93-C171 WeakPolarHBondContact CB-SG 3.27Å; C93-C171 WeakPolarHBondContact SG-CA 3.27Å; C93-C171 WeakPolarHBondContact SG-CB 3.07Å; C93-C171 CovalentContact SG-SG 2.01Å; C93-C171 PolarHBondContact SG-SG 2.87Å
94Q87.3Confident88.9Confident31 Ų3137.7 Ų37.715%0.14520%0.2CC..Hα-helixtrans-58.6-47.1178.4-65.1173-6.600111.2G90 I91 S96 V97 S98 G156 F157 N160G90-Q94 WeakPolarHBondContact O-CG 3.44Å; G90-Q94 PolarHBondContact O-N 2.68Å; I91-Q94 PolarHBondContact O-N 2.92Å; Q94-S96 PolarHBondContact O-N 3.42Å; Q94-V97 PolarHBondContact O-N 3.49Å; Q94-S98 WeakPolarHBondContact O-CB 3.19Å; Q94-S98 PolarHBondContact O-N 2.68Å; Q94-S98 PolarHBondContact O-OG 3.26Å; Q94-G156 WeakPolarHBondContact CG-O 3.37Å; Q94-F157 VanDerWaalsContact OE1-CD1 3.24Å; Q94-F157 VanDerWaalsContact OE1-CE1 3.28Å; Q94-N160 PolarHBondContact NE2-OD1 2.96Å
95I90Very high89.1Confident77 Ų7734.3 Ų34.340%0.39519%0.185SC..Hα-helixtrans-59.2-46.5176.6-69.2170000110.9I91 C93 V97 S98 L99I91-I95 HydrophobicContact CG2-CD1 3.79Å; I91-I95 HydrophobicContact CG2-CG1 4.46Å; I91-I95 WeakPolarHBondContact O-CG1 3.32Å; I91-I95 PolarHBondContact O-N 3.45Å; C93-I95 PolarHBondContact O-N 3.16Å; I95-V97 VanDerWaalsContact C-N 3.34Å; I95-V97 PolarHBondContact O-N 3.45Å; I95-S98 PolarHBondContact O-N 2.81Å; I95-L99 HydrophobicContact CG2-CD1 3.7Å; I95-L99 HydrophobicContact CG2-CG 4.21Å; I95-L99 WeakPolarHBondContact O-CB 3.13Å; I95-L99 WeakPolarHBondContact O-CG 3.34Å; I95-L99 PolarHBondContact O-N 3.33Å
96S91.3Very high89.4Confident0 Ų032 Ų320%017%0.173CC..Hα-helixtrans-63.4-39.8-179.8-173.90000112.1R77 F92 C93 Q94 F100R77-S96 PolarHBondContact NE-OG 3.48Å; R77-S96 PolarHBondContact NH2-O 2.95Å; F92-S96 VanDerWaalsContact O-CB 3.3Å; F92-S96 WeakPolarHBondContact O-CB 3.42Å; F92-S96 PolarHBondContact O-N 3.49Å; C93-S96 PolarHBondContact O-N 3.28Å; Q94-S96 PolarHBondContact O-N 3.42Å; S96-F100 PolarHBondContact O-N 2.8Å
97V87.7Confident89.6Confident6 Ų632 Ų324%0.03617%0.173CC..Hα-helixtrans-67.8-49175.9174.20000110.7C93 Q94 I95 L99 F100 Y101 L159 F172C93-V97 WeakPolarHBondContact O-CG2 3.48Å; C93-V97 PolarHBondContact O-N 2.91Å; Q94-V97 PolarHBondContact O-N 3.49Å; I95-V97 VanDerWaalsContact C-N 3.34Å; I95-V97 PolarHBondContact O-N 3.45Å; V97-L99 PolarHBondContact O-N 2.81Å; V97-F100 WeakPolarHBondContact O-CB 3.44Å; V97-F100 PolarHBondContact O-N 3.24Å; V97-Y101 HydrophobicContact CG1-CD2 3.95Å; V97-Y101 HydrophobicContact CG1-CE2 3.84Å; V97-Y101 WeakPolarHBondContact O-CD2 3.47Å; V97-Y101 PolarHBondContact O-N 3.03Å; V97-L159 HydrophobicContact CG1-CB 4.44Å; V97-L159 HydrophobicContact CG1-CD1 3.79Å; V97-F172 HydrophobicContact CG2-CD1 3.85Å; V97-F172 HydrophobicContact CG2-CE1 3.7Å
98S89.7Confident89.7Confident5 Ų528.4 Ų28.44%0.03515%0.15CC..Hα-helixtrans-62.3-42.9-179.5-70.50000112.8Q94 I95 F100 Y101 T102 S152 G156Q94-S98 WeakPolarHBondContact O-CB 3.19Å; Q94-S98 PolarHBondContact O-N 2.68Å; Q94-S98 PolarHBondContact O-OG 3.26Å; I95-S98 PolarHBondContact O-N 2.81Å; S98-F100 VanDerWaalsContact C-N 3.29Å; S98-F100 PolarHBondContact O-N 3.39Å; S98-Y101 PolarHBondContact O-N 2.97Å; S98-T102 VanDerWaalsContact O-CB 3.22Å; S98-T102 WeakPolarHBondContact O-CB 3.37Å; S98-T102 PolarHBondContact O-N 2.82Å; S98-T102 PolarHBondContact O-OG1 3.47Å; S98-S152 WeakPolarHBondContact O-CB 3.25Å; S98-S152 PolarHBondContact OG-O 2.65Å; S98-G156 WeakPolarHBondContact OG-CA 3.29Å
99L92.9Very high90Very high35 Ų3526.7 Ų26.718%0.18314%0.144CC..Hα-helixtrans-68-29.6179.5-74.1179.6000112.7L69 T73 I95 V97 N103L69-L99 HydrophobicContact CB-CD2 4.2Å; T73-L99 HydrophobicContact CG2-CB 4.11Å; T73-L99 HydrophobicContact CG2-CD1 3.53Å; T73-L99 HydrophobicContact CG2-CG 4.44Å; I95-L99 HydrophobicContact CG2-CD1 3.7Å; I95-L99 HydrophobicContact CG2-CG 4.21Å; I95-L99 WeakPolarHBondContact O-CB 3.13Å; I95-L99 WeakPolarHBondContact O-CG 3.34Å; I95-L99 PolarHBondContact O-N 3.33Å; V97-L99 PolarHBondContact O-N 2.81Å; L99-N103 VanDerWaalsContact O-CB 3.25Å; L99-N103 WeakPolarHBondContact O-CB 3.29Å; L99-N103 PolarHBondContact O-N 2.97Å
100F90.9Very high90.3Very high13 Ų1325 Ų256%0.05713%0.126CC..Hα-helixtrans-65.6-49.8172.3163.8-98.1000112.6F70 S96 V97 S98 T102 N103 M104 L281 V285F70-F100 HydrophobicContact CD2-CB 4.08Å; F70-F100 HydrophobicContact CD2-CD2 4.43Å; F70-F100 HydrophobicContact CE2-CB 3.92Å; F70-F100 AromaticContact CE2-CD2 3.66Å; F70-F100 HydrophobicContact CE2-CD2 3.66Å; F70-F100 HydrophobicContact CE2-CG 4.29Å; F70-F100 AromaticContact CZ-CD2 3.99Å; F70-F100 HydrophobicContact CZ-CD2 3.99Å; S96-F100 PolarHBondContact O-N 2.8Å; V97-F100 WeakPolarHBondContact O-CB 3.44Å; V97-F100 PolarHBondContact O-N 3.24Å; S98-F100 VanDerWaalsContact C-N 3.29Å; S98-F100 PolarHBondContact O-N 3.39Å; F100-T102 VanDerWaalsContact C-N 3.34Å; F100-N103 PolarHBondContact O-N 2.86Å; F100-M104 HydrophobicContact CZ-SD 4.37Å; F100-M104 WeakPolarHBondContact O-CB 3.3Å; F100-M104 PolarHBondContact O-N 3.39Å; F100-L281 HydrophobicContact CE1-CD1 4.31Å; F100-L281 HydrophobicContact CE2-CD1 3.61Å; F100-L281 HydrophobicContact CZ-CD1 3.27Å; F100-V285 HydrophobicContact CD2-CG2 4.22Å; F100-V285 HydrophobicContact CE2-CG2 3.67Å
101Y87.8Confident90.5Very high33 Ų3324.1 Ų24.113%0.12912%0.117CC..Hα-helixtrans-66.5-39.2176.9-75.7-70.4000111.8V97 S98 N103 M104 Y105 S152 T155 E192V97-Y101 HydrophobicContact CG1-CD2 3.95Å; V97-Y101 HydrophobicContact CG1-CE2 3.84Å; V97-Y101 WeakPolarHBondContact O-CD2 3.47Å; V97-Y101 PolarHBondContact O-N 3.03Å; S98-Y101 PolarHBondContact O-N 2.97Å; Y101-N103 VanDerWaalsContact C-N 3.29Å; Y101-N103 PolarHBondContact O-N 3.16Å; Y101-M104 PolarHBondContact O-N 3.25Å; Y101-Y105 AromaticContact CD1-CE2 3.98Å; Y101-Y105 HydrophobicContact CD1-CE2 3.98Å; Y101-Y105 VanDerWaalsContact O-CD2 3.24Å; Y101-Y105 WeakPolarHBondContact O-CD2 3.28Å; Y101-Y105 PolarHBondContact O-N 2.94Å; Y101-S152 WeakPolarHBondContact CB-OG 3.32Å; Y101-T155 HydrophobicContact CD2-CG2 4.22Å; Y101-T155 HydrophobicContact CE2-CG2 3.99Å; Y101-E192 WeakPolarHBondContact CE1-OE1 3.34Å
102T92.3Very high90.7Very high2 Ų218.8 Ų18.81%0.0129%0.09CC..Hα-helixtrans-58.3-44.6174.9-61.30000110.6S98 F100 G106 W145 V148 L149 S152S98-T102 VanDerWaalsContact O-CB 3.22Å; S98-T102 WeakPolarHBondContact O-CB 3.37Å; S98-T102 PolarHBondContact O-N 2.82Å; S98-T102 PolarHBondContact O-OG1 3.47Å; F100-T102 VanDerWaalsContact C-N 3.34Å; T102-G106 VanDerWaalsContact O-CA 3.27Å; T102-G106 WeakPolarHBondContact O-CA 3.21Å; T102-G106 PolarHBondContact O-N 3.22Å; T102-W145 HydrophobicContact CG2-CE3 4.24Å; T102-W145 HydrophobicContact CG2-CZ3 3.62Å; T102-V148 HydrophobicContact CG2-CG2 3.89Å; T102-L149 HydrophobicContact CG2-CD2 3.94Å; T102-S152 PolarHBondContact N-OG 2.96Å; T102-S152 VanDerWaalsContact N-OG 3.16Å; T102-S152 VanDerWaalsContact OG1-CB 3.26Å; T102-S152 WeakPolarHBondContact OG1-CB 3.25Å; T102-S152 PolarHBondContact OG1-OG 3.2Å
103N94.3Very high90.8Very high6 Ų614.3 Ų14.33%0.0327%0.072CC..Hα-helixtrans-65.9-50.5176.4176.3-99000112.1S66 D67 F70 L99 F100 Y101 Y105 G106 S107S66-N103 VanDerWaalsContact C-ND2 3.3Å; S66-N103 PolarHBondContact O-ND2 3.25Å; S66-N103 VanDerWaalsContact O-ND2 3.15Å; S66-N103 WeakPolarHBondContact OG-CA 3.45Å; S66-N103 PolarHBondContact OG-ND2 3Å; D67-N103 VanDerWaalsContact CA-ND2 3.31Å; D67-N103 WeakPolarHBondContact CA-ND2 3.34Å; D67-N103 PolarHBondContact N-ND2 2.95Å; D67-N103 PolarHBondContact OD1-ND2 2.74Å; F70-N103 HydrophobicContact CB-CB 3.5Å; F70-N103 HydrophobicContact CD1-CB 4.32Å; F70-N103 HydrophobicContact CG-CB 3.89Å; L99-N103 VanDerWaalsContact O-CB 3.25Å; L99-N103 WeakPolarHBondContact O-CB 3.29Å; L99-N103 PolarHBondContact O-N 2.97Å; F100-N103 PolarHBondContact O-N 2.86Å; Y101-N103 VanDerWaalsContact C-N 3.29Å; Y101-N103 PolarHBondContact O-N 3.16Å; N103-Y105 PolarHBondContact O-N 3.21Å; N103-G106 PolarHBondContact O-N 3.26Å; N103-S107 VanDerWaalsContact O-CB 3.26Å; N103-S107 WeakPolarHBondContact O-CB 3.5Å; N103-S107 PolarHBondContact O-N 3.07Å; N103-S107 PolarHBondContact O-OG 3.47Å
104M90.1Very high90.8Very high6 Ų614.4 Ų14.43%0.037%0.073CC..Hα-helixtrans-55.3-51.2-178.7-175.5-178.7121.200112F100 Y101 M108 F246 Y249 N250F100-M104 HydrophobicContact CZ-SD 4.37Å; F100-M104 WeakPolarHBondContact O-CB 3.3Å; F100-M104 PolarHBondContact O-N 3.39Å; Y101-M104 PolarHBondContact O-N 3.25Å; M104-M108 HydrophobicContact CE-CE 3.66Å; M104-M108 HydrophobicContact CG-CE 3.68Å; M104-M108 WeakPolarHBondContact O-CG 3.46Å; M104-M108 PolarHBondContact O-N 3.5Å; M104-M108 HydrophobicContact SD-CE 4.41Å; M104-F246 HydrophobicContact CG-CD1 4.44Å; M104-F246 HydrophobicContact CG-CE1 4.34Å; M104-Y249 HydrophobicContact CE-CD1 3.81Å; M104-Y249 HydrophobicContact CE-CE1 3.52Å; M104-Y249 HydrophobicContact SD-CD1 3.68Å; M104-Y249 HydrophobicContact SD-CE1 3.38Å; M104-Y249 WeakPolarHBondContact SD-CE1 3.35Å; M104-N250 WeakPolarHBondContact CE-OD1 3.4Å
105Y90.1Very high90.8Very high21 Ų2113.5 Ų13.58%0.0827%0.07CC..Hα-helixtrans-76.2-36.7179.6-70.4-62.5000113.6Y101 N103 S107 M108 L109 E192Y101-Y105 AromaticContact CD1-CE2 3.98Å; Y101-Y105 HydrophobicContact CD1-CE2 3.98Å; Y101-Y105 VanDerWaalsContact O-CD2 3.24Å; Y101-Y105 WeakPolarHBondContact O-CD2 3.28Å; Y101-Y105 PolarHBondContact O-N 2.94Å; N103-Y105 PolarHBondContact O-N 3.21Å; Y105-S107 VanDerWaalsContact C-N 3.32Å; Y105-S107 PolarHBondContact O-N 2.79Å; Y105-M108 HydrophobicContact CD1-SD 4.24Å; Y105-M108 HydrophobicContact CE1-SD 4.48Å; Y105-M108 PolarHBondContact O-N 2.85Å; Y105-L109 WeakPolarHBondContact O-CB 3.13Å; Y105-L109 WeakPolarHBondContact O-CG 3.36Å; Y105-L109 PolarHBondContact O-N 2.87Å; Y105-E192 WeakPolarHBondContact CE2-OE1 3.34Å; Y105-E192 VanDerWaalsContact OH-CA 3.26Å; Y105-E192 WeakPolarHBondContact OH-CA 3.49Å; Y105-E192 WeakPolarHBondContact OH-CB 2.99Å; Y105-E192 WeakPolarHBondContact OH-CG 3.49Å; Y105-E192 PolarHBondContact OH-OE1 3.49Å; Y105-E192 PolarHBondContact OH-OE2 2.85Å
106G93.6Very high90.7Very high0 Ų012 Ų120%06%0.064CC..Hα-helixtrans-57.7-48.6174.700000110.3T102 N103 M108 L109 F110T102-G106 VanDerWaalsContact O-CA 3.27Å; T102-G106 WeakPolarHBondContact O-CA 3.21Å; T102-G106 PolarHBondContact O-N 3.22Å; N103-G106 PolarHBondContact O-N 3.26Å; G106-M108 PolarHBondContact O-N 2.75Å; G106-L109 PolarHBondContact O-N 3.41Å; G106-F110 WeakPolarHBondContact O-CB 3.35Å; G106-F110 WeakPolarHBondContact O-CD2 3.39Å; G106-F110 WeakPolarHBondContact O-CG 2.98Å; G106-F110 PolarHBondContact O-N 3.29Å
107S92.9Very high90.5Very high0 Ų012.3 Ų12.30%07%0.066CC..Hα-helixtrans-63.2-43.8179.7-59.70000112.2L63 D67 N103 Y105 L109 F110 L111L63-S107 VanDerWaalsContact CD1-CA 3.45Å; L63-S107 VanDerWaalsContact CD1-OG 3.24Å; L63-S107 WeakPolarHBondContact CD1-OG 3.29Å; D67-S107 PolarHBondContact OD1-OG 3.26Å; N103-S107 VanDerWaalsContact O-CB 3.26Å; N103-S107 WeakPolarHBondContact O-CB 3.5Å; N103-S107 PolarHBondContact O-N 3.07Å; N103-S107 PolarHBondContact O-OG 3.47Å; Y105-S107 VanDerWaalsContact C-N 3.32Å; Y105-S107 PolarHBondContact O-N 2.79Å; S107-L109 PolarHBondContact O-N 3.47Å; S107-F110 PolarHBondContact O-N 2.93Å; S107-L111 VanDerWaalsContact O-CB 3.29Å; S107-L111 WeakPolarHBondContact O-CB 3.31Å; S107-L111 WeakPolarHBondContact O-CD1 3.45Å; S107-L111 WeakPolarHBondContact O-CG 3.23Å; S107-L111 PolarHBondContact O-N 3.29Å
108M91.1Very high90.4Very high0 Ų014.7 Ų14.70%07%0.074CC..Hα-helixtrans-57.4-47.9173.1-70.8179.7-154.700112.6M104 Y105 G106 T112 F196 P199 F242 F246 N250M104-M108 HydrophobicContact CE-CE 3.66Å; M104-M108 HydrophobicContact CG-CE 3.68Å; M104-M108 WeakPolarHBondContact O-CG 3.46Å; M104-M108 PolarHBondContact O-N 3.5Å; M104-M108 HydrophobicContact SD-CE 4.41Å; Y105-M108 HydrophobicContact CD1-SD 4.24Å; Y105-M108 HydrophobicContact CE1-SD 4.48Å; Y105-M108 PolarHBondContact O-N 2.85Å; G106-M108 PolarHBondContact O-N 2.75Å; M108-T112 WeakPolarHBondContact O-CB 3.39Å; M108-T112 PolarHBondContact O-N 2.98Å; M108-T112 PolarHBondContact O-OG1 3.44Å; M108-F196 HydrophobicContact CE-CD2 4.19Å; M108-F196 HydrophobicContact SD-CD2 4.03Å; M108-P199 HydrophobicContact CB-CB 4.28Å; M108-F242 HydrophobicContact CB-CE2 3.84Å; M108-F242 HydrophobicContact CB-CZ 4.45Å; M108-F242 HydrophobicContact CG-CE2 3.79Å; M108-F242 HydrophobicContact CG-CZ 4.21Å; M108-F246 HydrophobicContact CE-CB 3.87Å; M108-F246 HydrophobicContact CE-CD1 3.3Å; M108-F246 HydrophobicContact CE-CE1 3.96Å; M108-F246 HydrophobicContact CE-CG 3.67Å; M108-F246 HydrophobicContact CG-CD1 3.92Å; M108-F246 HydrophobicContact CG-CD2 3.83Å; M108-F246 HydrophobicContact CG-CE1 3.99Å; M108-F246 HydrophobicContact CG-CE2 3.94Å; M108-F246 HydrophobicContact CG-CG 3.83Å; M108-F246 HydrophobicContact CG-CZ 4.01Å; M108-F246 HydrophobicContact SD-CD1 4.41Å; M108-F246 HydrophobicContact SD-CG 4.38Å; M108-N250 VanDerWaalsContact CE-ND2 3.32Å; M108-N250 WeakPolarHBondContact CE-ND2 3.35Å
109L92.6Very high90.1Very high36 Ų3615.5 Ų15.519%0.1888%0.077CC..Hα-helixtrans-71-40.7-177.1-70.7172.6000112.1Y105 G106 S107 T112 C113 V144 L147 V148 P199Y105-L109 WeakPolarHBondContact O-CB 3.13Å; Y105-L109 WeakPolarHBondContact O-CG 3.36Å; Y105-L109 PolarHBondContact O-N 2.87Å; G106-L109 PolarHBondContact O-N 3.41Å; S107-L109 PolarHBondContact O-N 3.47Å; L109-T112 WeakPolarHBondContact O-CB 3.26Å; L109-T112 PolarHBondContact O-N 3.38Å; L109-C113 PolarHBondContact O-N 3.1Å; L109-C113 PolarHBondContact O-SG 2.8Å; L109-V144 HydrophobicContact CB-CG1 3.78Å; L109-V144 HydrophobicContact CB-CG2 4.14Å; L109-V144 HydrophobicContact CD1-CG1 4.02Å; L109-L147 HydrophobicContact CD1-CD2 3.96Å; L109-V148 HydrophobicContact CD1-CG1 3.69Å; L109-P199 HydrophobicContact CD2-CG 3.81Å
110F93.1Very high89.7Confident0 Ų015.5 Ų15.50%08%0.077CC..Hα-helixtrans-66.5-40.8176.6-71.8-52.4000112Y59 N62 L63 G106 S107 T112 C113 I114 C141 V144 W145Y59-F110 HydrophobicContact CD1-CD1 4.47Å; N62-F110 HydrophobicContact CB-CD1 4.1Å; N62-F110 HydrophobicContact CB-CD2 4.38Å; N62-F110 HydrophobicContact CB-CE1 3.54Å; N62-F110 HydrophobicContact CB-CE2 3.86Å; N62-F110 HydrophobicContact CB-CZ 3.43Å; N62-F110 VanDerWaalsContact CB-CZ 3.43Å; L63-F110 HydrophobicContact CB-CB 4.21Å; L63-F110 HydrophobicContact CB-CD2 4.48Å; L63-F110 HydrophobicContact CD1-CB 4.19Å; L63-F110 HydrophobicContact CD1-CD2 4.43Å; G106-F110 WeakPolarHBondContact O-CB 3.35Å; G106-F110 WeakPolarHBondContact O-CD2 3.39Å; G106-F110 WeakPolarHBondContact O-CG 2.98Å; G106-F110 PolarHBondContact O-N 3.29Å; S107-F110 PolarHBondContact O-N 2.93Å; F110-T112 VanDerWaalsContact C-N 3.31Å; F110-T112 PolarHBondContact O-N 3.36Å; F110-C113 WeakPolarHBondContact O-CB 3.34Å; F110-C113 PolarHBondContact O-N 3.38Å; F110-I114 WeakPolarHBondContact O-CG1 3.45Å; F110-I114 PolarHBondContact O-N 3.43Å; F110-C141 HydrophobicContact CE1-CB 4.17Å; F110-V144 HydrophobicContact CD1-CG1 4.24Å; F110-V144 HydrophobicContact CD2-CG1 4.46Å; F110-V144 HydrophobicContact CE1-CB 3.98Å; F110-V144 HydrophobicContact CE1-CG1 3.75Å; F110-V144 HydrophobicContact CE1-CG2 4.46Å; F110-V144 HydrophobicContact CE2-CG1 3.99Å; F110-V144 HydrophobicContact CZ-CB 4.11Å; F110-V144 HydrophobicContact CZ-CG1 3.58Å; F110-W145 HydrophobicContact CE2-CZ2 4.38Å; F110-W145 AromaticContact CZ-NE1 3.72Å
111L89.1Confident89.3Confident2 Ų216.2 Ų16.21%0.019%0.085CC..Hα-helixtrans-61.3-41.6172.2-70.6170.5000111.2L63 S107 C113 I114 S115 F242 F246 V294L63-L111 HydrophobicContact CD2-CD2 3.95Å; L63-L111 HydrophobicContact CD2-CG 4.25Å; S107-L111 VanDerWaalsContact O-CB 3.29Å; S107-L111 WeakPolarHBondContact O-CB 3.31Å; S107-L111 WeakPolarHBondContact O-CD1 3.45Å; S107-L111 WeakPolarHBondContact O-CG 3.23Å; S107-L111 PolarHBondContact O-N 3.29Å; L111-C113 PolarHBondContact O-N 3.03Å; L111-I114 PolarHBondContact O-N 2.91Å; L111-S115 PolarHBondContact O-N 2.88Å; L111-S115 PolarHBondContact O-OG 2.84Å; L111-F242 HydrophobicContact CD1-CD2 4.31Å; L111-F246 HydrophobicContact CD1-CE2 3.96Å; L111-V294 HydrophobicContact CD2-CG1 4.17Å; L111-V294 HydrophobicContact CD2-CG2 4.38Å
112T90.3Very high88.9Confident8 Ų816.5 Ų16.55%0.0499%0.089CC..Hα-helixtrans-59.8-45.3173-52.10000111.7M108 L109 F110 I114 S115 V116 L202 N203M108-T112 WeakPolarHBondContact O-CB 3.39Å; M108-T112 PolarHBondContact O-N 2.98Å; M108-T112 PolarHBondContact O-OG1 3.44Å; L109-T112 WeakPolarHBondContact O-CB 3.26Å; L109-T112 PolarHBondContact O-N 3.38Å; F110-T112 VanDerWaalsContact C-N 3.31Å; F110-T112 PolarHBondContact O-N 3.36Å; T112-I114 VanDerWaalsContact C-N 3.3Å; T112-I114 PolarHBondContact O-N 3.22Å; T112-S115 WeakPolarHBondContact O-CB 2.91Å; T112-S115 PolarHBondContact O-N 3.21Å; T112-S115 VanDerWaalsContact O-N 3.16Å; T112-V116 HydrophobicContact CG2-CG2 4.33Å; T112-V116 WeakPolarHBondContact O-CG2 3.3Å; T112-V116 PolarHBondContact O-N 3.46Å; T112-L202 HydrophobicContact CG2-CB 3.68Å; T112-L202 HydrophobicContact CG2-CD1 4.05Å; T112-N203 PolarHBondContact OG1-ND2 2.97Å
113C91.8Very high88.3Confident20 Ų2018 Ų1814%0.13510%0.098CC..Hα-helixtrans-61-39.7177.9-68.20000111.4Y59 L109 F110 L111 V116 D117Y59-C113 HydrophobicContact CD1-CB 3.72Å; Y59-C113 HydrophobicContact CD2-CB 4.24Å; Y59-C113 HydrophobicContact CE1-CB 3.79Å; Y59-C113 HydrophobicContact CE2-CB 4.29Å; Y59-C113 HydrophobicContact CG-CB 3.97Å; L109-C113 PolarHBondContact O-N 3.1Å; L109-C113 PolarHBondContact O-SG 2.8Å; F110-C113 WeakPolarHBondContact O-CB 3.34Å; F110-C113 PolarHBondContact O-N 3.38Å; L111-C113 PolarHBondContact O-N 3.03Å; C113-V116 PolarHBondContact O-N 3.35Å; C113-D117 WeakPolarHBondContact O-CB 3.3Å; C113-D117 PolarHBondContact O-N 3.43Å
114I88.4Confident87.7Confident1 Ų121.9 Ų21.91%0.00512%0.115CC..Hα-helixtrans-63.7-44.8174.1-66.2164000110.6T56 Y59 M60 F110 L111 T112 V116 D117 R118 H238 T298T56-I114 HydrophobicContact CG2-CG1 4.34Å; T56-I114 HydrophobicContact CG2-CG2 3.93Å; Y59-I114 HydrophobicContact CD2-CG1 4.47Å; Y59-I114 HydrophobicContact CG-CG1 4.47Å; M60-I114 HydrophobicContact CG-CD1 4.05Å; F110-I114 WeakPolarHBondContact O-CG1 3.45Å; F110-I114 PolarHBondContact O-N 3.43Å; L111-I114 PolarHBondContact O-N 2.91Å; T112-I114 VanDerWaalsContact C-N 3.3Å; T112-I114 PolarHBondContact O-N 3.22Å; I114-V116 PolarHBondContact O-N 3.41Å; I114-D117 WeakPolarHBondContact O-CB 3.22Å; I114-D117 PolarHBondContact O-N 2.99Å; I114-R118 WeakPolarHBondContact O-CG 3.35Å; I114-R118 PolarHBondContact O-N 3.33Å; I114-R118 VanDerWaalsContact O-N 3.09Å; I114-H238 WeakPolarHBondContact CG2-NE2 3.23Å; I114-T298 HydrophobicContact CG2-CG2 4.3Å
115S86.7Confident87Confident13 Ų1324.6 Ų24.69%0.09113%0.134CC..Hα-helixtrans-60.9-44.1176.2-65.90000112.5L111 T112 R118 F119 N203L111-S115 PolarHBondContact O-N 2.88Å; L111-S115 PolarHBondContact O-OG 2.84Å; T112-S115 WeakPolarHBondContact O-CB 2.91Å; T112-S115 PolarHBondContact O-N 3.21Å; T112-S115 VanDerWaalsContact O-N 3.16Å; S115-R118 PolarHBondContact O-N 3.33Å; S115-F119 WeakPolarHBondContact O-CB 3.4Å; S115-F119 PolarHBondContact O-N 2.98Å; S115-N203 VanDerWaalsContact CB-OD1 3.25Å; S115-N203 WeakPolarHBondContact CB-OD1 3.5Å; S115-N203 PolarHBondContact OG-OD1 3.23Å
116V88.1Confident86.2Confident45 Ų4531.9 Ų31.927%0.27317%0.166SC..Hα-helixtrans-66.8-42.6177.6172.70000111.4T112 C113 I114 R118 F119 L120T112-V116 HydrophobicContact CG2-CG2 4.33Å; T112-V116 WeakPolarHBondContact O-CG2 3.3Å; T112-V116 PolarHBondContact O-N 3.46Å; C113-V116 PolarHBondContact O-N 3.35Å; I114-V116 PolarHBondContact O-N 3.41Å; V116-R118 PolarHBondContact O-N 3.48Å; V116-F119 WeakPolarHBondContact O-CB 3.31Å; V116-F119 PolarHBondContact O-N 3.3Å; V116-L120 HydrophobicContact CG1-CD1 4.1Å; V116-L120 HydrophobicContact CG1-CG 4.34Å; V116-L120 WeakPolarHBondContact O-CG 3.35Å; V116-L120 PolarHBondContact O-N 3.38Å
117D87.4Confident85.5Confident6 Ų639.9 Ų39.93%0.03220%0.196CC..Hα-helixtrans-55.3-43.1175.5-179.481.3000111.3T56 Y59 C113 I114 A121 R132T56-D117 PolarHBondContact OG1-OD2 2.92Å; Y59-D117 HydrophobicContact CE2-CB 4.14Å; C113-D117 WeakPolarHBondContact O-CB 3.3Å; C113-D117 PolarHBondContact O-N 3.43Å; I114-D117 WeakPolarHBondContact O-CB 3.22Å; I114-D117 PolarHBondContact O-N 2.99Å; D117-A121 WeakPolarHBondContact O-CB 3.49Å; D117-A121 PolarHBondContact O-N 3.39Å; D117-R132 WeakPolarHBondContact OD1-CD 3.39Å; D117-R132 WeakPolarHBondContact OD1-CG 3.13Å
118R84.3Confident84.9Confident56 Ų5640.2 Ų40.221%0.21120%0.199CC..Hα-helixtrans-71.6-39.8177.2-65.4-66.5-169.5-157.12.9112.5I114 S115 V116 A121 I122 M234 T298I114-R118 WeakPolarHBondContact O-CG 3.35Å; I114-R118 PolarHBondContact O-N 3.33Å; I114-R118 VanDerWaalsContact O-N 3.09Å; S115-R118 PolarHBondContact O-N 3.33Å; V116-R118 PolarHBondContact O-N 3.48Å; R118-A121 WeakPolarHBondContact O-CB 3.25Å; R118-A121 PolarHBondContact O-N 3.38Å; R118-I122 WeakPolarHBondContact O-CD1 3.21Å; R118-I122 WeakPolarHBondContact O-CG1 3.33Å; R118-I122 PolarHBondContact O-N 3.27Å; R118-M234 HydrophobicContact CB-CE 4.03Å; R118-M234 HydrophobicContact CG-CE 3.44Å; R118-M234 VanDerWaalsContact CG-CE 3.44Å; R118-M234 HydrophobicContact CG-SD 4.35Å; R118-T298 VanDerWaalsContact NH2-CG2 3.29Å; R118-T298 PolarHBondContact NH2-O 3.31Å
119F85.1Confident84.2Confident22 Ų2248.7 Ų48.710%0.09624%0.235CC..Hα-helixtrans-57.5-51.8172.4163.6-100.8000111.8S115 V116 A121 I122 V123 H124 C206 M209 V210S115-F119 WeakPolarHBondContact O-CB 3.4Å; S115-F119 PolarHBondContact O-N 2.98Å; V116-F119 WeakPolarHBondContact O-CB 3.31Å; V116-F119 PolarHBondContact O-N 3.3Å; F119-A121 VanDerWaalsContact C-N 3.3Å; F119-A121 PolarHBondContact O-N 3.41Å; F119-I122 PolarHBondContact O-N 2.95Å; F119-V123 HydrophobicContact CD2-CB 3.92Å; F119-V123 HydrophobicContact CD2-CG2 3.48Å; F119-V123 VanDerWaalsContact CD2-CG2 3.48Å; F119-V123 HydrophobicContact CE2-CB 3.63Å; F119-V123 HydrophobicContact CE2-CG1 3.77Å; F119-V123 HydrophobicContact CE2-CG2 3.57Å; F119-V123 HydrophobicContact CG-CG2 4.44Å; F119-V123 HydrophobicContact CZ-CB 4.22Å; F119-V123 HydrophobicContact CZ-CG1 4.25Å; F119-V123 WeakPolarHBondContact O-CB 3.27Å; F119-V123 WeakPolarHBondContact O-CG2 3.47Å; F119-V123 PolarHBondContact O-N 3.45Å; F119-H124 AromaticContact CE1-CD2 3.87Å; F119-H124 AromaticContact CZ-CD2 3.62Å; F119-H124 AromaticContact CZ-NE2 3.69Å; F119-C206 HydrophobicContact CB-CB 4.14Å; F119-M209 HydrophobicContact CD2-CB 3.92Å; F119-M209 HydrophobicContact CD2-CE 3.99Å; F119-M209 HydrophobicContact CE1-CE 4.36Å; F119-M209 HydrophobicContact CE2-CB 3.64Å; F119-M209 HydrophobicContact CE2-CE 3.49Å; F119-M209 VanDerWaalsContact CE2-CE 3.49Å; F119-M209 HydrophobicContact CE2-CG 4.26Å; F119-M209 HydrophobicContact CE2-SD 3.63Å; F119-M209 HydrophobicContact CZ-CE 3.71Å; F119-M209 HydrophobicContact CZ-SD 3.93Å; F119-V210 HydrophobicContact CB-CG2 3.83Å; F119-V210 HydrophobicContact CD2-CG2 4.02Å; F119-V210 HydrophobicContact CG-CG2 4.44Å
120L84.5Confident83.7Confident36 Ų3652.8 Ų52.819%0.18826%0.255CS..Hα-helixtrans-60.6-41.3179.2-70.3174.2000111.7V116 I122 H124 S128 L131V116-L120 HydrophobicContact CG1-CD1 4.1Å; V116-L120 HydrophobicContact CG1-CG 4.34Å; V116-L120 WeakPolarHBondContact O-CG 3.35Å; V116-L120 PolarHBondContact O-N 3.38Å; L120-I122 VanDerWaalsContact C-N 3.27Å; L120-I122 PolarHBondContact O-N 3.46Å; L120-H124 CarbonylContact O-C 3.18Å; L120-H124 PolarHBondContact O-N 2.81Å; L120-S128 WeakPolarHBondContact O-CB 3.41Å; L120-L131 HydrophobicContact CD1-CD1 4.46Å; L120-L131 HydrophobicContact CD2-CD1 4.42Å
121A82.5Confident83.2Confident27 Ų2756.6 Ų56.622%0.22328%0.275CS..Hα-helixtrans-57.8-36.8178.500000113.9D117 R118 F119D117-A121 WeakPolarHBondContact O-CB 3.49Å; D117-A121 PolarHBondContact O-N 3.39Å; R118-A121 WeakPolarHBondContact O-CB 3.25Å; R118-A121 PolarHBondContact O-N 3.38Å; F119-A121 VanDerWaalsContact C-N 3.3Å; F119-A121 PolarHBondContact O-N 3.41Å
122I78.3Confident83Confident40 Ų4060.6 Ų60.621%0.20529%0.29CS..Hα-helixtrans-100.4-46.9-169.1-63.2161.9000111.1R118 F119 L120 V210 T213 L214 I231R118-I122 WeakPolarHBondContact O-CD1 3.21Å; R118-I122 WeakPolarHBondContact O-CG1 3.33Å; R118-I122 PolarHBondContact O-N 3.27Å; F119-I122 PolarHBondContact O-N 2.95Å; L120-I122 VanDerWaalsContact C-N 3.27Å; L120-I122 PolarHBondContact O-N 3.46Å; I122-V210 HydrophobicContact CD1-CG1 3.64Å; I122-V210 HydrophobicContact CG2-CG1 4.38Å; I122-T213 HydrophobicContact CG2-CG2 4.26Å; I122-L214 HydrophobicContact CG2-CD2 4.23Å; I122-L214 HydrophobicContact CG2-CG 4.48Å; I122-I231 HydrophobicContact CD1-CD1 4.2Å; I122-I231 HydrophobicContact CD1-CG2 3.43Å; I122-I231 VanDerWaalsContact CD1-CG2 3.43Å
123V80.4Confident82.9Confident33 Ų3362.5 Ų62.520%0.230%0.302CS..Hα-helixtrans-84.9-33.7-172-172.70000111.3F119 V210 T213F119-V123 HydrophobicContact CD2-CB 3.92Å; F119-V123 HydrophobicContact CD2-CG2 3.48Å; F119-V123 VanDerWaalsContact CD2-CG2 3.48Å; F119-V123 HydrophobicContact CE2-CB 3.63Å; F119-V123 HydrophobicContact CE2-CG1 3.77Å; F119-V123 HydrophobicContact CE2-CG2 3.57Å; F119-V123 HydrophobicContact CG-CG2 4.44Å; F119-V123 HydrophobicContact CZ-CB 4.22Å; F119-V123 HydrophobicContact CZ-CG1 4.25Å; F119-V123 WeakPolarHBondContact O-CB 3.27Å; F119-V123 WeakPolarHBondContact O-CG2 3.47Å; F119-V123 PolarHBondContact O-N 3.45Å; V123-V210 HydrophobicContact CG2-CG2 4.15Å; V123-T213 HydrophobicContact CG2-CG2 4.22Å; V123-T213 WeakPolarHBondContact CG2-OG1 3.31Å
124H80.6Confident82.6Confident87 Ų8765.7 Ų65.740%0.40331%0.313SS..  trans-130.461.9-176.1-62.5-63.2000113F119 L120 F126 R127 S128F119-H124 AromaticContact CE1-CD2 3.87Å; F119-H124 AromaticContact CZ-CD2 3.62Å; F119-H124 AromaticContact CZ-NE2 3.69Å; L120-H124 CarbonylContact O-C 3.18Å; L120-H124 PolarHBondContact O-N 2.81Å; H124-F126 VanDerWaalsContact C-N 3.27Å; H124-F126 PolarHBondContact O-N 3.29Å; H124-F126 VanDerWaalsContact O-N 3.14Å; H124-R127 HydrophobicContact CB-CB 4.25Å; H124-R127 PolarHBondContact O-N 3.07Å; H124-R127 VanDerWaalsContact O-N 3.17Å; H124-S128 WeakPolarHBondContact O-CB 3.25Å; H124-S128 PolarHBondContact O-N 3.46Å
125P75.6Confident82.7Confident64 Ų6474.9 Ų74.942%0.41635%0.348SS..Hα-helixtrans-59.7-31.8-172.124-34.9000114.2S128 K129P125-S128 WeakPolarHBondContact O-CB 3.44Å; P125-K129 PolarHBondContact O-N 3.48Å
126F74.9Confident82.9Confident173 Ų17376.9 Ų76.976%0.75936%0.358SS*.Hα-helixtrans-71.4-44.6177.7-62.1-71.9000112.7H124 S128H124-F126 VanDerWaalsContact C-N 3.27Å; H124-F126 PolarHBondContact O-N 3.29Å; H124-F126 VanDerWaalsContact O-N 3.14Å; F126-S128 VanDerWaalsContact C-N 3.31Å
127R77.6Confident83.2Confident168 Ų16874.8 Ų74.863%0.63435%0.345SS*.Hα-helixtrans-69.4-32.3173.6-68.1-73.6-172.91690.6111.3H124 K129 M130 L131H124-R127 HydrophobicContact CB-CB 4.25Å; H124-R127 PolarHBondContact O-N 3.07Å; H124-R127 VanDerWaalsContact O-N 3.17Å; R127-K129 VanDerWaalsContact C-N 3.28Å; R127-K129 PolarHBondContact O-N 3.35Å; R127-M130 PolarHBondContact O-N 2.95Å; R127-M130 VanDerWaalsContact O-N 3.11Å; R127-L131 HydrophobicContact CB-CD1 4.37Å; R127-L131 PolarHBondContact O-N 3.01Å
128S80.4Confident83.4Confident7 Ų782 Ų825%0.04937%0.372CS..Hα-helixtrans-55.9-40.4177.6-168.80000112.3L120 H124 P125 F126 M130 L131 R132L120-S128 WeakPolarHBondContact O-CB 3.41Å; H124-S128 WeakPolarHBondContact O-CB 3.25Å; H124-S128 PolarHBondContact O-N 3.46Å; P125-S128 WeakPolarHBondContact O-CB 3.44Å; F126-S128 VanDerWaalsContact C-N 3.31Å; S128-M130 PolarHBondContact O-N 2.92Å; S128-L131 PolarHBondContact O-N 3.39Å; S128-R132 WeakPolarHBondContact O-CA 3.22Å; S128-R132 WeakPolarHBondContact O-CB 3.42Å; S128-R132 PolarHBondContact O-N 3.39Å
129K76.7Confident84Confident178 Ų17883.9 Ų83.977%0.77439%0.385SS*.Hα-helixtrans-58.3-33.4178.2-71.9-174.8178.5-175.90113.6P125 R127P125-K129 PolarHBondContact O-N 3.48Å; R127-K129 VanDerWaalsContact C-N 3.28Å; R127-K129 PolarHBondContact O-N 3.35Å
130M81.7Confident84.5Confident122 Ų12285.4 Ų85.460%0.60140%0.396SS*.Hα-helixtrans-88.5-37.6-179.5-170.217575.100112.4R127 S128R127-M130 PolarHBondContact O-N 2.95Å; R127-M130 VanDerWaalsContact O-N 3.11Å; S128-M130 PolarHBondContact O-N 2.92Å
131L83Confident85.1Confident81 Ų8183.8 Ų83.842%0.42439%0.388SS..Hα-helixtrans-84.7-38.7-175.3-70.7170.5000113L120 R127 S128 T133 N136L120-L131 HydrophobicContact CD1-CD1 4.46Å; L120-L131 HydrophobicContact CD2-CD1 4.42Å; R127-L131 HydrophobicContact CB-CD1 4.37Å; R127-L131 PolarHBondContact O-N 3.01Å; S128-L131 PolarHBondContact O-N 3.39Å; L131-T133 VanDerWaalsContact C-N 3.27Å; L131-T133 PolarHBondContact O-N 3.48Å; L131-N136 WeakPolarHBondContact O-CB 3.24Å; L131-N136 PolarHBondContact O-ND2 3.39Å
132R85.4Confident85.8Confident85 Ų8586.9 Ų86.932%0.32140%0.404SS..  trans-8767.2-173.2-152.8-174.776.9-164.1-4.7110.8E55 D117 S128E55-R132 HydrophobicContact CB-CG 3.9Å; E55-R132 VanDerWaalsContact CD-O 3.26Å; E55-R132 HydrophobicContact CG-CG 3.81Å; E55-R132 WeakPolarHBondContact CG-O 3.49Å; E55-R132 IonicContact OE2-CZ 2.68Å; E55-R132 IonicContact OE2-NE 2.63Å; E55-R132 PolarHBondContact OE2-NE 3.36Å; E55-R132 VanDerWaalsContact OE2-NE 3.13Å; E55-R132 IonicContact OE2-NH2 3.17Å; D117-R132 WeakPolarHBondContact OD1-CD 3.39Å; D117-R132 WeakPolarHBondContact OD1-CG 3.13Å; S128-R132 WeakPolarHBondContact O-CA 3.22Å; S128-R132 WeakPolarHBondContact O-CB 3.42Å; S128-R132 PolarHBondContact O-N 3.39Å
133T87.1Confident86.6Confident48 Ų4887.8 Ų87.829%0.29442%0.417SS..  trans-110.9152.3174.472.40000110.7L131 R135 N136 A137L131-T133 VanDerWaalsContact C-N 3.27Å; L131-T133 PolarHBondContact O-N 3.48Å; T133-R135 PolarHBondContact O-N 2.98Å; T133-N136 PolarHBondContact O-N 3.19Å; T133-N136 VanDerWaalsContact O-N 3.16Å; T133-N136 WeakPolarHBondContact OG1-CB 3.13Å; T133-N136 PolarHBondContact OG1-N 3.13Å; T133-N136 PolarHBondContact OG1-ND2 2.89Å; T133-N136 PolarHBondContact OG1-OD1 3.42Å; T133-A137 PolarHBondContact O-N 3.4Å
134K86.9Confident87.4Confident87 Ų8786.8 Ų86.838%0.37841%0.411SS..Hα-helixtrans-58.2-34.4176.5-57.8-176.1-162.3-168.90112.5R53 R138R53-K134 WeakPolarHBondContact O-CD 3.38Å; R53-K134 WeakPolarHBondContact O-CE 3.44Å; R53-K134 PolarHBondContact O-NZ 3.44Å; K134-R138 WeakPolarHBondContact O-CG 3.26Å; K134-R138 PolarHBondContact O-N 3.48Å
135R90.1Very high88.2Confident194 Ų19484.7 Ų84.773%0.73240%0.4SS*.Hα-helixtrans-62.9-50.8176.4-177.2179.5179.2-179.8-0110.4T133 A137 R138 I139T133-R135 PolarHBondContact O-N 2.98Å; R135-A137 VanDerWaalsContact C-N 3.35Å; R135-A137 PolarHBondContact O-N 2.01Å; R135-R138 PolarHBondContact O-N 2.95Å; R135-I139 HydrophobicContact CG-CD1 4.01Å; R135-I139 WeakPolarHBondContact O-CG1 3.11Å; R135-I139 PolarHBondContact O-N 3.44Å
136N91.5Very high89.1Confident55 Ų5586.1 Ų86.129%0.29441%0.407SS..Hα-helixtrans-63.5-42.1179.4-64.4-7.4000111.1L131 T133 R138 I139 V140L131-N136 WeakPolarHBondContact O-CB 3.24Å; L131-N136 PolarHBondContact O-ND2 3.39Å; T133-N136 PolarHBondContact O-N 3.19Å; T133-N136 VanDerWaalsContact O-N 3.16Å; T133-N136 WeakPolarHBondContact OG1-CB 3.13Å; T133-N136 PolarHBondContact OG1-N 3.13Å; T133-N136 PolarHBondContact OG1-ND2 2.89Å; T133-N136 PolarHBondContact OG1-OD1 3.42Å; N136-R138 VanDerWaalsContact C-N 3.32Å; N136-R138 PolarHBondContact O-N 2.93Å; N136-I139 PolarHBondContact O-N 2.87Å; N136-V140 WeakPolarHBondContact O-CG2 3.45Å; N136-V140 PolarHBondContact O-N 3.45Å
137A92.5Very high90Very high2 Ų283 Ų832%0.01740%0.398CS..Hα-helixtrans-59.5-41.1176.300000112.5E55 T58 Y59 T133 R135 V140 C141E55-A137 HydrophobicContact CB-CB 4.15Å; T58-A137 HydrophobicContact CG2-CB 4.4Å; Y59-A137 HydrophobicContact CE1-CB 4.24Å; Y59-A137 HydrophobicContact CE2-CB 4.28Å; Y59-A137 WeakPolarHBondContact OH-CA 3.36Å; T133-A137 PolarHBondContact O-N 3.4Å; R135-A137 VanDerWaalsContact C-N 3.35Å; R135-A137 PolarHBondContact O-N 2.01Å; A137-V140 PolarHBondContact O-N 2.69Å; A137-C141 PolarHBondContact O-N 3.25Å; A137-C141 PolarHBondContact O-SG 3.29Å
138R93.5Very high90.7Very high157 Ų15775.3 Ų75.359%0.59237%0.369SS*.Hα-helixtrans-64.7-44.2174-73.5177.8-172.6176.41.2112.2T58 K134 R135 N136 V140 C141 V142T58-R138 HydrophobicContact CG2-CG 4.11Å; K134-R138 WeakPolarHBondContact O-CG 3.26Å; K134-R138 PolarHBondContact O-N 3.48Å; R135-R138 PolarHBondContact O-N 2.95Å; N136-R138 VanDerWaalsContact C-N 3.32Å; N136-R138 PolarHBondContact O-N 2.93Å; R138-V140 VanDerWaalsContact C-N 3.31Å; R138-V140 PolarHBondContact O-N 2.89Å; R138-C141 PolarHBondContact O-N 2.84Å; R138-V142 WeakPolarHBondContact O-CG2 3.35Å; R138-V142 PolarHBondContact O-N 3.22Å
139I95.6Very high91.2Very high95 Ų9577.9 Ų77.949%0.48738%0.382SS..Hα-helixtrans-59-45.8176.9-67.7166.1000110.1R135 N136 C141 V142 A143R135-I139 HydrophobicContact CG-CD1 4.01Å; R135-I139 WeakPolarHBondContact O-CG1 3.11Å; R135-I139 PolarHBondContact O-N 3.44Å; N136-I139 PolarHBondContact O-N 2.87Å; I139-C141 PolarHBondContact O-N 3.49Å; I139-V142 PolarHBondContact O-N 2.87Å; I139-A143 WeakPolarHBondContact O-CB 3.38Å; I139-A143 PolarHBondContact O-N 2.97Å
140V95.8Very high91.8Very high54 Ų5472.7 Ų72.733%0.32737%0.369SS..Hα-helixtrans-61.3-43.5175.9172.90000111Y59 N136 A137 R138 V142 A143 V144Y59-V140 HydrophobicContact CE1-CB 4.07Å; Y59-V140 HydrophobicContact CE1-CG1 3.82Å; N136-V140 WeakPolarHBondContact O-CG2 3.45Å; N136-V140 PolarHBondContact O-N 3.45Å; A137-V140 PolarHBondContact O-N 2.69Å; R138-V140 VanDerWaalsContact C-N 3.31Å; R138-V140 PolarHBondContact O-N 2.89Å; V140-V142 PolarHBondContact O-N 2.95Å; V140-A143 PolarHBondContact O-N 2.95Å; V140-V144 HydrophobicContact CG1-CG2 4.4Å; V140-V144 WeakPolarHBondContact O-CG2 3.44Å; V140-V144 PolarHBondContact O-N 3.27Å
141C96.5Very high91.9Very high3 Ų368.4 Ų68.42%0.0236%0.355CS..Hα-helixtrans-61.3-44176.7-66.20000112.1Y59 N62 F110 A137 R138 I139 A143 V144 W145Y59-C141 WeakPolarHBondContact CD1-SG 3.5Å; N62-C141 PolarHBondContact ND2-SG 3.41Å; F110-C141 HydrophobicContact CE1-CB 4.17Å; A137-C141 PolarHBondContact O-N 3.25Å; A137-C141 PolarHBondContact O-SG 3.29Å; R138-C141 PolarHBondContact O-N 2.84Å; I139-C141 PolarHBondContact O-N 3.49Å; C141-A143 VanDerWaalsContact C-N 3.33Å; C141-A143 PolarHBondContact O-N 3.14Å; C141-V144 PolarHBondContact O-N 2.88Å; C141-W145 PolarHBondContact O-N 3.3Å
142V97.3Very high92Very high92 Ų9264.7 Ų64.756%0.55834%0.336SS*.Hα-helixtrans-61.5-43.8175.6171.90000110.5R138 I139 V140 V144 W145 V146R138-V142 WeakPolarHBondContact O-CG2 3.35Å; R138-V142 PolarHBondContact O-N 3.22Å; I139-V142 PolarHBondContact O-N 2.87Å; V140-V142 PolarHBondContact O-N 2.95Å; V142-V144 PolarHBondContact O-N 3.25Å; V142-W145 PolarHBondContact O-N 3.01Å; V142-V146 HydrophobicContact CG1-CG2 4.35Å; V142-V146 VanDerWaalsContact O-CG2 3.31Å; V142-V146 WeakPolarHBondContact O-CG2 3.44Å; V142-V146 PolarHBondContact O-N 3.33Å
143A96.7Very high91.9Very high58 Ų5864.2 Ų64.248%0.47934%0.339SS..Hα-helixtrans-61.7-42.4176.800000112.2I139 V140 C141 V146 L147I139-A143 WeakPolarHBondContact O-CB 3.38Å; I139-A143 PolarHBondContact O-N 2.97Å; V140-A143 PolarHBondContact O-N 2.95Å; C141-A143 VanDerWaalsContact C-N 3.33Å; C141-A143 PolarHBondContact O-N 3.14Å; A143-V146 PolarHBondContact O-N 3.13Å; A143-L147 WeakPolarHBondContact O-CB 3.38Å; A143-L147 PolarHBondContact O-N 3.24Å
144V96Very high91.6Very high12 Ų1265 Ų657%0.07335%0.345CS..Hα-helixtrans-59.8-50.5174.1169.60000110.2L109 F110 V140 C141 V142 V146 L147 V148L109-V144 HydrophobicContact CB-CG1 3.78Å; L109-V144 HydrophobicContact CB-CG2 4.14Å; L109-V144 HydrophobicContact CD1-CG1 4.02Å; F110-V144 HydrophobicContact CD1-CG1 4.24Å; F110-V144 HydrophobicContact CD2-CG1 4.46Å; F110-V144 HydrophobicContact CE1-CB 3.98Å; F110-V144 HydrophobicContact CE1-CG1 3.75Å; F110-V144 HydrophobicContact CE1-CG2 4.46Å; F110-V144 HydrophobicContact CE2-CG1 3.99Å; F110-V144 HydrophobicContact CZ-CB 4.11Å; F110-V144 HydrophobicContact CZ-CG1 3.58Å; V140-V144 HydrophobicContact CG1-CG2 4.4Å; V140-V144 WeakPolarHBondContact O-CG2 3.44Å; V140-V144 PolarHBondContact O-N 3.27Å; C141-V144 PolarHBondContact O-N 2.88Å; V142-V144 PolarHBondContact O-N 3.25Å; V144-V146 PolarHBondContact O-N 3.4Å; V144-L147 PolarHBondContact O-N 3.28Å; V144-V148 HydrophobicContact CG1-CG1 4.37Å; V144-V148 WeakPolarHBondContact O-CG1 3.24Å; V144-V148 WeakPolarHBondContact O-CG2 3.08Å; V144-V148 PolarHBondContact O-N 3.31Å
145W97.1Very high90.9Very high44 Ų4462.1 Ų62.117%0.16734%0.335CS..Hα-helixtrans-57-47.9177.9-83.1115.3000112.8N62 V65 L69 T102 F110 C141 V142 L147 V148 L149N62-W145 PolarHBondContact OD1-NE1 3.2Å; V65-W145 HydrophobicContact CG1-CH2 4.49Å; V65-W145 HydrophobicContact CG1-CZ2 4.16Å; L69-W145 HydrophobicContact CD1-CH2 4.07Å; T102-W145 HydrophobicContact CG2-CE3 4.24Å; T102-W145 HydrophobicContact CG2-CZ3 3.62Å; F110-W145 HydrophobicContact CE2-CZ2 4.38Å; F110-W145 AromaticContact CZ-NE1 3.72Å; C141-W145 PolarHBondContact O-N 3.3Å; V142-W145 PolarHBondContact O-N 3.01Å; W145-L147 VanDerWaalsContact C-N 3.33Å; W145-L147 PolarHBondContact O-N 3.47Å; W145-V148 HydrophobicContact CE3-CG2 4.22Å; W145-V148 WeakPolarHBondContact O-CG2 3.36Å; W145-V148 PolarHBondContact O-N 2.81Å; W145-L149 HydrophobicContact CE3-CD1 4.17Å; W145-L149 HydrophobicContact CE3-CG 4.27Å; W145-L149 VanDerWaalsContact O-CB 3.23Å; W145-L149 WeakPolarHBondContact O-CB 3.44Å; W145-L149 WeakPolarHBondContact O-CG 3.26Å; W145-L149 PolarHBondContact O-N 2.89Å
146V96Very high90.1Very high94 Ų9452.9 Ų52.957%0.5730%0.3SS*.Hα-helixtrans-59-47177.3169.90000110.3V142 A143 V144 S150V142-V146 HydrophobicContact CG1-CG2 4.35Å; V142-V146 VanDerWaalsContact O-CG2 3.31Å; V142-V146 WeakPolarHBondContact O-CG2 3.44Å; V142-V146 PolarHBondContact O-N 3.33Å; A143-V146 PolarHBondContact O-N 3.13Å; V144-V146 PolarHBondContact O-N 3.4Å; V146-S150 WeakPolarHBondContact O-CB 3Å; V146-S150 PolarHBondContact O-N 3.31Å; V146-S150 PolarHBondContact O-OG 2.84Å; V146-S150 VanDerWaalsContact O-OG 3.12Å
147L92Very high89.1Confident108 Ų10856.4 Ų56.457%0.56531%0.313SS*.Hα-helixtrans-60.2-52.7179.7-17665.5000111.4L109 A143 V144 W145 L149 S150 G151L109-L147 HydrophobicContact CD1-CD2 3.96Å; A143-L147 WeakPolarHBondContact O-CB 3.38Å; A143-L147 PolarHBondContact O-N 3.24Å; V144-L147 PolarHBondContact O-N 3.28Å; W145-L147 VanDerWaalsContact C-N 3.33Å; W145-L147 PolarHBondContact O-N 3.47Å; L147-L149 PolarHBondContact O-N 3.15Å; L147-S150 PolarHBondContact O-N 2.87Å; L147-S150 PolarHBondContact O-OG 3.37Å; L147-G151 PolarHBondContact O-N 3.34Å
148V92.5Very high87.9Confident6 Ų661.2 Ų61.24%0.03634%0.338CS..Hα-helixtrans-69-37.7-175.7-590000112.4T102 L109 V144 W145 G151 S152T102-V148 HydrophobicContact CG2-CG2 3.89Å; L109-V148 HydrophobicContact CD1-CG1 3.69Å; V144-V148 HydrophobicContact CG1-CG1 4.37Å; V144-V148 WeakPolarHBondContact O-CG1 3.24Å; V144-V148 WeakPolarHBondContact O-CG2 3.08Å; V144-V148 PolarHBondContact O-N 3.31Å; W145-V148 HydrophobicContact CE3-CG2 4.22Å; W145-V148 WeakPolarHBondContact O-CG2 3.36Å; W145-V148 PolarHBondContact O-N 2.81Å; V148-G151 PolarHBondContact O-N 3.33Å; V148-S152 WeakPolarHBondContact O-CB 3.38Å; V148-S152 PolarHBondContact O-N 3.46Å; V148-S152 PolarHBondContact O-OG 3.26Å
149L92.1Very high86.6Confident60 Ų6055.3 Ų55.331%0.31432%0.318SS..Hα-helixtrans-69-40.3176.5-70.4170.8000111T102 W145 L147 G151 S152 L153T102-L149 HydrophobicContact CG2-CD2 3.94Å; W145-L149 HydrophobicContact CE3-CD1 4.17Å; W145-L149 HydrophobicContact CE3-CG 4.27Å; W145-L149 VanDerWaalsContact O-CB 3.23Å; W145-L149 WeakPolarHBondContact O-CB 3.44Å; W145-L149 WeakPolarHBondContact O-CG 3.26Å; W145-L149 PolarHBondContact O-N 2.89Å; L147-L149 PolarHBondContact O-N 3.15Å; L149-G151 VanDerWaalsContact C-N 3.26Å; L149-G151 PolarHBondContact O-N 2.83Å; L149-S152 PolarHBondContact O-N 3.36Å; L149-L153 HydrophobicContact CB-CD1 4.22Å; L149-L153 VanDerWaalsContact O-CB 3.29Å; L149-L153 WeakPolarHBondContact O-CB 3.4Å; L149-L153 VanDerWaalsContact O-CG 3.29Å; L149-L153 WeakPolarHBondContact O-CG 3.42Å; L149-L153 PolarHBondContact O-N 3.4Å
150S89.3Confident85.2Confident70 Ų7054.6 Ų54.649%0.4932%0.316SS..Hα-helixtrans-62.2-32177.872.60000113V146 L147 P154V146-S150 WeakPolarHBondContact O-CB 3Å; V146-S150 PolarHBondContact O-N 3.31Å; V146-S150 PolarHBondContact O-OG 2.84Å; V146-S150 VanDerWaalsContact O-OG 3.12Å; L147-S150 PolarHBondContact O-N 2.87Å; L147-S150 PolarHBondContact O-OG 3.37Å; S150-P154 WeakPolarHBondContact O-CD 3.43Å; S150-P154 WeakPolarHBondContact O-CG 3.35Å
151G82.8Confident83.8Confident31 Ų3153.2 Ų53.232%0.3231%0.308SS..Hα-helixtrans-83.5-38.1174.100000113.7L147 V148 L149 T155L147-G151 PolarHBondContact O-N 3.34Å; V148-G151 PolarHBondContact O-N 3.33Å; L149-G151 VanDerWaalsContact C-N 3.26Å; L149-G151 PolarHBondContact O-N 2.83Å; G151-T155 PolarHBondContact O-OG1 2.87Å
152S85.2Confident82.4Confident3 Ų355.9 Ų55.92%0.02133%0.325CS..Hα-helixtrans-83.3-32.1-171.3-54.80000113.8S98 Y101 T102 V148 L149 G156S98-S152 WeakPolarHBondContact O-CB 3.25Å; S98-S152 PolarHBondContact OG-O 2.65Å; Y101-S152 WeakPolarHBondContact CB-OG 3.32Å; T102-S152 PolarHBondContact N-OG 2.96Å; T102-S152 VanDerWaalsContact N-OG 3.16Å; T102-S152 VanDerWaalsContact OG1-CB 3.26Å; T102-S152 WeakPolarHBondContact OG1-CB 3.25Å; T102-S152 PolarHBondContact OG1-OG 3.2Å; V148-S152 WeakPolarHBondContact O-CB 3.38Å; V148-S152 PolarHBondContact O-N 3.46Å; V148-S152 PolarHBondContact O-OG 3.26Å; L149-S152 PolarHBondContact O-N 3.36Å; S152-G156 PolarHBondContact O-N 3.43Å
153L84.4Confident80.8Confident75 Ų7556.1 Ų56.139%0.39333%0.326SS..Hα-helixtrans-67.6-51.5179.5-69.6172.7000112L149 T155 G156 F157L149-L153 HydrophobicContact CB-CD1 4.22Å; L149-L153 VanDerWaalsContact O-CB 3.29Å; L149-L153 WeakPolarHBondContact O-CB 3.4Å; L149-L153 VanDerWaalsContact O-CG 3.29Å; L149-L153 WeakPolarHBondContact O-CG 3.42Å; L149-L153 PolarHBondContact O-N 3.4Å; L153-T155 PolarHBondContact O-N 3.07Å; L153-G156 PolarHBondContact O-N 2.8Å; L153-F157 HydrophobicContact CB-CD2 4.45Å; L153-F157 HydrophobicContact CB-CE2 4.33Å; L153-F157 WeakPolarHBondContact O-CD2 3.38Å; L153-F157 PolarHBondContact O-N 3.15Å
154P81Confident79.2Confident65 Ų6558.1 Ų58.142%0.42232%0.324SS..Hα-helixtrans-58.7-40177.7-2435.4000111.9S150 G156 F157 L158S150-P154 WeakPolarHBondContact O-CD 3.43Å; S150-P154 WeakPolarHBondContact O-CG 3.35Å; P154-G156 VanDerWaalsContact C-N 3.34Å; P154-G156 PolarHBondContact O-N 3.3Å; P154-F157 PolarHBondContact O-N 2.98Å; P154-L158 WeakPolarHBondContact O-CB 3.13Å; P154-L158 WeakPolarHBondContact O-CG 3.02Å; P154-L158 PolarHBondContact O-N 3.32Å
155T72.3Confident77.4Confident27 Ų2763.7 Ų63.717%0.16636%0.364CS..Hα-helixtrans-60-43.9175.9-55.60000111.3Y101 G151 L153 L158 L159Y101-T155 HydrophobicContact CD2-CG2 4.22Å; Y101-T155 HydrophobicContact CE2-CG2 3.99Å; G151-T155 PolarHBondContact O-OG1 2.87Å; L153-T155 PolarHBondContact O-N 3.07Å; T155-L158 PolarHBondContact O-N 2.91Å; T155-L159 HydrophobicContact CG2-CD1 3.78Å; T155-L159 WeakPolarHBondContact O-CB 3.33Å; T155-L159 WeakPolarHBondContact O-CD1 3.32Å; T155-L159 WeakPolarHBondContact O-CG 3.21Å; T155-L159 PolarHBondContact O-N 3.36Å; T155-L159 VanDerWaalsContact O-N 3.15Å
156G71.6Confident75.8Confident0 Ų068 Ų680%039%0.39CS..Hα-helixtrans-63.1-45.7174.100000113.2Q94 S98 S152 L153 P154 L158 L159Q94-G156 WeakPolarHBondContact CG-O 3.37Å; S98-G156 WeakPolarHBondContact OG-CA 3.29Å; S152-G156 PolarHBondContact O-N 3.43Å; L153-G156 PolarHBondContact O-N 2.8Å; P154-G156 VanDerWaalsContact C-N 3.34Å; P154-G156 PolarHBondContact O-N 3.3Å; G156-L158 VanDerWaalsContact C-N 3.32Å; G156-L158 PolarHBondContact O-N 3.42Å; G156-L159 CarbonylContact O-C 3.44Å; G156-L159 PolarHBondContact O-N 3.28Å; G156-L159 VanDerWaalsContact O-N 3.13Å
157F71Confident74.4Confident129 Ų12966.1 Ų66.157%0.56639%0.39SS*.Hα-helixtrans-63.2-36.3178.7-77.8-66.9000113.3Q94 L153 P154 L159Q94-F157 VanDerWaalsContact OE1-CD1 3.24Å; Q94-F157 VanDerWaalsContact OE1-CE1 3.28Å; L153-F157 HydrophobicContact CB-CD2 4.45Å; L153-F157 HydrophobicContact CB-CE2 4.33Å; L153-F157 WeakPolarHBondContact O-CD2 3.38Å; L153-F157 PolarHBondContact O-N 3.15Å; P154-F157 PolarHBondContact O-N 2.98Å; F157-L159 VanDerWaalsContact C-N 3.3Å
158L68.2Low73.4Confident102 Ų10264.4 Ų64.453%0.53438%0.381SS..Hα-helixtrans-70.6-28.3176.1-70.2169.5000112.3P154 T155 G156 N160 L184P154-L158 WeakPolarHBondContact O-CB 3.13Å; P154-L158 WeakPolarHBondContact O-CG 3.02Å; P154-L158 PolarHBondContact O-N 3.32Å; T155-L158 PolarHBondContact O-N 2.91Å; G156-L158 VanDerWaalsContact C-N 3.32Å; G156-L158 PolarHBondContact O-N 3.42Å; L158-N160 PolarHBondContact O-N 3.25Å; L158-L184 HydrophobicContact CD1-CD2 4.02Å
159L65.4Low72.7Confident33 Ų3365.3 Ų65.317%0.17339%0.386CS..SBendtrans-95.368.5179.3-62.2172000109.5V97 T155 G156 F157 F175V97-L159 HydrophobicContact CG1-CB 4.44Å; V97-L159 HydrophobicContact CG1-CD1 3.79Å; T155-L159 HydrophobicContact CG2-CD1 3.78Å; T155-L159 WeakPolarHBondContact O-CB 3.33Å; T155-L159 WeakPolarHBondContact O-CD1 3.32Å; T155-L159 WeakPolarHBondContact O-CG 3.21Å; T155-L159 PolarHBondContact O-N 3.36Å; T155-L159 VanDerWaalsContact O-N 3.15Å; G156-L159 CarbonylContact O-C 3.44Å; G156-L159 PolarHBondContact O-N 3.28Å; G156-L159 VanDerWaalsContact O-N 3.13Å; F157-L159 VanDerWaalsContact C-N 3.3Å; L159-F175 HydrophobicContact CB-CD1 4.25Å; L159-F175 HydrophobicContact CB-CE1 3.51Å; L159-F175 HydrophobicContact CB-CZ 3.94Å; L159-F175 HydrophobicContact CD1-CZ 4.31Å; L159-F175 HydrophobicContact CD2-CB 4.49Å; L159-F175 HydrophobicContact CD2-CD1 3.26Å; L159-F175 HydrophobicContact CD2-CD2 3.95Å; L159-F175 HydrophobicContact CD2-CE1 3.29Å; L159-F175 HydrophobicContact CD2-CE2 3.95Å; L159-F175 HydrophobicContact CD2-CG 3.61Å; L159-F175 HydrophobicContact CD2-CZ 3.64Å; L159-F175 HydrophobicContact CG-CD1 4.3Å; L159-F175 HydrophobicContact CG-CE1 3.89Å; L159-F175 HydrophobicContact CG-CZ 4.14Å
160N65.8Low72Confident81 Ų8163.6 Ų63.643%0.43338%0.377SS..  trans-79.2155.2178.8-159.411.9000112.1Q94 L158Q94-N160 PolarHBondContact NE2-OD1 2.96Å; L158-N160 PolarHBondContact O-N 3.25Å
161S67.8Low71.2Confident25 Ų2560.3 Ų60.318%0.17535%0.353CS..  trans-63.5135.8174.156.60000111G90 F170G90-S161 WeakPolarHBondContact CA-OG 3.23Å; S161-F170 CarbonylContact C-O 3.58Å; S161-F170 WeakPolarHBondContact CA-O 3.37Å
162T65.7Low70.6Confident59 Ų5960.5 Ų60.536%0.36235%0.346SS..EExtended strand (participates in β ladder)trans-111.3124.6177.438.90000110.6F170T162-F170 PolarHBondContact N-O 2.79Å; T162-F170 PolarHBondContact O-N 2.65Å
163T64.6Low69.5Low97 Ų9761.6 Ų61.660%0.59535%0.35SS*.EExtended strand (participates in β ladder)trans-92.5124.4174.1-53.70000109T169T163-T169 PolarHBondContact OG1-OG1 2.72Å
164K63.6Low68.1Low100 Ų10062.1 Ų62.144%0.43535%0.354SS..  trans-82.8162.2173.1-84.2-166.4173.9-1730111.1D166 G167 N168 F170K164-D166 PolarHBondContact O-N 3.49Å; K164-D166 VanDerWaalsContact O-N 3.09Å; K164-G167 PolarHBondContact O-N 3Å; K164-N168 PolarHBondContact N-O 2.79Å; K164-F170 HydrophobicContact CB-CE2 4.35Å; K164-F170 HydrophobicContact CD-CD2 4.45Å; K164-F170 HydrophobicContact CD-CE2 3.88Å; K164-F170 HydrophobicContact CG-CD2 4.25Å; K164-F170 HydrophobicContact CG-CE2 4.06Å
165S57.1Low66.9Low129 Ų12962.4 Ų62.490%0.90235%0.348SS*.THydrogen-bonded Turntrans-57.1-23.1175.7-152.40000113.6G167S165-G167 PolarHBondContact O-N 3.07Å
166D63.2Low65.9Low135 Ų13563.6 Ų63.672%0.72236%0.358SS*.THydrogen-bonded Turntrans-81.46.2178.8-47.3-24.8000113.1K164 N168K164-D166 PolarHBondContact O-N 3.49Å; K164-D166 VanDerWaalsContact O-N 3.09Å; D166-N168 VanDerWaalsContact C-N 3.3Å; D166-N168 PolarHBondContact O-N 3.33Å
167G66.2Low64.8Low54 Ų5467.3 Ų67.356%0.55738%0.383SS*.SBendtrans84.4-13.5178.900000115.6K164 S165K164-G167 PolarHBondContact O-N 3Å; S165-G167 PolarHBondContact O-N 3.07Å
168N72.1Confident63.7Low72 Ų7266.5 Ų66.539%0.38539%0.389SS..  trans-77.2135.9178.2-72-20.2000112.3K164 D166 F170K164-N168 PolarHBondContact N-O 2.79Å; D166-N168 VanDerWaalsContact C-N 3.3Å; D166-N168 PolarHBondContact O-N 3.33Å; N168-F170 HydrophobicContact CB-CE2 3.86Å; N168-F170 HydrophobicContact CB-CZ 4.21Å
169T77.4Confident62.8Low25 Ų2565.4 Ų65.415%0.15339%0.387CS..EExtended strand (participates in β ladder)trans-104.8127.6178.8-60.10000111N85 W86 T163N85-T169 PolarHBondContact OD1-N 2.88Å; W86-T169 HydrophobicContact CB-CG2 4.31Å; W86-T169 WeakPolarHBondContact CB-O 3.38Å; W86-T169 PolarHBondContact N-O 3.26Å; W86-T169 WeakPolarHBondContact O-CB 3.47Å; T163-T169 PolarHBondContact OG1-OG1 2.72Å
170F77.2Confident62.2Low24 Ų2466.8 Ų66.811%0.10539%0.39CS..EExtended strand (participates in β ladder)trans-110.2137.4-178.5-64.2-92.8000110.7Y80 S161 T162 K164 N168Y80-F170 HydrophobicContact CE2-CD1 4.43Å; Y80-F170 WeakPolarHBondContact OH-CD1 3.44Å; S161-F170 CarbonylContact C-O 3.58Å; S161-F170 WeakPolarHBondContact CA-O 3.37Å; T162-F170 PolarHBondContact N-O 2.79Å; T162-F170 PolarHBondContact O-N 2.65Å; K164-F170 HydrophobicContact CB-CE2 4.35Å; K164-F170 HydrophobicContact CD-CD2 4.45Å; K164-F170 HydrophobicContact CD-CE2 3.88Å; K164-F170 HydrophobicContact CG-CD2 4.25Å; K164-F170 HydrophobicContact CG-CE2 4.06Å; N168-F170 HydrophobicContact CB-CE2 3.86Å; N168-F170 HydrophobicContact CB-CZ 4.21Å
171C73.6Confident61.5Low0 Ų070.7 Ų70.70%040%0.403CS..SBendtrans-117.5-39.3-177.8170.10000113.4W86 C93W86-C171 HydrophobicContact CB-CB 4.12Å; W86-C171 HydrophobicContact CD2-CB 3.69Å; W86-C171 HydrophobicContact CE3-CB 3.95Å; W86-C171 HydrophobicContact CG-CB 3.75Å; C93-C171 WeakPolarHBondContact CA-SG 3.2Å; C93-C171 HydrophobicContact CB-CB 3.82Å; C93-C171 WeakPolarHBondContact CB-SG 3.27Å; C93-C171 WeakPolarHBondContact SG-CA 3.27Å; C93-C171 WeakPolarHBondContact SG-CB 3.07Å; C93-C171 CovalentContact SG-SG 2.01Å; C93-C171 PolarHBondContact SG-SG 2.87Å
172F69.2Low60.9Low36 Ų3672.7 Ų72.716%0.15842%0.417CS..SBendtrans-104.81.4-175.1-54.3-69.6000113.5R77 Y80 F81 W86 V97R77-F172 HydrophobicContact CB-CE2 4.5Å; R77-F172 HydrophobicContact CG-CE1 4.3Å; R77-F172 HydrophobicContact CG-CE2 3.87Å; R77-F172 HydrophobicContact CG-CZ 3.59Å; Y80-F172 AromaticContact CD1-CD2 3.54Å; Y80-F172 HydrophobicContact CD1-CD2 3.54Å; Y80-F172 HydrophobicContact CD1-CE2 4.13Å; Y80-F172 HydrophobicContact CE1-CB 4.29Å; Y80-F172 AromaticContact CE1-CD2 3.78Å; Y80-F172 HydrophobicContact CE1-CD2 3.78Å; Y80-F172 AromaticContact CG-CD2 3.96Å; Y80-F172 HydrophobicContact CG-CD2 3.96Å; Y80-F172 HydrophobicContact CG-CE2 4.17Å; F81-F172 HydrophobicContact CZ-CB 4.43Å; F81-F172 HydrophobicContact CZ-CD2 4.28Å; W86-F172 AromaticContact CE3-CE2 3.86Å; W86-F172 HydrophobicContact CE3-CE2 3.86Å; W86-F172 HydrophobicContact CE3-CZ 4.39Å; W86-F172 HydrophobicContact CH2-CE2 4.37Å; W86-F172 HydrophobicContact CH2-CZ 4.15Å; W86-F172 AromaticContact CZ3-CE2 3.54Å; W86-F172 HydrophobicContact CZ3-CE2 3.54Å; W86-F172 AromaticContact CZ3-CZ 3.76Å; W86-F172 HydrophobicContact CZ3-CZ 3.76Å; V97-F172 HydrophobicContact CG2-CD1 3.85Å; V97-F172 HydrophobicContact CG2-CE1 3.7Å
173E61.5Low60.4Low25 Ų2576.7 Ų76.712%0.11743%0.431CS..SBendtrans-140.9162.5-170.5-61.2-177.8120.600110.4K20 Y21 Y80K20-E173 WeakPolarHBondContact CE-OE1 3.2Å; K20-E173 IonicContact NZ-OE1 3.87Å; K20-E173 PolarHBondContact NZ-OE1 2.71Å; Y21-E173 PolarHBondContact OH-OE1 2.93Å; Y21-E173 PolarHBondContact OH-OE2 3.36Å; Y80-E173 PolarHBondContact OH-OE2 3.39Å
174N55.4Low60.1Low87 Ų8775.6 Ų75.647%0.46542%0.421SS..  trans64.436.2-179.5-69.1-52.4000116.1S176N174-S176 PolarHBondContact O-N 3.03Å
175F57.1Low60.1Low71 Ų7171.2 Ų71.231%0.31140%0.403SS..  trans-60.1126.2164.8-55.7-61.1000109.9L159 S177L159-F175 HydrophobicContact CB-CD1 4.25Å; L159-F175 HydrophobicContact CB-CE1 3.51Å; L159-F175 HydrophobicContact CB-CZ 3.94Å; L159-F175 HydrophobicContact CD1-CZ 4.31Å; L159-F175 HydrophobicContact CD2-CB 4.49Å; L159-F175 HydrophobicContact CD2-CD1 3.26Å; L159-F175 HydrophobicContact CD2-CD2 3.95Å; L159-F175 HydrophobicContact CD2-CE1 3.29Å; L159-F175 HydrophobicContact CD2-CE2 3.95Å; L159-F175 HydrophobicContact CD2-CG 3.61Å; L159-F175 HydrophobicContact CD2-CZ 3.64Å; L159-F175 HydrophobicContact CG-CD1 4.3Å; L159-F175 HydrophobicContact CG-CE1 3.89Å; L159-F175 HydrophobicContact CG-CZ 4.14Å; F175-S177 PolarHBondContact O-N 3.47Å
176S50.3Low60.6Low52 Ų5271 Ų7136%0.36439%0.386SS..  trans-54.8135.6-171.91080000111N174 T178 T179 W180N174-S176 PolarHBondContact O-N 3.03Å; S176-T178 PolarHBondContact O-N 2.97Å; S176-T178 VanDerWaalsContact O-N 3.17Å; S176-T178 PolarHBondContact OG-OG1 3.3Å; S176-T178 VanDerWaalsContact OG-OG1 3.04Å; S176-T179 PolarHBondContact O-N 3.41Å; S176-T179 VanDerWaalsContact O-N 3.16Å; S176-T179 PolarHBondContact OG-N 2.95Å; S176-T179 VanDerWaalsContact OG-N 3.13Å; S176-T179 PolarHBondContact OG-OG1 2.92Å; S176-W180 PolarHBondContact O-N 3.33Å
177S48.9Very low60.8Low77 Ų7768.1 Ų68.154%0.53837%0.373SS..THydrogen-bonded Turntrans-62.5-22.5-177.456.30000112.6F175 K181F175-S177 PolarHBondContact O-N 3.47Å; S177-K181 WeakPolarHBondContact O-CB 3.4Å; S177-K181 WeakPolarHBondContact O-CD 3.37Å; S177-K181 WeakPolarHBondContact O-CG 3.3Å; S177-K181 PolarHBondContact O-N 3.46Å
178T46.8Very low60.9Low113 Ų11367.8 Ų67.869%0.69336%0.36SS*.THydrogen-bonded Turntrans-78.1-41.7174.422.40000112.6S176 W180 K181S176-T178 PolarHBondContact O-N 2.97Å; S176-T178 VanDerWaalsContact O-N 3.17Å; S176-T178 PolarHBondContact OG-OG1 3.3Å; S176-T178 VanDerWaalsContact OG-OG1 3.04Å; T178-W180 VanDerWaalsContact C-N 3.26Å; T178-W180 PolarHBondContact O-N 3.31Å; T178-K181 PolarHBondContact O-N 3.25Å
179T50.7Low60.8Low78 Ų7866.1 Ų66.148%0.47935%0.351SS..THydrogen-bonded Turntrans-64-33.4175.8-47.10000111.7S176 L184S176-T179 PolarHBondContact O-N 3.41Å; S176-T179 VanDerWaalsContact O-N 3.16Å; S176-T179 PolarHBondContact OG-N 2.95Å; S176-T179 VanDerWaalsContact OG-N 3.13Å; S176-T179 PolarHBondContact OG-OG1 2.92Å; T179-L184 HydrophobicContact CG2-CD1 4.09Å
180W52.1Low60.8Low63 Ų6371.5 Ų71.524%0.23937%0.373CS..THydrogen-bonded Turntrans-81.7-15.1179.4-146.590.8000113.7S176 T178 S185 Y256 R260S176-W180 PolarHBondContact O-N 3.33Å; T178-W180 VanDerWaalsContact C-N 3.26Å; T178-W180 PolarHBondContact O-N 3.31Å; W180-S185 WeakPolarHBondContact O-CB 3.47Å; W180-S185 PolarHBondContact O-OG 2.97Å; W180-Y256 HydrophobicContact CH2-CE1 4.47Å; W180-Y256 HydrophobicContact CZ2-CD1 4.37Å; W180-Y256 HydrophobicContact CZ2-CE1 4.14Å; W180-R260 VanDerWaalsContact CD2-NH2 3.28Å; W180-R260 HydrophobicContact CE3-CB 4.29Å; W180-R260 HydrophobicContact CH2-CB 3.39Å; W180-R260 HydrophobicContact CH2-CG 3.74Å; W180-R260 HydrophobicContact CZ2-CG 4.5Å; W180-R260 HydrophobicContact CZ3-CB 3.25Å; W180-R260 HydrophobicContact CZ3-CG 3.95Å
181K51.9Low60.7Low162 Ų16274.6 Ų74.670%0.70439%0.389SS*.SBendtrans-87.8-8.5-157.2-114.6179.3-179.4179.90119.4S177 T178S177-K181 WeakPolarHBondContact O-CB 3.4Å; S177-K181 WeakPolarHBondContact O-CD 3.37Å; S177-K181 WeakPolarHBondContact O-CG 3.3Å; S177-K181 PolarHBondContact O-N 3.46Å; T178-K181 PolarHBondContact O-N 3.25Å
182S53.5Low60.7Low67 Ų6775.1 Ų75.147%0.46939%0.392SS..SBendtrans-142.3-49.8-174.9-159.80000117.7K186S182-K186 WeakPolarHBondContact O-CD 3.32Å; S182-K186 VanDerWaalsContact O-CE 3.3Å; S182-K186 WeakPolarHBondContact O-CE 3.28Å; S182-K186 PolarHBondContact O-NZ 3.38Å
183H56.2Low61Low144 Ų14475.8 Ų75.867%0.66740%0.399SS*.SBendtrans-118.3-43.7-175.6-86.3-80.3000114.3S185 K186 V187H183-S185 PolarHBondContact O-N 3.27Å; H183-K186 PolarHBondContact O-N 3.43Å; H183-V187 WeakPolarHBondContact O-CG2 2.95Å; H183-V187 PolarHBondContact O-N 3.4Å; H183-V187 VanDerWaalsContact O-N 3.13Å
184L58.9Low61.9Low74 Ų7477.1 Ų77.139%0.38741%0.409SS..Hα-helixtrans-66.5-39.5-177-77.6168.4000113.1L158 T179 K186 V187 V188L158-L184 HydrophobicContact CD1-CD2 4.02Å; T179-L184 HydrophobicContact CG2-CD1 4.09Å; L184-K186 PolarHBondContact O-N 3.19Å; L184-V187 PolarHBondContact O-N 3.49Å; L184-V188 WeakPolarHBondContact O-CB 3.32Å; L184-V188 VanDerWaalsContact O-CG2 3.24Å; L184-V188 WeakPolarHBondContact O-CG2 3.34Å; L184-V188 PolarHBondContact O-N 3.38Å
185S62.8Low63.1Low7 Ų774.2 Ų74.25%0.04940%0.399CS..Hα-helixtrans-61.1-47.3175.949.90000111.4W180 H183 V187 V188 I189W180-S185 WeakPolarHBondContact O-CB 3.47Å; W180-S185 PolarHBondContact O-OG 2.97Å; H183-S185 PolarHBondContact O-N 3.27Å; S185-V187 VanDerWaalsContact C-N 3.33Å; S185-V187 PolarHBondContact O-N 3.31Å; S185-V188 PolarHBondContact O-N 3.38Å; S185-I189 WeakPolarHBondContact O-CB 3.13Å; S185-I189 WeakPolarHBondContact O-CD1 3.43Å; S185-I189 WeakPolarHBondContact O-CG1 3.27Å; S185-I189 PolarHBondContact O-N 3.01Å
186K67.2Low64.5Low124 Ų12471.6 Ų71.654%0.53939%0.388SS..Hα-helixtrans-59.5-42.3178.6-64.6178.1-172.9162.50112.4S182 H183 L184 F190S182-K186 WeakPolarHBondContact O-CD 3.32Å; S182-K186 VanDerWaalsContact O-CE 3.3Å; S182-K186 WeakPolarHBondContact O-CE 3.28Å; S182-K186 PolarHBondContact O-NZ 3.38Å; H183-K186 PolarHBondContact O-N 3.43Å; L184-K186 PolarHBondContact O-N 3.19Å; K186-F190 VanDerWaalsContact O-CB 3.3Å; K186-F190 WeakPolarHBondContact O-CB 3.39Å; K186-F190 PolarHBondContact O-N 3.13Å
187V68.1Low66.2Low75 Ų7573 Ų7346%0.45539%0.39SS..Hα-helixtrans-68.1-45.6178.1173.50000111.2H183 L184 S185 F190 I191H183-V187 WeakPolarHBondContact O-CG2 2.95Å; H183-V187 PolarHBondContact O-N 3.4Å; H183-V187 VanDerWaalsContact O-N 3.13Å; L184-V187 PolarHBondContact O-N 3.49Å; S185-V187 VanDerWaalsContact C-N 3.33Å; S185-V187 PolarHBondContact O-N 3.31Å; V187-F190 PolarHBondContact O-N 2.88Å; V187-I191 HydrophobicContact CG1-CD1 3.69Å; V187-I191 HydrophobicContact CG1-CG1 4.39Å; V187-I191 WeakPolarHBondContact O-CB 3.37Å; V187-I191 VanDerWaalsContact O-CG1 3.27Å; V187-I191 WeakPolarHBondContact O-CG1 3.23Å; V187-I191 PolarHBondContact O-N 3.34Å
188V68.2Low68.1Low47 Ų4773.8 Ų73.829%0.28539%0.388SS..Hα-helixtrans-60.8-47.3175.5170.60000110L184 S185 F190 I191 E192L184-V188 WeakPolarHBondContact O-CB 3.32Å; L184-V188 VanDerWaalsContact O-CG2 3.24Å; L184-V188 WeakPolarHBondContact O-CG2 3.34Å; L184-V188 PolarHBondContact O-N 3.38Å; S185-V188 PolarHBondContact O-N 3.38Å; V188-F190 VanDerWaalsContact C-N 3.31Å; V188-F190 PolarHBondContact O-N 3.5Å; V188-I191 PolarHBondContact O-N 2.79Å; V188-E192 HydrophobicContact CG1-CG 3.84Å; V188-E192 WeakPolarHBondContact O-CB 3.48Å; V188-E192 WeakPolarHBondContact O-CG 3.35Å; V188-E192 PolarHBondContact O-N 2.79Å
189I70.3Confident70Confident38 Ų3868.5 Ų68.520%0.19536%0.356CS..Hα-helixtrans-58.4-43.9176.7-65.8156000111.1S185 E192 T193 A257S185-I189 WeakPolarHBondContact O-CB 3.13Å; S185-I189 WeakPolarHBondContact O-CD1 3.43Å; S185-I189 WeakPolarHBondContact O-CG1 3.27Å; S185-I189 PolarHBondContact O-N 3.01Å; I189-E192 PolarHBondContact O-N 2.64Å; I189-T193 WeakPolarHBondContact O-CB 3.36Å; I189-T193 PolarHBondContact O-N 2.83Å; I189-T193 PolarHBondContact O-OG1 3.48Å; I189-A257 HydrophobicContact CD1-CB 3.21Å; I189-A257 HydrophobicContact CG1-CB 3.49Å; I189-A257 VanDerWaalsContact CG1-CB 3.49Å; I189-A257 HydrophobicContact CG2-CB 4.2Å
190F76.6Confident71.8Confident138 Ų13866.1 Ų66.161%0.60534%0.34SS*.Hα-helixtrans-62.4-48.3177.7178.1-96.5000111.4K186 V187 V188 E192 T193 V194K186-F190 VanDerWaalsContact O-CB 3.3Å; K186-F190 WeakPolarHBondContact O-CB 3.39Å; K186-F190 PolarHBondContact O-N 3.13Å; V187-F190 PolarHBondContact O-N 2.88Å; V188-F190 VanDerWaalsContact C-N 3.31Å; V188-F190 PolarHBondContact O-N 3.5Å; F190-E192 PolarHBondContact O-N 3.34Å; F190-T193 PolarHBondContact O-N 3.45Å; F190-V194 HydrophobicContact CD1-CG2 4.35Å; F190-V194 HydrophobicContact CD2-CG2 4.14Å; F190-V194 HydrophobicContact CE1-CG2 4.03Å; F190-V194 HydrophobicContact CE2-CG2 3.8Å; F190-V194 HydrophobicContact CG-CG2 4.41Å; F190-V194 HydrophobicContact CZ-CG2 3.74Å; F190-V194 WeakPolarHBondContact O-CB 3.27Å; F190-V194 VanDerWaalsContact O-CG2 3.28Å; F190-V194 WeakPolarHBondContact O-CG2 3.17Å; F190-V194 PolarHBondContact O-N 3Å
191I74.9Confident73.6Confident89 Ų8967.7 Ų67.746%0.45635%0.352SS..Hα-helixtrans-62.4-43.9178.3-68.2168.6000110.7V187 V188 G195V187-I191 HydrophobicContact CG1-CD1 3.69Å; V187-I191 HydrophobicContact CG1-CG1 4.39Å; V187-I191 WeakPolarHBondContact O-CB 3.37Å; V187-I191 VanDerWaalsContact O-CG1 3.27Å; V187-I191 WeakPolarHBondContact O-CG1 3.23Å; V187-I191 PolarHBondContact O-N 3.34Å; V188-I191 PolarHBondContact O-N 2.79Å; I191-G195 VanDerWaalsContact O-CA 3.27Å; I191-G195 WeakPolarHBondContact O-CA 3.34Å; I191-G195 PolarHBondContact O-N 3.49Å
192E73.4Confident75.3Confident11 Ų1163.9 Ų63.95%0.05134%0.339CS..Hα-helixtrans-65.5-42.6178.8-60.9-89.8125.400110.7Y101 Y105 V188 I189 F190 F196 L253Y101-E192 WeakPolarHBondContact CE1-OE1 3.34Å; Y105-E192 WeakPolarHBondContact CE2-OE1 3.34Å; Y105-E192 VanDerWaalsContact OH-CA 3.26Å; Y105-E192 WeakPolarHBondContact OH-CA 3.49Å; Y105-E192 WeakPolarHBondContact OH-CB 2.99Å; Y105-E192 WeakPolarHBondContact OH-CG 3.49Å; Y105-E192 PolarHBondContact OH-OE1 3.49Å; Y105-E192 PolarHBondContact OH-OE2 2.85Å; V188-E192 HydrophobicContact CG1-CG 3.84Å; V188-E192 WeakPolarHBondContact O-CB 3.48Å; V188-E192 WeakPolarHBondContact O-CG 3.35Å; V188-E192 PolarHBondContact O-N 2.79Å; I189-E192 PolarHBondContact O-N 2.64Å; F190-E192 PolarHBondContact O-N 3.34Å; E192-F196 VanDerWaalsContact O-CB 3.23Å; E192-F196 WeakPolarHBondContact O-CB 3.49Å; E192-F196 PolarHBondContact O-N 2.99Å; E192-L253 HydrophobicContact CB-CD2 3.85Å; E192-L253 HydrophobicContact CG-CD2 3.85Å; E192-L253 WeakPolarHBondContact OE2-CD2 3.04Å
193T76.4Confident76.9Confident50 Ų5060.8 Ų60.831%0.30732%0.317SS..Hα-helixtrans-65.9-49.8178.9-56.10000111.2I189 F190 F196 L197I189-T193 WeakPolarHBondContact O-CB 3.36Å; I189-T193 PolarHBondContact O-N 2.83Å; I189-T193 PolarHBondContact O-OG1 3.48Å; F190-T193 PolarHBondContact O-N 3.45Å; T193-F196 PolarHBondContact O-N 2.84Å; T193-L197 WeakPolarHBondContact O-CB 3.48Å; T193-L197 PolarHBondContact O-N 3.35Å
194V80.6Confident78.4Confident53 Ų5356.2 Ų56.232%0.32130%0.3SS..Hα-helixtrans-68.7-43.2-179.8173.40000110.6F190 F196 L197 I198F190-V194 HydrophobicContact CD1-CG2 4.35Å; F190-V194 HydrophobicContact CD2-CG2 4.14Å; F190-V194 HydrophobicContact CE1-CG2 4.03Å; F190-V194 HydrophobicContact CE2-CG2 3.8Å; F190-V194 HydrophobicContact CG-CG2 4.41Å; F190-V194 HydrophobicContact CZ-CG2 3.74Å; F190-V194 WeakPolarHBondContact O-CB 3.27Å; F190-V194 VanDerWaalsContact O-CG2 3.28Å; F190-V194 WeakPolarHBondContact O-CG2 3.17Å; F190-V194 PolarHBondContact O-N 3Å; V194-F196 PolarHBondContact O-N 3.45Å; V194-L197 PolarHBondContact O-N 3.39Å; V194-I198 HydrophobicContact CG1-CD1 3.44Å; V194-I198 VanDerWaalsContact CG1-CD1 3.44Å; V194-I198 HydrophobicContact CG1-CG1 4.14Å; V194-I198 WeakPolarHBondContact O-CB 3.38Å; V194-I198 WeakPolarHBondContact O-CG1 3.3Å; V194-I198 PolarHBondContact O-N 3.38Å; V194-I198 VanDerWaalsContact O-N 3.07Å
195G80.5Confident79.8Confident26 Ų2655.8 Ų55.827%0.26830%0.302SS..Hα-helixtrans-63.1-24.7178.400000113.5I191 P199I191-G195 VanDerWaalsContact O-CA 3.27Å; I191-G195 WeakPolarHBondContact O-CA 3.34Å; I191-G195 PolarHBondContact O-N 3.49Å; G195-P199 WeakPolarHBondContact O-CD 3.21Å; G195-P199 WeakPolarHBondContact O-CG 3.29Å
196F85.3Confident80.9Confident16 Ų1655.8 Ų55.87%0.0730%0.302CS..Hα-helixtrans-92.3-45.9171.8167.7-110.3000113.4M108 E192 T193 V194 I198 P199 L200 F242 F246 I247 N250M108-F196 HydrophobicContact CE-CD2 4.19Å; M108-F196 HydrophobicContact SD-CD2 4.03Å; E192-F196 VanDerWaalsContact O-CB 3.23Å; E192-F196 WeakPolarHBondContact O-CB 3.49Å; E192-F196 PolarHBondContact O-N 2.99Å; T193-F196 PolarHBondContact O-N 2.84Å; V194-F196 PolarHBondContact O-N 3.45Å; F196-I198 PolarHBondContact O-N 2.92Å; F196-P199 WeakPolarHBondContact O-CD 3.41Å; F196-L200 HydrophobicContact CE1-CD2 3.97Å; F196-L200 HydrophobicContact CE2-CB 4.44Å; F196-L200 HydrophobicContact CZ-CB 4.4Å; F196-L200 HydrophobicContact CZ-CD2 3.82Å; F196-L200 HydrophobicContact CZ-CG 4.49Å; F196-L200 WeakPolarHBondContact O-CB 3.39Å; F196-L200 PolarHBondContact O-N 2.69Å; F196-F242 HydrophobicContact CE2-CE1 4.27Å; F196-F246 HydrophobicContact CD2-CB 4.32Å; F196-F246 HydrophobicContact CE2-CB 3.88Å; F196-I247 HydrophobicContact CE2-CG1 4.42Å; F196-I247 HydrophobicContact CZ-CB 4.33Å; F196-I247 HydrophobicContact CZ-CG1 3.84Å; F196-N250 HydrophobicContact CB-CB 4Å; F196-N250 HydrophobicContact CD1-CB 3.47Å; F196-N250 VanDerWaalsContact CD1-CB 3.47Å; F196-N250 HydrophobicContact CD2-CB 3.76Å; F196-N250 VanDerWaalsContact CD2-CG 3.49Å; F196-N250 VanDerWaalsContact CD2-ND2 3.3Å; F196-N250 WeakPolarHBondContact CD2-ND2 3.4Å; F196-N250 HydrophobicContact CE1-CB 3.8Å; F196-N250 HydrophobicContact CE2-CB 4.07Å; F196-N250 HydrophobicContact CG-CB 3.44Å; F196-N250 VanDerWaalsContact CG-CB 3.44Å; F196-N250 VanDerWaalsContact CG-CG 3.42Å; F196-N250 HydrophobicContact CZ-CB 4.07Å
197L86.9Confident81.8Confident80 Ų8050.1 Ų50.142%0.41928%0.278SS..Hα-helixtrans-66.9-39.1-172.3-172.964.5000111.9T193 V194 L200 L201T193-L197 WeakPolarHBondContact O-CB 3.48Å; T193-L197 PolarHBondContact O-N 3.35Å; V194-L197 PolarHBondContact O-N 3.39Å; L197-L200 HydrophobicContact CD1-CD2 4.47Å; L197-L200 PolarHBondContact O-N 2.95Å; L197-L201 HydrophobicContact CD1-CD1 4.31Å; L197-L201 HydrophobicContact CD1-CG 4.25Å; L197-L201 HydrophobicContact CG-CD1 3.97Å; L197-L201 HydrophobicContact CG-CG 4.33Å; L197-L201 WeakPolarHBondContact O-CB 3.33Å; L197-L201 VanDerWaalsContact O-CG 3.27Å; L197-L201 WeakPolarHBondContact O-CG 3.36Å; L197-L201 PolarHBondContact O-N 2.88Å
198I87.7Confident82.6Confident94 Ų9450.6 Ų50.648%0.48228%0.277SS..Hα-helixtrans-62.6-54.1178-67.7175.4000110.8V194 F196 L200 L201 L202V194-I198 HydrophobicContact CG1-CD1 3.44Å; V194-I198 VanDerWaalsContact CG1-CD1 3.44Å; V194-I198 HydrophobicContact CG1-CG1 4.14Å; V194-I198 WeakPolarHBondContact O-CB 3.38Å; V194-I198 WeakPolarHBondContact O-CG1 3.3Å; V194-I198 PolarHBondContact O-N 3.38Å; V194-I198 VanDerWaalsContact O-N 3.07Å; F196-I198 PolarHBondContact O-N 2.92Å; I198-L200 VanDerWaalsContact C-N 3.32Å; I198-L200 PolarHBondContact O-N 2.88Å; I198-L201 PolarHBondContact O-N 2.9Å; I198-L202 HydrophobicContact CG2-CD1 3.95Å; I198-L202 WeakPolarHBondContact O-CB 3.46Å; I198-L202 WeakPolarHBondContact O-CG 3.35Å; I198-L202 PolarHBondContact O-N 3.36Å
199P87.7Confident83.4Confident3 Ų351.6 Ų51.62%0.01928%0.279CS..Hα-helixtrans-57.5-39.6173.9-31.239.8000114.1M108 L109 G195 F196 L202 N203 F242M108-P199 HydrophobicContact CB-CB 4.28Å; L109-P199 HydrophobicContact CD2-CG 3.81Å; G195-P199 WeakPolarHBondContact O-CD 3.21Å; G195-P199 WeakPolarHBondContact O-CG 3.29Å; F196-P199 WeakPolarHBondContact O-CD 3.41Å; P199-L202 PolarHBondContact O-N 2.86Å; P199-N203 WeakPolarHBondContact O-CB 3.49Å; P199-N203 PolarHBondContact O-N 3.3Å; P199-N203 PolarHBondContact O-ND2 2.93Å; P199-F242 HydrophobicContact CB-CE2 4.33Å; P199-F242 HydrophobicContact CB-CZ 4.05Å
200L88.9Confident83.9Confident28 Ų2849.8 Ų49.815%0.14727%0.27CS..Hα-helixtrans-60.8-52.6177.6176.868.1000111.2F196 L197 I198 L202 N203 V204 F242 I247F196-L200 HydrophobicContact CE1-CD2 3.97Å; F196-L200 HydrophobicContact CE2-CB 4.44Å; F196-L200 HydrophobicContact CZ-CB 4.4Å; F196-L200 HydrophobicContact CZ-CD2 3.82Å; F196-L200 HydrophobicContact CZ-CG 4.49Å; F196-L200 WeakPolarHBondContact O-CB 3.39Å; F196-L200 PolarHBondContact O-N 2.69Å; L197-L200 HydrophobicContact CD1-CD2 4.47Å; L197-L200 PolarHBondContact O-N 2.95Å; I198-L200 VanDerWaalsContact C-N 3.32Å; I198-L200 PolarHBondContact O-N 2.88Å; L200-L202 VanDerWaalsContact C-N 3.34Å; L200-L202 PolarHBondContact O-N 3.27Å; L200-N203 PolarHBondContact O-N 3.37Å; L200-V204 HydrophobicContact CD1-CG2 4.21Å; L200-V204 WeakPolarHBondContact O-CG2 3.24Å; L200-V204 PolarHBondContact O-N 3.28Å; L200-F242 HydrophobicContact CB-CE1 3.92Å; L200-F242 HydrophobicContact CB-CZ 4.36Å; L200-F242 HydrophobicContact CD1-CD1 4.03Å; L200-F242 HydrophobicContact CD1-CE1 3.6Å; L200-F242 HydrophobicContact CG-CE1 4.37Å; L200-I247 HydrophobicContact CD1-CD1 4.28Å; L200-I247 HydrophobicContact CD1-CG1 4.33Å
201L89.6Confident84.1Confident95 Ų9545.3 Ų45.350%0.49725%0.252SS..Hα-helixtrans-60.7-44.4179.8-70.6173.6000111L197 I198 N203 V204 C205L197-L201 HydrophobicContact CD1-CD1 4.31Å; L197-L201 HydrophobicContact CD1-CG 4.25Å; L197-L201 HydrophobicContact CG-CD1 3.97Å; L197-L201 HydrophobicContact CG-CG 4.33Å; L197-L201 WeakPolarHBondContact O-CB 3.33Å; L197-L201 VanDerWaalsContact O-CG 3.27Å; L197-L201 WeakPolarHBondContact O-CG 3.36Å; L197-L201 PolarHBondContact O-N 2.88Å; I198-L201 PolarHBondContact O-N 2.9Å; L201-N203 PolarHBondContact O-N 2.88Å; L201-V204 PolarHBondContact O-N 3.24Å; L201-C205 VanDerWaalsContact O-CB 3.25Å; L201-C205 WeakPolarHBondContact O-CB 3.5Å; L201-C205 PolarHBondContact O-N 2.9Å; L201-C205 PolarHBondContact O-SG 3.11Å
202L87.6Confident84.5Confident82 Ų8246.3 Ų46.343%0.42926%0.255SS..Hα-helixtrans-60.6-46177.1-74.3174.5000112.1T112 I198 P199 L200 C206T112-L202 HydrophobicContact CG2-CB 3.68Å; T112-L202 HydrophobicContact CG2-CD1 4.05Å; I198-L202 HydrophobicContact CG2-CD1 3.95Å; I198-L202 WeakPolarHBondContact O-CB 3.46Å; I198-L202 WeakPolarHBondContact O-CG 3.35Å; I198-L202 PolarHBondContact O-N 3.36Å; P199-L202 PolarHBondContact O-N 2.86Å; L200-L202 VanDerWaalsContact C-N 3.34Å; L200-L202 PolarHBondContact O-N 3.27Å; L202-C206 WeakPolarHBondContact O-CB 3.48Å; L202-C206 PolarHBondContact O-N 2.85Å; L202-C206 PolarHBondContact O-SG 3.04Å
203N86.9Confident84.8Confident2 Ų246.9 Ų46.91%0.01126%0.259CS..Hα-helixtrans-62.4-45.5177.5-84.1-68.7000112.1T112 S115 P199 L200 L201 S207 L239T112-N203 PolarHBondContact OG1-ND2 2.97Å; S115-N203 VanDerWaalsContact CB-OD1 3.25Å; S115-N203 WeakPolarHBondContact CB-OD1 3.5Å; S115-N203 PolarHBondContact OG-OD1 3.23Å; P199-N203 WeakPolarHBondContact O-CB 3.49Å; P199-N203 PolarHBondContact O-N 3.3Å; P199-N203 PolarHBondContact O-ND2 2.93Å; L200-N203 PolarHBondContact O-N 3.37Å; L201-N203 PolarHBondContact O-N 2.88Å; N203-S207 WeakPolarHBondContact O-CB 3.17Å; N203-S207 PolarHBondContact O-N 2.81Å; N203-S207 PolarHBondContact O-OG 3.46Å; N203-L239 HydrophobicContact CB-CD1 4.47Å
204V88.5Confident84.7Confident49 Ų4945.5 Ų45.530%0.29725%0.25SC..Hα-helixtrans-64-50.3179.6171.70000110.3L200 L201 S207 I208 L239L200-V204 HydrophobicContact CD1-CG2 4.21Å; L200-V204 WeakPolarHBondContact O-CG2 3.24Å; L200-V204 PolarHBondContact O-N 3.28Å; L201-V204 PolarHBondContact O-N 3.24Å; V204-S207 PolarHBondContact O-N 3.15Å; V204-I208 HydrophobicContact CG1-CD1 3.65Å; V204-I208 HydrophobicContact CG1-CG1 4.39Å; V204-I208 VanDerWaalsContact O-CG1 3.28Å; V204-I208 WeakPolarHBondContact O-CG1 3.31Å; V204-I208 PolarHBondContact O-N 2.94Å; V204-L239 HydrophobicContact CG2-CD1 4.05Å
205C87.7Confident84.5Confident64 Ų6453 Ų5343%0.43227%0.272SS..Hα-helixtrans-61.2-47.5179.1-69.20000111.9L201 S207 I208 M209L201-C205 VanDerWaalsContact O-CB 3.25Å; L201-C205 WeakPolarHBondContact O-CB 3.5Å; L201-C205 PolarHBondContact O-N 2.9Å; L201-C205 PolarHBondContact O-SG 3.11Å; C205-S207 VanDerWaalsContact C-N 3.32Å; C205-S207 PolarHBondContact O-N 3.21Å; C205-I208 PolarHBondContact O-N 3.27Å; C205-M209 HydrophobicContact CB-CE 4.46Å; C205-M209 WeakPolarHBondContact O-CE 3.3Å; C205-M209 WeakPolarHBondContact O-CG 3.21Å; C205-M209 PolarHBondContact O-N 3.48Å
206C85.6Confident84.2Confident8 Ų859.7 Ų59.75%0.05429%0.29CS..Hα-helixtrans-59.7-44.3176.9-70.40000111.2F119 L202 M209 V210F119-C206 HydrophobicContact CB-CB 4.14Å; L202-C206 WeakPolarHBondContact O-CB 3.48Å; L202-C206 PolarHBondContact O-N 2.85Å; L202-C206 PolarHBondContact O-SG 3.04Å; C206-M209 PolarHBondContact O-N 3.16Å; C206-V210 VanDerWaalsContact O-CG2 3.29Å; C206-V210 WeakPolarHBondContact O-CG2 3.38Å; C206-V210 PolarHBondContact O-N 3.27Å
207S85.3Confident83.1Confident5 Ų564.6 Ų64.64%0.03532%0.323CS..Hα-helixtrans-60.6-51.4177.6-61.50000110.9N203 V204 C205 M209 V210 L211 I235N203-S207 WeakPolarHBondContact O-CB 3.17Å; N203-S207 PolarHBondContact O-N 2.81Å; N203-S207 PolarHBondContact O-OG 3.46Å; V204-S207 PolarHBondContact O-N 3.15Å; C205-S207 VanDerWaalsContact C-N 3.32Å; C205-S207 PolarHBondContact O-N 3.21Å; S207-M209 PolarHBondContact O-N 3.01Å; S207-V210 PolarHBondContact O-N 3.31Å; S207-L211 WeakPolarHBondContact O-CD1 3.3Å; S207-L211 PolarHBondContact O-N 3.04Å; S207-I235 WeakPolarHBondContact OG-CG2 3.39Å
208I86.7Confident81.7Confident84 Ų8469.4 Ų69.443%0.43134%0.343SS..Hα-helixtrans-56.7-48.5179.3-69.4168000111V204 C205 V210 L211 Q212V204-I208 HydrophobicContact CG1-CD1 3.65Å; V204-I208 HydrophobicContact CG1-CG1 4.39Å; V204-I208 VanDerWaalsContact O-CG1 3.28Å; V204-I208 WeakPolarHBondContact O-CG1 3.31Å; V204-I208 PolarHBondContact O-N 2.94Å; C205-I208 PolarHBondContact O-N 3.27Å; I208-V210 VanDerWaalsContact C-N 3.34Å; I208-V210 PolarHBondContact O-N 2.87Å; I208-L211 PolarHBondContact O-N 3.45Å; I208-Q212 HydrophobicContact CG2-CG 4.31Å; I208-Q212 WeakPolarHBondContact O-CB 3.2Å; I208-Q212 VanDerWaalsContact O-CG 3.32Å; I208-Q212 WeakPolarHBondContact O-CG 3.25Å; I208-Q212 PolarHBondContact O-N 2.86Å
209M84.1Confident80Confident68 Ų6868.6 Ų68.634%0.33534%0.343SS..Hα-helixtrans-62.9-39.4-179.2-70.6-173.1-72.600112.5F119 C205 C206 S207 T213F119-M209 HydrophobicContact CD2-CB 3.92Å; F119-M209 HydrophobicContact CD2-CE 3.99Å; F119-M209 HydrophobicContact CE1-CE 4.36Å; F119-M209 HydrophobicContact CE2-CB 3.64Å; F119-M209 HydrophobicContact CE2-CE 3.49Å; F119-M209 VanDerWaalsContact CE2-CE 3.49Å; F119-M209 HydrophobicContact CE2-CG 4.26Å; F119-M209 HydrophobicContact CE2-SD 3.63Å; F119-M209 HydrophobicContact CZ-CE 3.71Å; F119-M209 HydrophobicContact CZ-SD 3.93Å; C205-M209 HydrophobicContact CB-CE 4.46Å; C205-M209 WeakPolarHBondContact O-CE 3.3Å; C205-M209 WeakPolarHBondContact O-CG 3.21Å; C205-M209 PolarHBondContact O-N 3.48Å; C206-M209 PolarHBondContact O-N 3.16Å; S207-M209 PolarHBondContact O-N 3.01Å; M209-T213 WeakPolarHBondContact O-CB 3.18Å; M209-T213 PolarHBondContact O-N 2.89Å; M209-T213 PolarHBondContact O-OG1 3.2Å
210V79.9Confident78.2Confident1 Ų172.2 Ų72.21%0.00637%0.365CS..Hα-helixtrans-66.8-44.7175.1177.20000111.1F119 I122 V123 C206 S207 I208 Q212 T213 L214 I235F119-V210 HydrophobicContact CB-CG2 3.83Å; F119-V210 HydrophobicContact CD2-CG2 4.02Å; F119-V210 HydrophobicContact CG-CG2 4.44Å; I122-V210 HydrophobicContact CD1-CG1 3.64Å; I122-V210 HydrophobicContact CG2-CG1 4.38Å; V123-V210 HydrophobicContact CG2-CG2 4.15Å; C206-V210 VanDerWaalsContact O-CG2 3.29Å; C206-V210 WeakPolarHBondContact O-CG2 3.38Å; C206-V210 PolarHBondContact O-N 3.27Å; S207-V210 PolarHBondContact O-N 3.31Å; I208-V210 VanDerWaalsContact C-N 3.34Å; I208-V210 PolarHBondContact O-N 2.87Å; V210-Q212 VanDerWaalsContact C-N 3.33Å; V210-Q212 PolarHBondContact O-N 2.84Å; V210-T213 PolarHBondContact O-N 2.82Å; V210-L214 HydrophobicContact CG1-CD1 3.76Å; V210-L214 HydrophobicContact CG1-CG 4.14Å; V210-L214 WeakPolarHBondContact O-CB 3.34Å; V210-L214 WeakPolarHBondContact O-CG 3.28Å; V210-L214 PolarHBondContact O-N 3.05Å; V210-I235 HydrophobicContact CB-CD1 3.72Å; V210-I235 HydrophobicContact CG1-CD1 3.22Å; V210-I235 HydrophobicContact CG2-CD1 4.28Å
211L81.8Confident76.2Confident44 Ų4476.6 Ų76.623%0.2340%0.398CS..Hα-helixtrans-58.6-45.4176.6-89.592000111.4S207 I208 T213 L214 R215 L232 I235S207-L211 WeakPolarHBondContact O-CD1 3.3Å; S207-L211 PolarHBondContact O-N 3.04Å; I208-L211 PolarHBondContact O-N 3.45Å; L211-T213 VanDerWaalsContact C-N 3.35Å; L211-T213 PolarHBondContact O-N 2.78Å; L211-L214 PolarHBondContact O-N 3.09Å; L211-R215 WeakPolarHBondContact O-CG 3.32Å; L211-R215 PolarHBondContact O-N 2.99Å; L211-R215 VanDerWaalsContact O-N 3.11Å; L211-L232 HydrophobicContact CD1-CD1 4.22Å; L211-L232 HydrophobicContact CD2-CD1 3.85Å; L211-L232 HydrophobicContact CG-CD1 3.68Å; L211-I235 HydrophobicContact CD1-CG2 3.87Å
212Q84.4Confident74.4Confident110 Ų11083.6 Ų83.651%0.51442%0.417SS..Hα-helixtrans-61.1-43.4176.7-73.4177.4-5.800111.8I208 V210 R215 R216I208-Q212 HydrophobicContact CG2-CG 4.31Å; I208-Q212 WeakPolarHBondContact O-CB 3.2Å; I208-Q212 VanDerWaalsContact O-CG 3.32Å; I208-Q212 WeakPolarHBondContact O-CG 3.25Å; I208-Q212 PolarHBondContact O-N 2.86Å; V210-Q212 VanDerWaalsContact C-N 3.33Å; V210-Q212 PolarHBondContact O-N 2.84Å; Q212-R215 PolarHBondContact O-N 3.25Å; Q212-R216 PolarHBondContact O-N 3.39Å
213T77.8Confident72.3Confident22 Ų2282.3 Ų82.314%0.13542%0.424CS..Hα-helixtrans-67.4-37.4180-57.40000112.2I122 V123 M209 V210 L211 R215 R216 T219I122-T213 HydrophobicContact CG2-CG2 4.26Å; V123-T213 HydrophobicContact CG2-CG2 4.22Å; V123-T213 WeakPolarHBondContact CG2-OG1 3.31Å; M209-T213 WeakPolarHBondContact O-CB 3.18Å; M209-T213 PolarHBondContact O-N 2.89Å; M209-T213 PolarHBondContact O-OG1 3.2Å; V210-T213 PolarHBondContact O-N 2.82Å; L211-T213 VanDerWaalsContact C-N 3.35Å; L211-T213 PolarHBondContact O-N 2.78Å; T213-R215 VanDerWaalsContact C-N 3.34Å; T213-R216 PolarHBondContact O-N 2.7Å; T213-T219 HydrophobicContact CG2-CG2 4.25Å; T213-T219 PolarHBondContact O-OG1 3.18Å
214L74.8Confident70.6Confident22 Ų2285.5 Ų85.512%0.11546%0.457CS..Hα-helixtrans-70-29.3177.4-73.6173.7000113.2I122 V210 L211 R216 K228 I231I122-L214 HydrophobicContact CG2-CD2 4.23Å; I122-L214 HydrophobicContact CG2-CG 4.48Å; V210-L214 HydrophobicContact CG1-CD1 3.76Å; V210-L214 HydrophobicContact CG1-CG 4.14Å; V210-L214 WeakPolarHBondContact O-CB 3.34Å; V210-L214 WeakPolarHBondContact O-CG 3.28Å; V210-L214 PolarHBondContact O-N 3.05Å; L211-L214 PolarHBondContact O-N 3.09Å; L214-R216 VanDerWaalsContact C-N 3.34Å; L214-K228 HydrophobicContact CD2-CG 4.19Å; L214-K228 PolarHBondContact O-NZ 2.92Å; L214-I231 HydrophobicContact CD1-CG2 3.99Å
215R76.1Confident68.9Low210 Ų21093.7 Ų93.779%0.79249%0.489SS*.Hα-helixtrans-73.7-20.4174.7-74.8179.7-178.7-172.61.2113.2L211 Q212 T213L211-R215 WeakPolarHBondContact O-CG 3.32Å; L211-R215 PolarHBondContact O-N 2.99Å; L211-R215 VanDerWaalsContact O-N 3.11Å; Q212-R215 PolarHBondContact O-N 3.25Å; T213-R215 VanDerWaalsContact C-N 3.34Å
216R75.4Confident67.6Low167 Ų16794.7 Ų94.763%0.6349%0.493SS*.  trans-71.4130.3177.4-69.8-176.3-176.4-153.71.5110.7Q212 T213 L214 Q218 T219Q212-R216 PolarHBondContact O-N 3.39Å; T213-R216 PolarHBondContact O-N 2.7Å; L214-R216 VanDerWaalsContact C-N 3.34Å; R216-Q218 PolarHBondContact O-N 3.09Å; R216-T219 HydrophobicContact CB-CG2 4.41Å; R216-T219 PolarHBondContact O-OG1 2.84Å
217P60.8Low66.8Low118 Ų11899 Ų9977%0.76652%0.516SS*.G310 helixtrans-70.6-27.7-175.323-30.7000113.7
218Q57.5Low66.2Low181 Ų181102.1 Ų102.185%0.84653%0.528SS*.G310 helixtrans-84.4-9.6-171.2-70.6-163.6-22.400116.3R216 V220R216-Q218 PolarHBondContact O-N 3.09Å; Q218-V220 PolarHBondContact O-N 3.37Å
219T53.7Low65.5Low77 Ų77102.3 Ų102.347%0.47253%0.534SS..G310 helixtrans-79.8-0.7-177.254.20000113.9T213 R216T213-T219 HydrophobicContact CG2-CG2 4.25Å; T213-T219 PolarHBondContact O-OG1 3.18Å; R216-T219 HydrophobicContact CB-CG2 4.41Å; R216-T219 PolarHBondContact O-OG1 2.84Å
220V49.8Very low65Low79 Ų79100.9 Ų100.948%0.47953%0.526SS..G310 helixtrans-98.6-17.4-167.5-168.50000113.7Q218 R222Q218-V220 PolarHBondContact O-N 3.37Å; V220-R222 VanDerWaalsContact C-N 3.29Å; V220-R222 PolarHBondContact O-N 2.92Å
221S46.8Very low64.8Low121 Ų121102.2 Ų102.285%0.84653%0.532SS*.THydrogen-bonded Turntrans-81.4-2.8-174.9-145.50000114.2
222R51.4Low64.5Low241 Ų241103.1 Ų103.191%0.90954%0.537SS*.THydrogen-bonded Turntrans-121.318.5-162.7-110.8179.1177.5179.8-0.8117.6V220V220-R222 VanDerWaalsContact C-N 3.29Å; V220-R222 PolarHBondContact O-N 2.92Å
223G43Very low64.3Low55 Ų55104.5 Ų104.557%0.56754%0.538SS*.SBendtrans164.1101.3164.900000115.9V226G223-V226 WeakPolarHBondContact O-CG2 3.31Å
224G50.9Low64.5Low69 Ų69103.7 Ų103.771%0.71153%0.533SS*.SBendtrans72.3153.9167.400000115.5V226G224-V226 PolarHBondContact O-N 3.1Å
225K52.8Low64.8Low221 Ų221103.1 Ų103.196%0.96153%0.53SS*.  trans-64.873168.4-93178.2172.8173.30109.8N227K225-N227 PolarHBondContact O-N 3.38Å
226V61.3Low65.2Low86 Ų8696.9 Ų96.952%0.52151%0.511SS..  trans-69.7114.2173.4-176.50000107.5G223 G224 K228 I231G223-V226 WeakPolarHBondContact O-CG2 3.31Å; G224-V226 PolarHBondContact O-N 3.1Å; V226-K228 VanDerWaalsContact C-N 3.32Å; V226-K228 PolarHBondContact O-N 3.23Å; V226-I231 HydrophobicContact CG1-CD1 3.33Å
227N69.4Low65.7Low99 Ų9990.3 Ų90.353%0.52949%0.489SS..  trans-73.785-177.4-166.2-13000110.4K225 T229 K230 I231K225-N227 PolarHBondContact O-N 3.38Å; N227-T229 PolarHBondContact O-N 3.11Å; N227-K230 HydrophobicContact CB-CB 4.04Å; N227-K230 WeakPolarHBondContact O-CB 3.33Å; N227-K230 PolarHBondContact O-N 3.13Å; N227-I231 PolarHBondContact O-N 3.17Å
228K71.8Confident66.7Low69 Ų6985 Ų8530%0.345%0.454SS..Hα-helixtrans-49-43.7-177.3-66.3-169.3173.2-164.60112.6L214 V226 K230 I231 L232L214-K228 HydrophobicContact CD2-CG 4.19Å; L214-K228 PolarHBondContact O-NZ 2.92Å; V226-K228 VanDerWaalsContact C-N 3.32Å; V226-K228 PolarHBondContact O-N 3.23Å; K228-K230 VanDerWaalsContact C-N 3.31Å; K228-K230 PolarHBondContact O-N 3.16Å; K228-I231 PolarHBondContact O-N 3.21Å; K228-L232 WeakPolarHBondContact O-CB 3.33Å; K228-L232 PolarHBondContact O-N 3.36Å
229T71.2Confident68.1Low89 Ų8978.6 Ų78.655%0.54643%0.426SS..Hα-helixtrans-62.7-37.9-178.7-49.50000112N227 R233N227-T229 PolarHBondContact O-N 3.11Å; T229-R233 VanDerWaalsContact O-CB 3.29Å; T229-R233 WeakPolarHBondContact O-CB 3.42Å; T229-R233 PolarHBondContact O-N 3.21Å
230K74.6Confident69.8Low37 Ų3778.5 Ų78.516%0.16143%0.428CS..Hα-helixtrans-66.6-45.9177.8-179.5174.9174.9164.20111.5N227 K228 R233 M234 E300N227-K230 HydrophobicContact CB-CB 4.04Å; N227-K230 WeakPolarHBondContact O-CB 3.33Å; N227-K230 PolarHBondContact O-N 3.13Å; K228-K230 VanDerWaalsContact C-N 3.31Å; K228-K230 PolarHBondContact O-N 3.16Å; K230-R233 PolarHBondContact O-N 3.04Å; K230-M234 WeakPolarHBondContact O-CB 3.16Å; K230-M234 PolarHBondContact O-N 3.44Å; K230-E300 VanDerWaalsContact NZ-CD 3.31Å; K230-E300 IonicContact NZ-OE1 3.71Å; K230-E300 PolarHBondContact NZ-OE1 2.97Å
231I75.1Confident71.7Confident29 Ų2975.6 Ų75.615%0.14941%0.409CS..Hα-helixtrans-64.6-44.6179-64.8172.9000110.7I122 L214 V226 N227 K228 M234 I235I122-I231 HydrophobicContact CD1-CD1 4.2Å; I122-I231 HydrophobicContact CD1-CG2 3.43Å; I122-I231 VanDerWaalsContact CD1-CG2 3.43Å; L214-I231 HydrophobicContact CD1-CG2 3.99Å; V226-I231 HydrophobicContact CG1-CD1 3.33Å; N227-I231 PolarHBondContact O-N 3.17Å; K228-I231 PolarHBondContact O-N 3.21Å; I231-M234 WeakPolarHBondContact O-CB 3.11Å; I231-M234 PolarHBondContact O-N 2.77Å; I231-I235 HydrophobicContact CG2-CD1 4.01Å; I231-I235 WeakPolarHBondContact O-CG1 3.23Å; I231-I235 PolarHBondContact O-N 2.89Å
232L76.4Confident73.6Confident64 Ų6469.9 Ų69.934%0.33537%0.369SS..Hα-helixtrans-60.8-47.2177.4-17866.2000111.1L211 K228 M234 I235 I236L211-L232 HydrophobicContact CD1-CD1 4.22Å; L211-L232 HydrophobicContact CD2-CD1 3.85Å; L211-L232 HydrophobicContact CG-CD1 3.68Å; K228-L232 WeakPolarHBondContact O-CB 3.33Å; K228-L232 PolarHBondContact O-N 3.36Å; L232-M234 VanDerWaalsContact C-N 3.3Å; L232-M234 PolarHBondContact O-N 3.14Å; L232-I235 PolarHBondContact O-N 2.89Å; L232-I236 HydrophobicContact CD1-CD1 4.05Å; L232-I236 HydrophobicContact CD1-CG1 4.4Å; L232-I236 HydrophobicContact CD2-CD1 4.47Å; L232-I236 HydrophobicContact CG-CD1 3.83Å; L232-I236 WeakPolarHBondContact O-CG1 3.42Å; L232-I236 PolarHBondContact O-N 3.38Å
233R80.3Confident75.5Confident138 Ų13860 Ų6052%0.52134%0.337SS..Hα-helixtrans-58.6-44.6176.8-172.9-177.8-61-171-0.9111.5T229 K230 I236 V237 F297T229-R233 VanDerWaalsContact O-CB 3.29Å; T229-R233 WeakPolarHBondContact O-CB 3.42Å; T229-R233 PolarHBondContact O-N 3.21Å; K230-R233 PolarHBondContact O-N 3.04Å; R233-I236 PolarHBondContact O-N 2.97Å; R233-V237 HydrophobicContact CG-CG2 4.42Å; R233-V237 WeakPolarHBondContact O-CB 3.34Å; R233-V237 VanDerWaalsContact O-CG2 3.23Å; R233-V237 WeakPolarHBondContact O-CG2 3.46Å; R233-V237 PolarHBondContact O-N 3.42Å; R233-F297 HydrophobicContact CG-CD1 3.94Å; R233-F297 HydrophobicContact CG-CE1 3.92Å; R233-F297 HydrophobicContact CG-CZ 4.47Å
234M81.1Confident77.8Confident6 Ų662.8 Ų62.83%0.0333%0.333CS..Hα-helixtrans-57.5-51.8176.1178.7-160.778.700110.9R118 K230 I231 L232 I236 V237 H238 F297 T298R118-M234 HydrophobicContact CB-CE 4.03Å; R118-M234 HydrophobicContact CG-CE 3.44Å; R118-M234 VanDerWaalsContact CG-CE 3.44Å; R118-M234 HydrophobicContact CG-SD 4.35Å; K230-M234 WeakPolarHBondContact O-CB 3.16Å; K230-M234 PolarHBondContact O-N 3.44Å; I231-M234 WeakPolarHBondContact O-CB 3.11Å; I231-M234 PolarHBondContact O-N 2.77Å; L232-M234 VanDerWaalsContact C-N 3.3Å; L232-M234 PolarHBondContact O-N 3.14Å; M234-I236 PolarHBondContact O-N 2.97Å; M234-V237 PolarHBondContact O-N 3.48Å; M234-H238 WeakPolarHBondContact CG-CE1 3.35Å; M234-H238 PolarHBondContact O-N 3.48Å; M234-H238 PolarHBondContact O-ND1 3.31Å; M234-F297 HydrophobicContact CB-CB 4.16Å; M234-F297 HydrophobicContact CG-CB 4.41Å; M234-T298 HydrophobicContact CG-CG2 4.38Å; M234-T298 WeakPolarHBondContact CG-OG1 3.16Å; M234-T298 HydrophobicContact SD-CG2 3.62Å
235I81.1Confident79.8Confident10 Ų1059.5 Ų59.55%0.05130%0.299CS..Hα-helixtrans-61.6-45.1-179.3-68.4168.1000111.8S207 V210 L211 I231 L232 V237 H238 L239S207-I235 WeakPolarHBondContact OG-CG2 3.39Å; V210-I235 HydrophobicContact CB-CD1 3.72Å; V210-I235 HydrophobicContact CG1-CD1 3.22Å; V210-I235 HydrophobicContact CG2-CD1 4.28Å; L211-I235 HydrophobicContact CD1-CG2 3.87Å; I231-I235 HydrophobicContact CG2-CD1 4.01Å; I231-I235 WeakPolarHBondContact O-CG1 3.23Å; I231-I235 PolarHBondContact O-N 2.89Å; L232-I235 PolarHBondContact O-N 2.89Å; I235-V237 PolarHBondContact O-N 3.48Å; I235-H238 PolarHBondContact O-N 3.39Å; I235-L239 WeakPolarHBondContact O-CB 3.15Å; I235-L239 PolarHBondContact O-N 2.86Å
236I84Confident81.6Confident79 Ų7949 Ų4941%0.40525%0.254SS..Hα-helixtrans-60-47.5178.6-68.8170.3000110.3L232 R233 M234 H238 L239 C240L232-I236 HydrophobicContact CD1-CD1 4.05Å; L232-I236 HydrophobicContact CD1-CG1 4.4Å; L232-I236 HydrophobicContact CD2-CD1 4.47Å; L232-I236 HydrophobicContact CG-CD1 3.83Å; L232-I236 WeakPolarHBondContact O-CG1 3.42Å; L232-I236 PolarHBondContact O-N 3.38Å; R233-I236 PolarHBondContact O-N 2.97Å; M234-I236 PolarHBondContact O-N 2.97Å; I236-H238 PolarHBondContact O-N 2.86Å; I236-L239 PolarHBondContact O-N 3.46Å; I236-C240 WeakPolarHBondContact O-CB 3.33Å; I236-C240 PolarHBondContact O-N 3.22Å; I236-C240 PolarHBondContact O-SG 3.49Å
237V85.9Confident83Confident28 Ų2847.7 Ų47.717%0.1724%0.243CC..Hα-helixtrans-60.8-46.1179.7168.60000111.4R233 M234 I235 L239 C240 I241 I293 F297R233-V237 HydrophobicContact CG-CG2 4.42Å; R233-V237 WeakPolarHBondContact O-CB 3.34Å; R233-V237 VanDerWaalsContact O-CG2 3.23Å; R233-V237 WeakPolarHBondContact O-CG2 3.46Å; R233-V237 PolarHBondContact O-N 3.42Å; M234-V237 PolarHBondContact O-N 3.48Å; I235-V237 PolarHBondContact O-N 3.48Å; V237-L239 PolarHBondContact O-N 2.97Å; V237-C240 PolarHBondContact O-N 3.47Å; V237-I241 HydrophobicContact CG1-CD1 3.64Å; V237-I241 HydrophobicContact CG1-CG1 4.5Å; V237-I241 WeakPolarHBondContact O-CG1 3.48Å; V237-I241 PolarHBondContact O-N 2.96Å; V237-I293 HydrophobicContact CG1-CG2 3.94Å; V237-F297 HydrophobicContact CB-CD2 4.21Å; V237-F297 HydrophobicContact CG1-CD2 3.93Å; V237-F297 HydrophobicContact CG1-CE2 4.4Å; V237-F297 HydrophobicContact CG2-CD2 3.87Å; V237-F297 HydrophobicContact CG2-CE2 3.95Å
238H82.2Confident84.1Confident7 Ų745.1 Ų45.13%0.03223%0.232CC..Hα-helixtrans-60.5-47.2176.9-74.194.3000112I114 M234 I235 I236 C240 I241 F242 V294 T298I114-H238 WeakPolarHBondContact CG2-NE2 3.23Å; M234-H238 WeakPolarHBondContact CG-CE1 3.35Å; M234-H238 PolarHBondContact O-N 3.48Å; M234-H238 PolarHBondContact O-ND1 3.31Å; I235-H238 PolarHBondContact O-N 3.39Å; I236-H238 PolarHBondContact O-N 2.86Å; H238-C240 VanDerWaalsContact C-N 3.35Å; H238-C240 PolarHBondContact O-N 3.5Å; H238-I241 PolarHBondContact O-N 3.24Å; H238-F242 VanDerWaalsContact O-CB 3.31Å; H238-F242 WeakPolarHBondContact O-CB 3.31Å; H238-F242 PolarHBondContact O-N 3.17Å; H238-V294 VanDerWaalsContact CD2-CG1 3.44Å; H238-V294 WeakPolarHBondContact CD2-CG1 3.2Å; H238-V294 WeakPolarHBondContact NE2-CG1 3.44Å; H238-T298 PolarHBondContact CE1-OG1 3.42Å; H238-T298 PolarHBondContact NE2-OG1 3.04Å
239L86.8Confident85Confident46 Ų4641.9 Ų41.924%0.24122%0.218CC..Hα-helixtrans-64.2-42.4-178.8-172.765.8000110.9N203 V204 I235 I236 V237 F242 C243N203-L239 HydrophobicContact CB-CD1 4.47Å; V204-L239 HydrophobicContact CG2-CD1 4.05Å; I235-L239 WeakPolarHBondContact O-CB 3.15Å; I235-L239 PolarHBondContact O-N 2.86Å; I236-L239 PolarHBondContact O-N 3.46Å; V237-L239 PolarHBondContact O-N 2.97Å; L239-F242 PolarHBondContact O-N 3.23Å; L239-C243 VanDerWaalsContact O-CB 3.23Å; L239-C243 WeakPolarHBondContact O-CB 3.47Å; L239-C243 PolarHBondContact O-N 3.36Å; L239-C243 PolarHBondContact O-SG 3.19Å
240C89.4Confident85.7Confident76 Ų7637.9 Ų37.951%0.51419%0.193SC..Hα-helixtrans-61.6-47176.3-72.30000111.9I236 V237 H238 C243 F244I236-C240 WeakPolarHBondContact O-CB 3.33Å; I236-C240 PolarHBondContact O-N 3.22Å; I236-C240 PolarHBondContact O-SG 3.49Å; V237-C240 PolarHBondContact O-N 3.47Å; H238-C240 VanDerWaalsContact C-N 3.35Å; H238-C240 PolarHBondContact O-N 3.5Å; C240-C243 PolarHBondContact O-N 3.43Å; C240-F244 WeakPolarHBondContact O-CB 3.35Å; C240-F244 PolarHBondContact O-N 3.3Å
241I89.6Confident86.4Confident17 Ų1739.1 Ų39.19%0.08720%0.203CC..Hα-helixtrans-64.4-46179-69.9165.4000110.4V237 H238 C243 F244 C245 F290 I293 V294V237-I241 HydrophobicContact CG1-CD1 3.64Å; V237-I241 HydrophobicContact CG1-CG1 4.5Å; V237-I241 WeakPolarHBondContact O-CG1 3.48Å; V237-I241 PolarHBondContact O-N 2.96Å; H238-I241 PolarHBondContact O-N 3.24Å; I241-C243 PolarHBondContact O-N 3.13Å; I241-F244 PolarHBondContact O-N 3.46Å; I241-C245 VanDerWaalsContact O-CB 3.3Å; I241-C245 WeakPolarHBondContact O-CB 3.38Å; I241-C245 PolarHBondContact O-N 2.73Å; I241-C245 PolarHBondContact O-SG 3.48Å; I241-F290 HydrophobicContact CD1-CB 3.97Å; I241-F290 HydrophobicContact CG1-CB 4.15Å; I241-F290 HydrophobicContact CG2-CB 3.82Å; I241-I293 HydrophobicContact CD1-CB 4.46Å; I241-V294 HydrophobicContact CD1-CG2 3.66Å
242F88.2Confident87Confident1 Ų138.2 Ų38.20%0.00420%0.199CC..Hα-helixtrans-58.5-50.8177.6-176.4-81.4000111.2M108 L111 F196 P199 L200 H238 L239 F246M108-F242 HydrophobicContact CB-CE2 3.84Å; M108-F242 HydrophobicContact CB-CZ 4.45Å; M108-F242 HydrophobicContact CG-CE2 3.79Å; M108-F242 HydrophobicContact CG-CZ 4.21Å; L111-F242 HydrophobicContact CD1-CD2 4.31Å; F196-F242 HydrophobicContact CE2-CE1 4.27Å; P199-F242 HydrophobicContact CB-CE2 4.33Å; P199-F242 HydrophobicContact CB-CZ 4.05Å; L200-F242 HydrophobicContact CB-CE1 3.92Å; L200-F242 HydrophobicContact CB-CZ 4.36Å; L200-F242 HydrophobicContact CD1-CD1 4.03Å; L200-F242 HydrophobicContact CD1-CE1 3.6Å; L200-F242 HydrophobicContact CG-CE1 4.37Å; H238-F242 VanDerWaalsContact O-CB 3.31Å; H238-F242 WeakPolarHBondContact O-CB 3.31Å; H238-F242 PolarHBondContact O-N 3.17Å; L239-F242 PolarHBondContact O-N 3.23Å; F242-F246 HydrophobicContact CB-CD2 4.36Å; F242-F246 HydrophobicContact CD1-CD2 4.42Å; F242-F246 AromaticContact CD2-CD2 3.63Å; F242-F246 HydrophobicContact CD2-CD2 3.63Å; F242-F246 AromaticContact CD2-CE2 3.96Å; F242-F246 HydrophobicContact CD2-CE2 3.96Å; F242-F246 AromaticContact CE2-CD2 3.93Å; F242-F246 HydrophobicContact CE2-CD2 3.93Å; F242-F246 HydrophobicContact CE2-CE2 4.39Å; F242-F246 AromaticContact CG-CD2 3.9Å; F242-F246 HydrophobicContact CG-CD2 3.9Å; F242-F246 HydrophobicContact CG-CE2 4.5Å; F242-F246 HydrophobicContact CZ-CD2 4.41Å; F242-F246 VanDerWaalsContact O-CB 3.32Å; F242-F246 WeakPolarHBondContact O-CB 3.39Å; F242-F246 VanDerWaalsContact O-CD2 3.28Å; F242-F246 WeakPolarHBondContact O-CD2 3.48Å; F242-F246 PolarHBondContact O-N 3.3Å
243C90.4Very high87.3Confident35 Ų3536.5 Ų36.524%0.23619%0.19CC..Hα-helixtrans-62.4-46.6179.9-72.70000111.5L239 C240 I241 I247 P248L239-C243 VanDerWaalsContact O-CB 3.23Å; L239-C243 WeakPolarHBondContact O-CB 3.47Å; L239-C243 PolarHBondContact O-N 3.36Å; L239-C243 PolarHBondContact O-SG 3.19Å; C240-C243 PolarHBondContact O-N 3.43Å; I241-C243 PolarHBondContact O-N 3.13Å; C243-I247 HydrophobicContact CB-CD1 3.55Å; C243-I247 HydrophobicContact CB-CG1 4.37Å; C243-I247 WeakPolarHBondContact O-CB 3.41Å; C243-I247 WeakPolarHBondContact O-CG1 3.25Å; C243-I247 PolarHBondContact O-N 2.86Å; C243-I247 VanDerWaalsContact O-N 3.13Å; C243-P248 WeakPolarHBondContact O-CD 3.18Å
244F92.2Very high87.5Confident112 Ų11232.3 Ų32.349%0.49118%0.18SC..Hα-helixtrans-65.5-44.6-178.5178-105.5000112.4C240 I241 P248 I283 F290C240-F244 WeakPolarHBondContact O-CB 3.35Å; C240-F244 PolarHBondContact O-N 3.3Å; I241-F244 PolarHBondContact O-N 3.46Å; F244-P248 WeakPolarHBondContact O-CD 3.35Å; F244-P248 VanDerWaalsContact O-CG 3.3Å; F244-P248 WeakPolarHBondContact O-CG 3.38Å; F244-I283 HydrophobicContact CD1-CG2 3.99Å; F244-I283 HydrophobicContact CE1-CG2 3.69Å; F244-I283 HydrophobicContact CE2-CG2 4.39Å; F244-I283 HydrophobicContact CG-CG2 4.47Å; F244-I283 HydrophobicContact CZ-CG2 3.9Å; F244-I283 VanDerWaalsContact O-CG2 3.22Å; F244-I283 WeakPolarHBondContact O-CG2 3.25Å; F244-F290 HydrophobicContact CD1-CE2 4.34Å; F244-F290 HydrophobicContact CE1-CE2 4.1Å; F244-F290 HydrophobicContact CE1-CZ 4.25Å
245C91.8Very high87.6Confident0 Ų036.4 Ų36.40%020%0.197CC..Hα-helixtrans-76.3-41.6-176.2-60.10000112.2I241 A284 N287I241-C245 VanDerWaalsContact O-CB 3.3Å; I241-C245 WeakPolarHBondContact O-CB 3.38Å; I241-C245 PolarHBondContact O-N 2.73Å; I241-C245 PolarHBondContact O-SG 3.48Å; C245-A284 WeakPolarHBondContact O-CA 3.18Å; C245-A284 VanDerWaalsContact O-CB 3.31Å; C245-A284 WeakPolarHBondContact O-CB 3.35Å; C245-N287 HydrophobicContact CB-CB 4.01Å
246F90.4Very high87.6Confident2 Ų238.3 Ų38.31%0.00921%0.205CC..Hα-helixtrans-102.6-32.7-166.2-59.5-58.8000114.5M104 M108 L111 F196 F242 N250 N287M104-F246 HydrophobicContact CG-CD1 4.44Å; M104-F246 HydrophobicContact CG-CE1 4.34Å; M108-F246 HydrophobicContact CE-CB 3.87Å; M108-F246 HydrophobicContact CE-CD1 3.3Å; M108-F246 HydrophobicContact CE-CE1 3.96Å; M108-F246 HydrophobicContact CE-CG 3.67Å; M108-F246 HydrophobicContact CG-CD1 3.92Å; M108-F246 HydrophobicContact CG-CD2 3.83Å; M108-F246 HydrophobicContact CG-CE1 3.99Å; M108-F246 HydrophobicContact CG-CE2 3.94Å; M108-F246 HydrophobicContact CG-CG 3.83Å; M108-F246 HydrophobicContact CG-CZ 4.01Å; M108-F246 HydrophobicContact SD-CD1 4.41Å; M108-F246 HydrophobicContact SD-CG 4.38Å; L111-F246 HydrophobicContact CD1-CE2 3.96Å; F196-F246 HydrophobicContact CD2-CB 4.32Å; F196-F246 HydrophobicContact CE2-CB 3.88Å; F242-F246 HydrophobicContact CB-CD2 4.36Å; F242-F246 HydrophobicContact CD1-CD2 4.42Å; F242-F246 AromaticContact CD2-CD2 3.63Å; F242-F246 HydrophobicContact CD2-CD2 3.63Å; F242-F246 AromaticContact CD2-CE2 3.96Å; F242-F246 HydrophobicContact CD2-CE2 3.96Å; F242-F246 AromaticContact CE2-CD2 3.93Å; F242-F246 HydrophobicContact CE2-CD2 3.93Å; F242-F246 HydrophobicContact CE2-CE2 4.39Å; F242-F246 AromaticContact CG-CD2 3.9Å; F242-F246 HydrophobicContact CG-CD2 3.9Å; F242-F246 HydrophobicContact CG-CE2 4.5Å; F242-F246 HydrophobicContact CZ-CD2 4.41Å; F242-F246 VanDerWaalsContact O-CB 3.32Å; F242-F246 WeakPolarHBondContact O-CB 3.39Å; F242-F246 VanDerWaalsContact O-CD2 3.28Å; F242-F246 WeakPolarHBondContact O-CD2 3.48Å; F242-F246 PolarHBondContact O-N 3.3Å; F246-N250 PolarHBondContact O-N 2.95Å; F246-N250 VanDerWaalsContact O-N 3.14Å; F246-N250 PolarHBondContact O-ND2 3.49Å; F246-N287 HydrophobicContact CE1-CB 4.37Å; F246-N287 HydrophobicContact CZ-CB 3.99Å; F246-N287 VanDerWaalsContact CZ-CG 3.49Å
247I90.8Very high87.2Confident58 Ų5834.8 Ų34.830%0.29719%0.187SC..Hα-helixtrans-61.2-50.2-179.2-64.6170.7000111.6F196 L200 C243 Y249 N250 V251F196-I247 HydrophobicContact CE2-CG1 4.42Å; F196-I247 HydrophobicContact CZ-CB 4.33Å; F196-I247 HydrophobicContact CZ-CG1 3.84Å; L200-I247 HydrophobicContact CD1-CD1 4.28Å; L200-I247 HydrophobicContact CD1-CG1 4.33Å; C243-I247 HydrophobicContact CB-CD1 3.55Å; C243-I247 HydrophobicContact CB-CG1 4.37Å; C243-I247 WeakPolarHBondContact O-CB 3.41Å; C243-I247 WeakPolarHBondContact O-CG1 3.25Å; C243-I247 PolarHBondContact O-N 2.86Å; C243-I247 VanDerWaalsContact O-N 3.13Å; I247-Y249 VanDerWaalsContact C-N 3.29Å; I247-Y249 PolarHBondContact O-N 3.37Å; I247-N250 PolarHBondContact O-N 2.93Å; I247-V251 HydrophobicContact CG2-CG2 3.71Å; I247-V251 VanDerWaalsContact O-CB 3.26Å; I247-V251 WeakPolarHBondContact O-CB 3.36Å; I247-V251 VanDerWaalsContact O-CG2 3.25Å; I247-V251 WeakPolarHBondContact O-CG2 3.3Å; I247-V251 PolarHBondContact O-N 3.33Å
248P92.4Very high86.9Confident45 Ų4536.2 Ų36.229%0.29219%0.193SC..Hα-helixtrans-58.8-42.3-174.5-25.235.7000112.3C243 F244 N252 A280C243-P248 WeakPolarHBondContact O-CD 3.18Å; F244-P248 WeakPolarHBondContact O-CD 3.35Å; F244-P248 VanDerWaalsContact O-CG 3.3Å; F244-P248 WeakPolarHBondContact O-CG 3.38Å; P248-N252 WeakPolarHBondContact O-CB 3.41Å; P248-N252 PolarHBondContact O-N 2.97Å; P248-N252 VanDerWaalsContact O-N 3.13Å; P248-A280 HydrophobicContact CB-CB 3.96Å
249Y90.5Very high86.8Confident0 Ų036.9 Ų36.90%020%0.198CC..Hα-helixtrans-68.9-53-178.4175.8-99.4000111.8M104 I247 V251 N252 L253 Y277 L281 A284M104-Y249 HydrophobicContact CE-CD1 3.81Å; M104-Y249 HydrophobicContact CE-CE1 3.52Å; M104-Y249 HydrophobicContact SD-CD1 3.68Å; M104-Y249 HydrophobicContact SD-CE1 3.38Å; M104-Y249 WeakPolarHBondContact SD-CE1 3.35Å; I247-Y249 VanDerWaalsContact C-N 3.29Å; I247-Y249 PolarHBondContact O-N 3.37Å; Y249-V251 PolarHBondContact O-N 2.99Å; Y249-N252 PolarHBondContact O-N 3.13Å; Y249-L253 HydrophobicContact CE1-CD2 4.29Å; Y249-L253 WeakPolarHBondContact O-CB 3.46Å; Y249-L253 PolarHBondContact O-N 2.93Å; Y249-Y277 HydrophobicContact CD2-CE2 4.41Å; Y249-Y277 AromaticContact CE2-CE2 3.69Å; Y249-Y277 HydrophobicContact CE2-CE2 3.69Å; Y249-Y277 AromaticContact CE2-CZ 3.9Å; Y249-Y277 PolarHBondContact OH-OH 3.41Å; Y249-L281 HydrophobicContact CD2-CB 4.04Å; Y249-L281 HydrophobicContact CD2-CD1 4.07Å; Y249-L281 HydrophobicContact CE2-CB 4.15Å; Y249-L281 HydrophobicContact CE2-CD1 3.66Å; Y249-L281 HydrophobicContact CE2-CG 4.47Å; Y249-A284 HydrophobicContact CG-CB 4.19Å
250N87.2Confident86.2Confident6 Ų639.4 Ų39.43%0.03220%0.204CC..Hα-helixtrans-68.2-39.4-174.7-70.9-77.9000112.1M104 M108 F196 F246 I247 L253 V254M104-N250 WeakPolarHBondContact CE-OD1 3.4Å; M108-N250 VanDerWaalsContact CE-ND2 3.32Å; M108-N250 WeakPolarHBondContact CE-ND2 3.35Å; F196-N250 HydrophobicContact CB-CB 4Å; F196-N250 HydrophobicContact CD1-CB 3.47Å; F196-N250 VanDerWaalsContact CD1-CB 3.47Å; F196-N250 HydrophobicContact CD2-CB 3.76Å; F196-N250 VanDerWaalsContact CD2-CG 3.49Å; F196-N250 VanDerWaalsContact CD2-ND2 3.3Å; F196-N250 WeakPolarHBondContact CD2-ND2 3.4Å; F196-N250 HydrophobicContact CE1-CB 3.8Å; F196-N250 HydrophobicContact CE2-CB 4.07Å; F196-N250 HydrophobicContact CG-CB 3.44Å; F196-N250 VanDerWaalsContact CG-CB 3.44Å; F196-N250 VanDerWaalsContact CG-CG 3.42Å; F196-N250 HydrophobicContact CZ-CB 4.07Å; F246-N250 PolarHBondContact O-N 2.95Å; F246-N250 VanDerWaalsContact O-N 3.14Å; F246-N250 PolarHBondContact O-ND2 3.49Å; I247-N250 PolarHBondContact O-N 2.93Å; N250-L253 PolarHBondContact O-N 3.44Å; N250-V254 WeakPolarHBondContact O-CG2 3.47Å; N250-V254 PolarHBondContact O-N 3.34Å; N250-V254 VanDerWaalsContact O-N 3.17Å
251V88.1Confident85.5Confident62 Ų6238.5 Ų38.538%0.37620%0.196SC..Hα-helixtrans-63.5-46.9175.2172.40000110.5I247 Y249 L253 V254 F255I247-V251 HydrophobicContact CG2-CG2 3.71Å; I247-V251 VanDerWaalsContact O-CB 3.26Å; I247-V251 WeakPolarHBondContact O-CB 3.36Å; I247-V251 VanDerWaalsContact O-CG2 3.25Å; I247-V251 WeakPolarHBondContact O-CG2 3.3Å; I247-V251 PolarHBondContact O-N 3.33Å; Y249-V251 PolarHBondContact O-N 2.99Å; V251-L253 VanDerWaalsContact C-N 3.29Å; V251-L253 PolarHBondContact O-N 3.33Å; V251-V254 PolarHBondContact O-N 3.03Å; V251-F255 HydrophobicContact CG1-CD2 3.82Å; V251-F255 HydrophobicContact CG1-CE2 3.54Å; V251-F255 VanDerWaalsContact O-CD2 3.23Å; V251-F255 WeakPolarHBondContact O-CD2 3.5Å; V251-F255 PolarHBondContact O-N 2.88Å; V251-F255 VanDerWaalsContact O-N 3.14Å
252N88.1Confident84.7Confident10 Ų1045.3 Ų45.35%0.05323%0.225CC..Hα-helixtrans-67.8-30.5179.7-166.768.3000112.4P248 Y249 F255 Y256 V273 I276 Y277P248-N252 WeakPolarHBondContact O-CB 3.41Å; P248-N252 PolarHBondContact O-N 2.97Å; P248-N252 VanDerWaalsContact O-N 3.13Å; Y249-N252 PolarHBondContact O-N 3.13Å; N252-F255 PolarHBondContact O-N 2.9Å; N252-Y256 VanDerWaalsContact O-CB 3.27Å; N252-Y256 WeakPolarHBondContact O-CB 3.48Å; N252-Y256 PolarHBondContact O-N 3.06Å; N252-V273 PolarHBondContact ND2-O 3.22Å; N252-I276 HydrophobicContact CB-CG2 4.14Å; N252-Y277 WeakPolarHBondContact ND2-CA 3.47Å; N252-Y277 VanDerWaalsContact ND2-CB 3.31Å; N252-Y277 WeakPolarHBondContact ND2-CB 3.3Å; N252-Y277 PolarHBondContact ND2-N 3.04Å
253L83.2Confident84.2Confident28 Ų2850 Ų5015%0.14725%0.254CS..Hα-helixtrans-63.1-40.6173.5-174.770.7000111.7E192 Y249 N250 V251 Y256 A257 Y277E192-L253 HydrophobicContact CB-CD2 3.85Å; E192-L253 HydrophobicContact CG-CD2 3.85Å; E192-L253 WeakPolarHBondContact OE2-CD2 3.04Å; Y249-L253 HydrophobicContact CE1-CD2 4.29Å; Y249-L253 WeakPolarHBondContact O-CB 3.46Å; Y249-L253 PolarHBondContact O-N 2.93Å; N250-L253 PolarHBondContact O-N 3.44Å; V251-L253 VanDerWaalsContact C-N 3.29Å; V251-L253 PolarHBondContact O-N 3.33Å; L253-Y256 PolarHBondContact O-N 2.88Å; L253-A257 WeakPolarHBondContact O-CB 3.01Å; L253-A257 PolarHBondContact O-N 3.11Å; L253-Y277 HydrophobicContact CD1-CE2 3.87Å
254V83.3Confident83.6Confident51 Ų5151 Ų5131%0.30926%0.257SS..Hα-helixtrans-63.8-44.9174.2174.90000111N250 V251 Y256 A257 L258N250-V254 WeakPolarHBondContact O-CG2 3.47Å; N250-V254 PolarHBondContact O-N 3.34Å; N250-V254 VanDerWaalsContact O-N 3.17Å; V251-V254 PolarHBondContact O-N 3.03Å; V254-Y256 PolarHBondContact O-N 3.1Å; V254-A257 WeakPolarHBondContact O-CB 3.4Å; V254-A257 PolarHBondContact O-N 3.15Å; V254-L258 HydrophobicContact CG1-CD1 4.19Å; V254-L258 WeakPolarHBondContact O-CG 3.17Å; V254-L258 PolarHBondContact O-N 3.47Å
255F84.5Confident82.8Confident91 Ų9153.1 Ų53.140%0.39927%0.268SS..Hα-helixtrans-63.7-40.9175.1-76.1-67000112.4V251 N252 A257 L258 V259 I264 V273V251-F255 HydrophobicContact CG1-CD2 3.82Å; V251-F255 HydrophobicContact CG1-CE2 3.54Å; V251-F255 VanDerWaalsContact O-CD2 3.23Å; V251-F255 WeakPolarHBondContact O-CD2 3.5Å; V251-F255 PolarHBondContact O-N 2.88Å; V251-F255 VanDerWaalsContact O-N 3.14Å; N252-F255 PolarHBondContact O-N 2.9Å; F255-A257 VanDerWaalsContact C-N 3.26Å; F255-A257 PolarHBondContact O-N 3.04Å; F255-L258 PolarHBondContact O-N 2.97Å; F255-V259 WeakPolarHBondContact O-CG2 3.23Å; F255-V259 PolarHBondContact O-N 3.05Å; F255-I264 HydrophobicContact CD1-CD1 4.36Å; F255-V273 HydrophobicContact CB-CG1 4.13Å; F255-V273 HydrophobicContact CB-CG2 3.88Å
256Y80Confident82.3Confident51 Ų5155 Ų5520%0.229%0.287CS..Hα-helixtrans-59-42.8176.6-174.8-87.9000110.8W180 N252 L253 V254 R260 V273 R274W180-Y256 HydrophobicContact CH2-CE1 4.47Å; W180-Y256 HydrophobicContact CZ2-CD1 4.37Å; W180-Y256 HydrophobicContact CZ2-CE1 4.14Å; N252-Y256 VanDerWaalsContact O-CB 3.27Å; N252-Y256 WeakPolarHBondContact O-CB 3.48Å; N252-Y256 PolarHBondContact O-N 3.06Å; L253-Y256 PolarHBondContact O-N 2.88Å; V254-Y256 PolarHBondContact O-N 3.1Å; Y256-R260 HydrophobicContact CD1-CG 3.92Å; Y256-R260 HydrophobicContact CE1-CG 3.61Å; Y256-R260 WeakPolarHBondContact O-CB 3.15Å; Y256-R260 WeakPolarHBondContact O-CG 3.42Å; Y256-R260 PolarHBondContact O-N 3.31Å; Y256-R260 PolarHBondContact OH-NH1 3.46Å; Y256-V273 VanDerWaalsContact CA-CG1 3.41Å; Y256-V273 HydrophobicContact CD2-CG1 4.1Å; Y256-V273 HydrophobicContact CG-CG1 4.4Å; Y256-R274 HydrophobicContact CD2-CG 4.35Å; Y256-R274 HydrophobicContact CE2-CG 3.95Å
257A76.5Confident81.9Confident5 Ų557 Ų574%0.04130%0.302CS..Hα-helixtrans-59.4-50.6173.100000113.5I189 L253 V254 F255 V259 R260 T261I189-A257 HydrophobicContact CD1-CB 3.21Å; I189-A257 HydrophobicContact CG1-CB 3.49Å; I189-A257 VanDerWaalsContact CG1-CB 3.49Å; I189-A257 HydrophobicContact CG2-CB 4.2Å; L253-A257 WeakPolarHBondContact O-CB 3.01Å; L253-A257 PolarHBondContact O-N 3.11Å; V254-A257 WeakPolarHBondContact O-CB 3.4Å; V254-A257 PolarHBondContact O-N 3.15Å; F255-A257 VanDerWaalsContact C-N 3.26Å; F255-A257 PolarHBondContact O-N 3.04Å; A257-V259 VanDerWaalsContact C-N 3.33Å; A257-V259 PolarHBondContact O-N 3.18Å; A257-R260 PolarHBondContact O-N 3.34Å; A257-R260 VanDerWaalsContact O-N 3.14Å; A257-T261 WeakPolarHBondContact O-CG2 3.25Å; A257-T261 PolarHBondContact O-N 3.35Å; A257-T261 PolarHBondContact O-OG1 3.29Å
258L79.9Confident81.5Confident57 Ų5762 Ų6230%0.29832%0.322SS..Hα-helixtrans-62.4-37.7-179.2-69.1171.2000113V254 F255 T261 T263 I264V254-L258 HydrophobicContact CG1-CD1 4.19Å; V254-L258 WeakPolarHBondContact O-CG 3.17Å; V254-L258 PolarHBondContact O-N 3.47Å; F255-L258 PolarHBondContact O-N 2.97Å; L258-T261 PolarHBondContact O-OG1 3.09Å; L258-T263 HydrophobicContact CD2-CG2 4.23Å; L258-T263 PolarHBondContact O-N 3.46Å; L258-I264 HydrophobicContact CB-CD1 3.9Å; L258-I264 HydrophobicContact CB-CG1 4.16Å; L258-I264 HydrophobicContact CD1-CD1 3.88Å; L258-I264 PolarHBondContact O-N 2.93Å
259V80Confident81.1Confident21 Ų2162.2 Ų62.213%0.12732%0.322CS..Hα-helixtrans-66.4-44.2173.9170.80000110.2F255 A257 T261 K262 I264 T269 E270 V273F255-V259 WeakPolarHBondContact O-CG2 3.23Å; F255-V259 PolarHBondContact O-N 3.05Å; A257-V259 VanDerWaalsContact C-N 3.33Å; A257-V259 PolarHBondContact O-N 3.18Å; V259-T261 PolarHBondContact O-N 3.13Å; V259-K262 PolarHBondContact O-N 2.92Å; V259-K262 VanDerWaalsContact O-N 3.1Å; V259-I264 HydrophobicContact CG2-CB 4.47Å; V259-T269 HydrophobicContact CG2-CG2 4.1Å; V259-E270 HydrophobicContact CG1-CB 3.81Å; V259-E270 HydrophobicContact CG1-CG 3.85Å; V259-V273 HydrophobicContact CG2-CG2 4.49Å
260R74.6Confident80.8Confident99 Ų9964.8 Ų64.837%0.37433%0.334SS..Hα-helixtrans-69.2-30.5-179.1-72.6-78-61.7-99.5-3.3113.7W180 Y256 A257 K262W180-R260 VanDerWaalsContact CD2-NH2 3.28Å; W180-R260 HydrophobicContact CE3-CB 4.29Å; W180-R260 HydrophobicContact CH2-CB 3.39Å; W180-R260 HydrophobicContact CH2-CG 3.74Å; W180-R260 HydrophobicContact CZ2-CG 4.5Å; W180-R260 HydrophobicContact CZ3-CB 3.25Å; W180-R260 HydrophobicContact CZ3-CG 3.95Å; Y256-R260 HydrophobicContact CD1-CG 3.92Å; Y256-R260 HydrophobicContact CE1-CG 3.61Å; Y256-R260 WeakPolarHBondContact O-CB 3.15Å; Y256-R260 WeakPolarHBondContact O-CG 3.42Å; Y256-R260 PolarHBondContact O-N 3.31Å; Y256-R260 PolarHBondContact OH-NH1 3.46Å; A257-R260 PolarHBondContact O-N 3.34Å; A257-R260 VanDerWaalsContact O-N 3.14Å; R260-K262 PolarHBondContact O-N 2.84Å
261T72.9Confident80.6Confident57 Ų5767.2 Ų67.235%0.3535%0.351SS..THydrogen-bonded Turntrans-79.52.9172.955.60000113.1A257 L258 V259 T263A257-T261 WeakPolarHBondContact O-CG2 3.25Å; A257-T261 PolarHBondContact O-N 3.35Å; A257-T261 PolarHBondContact O-OG1 3.29Å; L258-T261 PolarHBondContact O-OG1 3.09Å; V259-T261 PolarHBondContact O-N 3.13Å; T261-T263 PolarHBondContact O-N 2.92Å; T261-T263 PolarHBondContact OG1-OG1 2.98Å
262K74.5Confident80.6Confident160 Ų16066.7 Ų66.770%0.69635%0.348SS*.THydrogen-bonded Turntrans5920.6-175.3-56-171.3175.1-170.30114.3V259 R260 Q265V259-K262 PolarHBondContact O-N 2.92Å; V259-K262 VanDerWaalsContact O-N 3.1Å; R260-K262 PolarHBondContact O-N 2.84Å; K262-Q265 PolarHBondContact O-NE2 3.41Å
263T76.9Confident80.5Confident100 Ų10066.7 Ų66.761%0.61335%0.349SS*.SBendtrans-73.9-39175.6-52.20000110.6L258 T261L258-T263 HydrophobicContact CD2-CG2 4.23Å; L258-T263 PolarHBondContact O-N 3.46Å; T261-T263 PolarHBondContact O-N 2.92Å; T261-T263 PolarHBondContact OG1-OG1 2.98Å
264I77.2Confident80.5Confident57 Ų5767.5 Ų67.529%0.29235%0.349SS..SBendtrans-109.8127170-62.8175.9000107.7F255 L258 V259 T269F255-I264 HydrophobicContact CD1-CD1 4.36Å; L258-I264 HydrophobicContact CB-CD1 3.9Å; L258-I264 HydrophobicContact CB-CG1 4.16Å; L258-I264 HydrophobicContact CD1-CD1 3.88Å; L258-I264 PolarHBondContact O-N 2.93Å; V259-I264 HydrophobicContact CG2-CB 4.47Å; I264-T269 HydrophobicContact CG2-CG2 3.99Å
265Q76.4Confident80.6Confident155 Ų15567.9 Ų67.972%0.72435%0.352SS*.  trans-118.9136.7-177.9-60-177.8-0.700109.4K262K262-Q265 PolarHBondContact O-NE2 3.41Å
266G80.7Confident80.9Confident39 Ų3967 Ų6740%0.40235%0.351SS..  trans156.3124.7179.600000111.5F268 T269 E270G266-F268 VanDerWaalsContact C-N 3.3Å; G266-F268 PolarHBondContact O-N 3.2Å; G266-T269 PolarHBondContact O-N 3.11Å; G266-E270 PolarHBondContact O-N 3.36Å
267C81.6Confident81.3Confident46 Ų4667 Ų6731%0.31135%0.351SS..Hα-helixtrans-61-40.4-178-167.30000112.4C13 S271C13-C267 WeakPolarHBondContact CA-SG 3.34Å; C13-C267 HydrophobicContact CB-CB 4.47Å; C13-C267 WeakPolarHBondContact CB-SG 3.48Å; C13-C267 WeakPolarHBondContact SG-CA 2.91Å; C13-C267 WeakPolarHBondContact SG-CB 3.35Å; C13-C267 CovalentContact SG-SG 2.03Å; C13-C267 PolarHBondContact SG-SG 3.46Å; C267-S271 WeakPolarHBondContact O-CB 3.39Å; C267-S271 PolarHBondContact O-N 3.36Å
268F82.6Confident81.9Confident163 Ų16367 Ų6772%0.71535%0.35SS*.Hα-helixtrans-61.2-49.5175.5-179.6-101.6000111.4G266 E270 S271 V272G266-F268 VanDerWaalsContact C-N 3.3Å; G266-F268 PolarHBondContact O-N 3.2Å; F268-E270 PolarHBondContact O-N 3.15Å; F268-S271 PolarHBondContact O-N 2.86Å; F268-V272 HydrophobicContact CD1-CG2 4.18Å; F268-V272 HydrophobicContact CD2-CG2 4.3Å; F268-V272 HydrophobicContact CE1-CG2 3.83Å; F268-V272 HydrophobicContact CE2-CG2 3.95Å; F268-V272 HydrophobicContact CG-CG2 4.4Å; F268-V272 HydrophobicContact CZ-CG2 3.71Å; F268-V272 WeakPolarHBondContact O-CB 3.45Å; F268-V272 VanDerWaalsContact O-CG2 3.27Å; F268-V272 WeakPolarHBondContact O-CG2 3.35Å; F268-V272 PolarHBondContact O-N 2.84Å
269T84.3Confident82.5Confident49 Ų4968 Ų6830%0.30136%0.355SS..Hα-helixtrans-62.9-42.8179.7-52.60000112V259 I264 G266 V272 V273V259-T269 HydrophobicContact CG2-CG2 4.1Å; I264-T269 HydrophobicContact CG2-CG2 3.99Å; G266-T269 PolarHBondContact O-N 3.11Å; T269-V272 PolarHBondContact O-N 2.73Å; T269-V273 HydrophobicContact CG2-CG2 4.23Å; T269-V273 WeakPolarHBondContact O-CB 3.49Å; T269-V273 WeakPolarHBondContact O-CG2 3.42Å; T269-V273 PolarHBondContact O-N 2.78Å
270E83.2Confident83.2Confident54 Ų5467.1 Ų67.125%0.25235%0.35SS..Hα-helixtrans-60.7-46.2174.9-177.1179.4162.200111.4V259 G266 F268 R274V259-E270 HydrophobicContact CG1-CB 3.81Å; V259-E270 HydrophobicContact CG1-CG 3.85Å; G266-E270 PolarHBondContact O-N 3.36Å; F268-E270 PolarHBondContact O-N 3.15Å; E270-R274 HydrophobicContact CG-CG 4.43Å; E270-R274 VanDerWaalsContact O-CB 3.32Å; E270-R274 WeakPolarHBondContact O-CB 3.36Å; E270-R274 WeakPolarHBondContact O-CG 3.22Å; E270-R274 PolarHBondContact O-N 3.15Å; E270-R274 VanDerWaalsContact O-N 3.08Å; E270-R274 IonicContact OE1-NH1 3.13Å; E270-R274 PolarHBondContact OE1-NH1 2.93Å
271S84.1Confident84Confident56 Ų5663.1 Ų63.139%0.39234%0.336SS..Hα-helixtrans-61.5-46.7179.2-173.80000112C267 F268 R274 T275C267-S271 WeakPolarHBondContact O-CB 3.39Å; C267-S271 PolarHBondContact O-N 3.36Å; F268-S271 PolarHBondContact O-N 2.86Å; S271-R274 PolarHBondContact O-N 3.27Å; S271-T275 WeakPolarHBondContact O-CB 3.38Å; S271-T275 PolarHBondContact O-N 3.4Å; S271-T275 PolarHBondContact O-OG1 2.95Å
272V87.3Confident85Confident52 Ų5260.8 Ų60.832%0.31532%0.322SS..Hα-helixtrans-62.6-51.8180169.30000111.1F268 T269 R274 T275 I276F268-V272 HydrophobicContact CD1-CG2 4.18Å; F268-V272 HydrophobicContact CD2-CG2 4.3Å; F268-V272 HydrophobicContact CE1-CG2 3.83Å; F268-V272 HydrophobicContact CE2-CG2 3.95Å; F268-V272 HydrophobicContact CG-CG2 4.4Å; F268-V272 HydrophobicContact CZ-CG2 3.71Å; F268-V272 WeakPolarHBondContact O-CB 3.45Å; F268-V272 VanDerWaalsContact O-CG2 3.27Å; F268-V272 WeakPolarHBondContact O-CG2 3.35Å; F268-V272 PolarHBondContact O-N 2.84Å; T269-V272 PolarHBondContact O-N 2.73Å; V272-R274 VanDerWaalsContact C-N 3.29Å; V272-R274 PolarHBondContact O-N 3.48Å; V272-T275 PolarHBondContact O-N 3.22Å; V272-T275 VanDerWaalsContact O-N 3.13Å; V272-I276 HydrophobicContact CG1-CD1 3.54Å; V272-I276 HydrophobicContact CG1-CG1 4.32Å; V272-I276 WeakPolarHBondContact O-CG1 3.18Å; V272-I276 PolarHBondContact O-N 3.42Å
273V86.1Confident86Confident10 Ų1055.2 Ų55.26%0.06130%0.299CS..Hα-helixtrans-62.9-37.7-177171.10000111.6N252 F255 Y256 V259 T269 Y277N252-V273 PolarHBondContact ND2-O 3.22Å; F255-V273 HydrophobicContact CB-CG1 4.13Å; F255-V273 HydrophobicContact CB-CG2 3.88Å; Y256-V273 VanDerWaalsContact CA-CG1 3.41Å; Y256-V273 HydrophobicContact CD2-CG1 4.1Å; Y256-V273 HydrophobicContact CG-CG1 4.4Å; V259-V273 HydrophobicContact CG2-CG2 4.49Å; T269-V273 HydrophobicContact CG2-CG2 4.23Å; T269-V273 WeakPolarHBondContact O-CB 3.49Å; T269-V273 WeakPolarHBondContact O-CG2 3.42Å; T269-V273 PolarHBondContact O-N 2.78Å; V273-Y277 WeakPolarHBondContact O-CB 3.12Å; V273-Y277 PolarHBondContact O-N 3.19Å; V273-Y277 VanDerWaalsContact O-N 3.14Å
274R83.3Confident86.8Confident44 Ų4450.7 Ų50.717%0.16627%0.272CS..Hα-helixtrans-70.1-34.8175.6-72.2-177.267.5-174.5-4.3113.2K15 D17 Y256 E270 S271 V272 P278K15-R274 VanDerWaalsContact CE-NH1 3.28Å; D17-R274 IonicContact OD1-CZ 2.96Å; D17-R274 IonicContact OD1-NE 3.43Å; D17-R274 IonicContact OD1-NH2 3.77Å; D17-R274 PolarHBondContact OD1-NH2 3.28Å; D17-R274 IonicContact OD2-CZ 2.72Å; D17-R274 IonicContact OD2-NH2 3.63Å; D17-R274 PolarHBondContact OD2-NH2 2.94Å; Y256-R274 HydrophobicContact CD2-CG 4.35Å; Y256-R274 HydrophobicContact CE2-CG 3.95Å; E270-R274 HydrophobicContact CG-CG 4.43Å; E270-R274 VanDerWaalsContact O-CB 3.32Å; E270-R274 WeakPolarHBondContact O-CB 3.36Å; E270-R274 WeakPolarHBondContact O-CG 3.22Å; E270-R274 PolarHBondContact O-N 3.15Å; E270-R274 VanDerWaalsContact O-N 3.08Å; E270-R274 IonicContact OE1-NH1 3.13Å; E270-R274 PolarHBondContact OE1-NH1 2.93Å; S271-R274 PolarHBondContact O-N 3.27Å; V272-R274 VanDerWaalsContact C-N 3.29Å; V272-R274 PolarHBondContact O-N 3.48Å; R274-P278 WeakPolarHBondContact O-CD 3.11Å
275T86.9Confident87.5Confident59 Ų5948.1 Ų48.136%0.36226%0.259SS..Hα-helixtrans-72.6-40.3177.3-57.90000111.6F19 S271 V272 Y277 P278F19-T275 HydrophobicContact CE1-CG2 4.26Å; F19-T275 HydrophobicContact CZ-CG2 4.03Å; F19-T275 WeakPolarHBondContact CZ-O 3.41Å; S271-T275 WeakPolarHBondContact O-CB 3.38Å; S271-T275 PolarHBondContact O-N 3.4Å; S271-T275 PolarHBondContact O-OG1 2.95Å; V272-T275 PolarHBondContact O-N 3.22Å; V272-T275 VanDerWaalsContact O-N 3.13Å; T275-Y277 VanDerWaalsContact C-N 3.31Å; T275-Y277 PolarHBondContact O-N 3.02Å; T275-P278 WeakPolarHBondContact O-CD 3.33Å
276I89.9Confident88.3Confident72 Ų7241.9 Ų41.937%0.36923%0.232SC..Hα-helixtrans-69.5-30.8178.9-68.4173.1000111.3N252 V272 I279 A280N252-I276 HydrophobicContact CB-CG2 4.14Å; V272-I276 HydrophobicContact CG1-CD1 3.54Å; V272-I276 HydrophobicContact CG1-CG1 4.32Å; V272-I276 WeakPolarHBondContact O-CG1 3.18Å; V272-I276 PolarHBondContact O-N 3.42Å; I276-I279 PolarHBondContact O-N 3.4Å; I276-I279 VanDerWaalsContact O-N 3.12Å; I276-A280 HydrophobicContact CG2-CB 4.28Å; I276-A280 WeakPolarHBondContact O-CB 3.27Å; I276-A280 PolarHBondContact O-N 3.33Å
277Y87.9Confident88.9Confident52 Ų5240 Ų4020%0.20421%0.214CC..Hα-helixtrans-56.1-52.8-173.3-179-92000113.9Y249 N252 L253 V273 T275 I279 A280 L281Y249-Y277 HydrophobicContact CD2-CE2 4.41Å; Y249-Y277 AromaticContact CE2-CE2 3.69Å; Y249-Y277 HydrophobicContact CE2-CE2 3.69Å; Y249-Y277 AromaticContact CE2-CZ 3.9Å; Y249-Y277 PolarHBondContact OH-OH 3.41Å; N252-Y277 WeakPolarHBondContact ND2-CA 3.47Å; N252-Y277 VanDerWaalsContact ND2-CB 3.31Å; N252-Y277 WeakPolarHBondContact ND2-CB 3.3Å; N252-Y277 PolarHBondContact ND2-N 3.04Å; L253-Y277 HydrophobicContact CD1-CE2 3.87Å; V273-Y277 WeakPolarHBondContact O-CB 3.12Å; V273-Y277 PolarHBondContact O-N 3.19Å; V273-Y277 VanDerWaalsContact O-N 3.14Å; T275-Y277 VanDerWaalsContact C-N 3.31Å; T275-Y277 PolarHBondContact O-N 3.02Å; Y277-I279 VanDerWaalsContact C-N 3.3Å; Y277-I279 PolarHBondContact O-N 3.27Å; Y277-A280 PolarHBondContact O-N 2.85Å; Y277-L281 WeakPolarHBondContact O-CB 3.16Å; Y277-L281 PolarHBondContact O-N 2.85Å
278P90Very high89.3Confident5 Ų537.9 Ų37.93%0.03220%0.199CC..Hα-helixtrans-59.2-38.3175.2-26.635.3000114.3F19 K20 L23 Y24 R274 T275 L281 C282F19-P278 HydrophobicContact CE2-CB 4.16Å; F19-P278 HydrophobicContact CE2-CG 4.29Å; F19-P278 HydrophobicContact CZ-CB 4.29Å; F19-P278 HydrophobicContact CZ-CG 3.92Å; K20-P278 HydrophobicContact CB-CB 3.99Å; K20-P278 HydrophobicContact CB-CG 3.82Å; L23-P278 HydrophobicContact CD2-CB 4.08Å; Y24-P278 HydrophobicContact CE1-CB 3.69Å; Y24-P278 VanDerWaalsContact OH-CA 3.24Å; Y24-P278 WeakPolarHBondContact OH-CA 3.11Å; Y24-P278 WeakPolarHBondContact OH-CB 3.41Å; R274-P278 WeakPolarHBondContact O-CD 3.11Å; T275-P278 WeakPolarHBondContact O-CD 3.33Å; P278-L281 PolarHBondContact O-N 3.01Å; P278-C282 PolarHBondContact O-N 3.37Å; P278-C282 PolarHBondContact O-SG 3.36Å; P278-C282 VanDerWaalsContact O-SG 3.39Å
279I92.8Very high89.8Confident78 Ų7831.3 Ų31.340%0.417%0.173SC..Hα-helixtrans-66.5-50.2-179.1-59.5171.6000109.4F19 L23 I276 Y277 L281 C282 I283F19-I279 HydrophobicContact CE2-CG1 4.47Å; L23-I279 HydrophobicContact CD2-CG1 4.18Å; I276-I279 PolarHBondContact O-N 3.4Å; I276-I279 VanDerWaalsContact O-N 3.12Å; Y277-I279 VanDerWaalsContact C-N 3.3Å; Y277-I279 PolarHBondContact O-N 3.27Å; I279-L281 VanDerWaalsContact C-N 3.31Å; I279-L281 PolarHBondContact O-N 2.94Å; I279-C282 WeakPolarHBondContact O-CB 3.23Å; I279-C282 PolarHBondContact O-N 3.3Å; I279-I283 HydrophobicContact CG2-CD1 4.2Å; I279-I283 WeakPolarHBondContact O-CG1 3.26Å; I279-I283 PolarHBondContact O-N 3.48Å
280A93.6Very high90Very high2 Ų231.9 Ų31.92%0.01717%0.171CC..Hα-helixtrans-62.8-37.2178.700000112.3P248 I276 Y277 I283 A284P248-A280 HydrophobicContact CB-CB 3.96Å; I276-A280 HydrophobicContact CG2-CB 4.28Å; I276-A280 WeakPolarHBondContact O-CB 3.27Å; I276-A280 PolarHBondContact O-N 3.33Å; Y277-A280 PolarHBondContact O-N 2.85Å; A280-I283 PolarHBondContact O-N 2.8Å; A280-A284 PolarHBondContact O-N 2.86Å
281L91.6Very high90.2Very high15 Ų1529.3 Ų29.38%0.07916%0.159CC..Hα-helixtrans-61.7-45.7173.217863.3000111.8Y24 F100 Y249 Y277 P278 I279 I283 A284 V285Y24-L281 HydrophobicContact CE1-CB 4.46Å; Y24-L281 HydrophobicContact CE1-CD2 3.78Å; Y24-L281 HydrophobicContact CE1-CG 4.39Å; F100-L281 HydrophobicContact CE1-CD1 4.31Å; F100-L281 HydrophobicContact CE2-CD1 3.61Å; F100-L281 HydrophobicContact CZ-CD1 3.27Å; Y249-L281 HydrophobicContact CD2-CB 4.04Å; Y249-L281 HydrophobicContact CD2-CD1 4.07Å; Y249-L281 HydrophobicContact CE2-CB 4.15Å; Y249-L281 HydrophobicContact CE2-CD1 3.66Å; Y249-L281 HydrophobicContact CE2-CG 4.47Å; Y277-L281 WeakPolarHBondContact O-CB 3.16Å; Y277-L281 PolarHBondContact O-N 2.85Å; P278-L281 PolarHBondContact O-N 3.01Å; I279-L281 VanDerWaalsContact C-N 3.31Å; I279-L281 PolarHBondContact O-N 2.94Å; L281-I283 VanDerWaalsContact C-N 3.3Å; L281-I283 PolarHBondContact O-N 3.4Å; L281-A284 PolarHBondContact O-N 3.34Å; L281-V285 HydrophobicContact CD1-CG2 4.26Å; L281-V285 WeakPolarHBondContact O-CB 3.46Å; L281-V285 WeakPolarHBondContact O-CG2 3.41Å; L281-V285 PolarHBondContact O-N 3.13Å
282C94.7Very high90.1Very high8 Ų828 Ų285%0.05415%0.15CC..Hα-helixtrans-59.3-40.5175.3-790000112.5V27 P278 I279 S286V27-C282 HydrophobicContact CB-CB 4.31Å; V27-C282 HydrophobicContact CG1-CB 3.89Å; V27-C282 HydrophobicContact CG2-CB 4.2Å; P278-C282 PolarHBondContact O-N 3.37Å; P278-C282 PolarHBondContact O-SG 3.36Å; P278-C282 VanDerWaalsContact O-SG 3.39Å; I279-C282 WeakPolarHBondContact O-CB 3.23Å; I279-C282 PolarHBondContact O-N 3.3Å; C282-S286 PolarHBondContact O-N 2.96Å; C282-S286 VanDerWaalsContact O-N 3.15Å; C282-S286 PolarHBondContact O-OG 3.23Å
283I94.9Very high89.9Confident43 Ų4329 Ų2922%0.22115%0.153CC..Hα-helixtrans-63.5-45.5175.7-64.2170.1000110.2F244 I279 A280 L281 S286F244-I283 HydrophobicContact CD1-CG2 3.99Å; F244-I283 HydrophobicContact CE1-CG2 3.69Å; F244-I283 HydrophobicContact CE2-CG2 4.39Å; F244-I283 HydrophobicContact CG-CG2 4.47Å; F244-I283 HydrophobicContact CZ-CG2 3.9Å; F244-I283 VanDerWaalsContact O-CG2 3.22Å; F244-I283 WeakPolarHBondContact O-CG2 3.25Å; I279-I283 HydrophobicContact CG2-CD1 4.2Å; I279-I283 WeakPolarHBondContact O-CG1 3.26Å; I279-I283 PolarHBondContact O-N 3.48Å; A280-I283 PolarHBondContact O-N 2.8Å; L281-I283 VanDerWaalsContact C-N 3.3Å; L281-I283 PolarHBondContact O-N 3.4Å; I283-S286 WeakPolarHBondContact O-CB 3.42Å; I283-S286 PolarHBondContact O-N 3.4Å
284A93.1Very high89.6Confident6 Ų628.6 Ų28.65%0.0515%0.15CC..Hα-helixtrans-62.4-44.8178.300000112.8C245 Y249 A280 L281 S286 N287C245-A284 WeakPolarHBondContact O-CA 3.18Å; C245-A284 VanDerWaalsContact O-CB 3.31Å; C245-A284 WeakPolarHBondContact O-CB 3.35Å; Y249-A284 HydrophobicContact CG-CB 4.19Å; A280-A284 PolarHBondContact O-N 2.86Å; L281-A284 PolarHBondContact O-N 3.34Å; A284-S286 PolarHBondContact O-N 3.1Å; A284-N287 VanDerWaalsContact O-CB 3.25Å; A284-N287 WeakPolarHBondContact O-CB 3.37Å; A284-N287 PolarHBondContact O-N 3.33Å; A284-N287 VanDerWaalsContact O-N 3.11Å
285V92.4Very high89.5Confident2 Ų226.6 Ų26.61%0.01214%0.142CC..Hα-helixtrans-61.6-29.8177.2164.20000112.1F28 V31 F70 F100 L281 N287 C288F28-V285 HydrophobicContact CD1-CG1 3.82Å; F28-V285 HydrophobicContact CE1-CB 4.08Å; F28-V285 HydrophobicContact CE1-CG1 3.79Å; F28-V285 HydrophobicContact CE1-CG2 3.91Å; F28-V285 HydrophobicContact CZ-CG2 4.37Å; V31-V285 HydrophobicContact CB-CG1 4.37Å; V31-V285 HydrophobicContact CG1-CG1 3.92Å; V31-V285 HydrophobicContact CG2-CG1 4.29Å; F70-V285 HydrophobicContact CE1-CB 4.47Å; F70-V285 HydrophobicContact CE1-CG1 3.8Å; F70-V285 HydrophobicContact CE1-CG2 4.44Å; F70-V285 HydrophobicContact CZ-CB 4.3Å; F70-V285 HydrophobicContact CZ-CG1 3.7Å; F70-V285 HydrophobicContact CZ-CG2 3.87Å; F100-V285 HydrophobicContact CD2-CG2 4.22Å; F100-V285 HydrophobicContact CE2-CG2 3.67Å; L281-V285 HydrophobicContact CD1-CG2 4.26Å; L281-V285 WeakPolarHBondContact O-CB 3.46Å; L281-V285 WeakPolarHBondContact O-CG2 3.41Å; L281-V285 PolarHBondContact O-N 3.13Å; V285-N287 PolarHBondContact O-N 3.14Å; V285-C288 PolarHBondContact O-SG 3.49Å
286S93.8Very high89.1Confident24 Ų2427.7 Ų27.717%0.16814%0.14CC..THydrogen-bonded Turntrans-70.3-6.6178.1-57.80000113.7C282 I283 A284 C288 C289 F290C282-S286 PolarHBondContact O-N 2.96Å; C282-S286 VanDerWaalsContact O-N 3.15Å; C282-S286 PolarHBondContact O-OG 3.23Å; I283-S286 WeakPolarHBondContact O-CB 3.42Å; I283-S286 PolarHBondContact O-N 3.4Å; A284-S286 PolarHBondContact O-N 3.1Å; S286-C288 VanDerWaalsContact C-N 3.25Å; S286-C288 PolarHBondContact O-N 2.9Å; S286-C289 WeakPolarHBondContact O-CB 3.47Å; S286-C289 PolarHBondContact O-N 2.9Å; S286-F290 WeakPolarHBondContact O-CD2 3.5Å
287N92.7Very high88.5Confident1 Ų126 Ų261%0.00513%0.13CC..Hα-helixtrans-51.2-44.3176.8-177.675.8000112.6C245 F246 A284 V285 C289 F290 D291C245-N287 HydrophobicContact CB-CB 4.01Å; F246-N287 HydrophobicContact CE1-CB 4.37Å; F246-N287 HydrophobicContact CZ-CB 3.99Å; F246-N287 VanDerWaalsContact CZ-CG 3.49Å; A284-N287 VanDerWaalsContact O-CB 3.25Å; A284-N287 WeakPolarHBondContact O-CB 3.37Å; A284-N287 PolarHBondContact O-N 3.33Å; A284-N287 VanDerWaalsContact O-N 3.11Å; V285-N287 PolarHBondContact O-N 3.14Å; N287-C289 PolarHBondContact O-N 3.46Å; N287-C289 VanDerWaalsContact O-N 3.09Å; N287-F290 WeakPolarHBondContact O-CA 3.37Å; N287-F290 PolarHBondContact O-N 3.17Å; N287-D291 PolarHBondContact ND2-OD2 3.03Å; N287-D291 PolarHBondContact O-N 3.16Å; N287-D291 VanDerWaalsContact O-N 3.09Å
288C90.9Very high87.9Confident0 Ų023.8 Ų23.80%012%0.122CC..Hα-helixtrans-60.7-21.6-179.860.90000113.9V31 N39 D67 V71 V285 S286 D291V31-C288 WeakPolarHBondContact CG1-SG 2.88Å; N39-C288 PolarHBondContact ND2-O 2.84Å; D67-C288 HydrophobicContact CB-CB 3.88Å; V71-C288 HydrophobicContact CG2-CB 4.46Å; V285-C288 PolarHBondContact O-SG 3.49Å; S286-C288 VanDerWaalsContact C-N 3.25Å; S286-C288 PolarHBondContact O-N 2.9Å; C288-D291 WeakPolarHBondContact CA-OD2 3.31Å
289C91.5Very high87Confident25 Ų2524 Ų2417%0.16912%0.124CC..Hα-helixtrans-81.9-22.3173.2-61.70000112.7V34 S286 N287 P292V34-C289 HydrophobicContact CG1-CB 3.97Å; S286-C289 WeakPolarHBondContact O-CB 3.47Å; S286-C289 PolarHBondContact O-N 2.9Å; N287-C289 PolarHBondContact O-N 3.46Å; N287-C289 VanDerWaalsContact O-N 3.09Å; C289-P292 WeakPolarHBondContact O-CD 3.45Å
290F89.4Confident85.8Confident61 Ų6126 Ų2627%0.26813%0.131SC..Hα-helixtrans-93-22.3-179.4-61.2-58.6000113.1I241 F244 S286 N287 P292 I293 V294I241-F290 HydrophobicContact CD1-CB 3.97Å; I241-F290 HydrophobicContact CG1-CB 4.15Å; I241-F290 HydrophobicContact CG2-CB 3.82Å; F244-F290 HydrophobicContact CD1-CE2 4.34Å; F244-F290 HydrophobicContact CE1-CE2 4.1Å; F244-F290 HydrophobicContact CE1-CZ 4.25Å; S286-F290 WeakPolarHBondContact O-CD2 3.5Å; N287-F290 WeakPolarHBondContact O-CA 3.37Å; N287-F290 PolarHBondContact O-N 3.17Å; F290-P292 VanDerWaalsContact C-N 3.32Å; F290-I293 HydrophobicContact CD1-CD1 4.11Å; F290-I293 WeakPolarHBondContact O-CA 3.28Å; F290-I293 WeakPolarHBondContact O-CB 3.23Å; F290-I293 PolarHBondContact O-N 3.14Å; F290-V294 PolarHBondContact O-N 3.41Å
291D86.7Confident84.3Confident0 Ų028.1 Ų28.10%014%0.144CC..Hα-helixtrans-54.8-34.3177.1-69.6-44.8000115L63 D67 N287 C288 I293 V294 Y295L63-D291 HydrophobicContact CD2-CB 4.45Å; D67-D291 VanDerWaalsContact OD2-OD2 3.11Å; N287-D291 PolarHBondContact ND2-OD2 3.03Å; N287-D291 PolarHBondContact O-N 3.16Å; N287-D291 VanDerWaalsContact O-N 3.09Å; C288-D291 WeakPolarHBondContact CA-OD2 3.31Å; D291-I293 VanDerWaalsContact C-N 3.25Å; D291-I293 PolarHBondContact O-N 2.95Å; D291-V294 CarbonylContact O-C 3.38Å; D291-V294 WeakPolarHBondContact O-CA 3.35Å; D291-V294 VanDerWaalsContact O-CB 3.22Å; D291-V294 WeakPolarHBondContact O-CB 3.41Å; D291-V294 PolarHBondContact O-N 3.22Å; D291-Y295 HydrophobicContact CB-CE1 4.4Å; D291-Y295 HydrophobicContact CB-CE2 3.98Å; D291-Y295 WeakPolarHBondContact O-CD1 3.4Å; D291-Y295 VanDerWaalsContact O-CD2 3.25Å; D291-Y295 WeakPolarHBondContact O-CD2 3.03Å; D291-Y295 PolarHBondContact O-N 3.25Å
292P82.1Confident83Confident30 Ų3027.6 Ų27.620%0.19514%0.142CC..Hα-helixtrans-57.2-34.2169.9-25.133000114.6T38 C289 F290 Y295 Y296T38-P292 HydrophobicContact CG2-CG 4.13Å; T38-P292 WeakPolarHBondContact OG1-CG 3.17Å; C289-P292 WeakPolarHBondContact O-CD 3.45Å; F290-P292 VanDerWaalsContact C-N 3.32Å; P292-Y295 PolarHBondContact O-N 3.49Å; P292-Y296 PolarHBondContact O-N 3.19Å
293I82.8Confident81.8Confident73 Ų7328.3 Ų28.337%0.37414%0.144SC..Hα-helixtrans-67.2-43.7175.8-54.4178.2000109V237 I241 F290 D291 Y295 Y296 F297V237-I293 HydrophobicContact CG1-CG2 3.94Å; I241-I293 HydrophobicContact CD1-CB 4.46Å; F290-I293 HydrophobicContact CD1-CD1 4.11Å; F290-I293 WeakPolarHBondContact O-CA 3.28Å; F290-I293 WeakPolarHBondContact O-CB 3.23Å; F290-I293 PolarHBondContact O-N 3.14Å; D291-I293 VanDerWaalsContact C-N 3.25Å; D291-I293 PolarHBondContact O-N 2.95Å; I293-Y295 VanDerWaalsContact C-N 3.33Å; I293-Y295 PolarHBondContact O-N 2.85Å; I293-Y296 PolarHBondContact O-N 3.39Å; I293-F297 HydrophobicContact CG2-CD2 3.81Å; I293-F297 HydrophobicContact CG2-CE2 3.59Å; I293-F297 WeakPolarHBondContact O-CD2 3.32Å; I293-F297 PolarHBondContact O-N 3Å; I293-F297 VanDerWaalsContact O-N 3.1Å
294V80.1Confident80.6Confident0 Ų030.7 Ų30.70%016%0.158CC..Hα-helixtrans-56.2-48172.2159.10000110.6L111 H238 I241 F290 D291 Y296 F297 T298L111-V294 HydrophobicContact CD2-CG1 4.17Å; L111-V294 HydrophobicContact CD2-CG2 4.38Å; H238-V294 VanDerWaalsContact CD2-CG1 3.44Å; H238-V294 WeakPolarHBondContact CD2-CG1 3.2Å; H238-V294 WeakPolarHBondContact NE2-CG1 3.44Å; I241-V294 HydrophobicContact CD1-CG2 3.66Å; F290-V294 PolarHBondContact O-N 3.41Å; D291-V294 CarbonylContact O-C 3.38Å; D291-V294 WeakPolarHBondContact O-CA 3.35Å; D291-V294 VanDerWaalsContact O-CB 3.22Å; D291-V294 WeakPolarHBondContact O-CB 3.41Å; D291-V294 PolarHBondContact O-N 3.22Å; V294-Y296 PolarHBondContact O-N 2.8Å; V294-F297 PolarHBondContact O-N 3.19Å; V294-T298 VanDerWaalsContact O-CB 3.28Å; V294-T298 WeakPolarHBondContact O-CB 3.17Å; V294-T298 PolarHBondContact O-N 2.86Å; V294-T298 VanDerWaalsContact O-N 3.07Å; V294-T298 PolarHBondContact O-OG1 3.19Å
295Y81.1Confident79.3Confident2 Ų231.2 Ų31.21%0.00816%0.161CC..Hα-helixtrans-62.1-41.9179.7-54-33000112.3A42 F46 M60 L63 V64 D291 P292 I293 T298 S299 I302A42-Y295 HydrophobicContact CB-CD2 3.8Å; A42-Y295 HydrophobicContact CB-CE2 3.97Å; F46-Y295 HydrophobicContact CE2-CD1 4.18Å; F46-Y295 HydrophobicContact CE2-CD2 4.08Å; F46-Y295 HydrophobicContact CE2-CE1 4.37Å; F46-Y295 HydrophobicContact CE2-CE2 4.34Å; F46-Y295 HydrophobicContact CE2-CG 4.06Å; F46-Y295 AromaticContact CZ-CD1 3.94Å; F46-Y295 HydrophobicContact CZ-CD1 3.94Å; F46-Y295 HydrophobicContact CZ-CD2 4.23Å; F46-Y295 AromaticContact CZ-CG 3.79Å; F46-Y295 HydrophobicContact CZ-CG 3.79Å; M60-Y295 HydrophobicContact CB-CD1 4.06Å; M60-Y295 HydrophobicContact CB-CE1 3.91Å; M60-Y295 HydrophobicContact CG-CD1 3.82Å; M60-Y295 HydrophobicContact CG-CE1 3.98Å; M60-Y295 HydrophobicContact SD-CD1 4.05Å; L63-Y295 HydrophobicContact CD2-CE1 3.99Å; L63-Y295 VanDerWaalsContact CG-OH 3.31Å; L63-Y295 WeakPolarHBondContact CG-OH 3.47Å; V64-Y295 HydrophobicContact CG2-CD2 4.38Å; V64-Y295 HydrophobicContact CG2-CE1 4.36Å; V64-Y295 HydrophobicContact CG2-CE2 3.45Å; V64-Y295 VanDerWaalsContact CG2-CE2 3.45Å; V64-Y295 VanDerWaalsContact CG2-CZ 3.44Å; V64-Y295 VanDerWaalsContact CG2-OH 3.23Å; V64-Y295 WeakPolarHBondContact CG2-OH 3.19Å; V64-Y295 PolarHBondContact N-OH 3.17Å; D291-Y295 HydrophobicContact CB-CE1 4.4Å; D291-Y295 HydrophobicContact CB-CE2 3.98Å; D291-Y295 WeakPolarHBondContact O-CD1 3.4Å; D291-Y295 VanDerWaalsContact O-CD2 3.25Å; D291-Y295 WeakPolarHBondContact O-CD2 3.03Å; D291-Y295 PolarHBondContact O-N 3.25Å; P292-Y295 PolarHBondContact O-N 3.49Å; I293-Y295 VanDerWaalsContact C-N 3.33Å; I293-Y295 PolarHBondContact O-N 2.85Å; Y295-T298 PolarHBondContact O-N 3.42Å; Y295-S299 WeakPolarHBondContact O-CB 3.36Å; Y295-S299 PolarHBondContact O-N 3.44Å; Y295-I302 HydrophobicContact CG-CD1 4.5Å
296Y80Confident78.1Confident82 Ų8236.2 Ų36.232%0.32218%0.183SC..Hα-helixtrans-61.3-44.4177.5177.3-95.9000112.4P292 I293 V294 T298 I302 Q303 F306P292-Y296 PolarHBondContact O-N 3.19Å; I293-Y296 PolarHBondContact O-N 3.39Å; V294-Y296 PolarHBondContact O-N 2.8Å; Y296-T298 VanDerWaalsContact C-N 3.28Å; Y296-T298 PolarHBondContact O-N 2.91Å; Y296-I302 HydrophobicContact CD2-CG2 4.19Å; Y296-Q303 HydrophobicContact CD2-CG 4.03Å; Y296-Q303 HydrophobicContact CE1-CG 4.47Å; Y296-Q303 HydrophobicContact CE2-CB 4.22Å; Y296-Q303 HydrophobicContact CE2-CG 3.81Å; Y296-Q303 HydrophobicContact CG-CG 4.43Å; Y296-Q303 WeakPolarHBondContact O-CG 3.28Å; Y296-Q303 PolarHBondContact O-NE2 2.83Å; Y296-F306 HydrophobicContact CD2-CD2 4.13Å; Y296-F306 HydrophobicContact CE2-CB 4.45Å
297F77.3Confident77Confident37 Ų3740.5 Ų40.516%0.16220%0.198CC..Hα-helixtrans-74.8-20.4179.7-72.6-63.6000113.6R233 M234 V237 I293 V294R233-F297 HydrophobicContact CG-CD1 3.94Å; R233-F297 HydrophobicContact CG-CE1 3.92Å; R233-F297 HydrophobicContact CG-CZ 4.47Å; M234-F297 HydrophobicContact CB-CB 4.16Å; M234-F297 HydrophobicContact CG-CB 4.41Å; V237-F297 HydrophobicContact CB-CD2 4.21Å; V237-F297 HydrophobicContact CG1-CD2 3.93Å; V237-F297 HydrophobicContact CG1-CE2 4.4Å; V237-F297 HydrophobicContact CG2-CD2 3.87Å; V237-F297 HydrophobicContact CG2-CE2 3.95Å; I293-F297 HydrophobicContact CG2-CD2 3.81Å; I293-F297 HydrophobicContact CG2-CE2 3.59Å; I293-F297 WeakPolarHBondContact O-CD2 3.32Å; I293-F297 PolarHBondContact O-N 3Å; I293-F297 VanDerWaalsContact O-N 3.1Å; V294-F297 PolarHBondContact O-N 3.19Å
298T73.6Confident75.6Confident6 Ų648.6 Ų48.64%0.03723%0.229CC..Hα-helixtrans-99.3-30.9-174.4-480000113.7T56 M60 I114 R118 M234 H238 V294 Y295 Y296T56-T298 HydrophobicContact CG2-CG2 3.85Å; M60-T298 HydrophobicContact CE-CG2 2.98Å; I114-T298 HydrophobicContact CG2-CG2 4.3Å; R118-T298 VanDerWaalsContact NH2-CG2 3.29Å; R118-T298 PolarHBondContact NH2-O 3.31Å; M234-T298 HydrophobicContact CG-CG2 4.38Å; M234-T298 WeakPolarHBondContact CG-OG1 3.16Å; M234-T298 HydrophobicContact SD-CG2 3.62Å; H238-T298 PolarHBondContact CE1-OG1 3.42Å; H238-T298 PolarHBondContact NE2-OG1 3.04Å; V294-T298 VanDerWaalsContact O-CB 3.28Å; V294-T298 WeakPolarHBondContact O-CB 3.17Å; V294-T298 PolarHBondContact O-N 2.86Å; V294-T298 VanDerWaalsContact O-N 3.07Å; V294-T298 PolarHBondContact O-OG1 3.19Å; Y295-T298 PolarHBondContact O-N 3.42Å; Y296-T298 VanDerWaalsContact C-N 3.28Å; Y296-T298 PolarHBondContact O-N 2.91Å
299S71.8Confident74.2Confident10 Ų1055.8 Ų55.87%0.0726%0.26CS..  trans-109.5115.7-176.1-179.20000112Y295 T301 I302 Q303Y295-S299 WeakPolarHBondContact O-CB 3.36Å; Y295-S299 PolarHBondContact O-N 3.44Å; S299-T301 PolarHBondContact O-N 3.36Å; S299-I302 PolarHBondContact O-N 3.35Å; S299-I302 PolarHBondContact OG-N 3.42Å; S299-Q303 PolarHBondContact O-N 3.38Å
300E68Low72.8Confident118 Ų11857.1 Ų57.155%0.55127%0.27SS*.Hα-helixtrans-64.2-29.9175-40.2-147.6124.400112.2K230 I302 Q303 N304K230-E300 VanDerWaalsContact NZ-CD 3.31Å; K230-E300 IonicContact NZ-OE1 3.71Å; K230-E300 PolarHBondContact NZ-OE1 2.97Å; E300-I302 VanDerWaalsContact C-N 3.32Å; E300-I302 PolarHBondContact O-N 2.93Å; E300-Q303 WeakPolarHBondContact O-CB 3.38Å; E300-Q303 PolarHBondContact O-N 3.13Å; E300-N304 WeakPolarHBondContact O-CB 3.47Å; E300-N304 VanDerWaalsContact O-CG 3.27Å; E300-N304 PolarHBondContact O-N 3.17Å
301T61.7Low71.4Confident47 Ų4760.9 Ų60.929%0.28829%0.288SS..Hα-helixtrans-68.2-35.7179.3-53.10000111.4L50 S299 S305L50-T301 HydrophobicContact CD1-CG2 4.47Å; L50-T301 HydrophobicContact CD2-CG2 4.04Å; L50-T301 WeakPolarHBondContact CD2-OG1 3.47Å; L50-T301 HydrophobicContact CG-CG2 3.8Å; S299-T301 PolarHBondContact O-N 3.36Å; T301-S305 WeakPolarHBondContact O-CB 3.24Å; T301-S305 PolarHBondContact O-N 3.05Å; T301-S305 PolarHBondContact O-OG 3.39Å
302I63.9Low70Confident4 Ų463.8 Ų63.82%0.02131%0.312CS..Hα-helixtrans-66.4-47.7172.1-72.5177.2000109.6I45 F46 Y295 Y296 S299 E300 N304 S305 F306I45-I302 HydrophobicContact CG2-CG1 3.84Å; F46-I302 HydrophobicContact CD1-CD1 4.24Å; F46-I302 HydrophobicContact CE1-CD1 3.37Å; F46-I302 HydrophobicContact CE1-CG1 4.22Å; F46-I302 HydrophobicContact CZ-CD1 3.54Å; Y295-I302 HydrophobicContact CG-CD1 4.5Å; Y296-I302 HydrophobicContact CD2-CG2 4.19Å; S299-I302 PolarHBondContact O-N 3.35Å; S299-I302 PolarHBondContact OG-N 3.42Å; E300-I302 VanDerWaalsContact C-N 3.32Å; E300-I302 PolarHBondContact O-N 2.93Å; I302-N304 VanDerWaalsContact C-N 3.28Å; I302-N304 PolarHBondContact O-N 2.9Å; I302-S305 PolarHBondContact O-N 3Å; I302-S305 VanDerWaalsContact O-N 3.14Å; I302-F306 HydrophobicContact CG2-CD2 3.57Å; I302-F306 HydrophobicContact CG2-CE2 3.58Å; I302-F306 VanDerWaalsContact O-CD2 3.31Å; I302-F306 WeakPolarHBondContact O-CD2 3.32Å; I302-F306 PolarHBondContact O-N 2.9Å
303Q69.4Low68.8Low23 Ų2365.8 Ų65.811%0.10733%0.326CS..Hα-helixtrans-54.7-44.4176.6-63.8-179.4-3.600112.1Y296 S299 E300 K307Y296-Q303 HydrophobicContact CD2-CG 4.03Å; Y296-Q303 HydrophobicContact CE1-CG 4.47Å; Y296-Q303 HydrophobicContact CE2-CB 4.22Å; Y296-Q303 HydrophobicContact CE2-CG 3.81Å; Y296-Q303 HydrophobicContact CG-CG 4.43Å; Y296-Q303 WeakPolarHBondContact O-CG 3.28Å; Y296-Q303 PolarHBondContact O-NE2 2.83Å; S299-Q303 PolarHBondContact O-N 3.38Å; E300-Q303 WeakPolarHBondContact O-CB 3.38Å; E300-Q303 PolarHBondContact O-N 3.13Å; Q303-K307 WeakPolarHBondContact O-CB 3.48Å; Q303-K307 VanDerWaalsContact O-CG 3.27Å; Q303-K307 WeakPolarHBondContact O-CG 3.07Å; Q303-K307 PolarHBondContact O-N 3.16Å
304N69.9Low67.6Low94 Ų9470.8 Ų70.850%0.50334%0.341SS..Hα-helixtrans-70.9-36.4180-69-12.4000112.4E300 I302 K307 R308E300-N304 WeakPolarHBondContact O-CB 3.47Å; E300-N304 VanDerWaalsContact O-CG 3.27Å; E300-N304 PolarHBondContact O-N 3.17Å; I302-N304 VanDerWaalsContact C-N 3.28Å; I302-N304 PolarHBondContact O-N 2.9Å; N304-K307 PolarHBondContact O-N 2.92Å; N304-R308 WeakPolarHBondContact O-CB 3.33Å; N304-R308 PolarHBondContact O-N 3.32Å
305S65.4Low66.5Low17 Ų1773.7 Ų73.712%0.11936%0.361CS..Hα-helixtrans-64.9-41.6175.6-59.80000111.7T301 I302 R308 K309T301-S305 WeakPolarHBondContact O-CB 3.24Å; T301-S305 PolarHBondContact O-N 3.05Å; T301-S305 PolarHBondContact O-OG 3.39Å; I302-S305 PolarHBondContact O-N 3Å; I302-S305 VanDerWaalsContact O-N 3.14Å; S305-R308 PolarHBondContact O-N 3.45Å; S305-K309 PolarHBondContact O-N 2.94Å
306F67.4Low65.3Low107 Ų10779.3 Ų79.347%0.46939%0.386SS..Hα-helixtrans-66.1-43.1173.8-86.1-78.4000112.2Y296 I302 R308 K309 S310Y296-F306 HydrophobicContact CD2-CD2 4.13Å; Y296-F306 HydrophobicContact CE2-CB 4.45Å; I302-F306 HydrophobicContact CG2-CD2 3.57Å; I302-F306 HydrophobicContact CG2-CE2 3.58Å; I302-F306 VanDerWaalsContact O-CD2 3.31Å; I302-F306 WeakPolarHBondContact O-CD2 3.32Å; I302-F306 PolarHBondContact O-N 2.9Å; F306-R308 PolarHBondContact O-N 3.17Å; F306-K309 PolarHBondContact O-N 2.79Å; F306-S310 WeakPolarHBondContact O-CB 3.4Å; F306-S310 PolarHBondContact O-N 3.39Å
307K70.6Confident64.3Low114 Ų11478.5 Ų78.550%0.49639%0.387SS..Hα-helixtrans-60.9-43175-74.8174.7-178.1-177.40112.3Q303 N304 S310 Q311Q303-K307 WeakPolarHBondContact O-CB 3.48Å; Q303-K307 VanDerWaalsContact O-CG 3.27Å; Q303-K307 WeakPolarHBondContact O-CG 3.07Å; Q303-K307 PolarHBondContact O-N 3.16Å; N304-K307 PolarHBondContact O-N 2.92Å; K307-S310 PolarHBondContact O-N 3.42Å; K307-Q311 PolarHBondContact O-N 3.03Å
308R64.1Low63.6Low170 Ų17080.6 Ų80.664%0.64240%0.403SS*.Hα-helixtrans-66.1-41.5178.1-168.5176.568-165.80.7112.1N304 S305 F306 Q311 A312N304-R308 WeakPolarHBondContact O-CB 3.33Å; N304-R308 PolarHBondContact O-N 3.32Å; S305-R308 PolarHBondContact O-N 3.45Å; F306-R308 PolarHBondContact O-N 3.17Å; R308-Q311 PolarHBondContact O-N 2.73Å; R308-A312 WeakPolarHBondContact O-CB 3.31Å; R308-A312 PolarHBondContact O-N 3.36Å
309K61.5Low63.1Low151 Ų15187 Ų8766%0.65743%0.43SS*.Hα-helixtrans-63.1-42.2172.2-85-171172.8-171.20112S305 F306 A312 S313S305-K309 PolarHBondContact O-N 2.94Å; F306-K309 PolarHBondContact O-N 2.79Å; K309-A312 PolarHBondContact O-N 3.39Å; K309-S313 WeakPolarHBondContact O-CB 3.35Å; K309-S313 PolarHBondContact O-N 2.69Å
310S61.3Low62.5Low54 Ų5488.6 Ų88.638%0.37844%0.436SS..Hα-helixtrans-64.3-39.4176.7-177.70000112.2F306 K307 R314F306-S310 WeakPolarHBondContact O-CB 3.4Å; F306-S310 PolarHBondContact O-N 3.39Å; K307-S310 PolarHBondContact O-N 3.42Å; S310-R314 WeakPolarHBondContact O-CB 3.32Å; S310-R314 VanDerWaalsContact O-CG 3.3Å; S310-R314 WeakPolarHBondContact O-CG 3.19Å; S310-R314 PolarHBondContact O-N 3.24Å
311Q59.5Low62.1Low140 Ų14085.7 Ų85.765%0.65443%0.428SS*.Hα-helixtrans-68.1-39.5173-79.4177.8-42.900112.7K307 R308 R314 S315K307-Q311 PolarHBondContact O-N 3.03Å; R308-Q311 PolarHBondContact O-N 2.73Å; Q311-R314 PolarHBondContact O-N 3.37Å; Q311-S315 VanDerWaalsContact O-CB 3.23Å; Q311-S315 WeakPolarHBondContact O-CB 3.44Å; Q311-S315 PolarHBondContact O-N 3Å
312A58.8Low62.1Low60 Ų6089.1 Ų89.150%0.49644%0.441SS..Hα-helixtrans-65.2-42.6175.400000111.8R308 K309 S315 F316R308-A312 WeakPolarHBondContact O-CB 3.31Å; R308-A312 PolarHBondContact O-N 3.36Å; K309-A312 PolarHBondContact O-N 3.39Å; A312-S315 PolarHBondContact O-N 2.93Å; A312-F316 WeakPolarHBondContact O-CB 3.22Å; A312-F316 PolarHBondContact O-N 3.42Å
313S57Low61.8Low72 Ų7291.3 Ų91.350%0.50346%0.46SS..Hα-helixtrans-63.6-44.6174.8-168.30000111.6K309 F316 D317K309-S313 WeakPolarHBondContact O-CB 3.35Å; K309-S313 PolarHBondContact O-N 2.69Å; S313-F316 PolarHBondContact O-N 2.63Å; S313-D317 PolarHBondContact O-N 3.39Å
314R57.8Low61.1Low178 Ų17891.2 Ų91.267%0.67246%0.461SS*.Hα-helixtrans-64.8-40.1175-77.2178.2178-176.2-0.6112.3S310 Q311 F316 D317 V318S310-R314 WeakPolarHBondContact O-CB 3.32Å; S310-R314 VanDerWaalsContact O-CG 3.3Å; S310-R314 WeakPolarHBondContact O-CG 3.19Å; S310-R314 PolarHBondContact O-N 3.24Å; Q311-R314 PolarHBondContact O-N 3.37Å; R314-F316 VanDerWaalsContact C-N 3.32Å; R314-D317 PolarHBondContact O-N 2.72Å; R314-V318 WeakPolarHBondContact O-CB 3.48Å; R314-V318 WeakPolarHBondContact O-CG2 3.21Å; R314-V318 PolarHBondContact O-N 3.46Å
315S55.9Low60.5Low62 Ų6294.6 Ų94.643%0.43447%0.474SS..Hα-helixtrans-67-35.5176.8-176.10000111.7Q311 A312 K319Q311-S315 VanDerWaalsContact O-CB 3.23Å; Q311-S315 WeakPolarHBondContact O-CB 3.44Å; Q311-S315 PolarHBondContact O-N 3Å; A312-S315 PolarHBondContact O-N 2.93Å; S315-K319 WeakPolarHBondContact O-CB 3.41Å; S315-K319 WeakPolarHBondContact O-CG 3.36Å; S315-K319 PolarHBondContact O-N 3.14Å
316F56.1Low60Low120 Ų12098.8 Ų98.853%0.52650%0.503SS..Hα-helixtrans-67.5-44.5173.1-173.7-100.7000111.9A312 S313 R314 V318 K319 F320A312-F316 WeakPolarHBondContact O-CB 3.22Å; A312-F316 PolarHBondContact O-N 3.42Å; S313-F316 PolarHBondContact O-N 2.63Å; R314-F316 VanDerWaalsContact C-N 3.32Å; F316-V318 PolarHBondContact O-N 3.49Å; F316-K319 PolarHBondContact O-N 2.87Å; F316-F320 VanDerWaalsContact O-CB 3.23Å; F316-F320 WeakPolarHBondContact O-CB 3.32Å; F316-F320 PolarHBondContact O-N 2.88Å
317D58Low59.1Low65 Ų6598.2 Ų98.235%0.34850%0.502SS..Hα-helixtrans-66.2-35.1176.2-80.2-41.3000113S313 R314 S321 K340S313-D317 PolarHBondContact O-N 3.39Å; R314-D317 PolarHBondContact O-N 2.72Å; D317-S321 VanDerWaalsContact O-CB 3.31Å; D317-S321 WeakPolarHBondContact O-CB 3.36Å; D317-S321 PolarHBondContact O-N 3.12Å; D317-S321 PolarHBondContact O-OG 3.36Å; D317-K340 IonicContact OD1-NZ 3.92Å; D317-K340 PolarHBondContact OD1-NZ 2.94Å
318V64.2Low58.2Low80 Ų8098.8 Ų98.849%0.48552%0.52SS..Hα-helixtrans-67.5-49.4173.9171.20000110.8R314 F316 F320 S321 E322R314-V318 WeakPolarHBondContact O-CB 3.48Å; R314-V318 WeakPolarHBondContact O-CG2 3.21Å; R314-V318 PolarHBondContact O-N 3.46Å; F316-V318 PolarHBondContact O-N 3.49Å; V318-F320 VanDerWaalsContact C-N 3.31Å; V318-F320 PolarHBondContact O-N 3.49Å; V318-S321 PolarHBondContact O-N 3.23Å; V318-S321 VanDerWaalsContact O-N 3.13Å; V318-E322 WeakPolarHBondContact O-CG 3.44Å; V318-E322 PolarHBondContact O-N 3.08Å
319K61.9Low57.7Low141 Ų14193.8 Ų93.861%0.61351%0.511SS*.Hα-helixtrans-61.8-37.7176.6-77.7-175.6176.9-1720112.7S315 F316 A323S315-K319 WeakPolarHBondContact O-CB 3.41Å; S315-K319 WeakPolarHBondContact O-CG 3.36Å; S315-K319 PolarHBondContact O-N 3.14Å; F316-K319 PolarHBondContact O-N 2.87Å; K319-A323 WeakPolarHBondContact O-CB 3.3Å; K319-A323 PolarHBondContact O-N 2.84Å
320F59Low57.4Low44 Ų4491.7 Ų91.719%0.19351%0.513CS..Hα-helixtrans-67.2-40.3175.3-174.5-94.1000111.3F316 V318 A323 T324 K340F316-F320 VanDerWaalsContact O-CB 3.23Å; F316-F320 WeakPolarHBondContact O-CB 3.32Å; F316-F320 PolarHBondContact O-N 2.88Å; V318-F320 VanDerWaalsContact C-N 3.31Å; V318-F320 PolarHBondContact O-N 3.49Å; F320-A323 PolarHBondContact O-N 3.33Å; F320-T324 HydrophobicContact CE1-CG2 4.16Å; F320-T324 HydrophobicContact CZ-CG2 4.36Å; F320-T324 PolarHBondContact O-N 3.39Å; F320-T324 PolarHBondContact O-OG1 3.3Å; F320-K340 HydrophobicContact CD1-CD 4.14Å; F320-K340 HydrophobicContact CE1-CD 3.63Å; F320-K340 HydrophobicContact CE2-CB 4.32Å; F320-K340 HydrophobicContact CE2-CD 4.18Å; F320-K340 HydrophobicContact CZ-CB 4.02Å; F320-K340 HydrophobicContact CZ-CD 3.65Å; F320-K340 HydrophobicContact CZ-CG 4.39Å
321S60.4Low57.1Low56 Ų5693.3 Ų93.339%0.39253%0.525SS..Hα-helixtrans-66.5-42177.7-60.20000112D317 V318 T324 Q325D317-S321 VanDerWaalsContact O-CB 3.31Å; D317-S321 WeakPolarHBondContact O-CB 3.36Å; D317-S321 PolarHBondContact O-N 3.12Å; D317-S321 PolarHBondContact O-OG 3.36Å; V318-S321 PolarHBondContact O-N 3.23Å; V318-S321 VanDerWaalsContact O-N 3.13Å; S321-T324 WeakPolarHBondContact CA-OG1 3.39Å; S321-T324 PolarHBondContact O-N 3.32Å; S321-T324 PolarHBondContact O-OG1 2.91Å; S321-Q325 WeakPolarHBondContact O-CG 3.37Å; S321-Q325 PolarHBondContact O-N 3.37Å; S321-Q325 VanDerWaalsContact O-N 3.13Å
322E62.1Low56.8Low119 Ų11990.8 Ų90.856%0.55652%0.515SS*.Hα-helixtrans-62-43173.3-74.7173.1170.300111.7V318 T324 Q325 S326V318-E322 WeakPolarHBondContact O-CG 3.44Å; V318-E322 PolarHBondContact O-N 3.08Å; E322-T324 PolarHBondContact O-N 3.24Å; E322-Q325 PolarHBondContact O-N 3.1Å; E322-Q325 VanDerWaalsContact O-N 3.17Å; E322-S326 PolarHBondContact O-N 3.12Å
323A57.9Low56.6Low50 Ų5091.6 Ų91.641%0.41351%0.508SS..Hα-helixtrans-62.4-39.5175.200000112.5K319 F320 Q325K319-A323 WeakPolarHBondContact O-CB 3.3Å; K319-A323 PolarHBondContact O-N 2.84Å; F320-A323 PolarHBondContact O-N 3.33Å; A323-Q325 VanDerWaalsContact C-N 3.3Å; A323-Q325 PolarHBondContact O-N 2.95Å
324T54.3Low56.5Low22 Ų2296.6 Ų96.614%0.13552%0.516CS..Hα-helixtrans-73.4-14.7175.137.80000115.2F320 S321 E322 Q333F320-T324 HydrophobicContact CE1-CG2 4.16Å; F320-T324 HydrophobicContact CZ-CG2 4.36Å; F320-T324 PolarHBondContact O-N 3.39Å; F320-T324 PolarHBondContact O-OG1 3.3Å; S321-T324 WeakPolarHBondContact CA-OG1 3.39Å; S321-T324 PolarHBondContact O-N 3.32Å; S321-T324 PolarHBondContact O-OG1 2.91Å; E322-T324 PolarHBondContact O-N 3.24Å; T324-Q333 HydrophobicContact CG2-CG 4.23Å; T324-Q333 PolarHBondContact O-NE2 3.24Å
325Q57Low56.4Low164 Ų16491 Ų9177%0.76651%0.505SS*.Hα-helixtrans-95-24.7176.6-74.5179.76.600112.7S321 E322 A323S321-Q325 WeakPolarHBondContact O-CG 3.37Å; S321-Q325 PolarHBondContact O-N 3.37Å; S321-Q325 VanDerWaalsContact O-N 3.13Å; E322-Q325 PolarHBondContact O-N 3.1Å; E322-Q325 VanDerWaalsContact O-N 3.17Å; A323-Q325 VanDerWaalsContact C-N 3.3Å; A323-Q325 PolarHBondContact O-N 2.95Å
326S55.3Low56.5Low105 Ų10590.2 Ų90.273%0.73450%0.496SS*.Hα-helixtrans-81.7-10.2-179.5-171.80000114.5E322E322-S326 PolarHBondContact O-N 3.12Å
327E49.1Very low56.6Low95 Ų9590.7 Ų90.744%0.44450%0.497SS..  trans-113.2113.1-176.5-72.8-176.6166.800111.8S329 L332E327-S329 VanDerWaalsContact C-N 3.3Å; E327-S329 PolarHBondContact O-N 3.39Å; E327-L332 WeakPolarHBondContact OE2-CD2 3.47Å
328S50.3Low56.6Low127 Ų12790.7 Ų90.789%0.88850%0.497SS*.  trans-84.217.5-174.253.40000115.2
329S54.1Low56.2Low64 Ų6491.4 Ų91.445%0.44850%0.498SS..  trans-111.9118.7179.2-89.10000112.9E327 S331 L332E327-S329 VanDerWaalsContact C-N 3.3Å; E327-S329 PolarHBondContact O-N 3.39Å; S329-S331 VanDerWaalsContact C-N 3.29Å; S329-S331 PolarHBondContact O-N 3.03Å; S329-L332 PolarHBondContact O-N 3.39Å
330P56.2Low56Low107 Ų10787.7 Ų87.770%0.69548%0.482SS*.Hα-helixtrans-67.9-21.5-17322.6-30.7000114.7
331S53.5Low55.9Low89 Ų8988 Ų8862%0.62249%0.492SS*.Hα-helixtrans-73.8-36.5178.855.50000113.3S329 S335S329-S331 VanDerWaalsContact C-N 3.29Å; S329-S331 PolarHBondContact O-N 3.03Å; S331-S335 PolarHBondContact O-N 2.72Å
332L53.7Low55.4Low86 Ų8693 Ų9345%0.4551%0.507SS..Hα-helixtrans-75.6-35.1179.4-120.7114.9000111.7E327 S329 W334 S335 L336E327-L332 WeakPolarHBondContact OE2-CD2 3.47Å; S329-L332 PolarHBondContact O-N 3.39Å; L332-W334 VanDerWaalsContact C-N 3.31Å; L332-W334 PolarHBondContact O-N 3.42Å; L332-S335 WeakPolarHBondContact O-CB 3.27Å; L332-S335 PolarHBondContact O-N 3.31Å; L332-S335 VanDerWaalsContact O-N 3.12Å; L332-L336 WeakPolarHBondContact O-CB 3.45Å; L332-L336 WeakPolarHBondContact O-CG 3.1Å; L332-L336 PolarHBondContact O-N 3.43Å
333Q54.8Low55Low77 Ų7791.4 Ų91.436%0.3651%0.505SS..Hα-helixtrans-62.9-36.8177.9-146.3-179.125.200112.2T324 K337T324-Q333 HydrophobicContact CG2-CG 4.23Å; T324-Q333 PolarHBondContact O-NE2 3.24Å; Q333-K337 WeakPolarHBondContact O-CG 3.32Å; Q333-K337 PolarHBondContact O-N 3.22Å; Q333-K337 VanDerWaalsContact O-N 3.1Å
334W54Low54.6Low177 Ų17794.4 Ų94.467%0.6751%0.509SS*.Hα-helixtrans-69.8-40.1172.6-173.882.4000112L332 K337 N338L332-W334 VanDerWaalsContact C-N 3.31Å; L332-W334 PolarHBondContact O-N 3.42Å; W334-K337 PolarHBondContact O-N 3.43Å; W334-N338 VanDerWaalsContact CD2-ND2 3.33Å; W334-N338 VanDerWaalsContact CE3-ND2 3.29Å; W334-N338 WeakPolarHBondContact CH2-ND2 3.35Å; W334-N338 WeakPolarHBondContact CZ2-ND2 3.34Å; W334-N338 WeakPolarHBondContact CZ3-ND2 3.34Å; W334-N338 WeakPolarHBondContact O-CB 3.08Å; W334-N338 PolarHBondContact O-N 2.75Å
335S56.3Low54Low61 Ų61100.2 Ų100.243%0.42753%0.534SS..Hα-helixtrans-65.2-39.7176.6-1530000112.5S331 L332 N338 L339S331-S335 PolarHBondContact O-N 2.72Å; L332-S335 WeakPolarHBondContact O-CB 3.27Å; L332-S335 PolarHBondContact O-N 3.31Å; L332-S335 VanDerWaalsContact O-N 3.12Å; S335-N338 CarbonylContact O-C 3.6Å; S335-N338 PolarHBondContact O-N 3.35Å; S335-L339 WeakPolarHBondContact O-CB 3.17Å; S335-L339 PolarHBondContact O-N 2.98Å
336L57.9Low52.9Low46 Ų4698.3 Ų98.324%0.24153%0.529CS..Hα-helixtrans-68.2-38.3174.7-75.3171000112.6L332 N338 L339 K340L332-L336 WeakPolarHBondContact O-CB 3.45Å; L332-L336 WeakPolarHBondContact O-CG 3.1Å; L332-L336 PolarHBondContact O-N 3.43Å; L336-N338 VanDerWaalsContact C-N 3.35Å; L336-L339 PolarHBondContact O-N 2.99Å; L336-K340 PolarHBondContact O-N 2.96Å
337K59.3Low52.2Low130 Ų130100.6 Ų100.657%0.56553%0.529SS*.Hα-helixtrans-63.9-40171.1-79.6-179.9177.9178.30111.7Q333 W334 K340 A341Q333-K337 WeakPolarHBondContact O-CG 3.32Å; Q333-K337 PolarHBondContact O-N 3.22Å; Q333-K337 VanDerWaalsContact O-N 3.1Å; W334-K337 PolarHBondContact O-N 3.43Å; K337-K340 PolarHBondContact O-N 3.38Å; K337-A341 PolarHBondContact O-N 3.23Å
338N56.4Low51.5Low65 Ų65100.2 Ų100.235%0.34854%0.537SS..Hα-helixtrans-70.3-33.3175.1-78.5-15.5000113.2W334 S335 L336 A341 K342W334-N338 VanDerWaalsContact CD2-ND2 3.33Å; W334-N338 VanDerWaalsContact CE3-ND2 3.29Å; W334-N338 WeakPolarHBondContact CH2-ND2 3.35Å; W334-N338 WeakPolarHBondContact CZ2-ND2 3.34Å; W334-N338 WeakPolarHBondContact CZ3-ND2 3.34Å; W334-N338 WeakPolarHBondContact O-CB 3.08Å; W334-N338 PolarHBondContact O-N 2.75Å; S335-N338 CarbonylContact O-C 3.6Å; S335-N338 PolarHBondContact O-N 3.35Å; L336-N338 VanDerWaalsContact C-N 3.35Å; N338-A341 PolarHBondContact O-N 2.97Å; N338-K342 WeakPolarHBondContact O-CB 2.93Å; N338-K342 PolarHBondContact O-N 3.13Å
339L57Low50.7Low94 Ų9498.4 Ų98.449%0.49252%0.524SS..Hα-helixtrans-65.5-43.4170.4-98.7152.7000111.3S335 L336 A341 K342 V343S335-L339 WeakPolarHBondContact O-CB 3.17Å; S335-L339 PolarHBondContact O-N 2.98Å; L336-L339 PolarHBondContact O-N 2.99Å; L339-A341 VanDerWaalsContact C-N 3.35Å; L339-A341 PolarHBondContact O-N 3.47Å; L339-K342 PolarHBondContact O-N 2.89Å; L339-V343 VanDerWaalsContact O-CG2 3.31Å; L339-V343 WeakPolarHBondContact O-CG2 3.36Å; L339-V343 PolarHBondContact O-N 3.25Å
340K58Low49.8Very low63 Ų63105.3 Ų105.327%0.27456%0.563SS.*Hα-helixtrans-59.1-46.7171.9-171.2169.8-177.3169.60110.4D317 F320 L336 K337 K342 V343 F344D317-K340 IonicContact OD1-NZ 3.92Å; D317-K340 PolarHBondContact OD1-NZ 2.94Å; F320-K340 HydrophobicContact CD1-CD 4.14Å; F320-K340 HydrophobicContact CE1-CD 3.63Å; F320-K340 HydrophobicContact CE2-CB 4.32Å; F320-K340 HydrophobicContact CE2-CD 4.18Å; F320-K340 HydrophobicContact CZ-CB 4.02Å; F320-K340 HydrophobicContact CZ-CD 3.65Å; F320-K340 HydrophobicContact CZ-CG 4.39Å; L336-K340 PolarHBondContact O-N 2.96Å; K337-K340 PolarHBondContact O-N 3.38Å; K340-K342 VanDerWaalsContact C-N 3.35Å; K340-K342 PolarHBondContact O-N 3.47Å; K340-V343 PolarHBondContact O-N 2.84Å; K340-F344 HydrophobicContact CD-CE2 4.46Å; K340-F344 HydrophobicContact CG-CD2 3.83Å; K340-F344 HydrophobicContact CG-CE2 3.84Å; K340-F344 VanDerWaalsContact O-CD2 3.28Å; K340-F344 WeakPolarHBondContact O-CD2 3.48Å; K340-F344 PolarHBondContact O-N 3.12Å
341A55.8Low49.5Very low51 Ų51105.2 Ų105.242%0.42156%0.556SS.*Hα-helixtrans-61.4-39.4176.200000112.9K337 N338 L339 H345K337-A341 PolarHBondContact O-N 3.23Å; N338-A341 PolarHBondContact O-N 2.97Å; L339-A341 VanDerWaalsContact C-N 3.35Å; L339-A341 PolarHBondContact O-N 3.47Å; A341-H345 WeakPolarHBondContact O-CB 3.05Å; A341-H345 PolarHBondContact O-N 3.32Å
342K50.4Low49.2Very low162 Ų162106.1 Ų106.170%0.70455%0.553SS**Hα-helixtrans-69.5-38.7176-100177.2172.2176.60113.4N338 L339 K340 H345 N346N338-K342 WeakPolarHBondContact O-CB 2.93Å; N338-K342 PolarHBondContact O-N 3.13Å; L339-K342 PolarHBondContact O-N 2.89Å; K340-K342 VanDerWaalsContact C-N 3.35Å; K340-K342 PolarHBondContact O-N 3.47Å; K342-H345 PolarHBondContact O-N 2.03Å; K342-N346 WeakPolarHBondContact O-CB 3.46Å; K342-N346 PolarHBondContact O-N 3.04Å
343V53.6Low49Very low84 Ų84107.2 Ų107.251%0.50956%0.558SS.*Hα-helixtrans-66.2-42.6176.7170.80000110.6L339 K340 N346 E347L339-V343 VanDerWaalsContact O-CG2 3.31Å; L339-V343 WeakPolarHBondContact O-CG2 3.36Å; L339-V343 PolarHBondContact O-N 3.25Å; K340-V343 PolarHBondContact O-N 2.84Å; V343-N346 PolarHBondContact O-N 3.04Å; V343-E347 PolarHBondContact O-N 3.14Å
344F50.4Low48.7Very low113 Ų113108.9 Ų108.950%0.49657%0.57SS.*Hα-helixtrans-72-26175.4-80.4-76.2000113.6K340 S348K340-F344 HydrophobicContact CD-CE2 4.46Å; K340-F344 HydrophobicContact CG-CD2 3.83Å; K340-F344 HydrophobicContact CG-CE2 3.84Å; K340-F344 VanDerWaalsContact O-CD2 3.28Å; K340-F344 WeakPolarHBondContact O-CD2 3.48Å; K340-F344 PolarHBondContact O-N 3.12Å; F344-S348 PolarHBondContact O-OG 3.37Å
345H40.6Very low48.3Very low144 Ų144104.7 Ų104.767%0.66756%0.564SS**Hα-helixtrans-76.2-26.5170.4-108-70.8000113.7A341 K342 S348A341-H345 WeakPolarHBondContact O-CB 3.05Å; A341-H345 PolarHBondContact O-N 3.32Å; K342-H345 PolarHBondContact O-N 2.03Å; H345-S348 PolarHBondContact O-N 2.91Å; H345-S348 PolarHBondContact O-OG 3.12Å
346N35.2Very low47.8Very low124 Ų124107.6 Ų107.666%0.66357%0.573SS**Hα-helixtrans-81.8-18.4177.7-121.231.3000113.3K342 V343 S348K342-N346 WeakPolarHBondContact O-CB 3.46Å; K342-N346 PolarHBondContact O-N 3.04Å; V343-N346 PolarHBondContact O-N 3.04Å; N346-S348 PolarHBondContact O-N 3.26Å
347E40.4Very low47.1Very low153 Ų153112 Ų11272%0.71560%0.597SS**THydrogen-bonded Turntrans-79.5-2169.3-75.9-164.7132.200113.2V343V343-E347 PolarHBondContact O-N 3.14Å
348S34.6Very low46.1Very low88 Ų88110.6 Ų110.662%0.61560%0.599SS**THydrogen-bonded Turntrans-98.27.6175.6-5.90000114F344 H345 N346F344-S348 PolarHBondContact O-OG 3.37Å; H345-S348 PolarHBondContact O-N 2.91Å; H345-S348 PolarHBondContact O-OG 3.12Å; N346-S348 PolarHBondContact O-N 3.26Å
349S33.3Very low45.3Very low88 Ų88114.4 Ų114.462%0.61562%0.62SS**  trans-138.141.7-17843.30000114.6
350V33.9Very low44.2Very low209 Ų209116.3 Ų116.3100%1.26763%0.632SS**  trans-135.90154.9-176.50000110.1

Retrieved 350 of 350 residues in 92 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).