G4M0H4_SCHMA Loading...

Rhodopsin-like orphan GPCR,putative

AlphaFold DB , UniProt , Accession G4M0H4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 367 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M48.7Very low40.1Very low18 Ų1867.1 Ų67.19%0.08936%0.36CS..  0-36.60-155.6158.9-83.100118.8D187 F188 Y191 V270 V271 Y274 Q302M1-D187 PolarHBondContact N-OD2 2.89Å; M1-F188 HydrophobicContact CE-CD1 3.28Å; M1-F188 HydrophobicContact CE-CE1 3.36Å; M1-Y191 HydrophobicContact CE-CD1 3.73Å; M1-Y191 HydrophobicContact CE-CE1 4.09Å; M1-Y191 HydrophobicContact SD-CD1 3.72Å; M1-Y191 HydrophobicContact SD-CE1 3.45Å; M1-Y191 WeakPolarHBondContact SD-CE1 3.48Å; M1-V270 HydrophobicContact CG-CB 4.5Å; M1-V270 HydrophobicContact CG-CG1 4.18Å; M1-V270 HydrophobicContact CG-CG2 3.59Å; M1-V270 HydrophobicContact SD-CB 4.18Å; M1-V270 HydrophobicContact SD-CG1 3.37Å; M1-V270 WeakPolarHBondContact SD-CG1 3.27Å; M1-V270 HydrophobicContact SD-CG2 3.89Å; M1-V271 HydrophobicContact CE-CB 4.15Å; M1-V271 HydrophobicContact CE-CG2 3.41Å; M1-V271 VanDerWaalsContact CE-CG2 3.41Å; M1-V271 HydrophobicContact SD-CG2 4.08Å; M1-Y274 HydrophobicContact CG-CD2 4.11Å; M1-Y274 HydrophobicContact CG-CE2 4.2Å; M1-Y274 WeakPolarHBondContact O-CE2 3.4Å; M1-Y274 PolarHBondContact O-OH 2.88Å; M1-Q302 PolarHBondContact SD-NE2 3.47Å; M1-Q302 VanDerWaalsContact SD-NE2 3.45Å
2I43.4Very low39.4Very low6 Ų676.3 Ų76.33%0.03139%0.388CS..  trans-87.76.8171-76.6-163.3000113.1F104 V299 M303I2-F104 HydrophobicContact CB-CD1 4.33Å; I2-F104 HydrophobicContact CB-CE1 3.62Å; I2-F104 HydrophobicContact CB-CZ 4.05Å; I2-F104 HydrophobicContact CD1-CE1 3.98Å; I2-F104 HydrophobicContact CD1-CE2 4.29Å; I2-F104 HydrophobicContact CD1-CZ 3.47Å; I2-F104 VanDerWaalsContact CD1-CZ 3.47Å; I2-F104 HydrophobicContact CG1-CE1 3.82Å; I2-F104 HydrophobicContact CG1-CZ 3.85Å; I2-F104 HydrophobicContact CG2-CE1 4.37Å; I2-V299 HydrophobicContact CD1-CG1 3.83Å; I2-V299 HydrophobicContact CG1-CG1 4.16Å; I2-M303 HydrophobicContact CD1-CE 3.52Å; I2-M303 HydrophobicContact CD1-SD 3.84Å; I2-M303 HydrophobicContact CG1-CE 4.46Å
3L47.8Very low38.9Very low25 Ų2576.8 Ų76.813%0.13139%0.388CS..  trans-112.374.3-169.5-50.6169.5000106.5I5 L101 T105 Y159L3-I5 HydrophobicContact CB-CG1 4.4Å; L3-I5 PolarHBondContact O-N 3.35Å; L3-L101 HydrophobicContact CB-CD2 4.46Å; L3-L101 HydrophobicContact CD1-CB 3.87Å; L3-L101 HydrophobicContact CD1-CD2 3.65Å; L3-L101 HydrophobicContact CD1-CG 3.41Å; L3-L101 VanDerWaalsContact CD1-CG 3.41Å; L3-L101 HydrophobicContact CD2-CD1 3.77Å; L3-L101 HydrophobicContact CD2-CD2 4.07Å; L3-L101 HydrophobicContact CD2-CG 3.45Å; L3-L101 VanDerWaalsContact CD2-CG 3.45Å; L3-L101 HydrophobicContact CG-CD2 4.23Å; L3-L101 HydrophobicContact CG-CG 3.94Å; L3-T105 WeakPolarHBondContact CD1-OG1 3.37Å; L3-Y159 HydrophobicContact CD1-CE1 4Å
4S43.6Very low38.7Very low38 Ų3877.6 Ų77.627%0.26640%0.4SS..  trans-55.392.1136.3-175.90000104.5D6S4-D6 PolarHBondContact OG-OD1 2.81Å
5I47.3Very low39Very low24 Ų2478.2 Ų78.212%0.12340%0.399CS..  trans-64.2115.8145.5-72.4177.2000101.5L3 G7 L101 Y159 V163 C170 P172 H180L3-I5 HydrophobicContact CB-CG1 4.4Å; L3-I5 PolarHBondContact O-N 3.35Å; I5-G7 WeakPolarHBondContact O-CA 3.4Å; I5-G7 PolarHBondContact O-N 3.43Å; I5-L101 HydrophobicContact CG1-CD2 4.4Å; I5-Y159 HydrophobicContact CD1-CE1 4.4Å; I5-V163 HydrophobicContact CD1-CG2 3.59Å; I5-V163 HydrophobicContact CG1-CG2 4.38Å; I5-C170 VanDerWaalsContact CA-O 3.3Å; I5-C170 WeakPolarHBondContact CA-O 3.09Å; I5-P172 HydrophobicContact CG2-CB 3.74Å; I5-P172 HydrophobicContact CG2-CG 3.35Å; I5-H180 WeakPolarHBondContact CD1-CE1 3.49Å; I5-H180 VanDerWaalsContact CD1-ND1 3.3Å; I5-H180 WeakPolarHBondContact CD1-ND1 3.48Å
6D44.4Very low39Very low88 Ų8879.3 Ų79.347%0.47141%0.41SS..  trans-62.484.7-179.6-68.6-33.4000108S4 N8 S169 C170S4-D6 PolarHBondContact OG-OD1 2.81Å; D6-N8 VanDerWaalsContact C-N 3.34Å; D6-S169 WeakPolarHBondContact OD2-CB 3.49Å; D6-S169 PolarHBondContact OD2-OG 2.91Å; D6-C170 PolarHBondContact N-O 3.22Å
7G37Very low39.5Very low32 Ų3280.8 Ų80.833%0.3342%0.415SS..  trans-86.5-12-16600000112.2I5I5-G7 WeakPolarHBondContact O-CA 3.4Å; I5-G7 PolarHBondContact O-N 3.43Å
8N35Very low40Very low95 Ų9586.6 Ų86.651%0.50844%0.439SS..SBendtrans-137.5141.7-169.2-91-17.8000115.6D6 T10D6-N8 VanDerWaalsContact C-N 3.34Å; N8-T10 VanDerWaalsContact C-N 3.3Å; N8-T10 PolarHBondContact O-N 2.91Å
9F35.6Very low40.6Very low168 Ų16886.4 Ų86.474%0.73745%0.447SS*.  trans-75.862-174.6-72.6-104000112.4
10T31Very low41.4Very low92 Ų9283.5 Ų83.556%0.56443%0.432SS*.  trans-101.4116.4158.946.80000107.4N8 Y12N8-T10 VanDerWaalsContact C-N 3.3Å; N8-T10 PolarHBondContact O-N 2.91Å; T10-Y12 PolarHBondContact O-N 3.32Å
11E27.8Very low42.4Very low152 Ų15280.3 Ų80.371%0.7142%0.42SS*.  trans-19.1123.1158.2-165.1170.2-158.100110.4H13E11-H13 PolarHBondContact O-CD2 2.95Å; E11-H13 PolarHBondContact O-N 3.07Å
12Y31.2Very low43.5Very low178 Ų17883 Ų8370%0.69844%0.437SS*.  trans-54.491.2177.6-177.1-91000108.1T10 P14T10-Y12 PolarHBondContact O-N 3.32Å; Y12-P14 HydrophobicContact CE1-CB 4.47Å; Y12-P14 VanDerWaalsContact O-CD 3.23Å; Y12-P14 WeakPolarHBondContact O-CD 3.06Å
13H33Very low45.5Very low83 Ų8385.9 Ų85.938%0.38445%0.452SS..  trans-73114.4166.7-70.4-61.7000103.6E11 K15E11-H13 PolarHBondContact O-CD2 2.95Å; E11-H13 PolarHBondContact O-N 3.07Å; H13-K15 PolarHBondContact O-N 2.84Å
14P36Very low47.3Very low87 Ų8785.2 Ų85.257%0.56545%0.448SS*.  trans-53.8114.7167.222.7-29.7000104.8Y12 V16Y12-P14 HydrophobicContact CE1-CB 4.47Å; Y12-P14 VanDerWaalsContact O-CD 3.23Å; Y12-P14 WeakPolarHBondContact O-CD 3.06Å; P14-V16 WeakPolarHBondContact O-CG2 3.16Å; P14-V16 PolarHBondContact O-N 3.42Å
15K44Very low49.3Very low87 Ų8785 Ų8538%0.37845%0.447SS..  trans-60.587.6176.5-68.8169.7174.8-171.20106.1H13 H17 E87 D292H13-K15 PolarHBondContact O-N 2.84Å; K15-H17 PolarHBondContact O-N 3.35Å; K15-E87 WeakPolarHBondContact CD-OE1 3.29Å; K15-E87 WeakPolarHBondContact CD-OE2 3.26Å; K15-E87 IonicContact NZ-OE1 2.99Å; K15-E87 PolarHBondContact NZ-OE1 3.5Å; K15-E87 IonicContact NZ-OE2 2.93Å; K15-E87 PolarHBondContact NZ-OE2 3.03Å; K15-D292 WeakPolarHBondContact CD-OD2 3.43Å; K15-D292 VanDerWaalsContact CE-OD1 3.29Å; K15-D292 WeakPolarHBondContact CE-OD1 3.24Å; K15-D292 IonicContact NZ-OD1 2.76Å; K15-D292 PolarHBondContact NZ-OD1 2.92Å
16V38.7Very low51.4Low96 Ų9687.3 Ų87.358%0.58246%0.462SS*.  trans-67.4102.3175.3174.50000104P14P14-V16 WeakPolarHBondContact O-CG2 3.16Å; P14-V16 PolarHBondContact O-N 3.42Å
17H46.4Very low53.8Low104 Ų10484 Ų8448%0.48145%0.447SS..  trans178.4109.2137.6-87.3-57000109.6K15 S19 L20K15-H17 PolarHBondContact O-N 3.35Å; H17-S19 PolarHBondContact O-N 2.8Å; H17-L20 HydrophobicContact CB-CD1 3.52Å; H17-L20 PolarHBondContact O-N 3.26Å; H17-L20 VanDerWaalsContact O-N 3.08Å
18H49.2Very low56.5Low186 Ų18682.6 Ų82.686%0.86143%0.432SS*.Hα-helixtrans-49.1-22.9174.7-111.9-86.8000114.6T22H18-T22 PolarHBondContact O-OG1 3.33Å
19S50.6Low59.4Low83 Ų8380.5 Ų80.558%0.5842%0.42SS*.Hα-helixtrans-76.6-23.5-179.5530000113.8H17 T22H17-S19 PolarHBondContact O-N 2.8Å; S19-T22 VanDerWaalsContact O-CB 3.28Å; S19-T22 WeakPolarHBondContact O-CB 3.46Å; S19-T22 PolarHBondContact O-OG1 3.37Å
20L57.2Low62.2Low27 Ų2776.7 Ų76.714%0.14141%0.406CS..Hα-helixtrans-87.6-33.1-175.6-77.284.1000113.1H17 T22 L23 T293H17-L20 HydrophobicContact CB-CD1 3.52Å; H17-L20 PolarHBondContact O-N 3.26Å; H17-L20 VanDerWaalsContact O-N 3.08Å; L20-T22 PolarHBondContact O-N 3.18Å; L20-L23 PolarHBondContact O-N 3.12Å; L20-L23 VanDerWaalsContact O-N 3.11Å; L20-T293 WeakPolarHBondContact CD2-OG1 3.43Å
21G62.7Low65.3Low18 Ų1872.7 Ų72.719%0.18638%0.381CS..Hα-helixtrans-57.4-27.6169.100000112.3L23 S25G21-L23 VanDerWaalsContact C-N 3.32Å; G21-L23 PolarHBondContact O-N 3.49Å; G21-S25 VanDerWaalsContact O-CB 3.31Å; G21-S25 WeakPolarHBondContact O-CB 3.4Å; G21-S25 PolarHBondContact O-N 2.99Å; G21-S25 PolarHBondContact O-OG 2.83Å
22T71.4Confident68.6Low74 Ų7466.3 Ų66.345%0.45435%0.352SS..Hα-helixtrans-61.4-36.3175.8-45.90000112.8H18 S19 L20 S25 V26H18-T22 PolarHBondContact O-OG1 3.33Å; S19-T22 VanDerWaalsContact O-CB 3.28Å; S19-T22 WeakPolarHBondContact O-CB 3.46Å; S19-T22 PolarHBondContact O-OG1 3.37Å; L20-T22 PolarHBondContact O-N 3.18Å; T22-S25 PolarHBondContact O-N 3.29Å; T22-V26 HydrophobicContact CG2-CG2 4.25Å; T22-V26 WeakPolarHBondContact O-CG2 3.25Å; T22-V26 PolarHBondContact O-N 3.35Å
23L85.2Confident71.7Confident66 Ų6663.4 Ų63.435%0.34635%0.348SS..Hα-helixtrans-67.5-47-174.8-17068.5000111.2L20 G21 S25 V26 A27 P28 R296 V297 I300L20-L23 PolarHBondContact O-N 3.12Å; L20-L23 VanDerWaalsContact O-N 3.11Å; G21-L23 VanDerWaalsContact C-N 3.32Å; G21-L23 PolarHBondContact O-N 3.49Å; L23-S25 VanDerWaalsContact C-N 3.31Å; L23-V26 PolarHBondContact O-N 3.13Å; L23-A27 WeakPolarHBondContact O-CB 3.28Å; L23-A27 PolarHBondContact O-N 3.28Å; L23-P28 WeakPolarHBondContact O-CD 3.25Å; L23-R296 HydrophobicContact CD2-CB 3.96Å; L23-V297 HydrophobicContact CD2-CG2 3.91Å; L23-I300 HydrophobicContact CD1-CD1 4.05Å; L23-I300 HydrophobicContact CD2-CD1 3.53Å; L23-I300 HydrophobicContact CG-CD1 3.38Å
24Y86.8Confident74.7Confident11 Ų1163 Ų634%0.04335%0.347CS..Hα-helixtrans-72-22.3172-81.7-5000113.5V26 P28 Q79 W80 I82 R296 I300Y24-V26 VanDerWaalsContact C-N 3.33Å; Y24-P28 HydrophobicContact CD1-CG 4.4Å; Y24-P28 WeakPolarHBondContact O-CD 3.4Å; Y24-P28 VanDerWaalsContact O-CG 3.31Å; Y24-P28 WeakPolarHBondContact O-CG 3.42Å; Y24-Q79 HydrophobicContact CD1-CB 4.31Å; Y24-Q79 HydrophobicContact CE1-CB 4.4Å; Y24-Q79 HydrophobicContact CE1-CG 4.43Å; Y24-Q79 HydrophobicContact CG-CB 4.36Å; Y24-W80 WeakPolarHBondContact O-CA 3.37Å; Y24-I82 HydrophobicContact CD2-CG2 4.36Å; Y24-R296 HydrophobicContact CD1-CB 4.2Å; Y24-R296 HydrophobicContact CD1-CG 4.24Å; Y24-R296 HydrophobicContact CD2-CG 4.13Å; Y24-R296 HydrophobicContact CE1-CB 3.68Å; Y24-R296 HydrophobicContact CE1-CG 3.78Å; Y24-R296 HydrophobicContact CE2-CB 4.46Å; Y24-R296 HydrophobicContact CE2-CG 3.64Å; Y24-R296 HydrophobicContact CG-CG 4.42Å; Y24-R296 VanDerWaalsContact CZ-CG 3.46Å; Y24-I300 HydrophobicContact CD1-CD1 4.01Å; Y24-I300 HydrophobicContact CD1-CG1 4.33Å; Y24-I300 HydrophobicContact CE1-CD1 4.13Å; Y24-I300 HydrophobicContact CE1-CG1 4.13Å
25S85.9Confident77.6Confident34 Ų3458.9 Ų58.924%0.23832%0.321CS..Hα-helixtrans-72.3-26.1173.3-62.50000113.2G21 T22 L23 W80 G83G21-S25 VanDerWaalsContact O-CB 3.31Å; G21-S25 WeakPolarHBondContact O-CB 3.4Å; G21-S25 PolarHBondContact O-N 2.99Å; G21-S25 PolarHBondContact O-OG 2.83Å; T22-S25 PolarHBondContact O-N 3.29Å; L23-S25 VanDerWaalsContact C-N 3.31Å; S25-W80 PolarHBondContact O-NE1 3.02Å; S25-G83 PolarHBondContact OG-O 3.46Å
26V91Very high80.2Confident72 Ų7256.9 Ų56.944%0.43631%0.314SS..Hα-helixtrans-114.1-49-171.9179.40000113.8T22 L23 Y24 I29 I30T22-V26 HydrophobicContact CG2-CG2 4.25Å; T22-V26 WeakPolarHBondContact O-CG2 3.25Å; T22-V26 PolarHBondContact O-N 3.35Å; L23-V26 PolarHBondContact O-N 3.13Å; Y24-V26 VanDerWaalsContact C-N 3.33Å; V26-I29 WeakPolarHBondContact O-CG2 3.26Å; V26-I29 PolarHBondContact O-N 3.28Å; V26-I30 HydrophobicContact CG1-CD1 3.77Å; V26-I30 WeakPolarHBondContact O-CG1 3.4Å; V26-I30 PolarHBondContact O-N 3.28Å
27A93.9Very high82.9Confident19 Ų1955.9 Ų55.916%0.15731%0.309CS..Hα-helixtrans-65.8-45-172.300000113.6L23 I29 I30 I31 I300L23-A27 WeakPolarHBondContact O-CB 3.28Å; L23-A27 PolarHBondContact O-N 3.28Å; A27-I29 VanDerWaalsContact C-N 3.32Å; A27-I29 PolarHBondContact O-N 2.78Å; A27-I30 PolarHBondContact O-N 3.07Å; A27-I31 WeakPolarHBondContact O-CG1 3.39Å; A27-I31 PolarHBondContact O-N 2.81Å; A27-I300 HydrophobicContact CB-CD1 3.7Å; A27-I300 HydrophobicContact CB-CG1 4.16Å; A27-I300 HydrophobicContact CB-CG2 4.11Å
28P94.4Very high85.3Confident3 Ų351.2 Ų51.22%0.01929%0.289CS..Hα-helixtrans-61.5-35.4179.7-2536.3000113.7L23 Y24 I31 L32 C76 Q79 W80L23-P28 WeakPolarHBondContact O-CD 3.25Å; Y24-P28 HydrophobicContact CD1-CG 4.4Å; Y24-P28 WeakPolarHBondContact O-CD 3.4Å; Y24-P28 VanDerWaalsContact O-CG 3.31Å; Y24-P28 WeakPolarHBondContact O-CG 3.42Å; P28-I31 PolarHBondContact O-N 3.15Å; P28-L32 VanDerWaalsContact O-CG 3.31Å; P28-L32 WeakPolarHBondContact O-CG 3.42Å; P28-L32 PolarHBondContact O-N 2.88Å; P28-C76 HydrophobicContact CB-CB 3.98Å; P28-C76 WeakPolarHBondContact CB-O 3.44Å; P28-Q79 HydrophobicContact CB-CB 4.29Å; P28-Q79 HydrophobicContact CG-CB 3.81Å; P28-W80 HydrophobicContact CB-CB 4.06Å
29I94.7Very high87.6Confident51 Ų5142.4 Ų42.426%0.26225%0.248SC..Hα-helixtrans-70.6-36.1178.9-170.863.8000112V26 A27 L32 I33 W80V26-I29 WeakPolarHBondContact O-CG2 3.26Å; V26-I29 PolarHBondContact O-N 3.28Å; A27-I29 VanDerWaalsContact C-N 3.32Å; A27-I29 PolarHBondContact O-N 2.78Å; I29-L32 HydrophobicContact CD1-CD1 4.2Å; I29-L32 PolarHBondContact O-N 2.82Å; I29-I33 HydrophobicContact CD1-CD1 4.46Å; I29-I33 HydrophobicContact CG1-CD1 4.09Å; I29-I33 WeakPolarHBondContact O-CG1 3.31Å; I29-I33 PolarHBondContact O-N 3.43Å; I29-W80 HydrophobicContact CB-CG 4.5Å
30I95.3Very high89.8Confident87 Ų8741.8 Ų41.845%0.44624%0.239SC..Hα-helixtrans-63.1-45.6172.8-65.1170000110V26 A27 L32 I33 I34V26-I30 HydrophobicContact CG1-CD1 3.77Å; V26-I30 WeakPolarHBondContact O-CG1 3.4Å; V26-I30 PolarHBondContact O-N 3.28Å; A27-I30 PolarHBondContact O-N 3.07Å; I30-L32 VanDerWaalsContact C-N 3.33Å; I30-L32 PolarHBondContact O-N 2.65Å; I30-I33 PolarHBondContact O-N 3.42Å; I30-I34 HydrophobicContact CG2-CD1 3.88Å; I30-I34 WeakPolarHBondContact O-CG1 3.49Å; I30-I34 PolarHBondContact O-N 3.06Å; I30-I34 VanDerWaalsContact O-N 3.15Å
31I96.4Very high91.7Very high8 Ų843.3 Ų43.34%0.04125%0.247CC..Hα-helixtrans-62.9-39.1177.6-62.8166.5000111A27 P28 G35 I72 I300 M303 I304 M307A27-I31 WeakPolarHBondContact O-CG1 3.39Å; A27-I31 PolarHBondContact O-N 2.81Å; P28-I31 PolarHBondContact O-N 3.15Å; I31-G35 VanDerWaalsContact O-CA 3.26Å; I31-G35 WeakPolarHBondContact O-CA 3.45Å; I31-G35 PolarHBondContact O-N 3.38Å; I31-I72 HydrophobicContact CG2-CG2 4.25Å; I31-I300 HydrophobicContact CD1-CG2 4.24Å; I31-M303 HydrophobicContact CD1-CB 3.99Å; I31-I304 HydrophobicContact CD1-CG1 3.78Å; I31-I304 HydrophobicContact CG1-CG1 4.23Å; I31-M307 HydrophobicContact CG1-CE 4.47Å; I31-M307 HydrophobicContact CG2-CB 4.36Å; I31-M307 HydrophobicContact CG2-SD 4.26Å
32L96.4Very high93.3Very high19 Ų1942.5 Ų42.510%0.09924%0.238CC..Hα-helixtrans-61-50.5175.7-78.7163.8000112.1P28 I29 I30 I34 I36 I72 C76P28-L32 VanDerWaalsContact O-CG 3.31Å; P28-L32 WeakPolarHBondContact O-CG 3.42Å; P28-L32 PolarHBondContact O-N 2.88Å; I29-L32 HydrophobicContact CD1-CD1 4.2Å; I29-L32 PolarHBondContact O-N 2.82Å; I30-L32 VanDerWaalsContact C-N 3.33Å; I30-L32 PolarHBondContact O-N 2.65Å; L32-I34 VanDerWaalsContact C-N 3.3Å; L32-I34 PolarHBondContact O-N 3.09Å; L32-I36 HydrophobicContact CD2-CD1 3.6Å; L32-I36 HydrophobicContact CD2-CG1 4.36Å; L32-I36 WeakPolarHBondContact O-CB 3.48Å; L32-I36 PolarHBondContact O-N 3.35Å; L32-I36 VanDerWaalsContact O-N 3.15Å; L32-I72 HydrophobicContact CD2-CG2 3.98Å; L32-C76 HydrophobicContact CD1-CB 4.03Å; L32-C76 HydrophobicContact CD2-CB 3.9Å; L32-C76 HydrophobicContact CG-CB 3.59Å
33I96.4Very high94.6Very high117 Ų11740.7 Ų40.760%0.623%0.225SC*.Hα-helixtrans-64.4-34.9-175.4-70169.2000111.8I29 I30 P37I29-I33 HydrophobicContact CD1-CD1 4.46Å; I29-I33 HydrophobicContact CG1-CD1 4.09Å; I29-I33 WeakPolarHBondContact O-CG1 3.31Å; I29-I33 PolarHBondContact O-N 3.43Å; I30-I33 PolarHBondContact O-N 3.42Å; I33-P37 WeakPolarHBondContact O-CD 3.44Å; I33-P37 VanDerWaalsContact O-CG 3.24Å; I33-P37 WeakPolarHBondContact O-CG 3.02Å
34I96.5Very high95.1Very high73 Ų7340.1 Ų40.137%0.37422%0.224SC..Hα-helixtrans-89.9-46.8-179.2-61.9173.4000110.9I30 L32 G38 M307 F311I30-I34 HydrophobicContact CG2-CD1 3.88Å; I30-I34 WeakPolarHBondContact O-CG1 3.49Å; I30-I34 PolarHBondContact O-N 3.06Å; I30-I34 VanDerWaalsContact O-N 3.15Å; L32-I34 VanDerWaalsContact C-N 3.3Å; L32-I34 PolarHBondContact O-N 3.09Å; I34-G38 PolarHBondContact O-N 3.17Å; I34-G38 VanDerWaalsContact O-N 3.1Å; I34-M307 HydrophobicContact CB-SD 3.57Å; I34-M307 VanDerWaalsContact CB-SD 3.57Å; I34-M307 HydrophobicContact CG2-CE 4.48Å; I34-M307 HydrophobicContact CG2-CG 4.24Å; I34-M307 HydrophobicContact CG2-SD 3.45Å; I34-M307 WeakPolarHBondContact CG2-SD 3.04Å; I34-F311 HydrophobicContact CG2-CE2 4.05Å; I34-F311 HydrophobicContact CG2-CZ 3.69Å
35G97.1Very high95.5Very high1 Ų139.8 Ų39.81%0.0122%0.223CC..Hα-helixtrans-72.2-40-170.300000114.2I31 N39I31-G35 VanDerWaalsContact O-CA 3.26Å; I31-G35 WeakPolarHBondContact O-CA 3.45Å; I31-G35 PolarHBondContact O-N 3.38Å; G35-N39 WeakPolarHBondContact O-CB 3.34Å; G35-N39 PolarHBondContact O-N 3.29Å
36I97.3Very high96Very high46 Ų4639.1 Ų39.124%0.23622%0.215CC..Hα-helixtrans-64.4-55.6178.6-67.7176.4000110.8L32 G38 N39 L40 T69 I72 A73L32-I36 HydrophobicContact CD2-CD1 3.6Å; L32-I36 HydrophobicContact CD2-CG1 4.36Å; L32-I36 WeakPolarHBondContact O-CB 3.48Å; L32-I36 PolarHBondContact O-N 3.35Å; L32-I36 VanDerWaalsContact O-N 3.15Å; I36-G38 VanDerWaalsContact C-N 3.34Å; I36-G38 PolarHBondContact O-N 3.05Å; I36-N39 PolarHBondContact O-N 3.48Å; I36-L40 HydrophobicContact CG2-CD1 3.67Å; I36-L40 HydrophobicContact CG2-CG 4.27Å; I36-L40 WeakPolarHBondContact O-CB 3.34Å; I36-L40 VanDerWaalsContact O-CG 3.26Å; I36-L40 WeakPolarHBondContact O-CG 3.24Å; I36-L40 PolarHBondContact O-N 3.25Å; I36-T69 HydrophobicContact CG2-CG2 4.33Å; I36-I72 HydrophobicContact CG1-CG2 3.9Å; I36-A73 HydrophobicContact CD1-CB 4.1Å
37P96.9Very high96.2Very high75 Ų7539 Ų3949%0.48721%0.212SC..Hα-helixtrans-61.7-40.4178.9-24.737000113I33 L40 L41I33-P37 WeakPolarHBondContact O-CD 3.44Å; I33-P37 VanDerWaalsContact O-CG 3.24Å; I33-P37 WeakPolarHBondContact O-CG 3.02Å; P37-L40 PolarHBondContact O-N 3.22Å; P37-L41 VanDerWaalsContact O-CB 3.23Å; P37-L41 WeakPolarHBondContact O-CB 3.04Å; P37-L41 PolarHBondContact O-N 2.82Å
38G96.6Very high96.3Very high6 Ų646.1 Ų46.16%0.06223%0.234CC..Hα-helixtrans-59.2-51.6178.200000112.4I34 I36 L41 S42 F310I34-G38 PolarHBondContact O-N 3.17Å; I34-G38 VanDerWaalsContact O-N 3.1Å; I36-G38 VanDerWaalsContact C-N 3.34Å; I36-G38 PolarHBondContact O-N 3.05Å; G38-L41 PolarHBondContact O-N 2.93Å; G38-S42 WeakPolarHBondContact O-CB 3.45Å; G38-S42 PolarHBondContact O-N 3.38Å; G38-S42 PolarHBondContact O-OG 3.33Å; G38-F310 VanDerWaalsContact O-CD2 3.31Å; G38-F310 WeakPolarHBondContact O-CD2 3.22Å
39N97.4Very high96.2Very high0 Ų048.6 Ų48.60%024%0.243CC..Hα-helixtrans-68.7-38.6179.6-77-23000112.7G35 I36 S42 M43 C65 D68 T69 I72 H306G35-N39 WeakPolarHBondContact O-CB 3.34Å; G35-N39 PolarHBondContact O-N 3.29Å; I36-N39 PolarHBondContact O-N 3.48Å; N39-S42 PolarHBondContact O-N 3.45Å; N39-M43 VanDerWaalsContact O-CB 3.31Å; N39-M43 WeakPolarHBondContact O-CB 3.47Å; N39-M43 PolarHBondContact O-N 3.5Å; N39-C65 HydrophobicContact CB-CB 4.5Å; N39-C65 WeakPolarHBondContact O-CB 3.27Å; N39-D68 VanDerWaalsContact ND2-CB 3.33Å; N39-D68 WeakPolarHBondContact ND2-CB 3.36Å; N39-T69 WeakPolarHBondContact CB-OG1 3.35Å; N39-I72 WeakPolarHBondContact ND2-CD1 3.12Å; N39-H306 PolarHBondContact ND2-O 3.2Å
40L97.2Very high96.2Very high71 Ų7149 Ų4937%0.37225%0.245SC..Hα-helixtrans-63.3-42.8175.4-72.7177.4000111.9I36 P37 M43 V44 T69I36-L40 HydrophobicContact CG2-CD1 3.67Å; I36-L40 HydrophobicContact CG2-CG 4.27Å; I36-L40 WeakPolarHBondContact O-CB 3.34Å; I36-L40 VanDerWaalsContact O-CG 3.26Å; I36-L40 WeakPolarHBondContact O-CG 3.24Å; I36-L40 PolarHBondContact O-N 3.25Å; P37-L40 PolarHBondContact O-N 3.22Å; L40-M43 HydrophobicContact CD2-CE 3.66Å; L40-M43 WeakPolarHBondContact O-CB 3.31Å; L40-M43 PolarHBondContact O-N 3.45Å; L40-V44 WeakPolarHBondContact O-CG2 3.45Å; L40-V44 PolarHBondContact O-N 3.41Å; L40-T69 HydrophobicContact CD2-CG2 3.94Å; L40-T69 HydrophobicContact CG-CG2 4.11Å
41L96.4Very high95.9Very high59 Ų5950.2 Ų50.231%0.30926%0.262SS..Hα-helixtrans-63.2-44.2175.5-178.655.4000111.1P37 G38 V44 I45 F310 L324 L327P37-L41 VanDerWaalsContact O-CB 3.23Å; P37-L41 WeakPolarHBondContact O-CB 3.04Å; P37-L41 PolarHBondContact O-N 2.82Å; G38-L41 PolarHBondContact O-N 2.93Å; L41-V44 PolarHBondContact O-N 3.37Å; L41-I45 HydrophobicContact CD1-CD1 4.16Å; L41-I45 HydrophobicContact CD1-CG1 4.46Å; L41-I45 HydrophobicContact CG-CD1 4.09Å; L41-I45 WeakPolarHBondContact O-CG1 3.38Å; L41-I45 PolarHBondContact O-N 3.47Å; L41-F310 HydrophobicContact CD2-CE2 4.17Å; L41-L324 HydrophobicContact CD1-CD1 4.42Å; L41-L324 HydrophobicContact CD2-CD1 3.45Å; L41-L324 VanDerWaalsContact CD2-CD1 3.45Å; L41-L324 HydrophobicContact CG-CD1 4.07Å; L41-L327 HydrophobicContact CD1-CD1 3.82Å
42S97Very high95.6Very high0 Ų054.2 Ų54.20%029%0.287CS..Hα-helixtrans-59.9-46.2174.6-74.30000112.4G38 N39 V44 I45 W46 C65 F310 F320G38-S42 WeakPolarHBondContact O-CB 3.45Å; G38-S42 PolarHBondContact O-N 3.38Å; G38-S42 PolarHBondContact O-OG 3.33Å; N39-S42 PolarHBondContact O-N 3.45Å; S42-V44 PolarHBondContact O-N 2.93Å; S42-I45 PolarHBondContact O-N 3.16Å; S42-W46 WeakPolarHBondContact O-CB 3.36Å; S42-W46 PolarHBondContact O-N 3.46Å; S42-C65 VanDerWaalsContact CB-SG 3.56Å; S42-F310 WeakPolarHBondContact OG-CD2 3.4Å; S42-F320 WeakPolarHBondContact OG-CE2 3.47Å; S42-F320 VanDerWaalsContact OG-CZ 3.29Å; S42-F320 WeakPolarHBondContact OG-CZ 3.38Å
43M97.1Very high95.2Very high36 Ų3654.5 Ų54.518%0.17729%0.29CS..Hα-helixtrans-54.8-50.4176.1178.8-174.168.700110.8N39 L40 I45 W46 L47 C65 M66N39-M43 VanDerWaalsContact O-CB 3.31Å; N39-M43 WeakPolarHBondContact O-CB 3.47Å; N39-M43 PolarHBondContact O-N 3.5Å; L40-M43 HydrophobicContact CD2-CE 3.66Å; L40-M43 WeakPolarHBondContact O-CB 3.31Å; L40-M43 PolarHBondContact O-N 3.45Å; M43-I45 PolarHBondContact O-N 3.33Å; M43-W46 PolarHBondContact O-N 3.02Å; M43-L47 HydrophobicContact CG-CD1 3.65Å; M43-L47 HydrophobicContact CG-CG 4.21Å; M43-L47 WeakPolarHBondContact O-CB 3.49Å; M43-L47 VanDerWaalsContact O-CG 3.27Å; M43-L47 WeakPolarHBondContact O-CG 3.38Å; M43-L47 PolarHBondContact O-N 2.99Å; M43-L47 HydrophobicContact SD-CD1 4.42Å; M43-C65 HydrophobicContact CB-CB 3.77Å; M43-M66 HydrophobicContact SD-CB 3.91Å; M43-M66 HydrophobicContact SD-CG 4.32Å
44V96.4Very high94.7Very high55 Ų5552.5 Ų52.533%0.33328%0.282SS..Hα-helixtrans-60.6-44.8179.8171.40000111.7L40 L41 S42 R48L40-V44 WeakPolarHBondContact O-CG2 3.45Å; L40-V44 PolarHBondContact O-N 3.41Å; L41-V44 PolarHBondContact O-N 3.37Å; S42-V44 PolarHBondContact O-N 2.93Å; V44-R48 WeakPolarHBondContact O-CB 3.16Å; V44-R48 VanDerWaalsContact O-CG 3.23Å; V44-R48 WeakPolarHBondContact O-CG 3.43Å; V44-R48 PolarHBondContact O-N 2.04Å; V44-R48 VanDerWaalsContact O-N 3.08Å
45I96.1Very high94.4Very high3 Ų349.3 Ų49.32%0.01527%0.268CS..Hα-helixtrans-60.7-48.6178.2-68.4165.9000110.3L41 S42 M43 R48 R49 F320 D323 L324 L327L41-I45 HydrophobicContact CD1-CD1 4.16Å; L41-I45 HydrophobicContact CD1-CG1 4.46Å; L41-I45 HydrophobicContact CG-CD1 4.09Å; L41-I45 WeakPolarHBondContact O-CG1 3.38Å; L41-I45 PolarHBondContact O-N 3.47Å; S42-I45 PolarHBondContact O-N 3.16Å; M43-I45 PolarHBondContact O-N 3.33Å; I45-R48 PolarHBondContact O-N 3.45Å; I45-R49 PolarHBondContact O-N 3.43Å; I45-F320 HydrophobicContact CB-CD2 4.41Å; I45-F320 HydrophobicContact CB-CE2 4.15Å; I45-F320 HydrophobicContact CD1-CD2 4.2Å; I45-F320 HydrophobicContact CD1-CE2 3.59Å; I45-F320 HydrophobicContact CD1-CZ 3.76Å; I45-F320 HydrophobicContact CG1-CE2 4.48Å; I45-F320 HydrophobicContact CG2-CD2 3.82Å; I45-F320 HydrophobicContact CG2-CE2 4.07Å; I45-D323 HydrophobicContact CG2-CB 3.85Å; I45-L324 HydrophobicContact CD1-CB 4.13Å; I45-L324 HydrophobicContact CD1-CD1 4.2Å; I45-L327 HydrophobicContact CD1-CD1 3.95Å; I45-L327 HydrophobicContact CG1-CD1 3.44Å; I45-L327 VanDerWaalsContact CG1-CD1 3.44Å
46W95.8Very high94.3Very high21 Ų2149.4 Ų49.48%0.0827%0.268CS..Hα-helixtrans-70.3-40.7-176-73.8117.1000112.9S42 M43 R48 R49 S58 I61 Y313 F320S42-W46 WeakPolarHBondContact O-CB 3.36Å; S42-W46 PolarHBondContact O-N 3.46Å; M43-W46 PolarHBondContact O-N 3.02Å; W46-R48 PolarHBondContact O-N 2.77Å; W46-R49 WeakPolarHBondContact O-CB 3.34Å; W46-R49 PolarHBondContact O-N 2.91Å; W46-R49 VanDerWaalsContact O-N 3.08Å; W46-S58 WeakPolarHBondContact O-CB 3.3Å; W46-I61 HydrophobicContact CB-CG2 4.17Å; W46-I61 HydrophobicContact CD2-CB 4.27Å; W46-I61 HydrophobicContact CD2-CD1 4.29Å; W46-I61 HydrophobicContact CD2-CG2 3.82Å; W46-I61 HydrophobicContact CE3-CD1 4.43Å; W46-I61 HydrophobicContact CG-CB 4.14Å; W46-I61 HydrophobicContact CG-CG2 3.49Å; W46-I61 VanDerWaalsContact CG-CG2 3.49Å; W46-I61 HydrophobicContact CH2-CD1 4.07Å; W46-I61 HydrophobicContact CZ2-CD1 3.92Å; W46-I61 HydrophobicContact CZ3-CD1 4.33Å; W46-I61 VanDerWaalsContact NE1-CG2 3.32Å; W46-Y313 AromaticContact CZ2-CD1 3.92Å; W46-Y313 HydrophobicContact CZ2-CD1 3.92Å; W46-Y313 HydrophobicContact CZ2-CE1 4.23Å; W46-Y313 HydrophobicContact CZ2-CG 4.46Å; W46-Y313 AromaticContact NE1-CD1 3.85Å; W46-Y313 AromaticContact NE1-CD2 3.79Å; W46-Y313 AromaticContact NE1-CE1 3.87Å; W46-Y313 AromaticContact NE1-CE2 3.87Å; W46-Y313 AromaticContact NE1-CG 3.82Å; W46-Y313 AromaticContact NE1-CZ 3.94Å; W46-F320 AromaticContact CE2-CD2 4Å; W46-F320 HydrophobicContact CZ2-CB 4.41Å; W46-F320 HydrophobicContact CZ2-CD2 4.27Å; W46-F320 AromaticContact NE1-CD2 3.64Å; W46-F320 AromaticContact NE1-CE2 3.91Å
47L95.6Very high94.1Very high69 Ų6947.4 Ų47.436%0.36126%0.258SS..Hα-helixtrans-67.4-34.9177.2-67-180000112.4M43 R49 L50M43-L47 HydrophobicContact CG-CD1 3.65Å; M43-L47 HydrophobicContact CG-CG 4.21Å; M43-L47 WeakPolarHBondContact O-CB 3.49Å; M43-L47 VanDerWaalsContact O-CG 3.27Å; M43-L47 WeakPolarHBondContact O-CG 3.38Å; M43-L47 PolarHBondContact O-N 2.99Å; M43-L47 HydrophobicContact SD-CD1 4.42Å; L47-R49 PolarHBondContact O-N 2.91Å; L47-L50 WeakPolarHBondContact O-CB 3.44Å; L47-L50 PolarHBondContact O-N 3.24Å; L47-L50 VanDerWaalsContact O-N 3.07Å
48R95.3Very high94Very high168 Ų16843.8 Ų43.863%0.63424%0.235SC*.Hα-helixtrans-62.6-24172.1-75.8177-175.8-164.75.6113V44 I45 W46 L50V44-R48 WeakPolarHBondContact O-CB 3.16Å; V44-R48 VanDerWaalsContact O-CG 3.23Å; V44-R48 WeakPolarHBondContact O-CG 3.43Å; V44-R48 PolarHBondContact O-N 2.04Å; V44-R48 VanDerWaalsContact O-N 3.08Å; I45-R48 PolarHBondContact O-N 3.45Å; W46-R48 PolarHBondContact O-N 2.77Å; R48-L50 VanDerWaalsContact C-N 3.34Å
49R93.1Very high94Very high55 Ų5544.7 Ų44.721%0.20824%0.238CC..THydrogen-bonded Turntrans-84.3-4.6176.4-75.2-166.9163-78.2-13.4114.2I45 W46 L47 S51 T52 T53 S58 D323I45-R49 PolarHBondContact O-N 3.43Å; W46-R49 WeakPolarHBondContact O-CB 3.34Å; W46-R49 PolarHBondContact O-N 2.91Å; W46-R49 VanDerWaalsContact O-N 3.08Å; L47-R49 PolarHBondContact O-N 2.91Å; R49-S51 PolarHBondContact O-N 3.31Å; R49-S51 VanDerWaalsContact O-N 3.14Å; R49-T52 PolarHBondContact O-N 3.3Å; R49-T52 PolarHBondContact O-OG1 2.84Å; R49-T53 WeakPolarHBondContact O-CB 3.4Å; R49-T53 PolarHBondContact O-N 2.99Å; R49-T53 PolarHBondContact O-OG1 2.87Å; R49-S58 WeakPolarHBondContact CB-OG 3.42Å; R49-D323 IonicContact CZ-OD1 2.8Å; R49-D323 IonicContact CZ-OD2 3.48Å; R49-D323 IonicContact NE-OD2 3.22Å; R49-D323 PolarHBondContact NE-OD2 3.39Å; R49-D323 IonicContact NH2-OD1 2.64Å; R49-D323 PolarHBondContact NH2-OD1 3.04Å; R49-D323 IonicContact NH2-OD2 3.08Å; R49-D323 PolarHBondContact NH2-OD2 3.1Å
50L93.2Very high94Very high59 Ų5944.8 Ų44.831%0.30924%0.239SC..THydrogen-bonded Turntrans-52.7-40.9-174.8-176.558.9000113.2L47 R48 L59 L138L47-L50 WeakPolarHBondContact O-CB 3.44Å; L47-L50 PolarHBondContact O-N 3.24Å; L47-L50 VanDerWaalsContact O-N 3.07Å; R48-L50 VanDerWaalsContact C-N 3.34Å; L50-L59 HydrophobicContact CD1-CB 3.78Å; L50-L138 HydrophobicContact CD1-CD1 3.69Å; L50-L138 HydrophobicContact CD1-CD2 3.95Å; L50-L138 HydrophobicContact CD1-CG 4.5Å; L50-L138 HydrophobicContact CG-CD2 4.36Å
51S90.1Very high93.9Very high113 Ų11341.7 Ų41.779%0.7922%0.222SC*.THydrogen-bonded Turntrans-77-18.8179.958.10000114.7R49R49-S51 PolarHBondContact O-N 3.31Å; R49-S51 VanDerWaalsContact O-N 3.14Å
52T89.8Confident93.9Very high93 Ų9338.9 Ų38.957%0.57121%0.208SC*.THydrogen-bonded Turntrans-106.7-24.4-174.760.60000113R49R49-T52 PolarHBondContact O-N 3.3Å; R49-T52 PolarHBondContact O-OG1 2.84Å
53T88.9Confident94Very high25 Ų2540.6 Ų40.615%0.15322%0.217CC..SBendtrans-80.6122.7177-65.70000109.9R49 G55 S58R49-T53 WeakPolarHBondContact O-CB 3.4Å; R49-T53 PolarHBondContact O-N 2.99Å; R49-T53 PolarHBondContact O-OG1 2.87Å; T53-G55 PolarHBondContact O-N 3.46Å; T53-S58 WeakPolarHBondContact CB-OG 3.39Å; T53-S58 WeakPolarHBondContact CG2-OG 3.34Å; T53-S58 PolarHBondContact OG1-OG 3.02Å
54V85.3Confident94Very high74 Ų7438.9 Ų38.945%0.44821%0.208SC..SBendtrans-68.7131.3171.4178.60000109.8R248V54-R248 PolarHBondContact O-NH2 2.85Å
55G90.2Very high94Very high7 Ų736.3 Ų36.37%0.07219%0.192CC..SBendtrans87.2-164.4-178.500000112.5T53 E121 C136T53-G55 PolarHBondContact O-N 3.46Å; G55-E121 WeakPolarHBondContact CA-OE1 3.45Å; G55-C136 WeakPolarHBondContact CA-O 3.4Å; G55-C136 PolarHBondContact N-O 3.5Å
56S94.3Very high94.1Very high2 Ų240.7 Ų40.71%0.01421%0.214CC..SBendtrans-1021.4-173.560.50000114.2S58 L59 L60 E121 G141S56-S58 VanDerWaalsContact C-N 3.32Å; S56-S58 PolarHBondContact O-N 3.32Å; S56-L59 WeakPolarHBondContact O-CB 3.32Å; S56-L59 PolarHBondContact O-N 2.82Å; S56-L60 WeakPolarHBondContact O-CG 3.4Å; S56-L60 PolarHBondContact O-N 2.85Å; S56-E121 PolarHBondContact N-OE1 3.27Å; S56-E121 VanDerWaalsContact OG-CD 3.24Å; S56-E121 PolarHBondContact OG-OE1 3.1Å; S56-G141 WeakPolarHBondContact OG-CA 3.41Å
57T93.1Very high94.2Very high4 Ų440 Ų403%0.02521%0.212CC..Hα-helixtrans-51.6-46.5-175.3-49.10000113.7L59 L60 I61 L118 E121 R122 V252T57-L59 VanDerWaalsContact C-N 3.35Å; T57-L60 PolarHBondContact O-N 2.78Å; T57-I61 HydrophobicContact CG2-CD1 3.82Å; T57-I61 WeakPolarHBondContact O-CB 3.46Å; T57-I61 WeakPolarHBondContact O-CG1 3.41Å; T57-I61 PolarHBondContact O-N 2.78Å; T57-L118 HydrophobicContact CG2-CD2 3.91Å; T57-E121 PolarHBondContact N-OE2 2.94Å; T57-E121 PolarHBondContact OG1-OE2 3.34Å; T57-R122 PolarHBondContact OG1-NH2 3.23Å; T57-V252 HydrophobicContact CG2-CG1 4.32Å
58S94.8Very high94.3Very high0 Ų036.8 Ų36.80%020%0.195CC..Hα-helixtrans-67-36.5-179.9-77.40000112.6W46 R49 T53 S56 G62W46-S58 WeakPolarHBondContact O-CB 3.3Å; R49-S58 WeakPolarHBondContact CB-OG 3.42Å; T53-S58 WeakPolarHBondContact CB-OG 3.39Å; T53-S58 WeakPolarHBondContact CG2-OG 3.34Å; T53-S58 PolarHBondContact OG1-OG 3.02Å; S56-S58 VanDerWaalsContact C-N 3.32Å; S56-S58 PolarHBondContact O-N 3.32Å; S58-G62 PolarHBondContact O-N 3.35Å
59L97Very high94.4Very high25 Ų2529.7 Ų29.713%0.13117%0.171CC..Hα-helixtrans-64.1-55.717317769.7000110.2L50 S56 T57 I61 G62 I63 L138 I142 L145L50-L59 HydrophobicContact CD1-CB 3.78Å; S56-L59 WeakPolarHBondContact O-CB 3.32Å; S56-L59 PolarHBondContact O-N 2.82Å; T57-L59 VanDerWaalsContact C-N 3.35Å; L59-I61 VanDerWaalsContact C-N 3.35Å; L59-I61 PolarHBondContact O-N 3.09Å; L59-G62 PolarHBondContact O-N 3.46Å; L59-G62 VanDerWaalsContact O-N 3.08Å; L59-I63 HydrophobicContact CD1-CG1 4.1Å; L59-I63 HydrophobicContact CG-CG1 4.37Å; L59-I63 WeakPolarHBondContact O-CG1 3.35Å; L59-I63 PolarHBondContact O-N 3.45Å; L59-L138 HydrophobicContact CB-CD1 4.04Å; L59-L138 HydrophobicContact CD2-CD1 3.87Å; L59-I142 HydrophobicContact CD2-CD1 4.29Å; L59-I142 HydrophobicContact CD2-CG1 3.43Å; L59-I142 VanDerWaalsContact CD2-CG1 3.43Å; L59-L145 HydrophobicContact CD2-CD2 4.49Å
60L96.9Very high94.6Very high2 Ų230.6 Ų30.61%0.0118%0.175CC..Hα-helixtrans-55.4-50.2-176.9-71.7176.3000110.9S56 T57 G62 I63 M64 I114 L117 L118 L145S56-L60 WeakPolarHBondContact O-CG 3.4Å; S56-L60 PolarHBondContact O-N 2.85Å; T57-L60 PolarHBondContact O-N 2.78Å; L60-G62 PolarHBondContact O-N 3.42Å; L60-I63 PolarHBondContact O-N 3.23Å; L60-M64 WeakPolarHBondContact O-CB 3.5Å; L60-M64 PolarHBondContact O-N 3.08Å; L60-I114 HydrophobicContact CB-CG2 3.94Å; L60-I114 HydrophobicContact CD2-CG2 4.45Å; L60-I114 WeakPolarHBondContact O-CG2 3.33Å; L60-L117 HydrophobicContact CD1-CB 3.99Å; L60-L117 HydrophobicContact CD2-CB 4.22Å; L60-L117 HydrophobicContact CD2-CD1 3.87Å; L60-L118 HydrophobicContact CB-CD2 3.79Å; L60-L118 HydrophobicContact CB-CG 4.18Å; L60-L118 HydrophobicContact CD1-CD2 3.88Å; L60-L118 HydrophobicContact CD1-CG 4.22Å; L60-L145 HydrophobicContact CD2-CB 4.22Å; L60-L145 HydrophobicContact CD2-CD1 4.23Å; L60-L145 HydrophobicContact CD2-CD2 4.43Å
61I95.4Very high94.8Very high5 Ų527.8 Ų27.83%0.02616%0.16CC..Hα-helixtrans-62.1-43.5176.6-68.4172.2000111.7W46 T57 L59 I63 M64 C65 L118 Y313W46-I61 HydrophobicContact CB-CG2 4.17Å; W46-I61 HydrophobicContact CD2-CB 4.27Å; W46-I61 HydrophobicContact CD2-CD1 4.29Å; W46-I61 HydrophobicContact CD2-CG2 3.82Å; W46-I61 HydrophobicContact CE3-CD1 4.43Å; W46-I61 HydrophobicContact CG-CB 4.14Å; W46-I61 HydrophobicContact CG-CG2 3.49Å; W46-I61 VanDerWaalsContact CG-CG2 3.49Å; W46-I61 HydrophobicContact CH2-CD1 4.07Å; W46-I61 HydrophobicContact CZ2-CD1 3.92Å; W46-I61 HydrophobicContact CZ3-CD1 4.33Å; W46-I61 VanDerWaalsContact NE1-CG2 3.32Å; T57-I61 HydrophobicContact CG2-CD1 3.82Å; T57-I61 WeakPolarHBondContact O-CB 3.46Å; T57-I61 WeakPolarHBondContact O-CG1 3.41Å; T57-I61 PolarHBondContact O-N 2.78Å; L59-I61 VanDerWaalsContact C-N 3.35Å; L59-I61 PolarHBondContact O-N 3.09Å; I61-I63 VanDerWaalsContact C-N 3.33Å; I61-I63 PolarHBondContact O-N 3.26Å; I61-M64 WeakPolarHBondContact O-CB 3.49Å; I61-M64 PolarHBondContact O-N 3.05Å; I61-C65 PolarHBondContact O-N 3.16Å; I61-C65 PolarHBondContact O-SG 3.45Å; I61-C65 VanDerWaalsContact O-SG 3.35Å; I61-L118 HydrophobicContact CG1-CD1 3.88Å; I61-L118 HydrophobicContact CG1-CD2 4.12Å; I61-Y313 HydrophobicContact CD1-CE1 4.14Å; I61-Y313 HydrophobicContact CG2-CE1 3.85Å; I61-Y313 HydrophobicContact CG2-CE2 4.12Å; I61-Y313 VanDerWaalsContact CG2-CZ 3.45Å; I61-Y313 WeakPolarHBondContact CG2-OH 3.33Å
62G97Very high95.1Very high0 Ų022.4 Ų22.40%012%0.122CC..Hα-helixtrans-59.7-43.1178.500000112.6S58 L59 L60 C65 M66S58-G62 PolarHBondContact O-N 3.35Å; L59-G62 PolarHBondContact O-N 3.46Å; L59-G62 VanDerWaalsContact O-N 3.08Å; L60-G62 PolarHBondContact O-N 3.42Å; G62-C65 PolarHBondContact O-N 2.86Å; G62-M66 PolarHBondContact O-N 3.36Å; G62-M66 VanDerWaalsContact O-N 3.11Å
63I98Very high95.4Very high37 Ų3719.6 Ų19.619%0.1911%0.108CC..Hα-helixtrans-67.5-38.8175.4-62.3-59.1000111.2L59 L60 I61 C65 M66 T67 I114 L145L59-I63 HydrophobicContact CD1-CG1 4.1Å; L59-I63 HydrophobicContact CG-CG1 4.37Å; L59-I63 WeakPolarHBondContact O-CG1 3.35Å; L59-I63 PolarHBondContact O-N 3.45Å; L60-I63 PolarHBondContact O-N 3.23Å; I61-I63 VanDerWaalsContact C-N 3.33Å; I61-I63 PolarHBondContact O-N 3.26Å; I63-C65 PolarHBondContact O-N 3.12Å; I63-M66 HydrophobicContact CD1-CE 3.95Å; I63-M66 HydrophobicContact CG2-CE 4.21Å; I63-M66 WeakPolarHBondContact O-CB 3.45Å; I63-M66 PolarHBondContact O-N 3.35Å; I63-M66 VanDerWaalsContact O-N 3.12Å; I63-T67 PolarHBondContact O-N 3.44Å; I63-T67 PolarHBondContact O-OG1 3.18Å; I63-I114 HydrophobicContact CB-CD1 4.36Å; I63-I114 HydrophobicContact CG2-CD1 3.86Å; I63-L145 HydrophobicContact CG1-CD2 4.22Å; I63-L145 HydrophobicContact CG2-CD2 4.46Å
64M96.9Very high95.6Very high0 Ų019.8 Ų19.80%011%0.108CC..Hα-helixtrans-60.1-45175-166.2174.766.500111.6L60 I61 M66 T67 D68 I114 I115 M259 Y313L60-M64 WeakPolarHBondContact O-CB 3.5Å; L60-M64 PolarHBondContact O-N 3.08Å; I61-M64 WeakPolarHBondContact O-CB 3.49Å; I61-M64 PolarHBondContact O-N 3.05Å; M64-M66 VanDerWaalsContact C-N 3.27Å; M64-M66 PolarHBondContact O-N 3.21Å; M64-T67 WeakPolarHBondContact CA-OG1 3.28Å; M64-T67 PolarHBondContact O-N 2.87Å; M64-T67 PolarHBondContact O-OG1 2.95Å; M64-D68 WeakPolarHBondContact O-CB 3.32Å; M64-D68 PolarHBondContact O-N 3.46Å; M64-I114 HydrophobicContact CB-CB 4.32Å; M64-I114 HydrophobicContact CB-CD1 4.08Å; M64-I114 HydrophobicContact CB-CG2 3.85Å; M64-I114 HydrophobicContact CG-CB 4.37Å; M64-I114 HydrophobicContact CG-CG2 4.25Å; M64-I114 HydrophobicContact SD-CB 4.4Å; M64-I114 HydrophobicContact SD-CG2 4.09Å; M64-I115 HydrophobicContact SD-CD1 4.5Å; M64-I115 HydrophobicContact SD-CG1 3.75Å; M64-M259 HydrophobicContact CE-CE 3.7Å; M64-M259 HydrophobicContact CE-SD 4.19Å; M64-Y313 WeakPolarHBondContact CE-OH 3.47Å
65C98Very high96Very high0 Ų016.3 Ų16.30%09%0.086CC..Hα-helixtrans-60.4-38.5174.4-67.30000111.9N39 S42 M43 I61 G62 I63 D68 T69N39-C65 HydrophobicContact CB-CB 4.5Å; N39-C65 WeakPolarHBondContact O-CB 3.27Å; S42-C65 VanDerWaalsContact CB-SG 3.56Å; M43-C65 HydrophobicContact CB-CB 3.77Å; I61-C65 PolarHBondContact O-N 3.16Å; I61-C65 PolarHBondContact O-SG 3.45Å; I61-C65 VanDerWaalsContact O-SG 3.35Å; G62-C65 PolarHBondContact O-N 2.86Å; I63-C65 PolarHBondContact O-N 3.12Å; C65-D68 PolarHBondContact O-N 2.88Å; C65-T69 WeakPolarHBondContact O-CB 3.5Å; C65-T69 PolarHBondContact O-N 3.02Å; C65-T69 PolarHBondContact O-OG1 3.42Å
66M97.4Very high96.2Very high95 Ų9516 Ų1647%0.4688%0.083SC..Hα-helixtrans-63.6-45.8175.4-176.2-176.770.700111.7M43 G62 I63 M64 T69 Y70M43-M66 HydrophobicContact SD-CB 3.91Å; M43-M66 HydrophobicContact SD-CG 4.32Å; G62-M66 PolarHBondContact O-N 3.36Å; G62-M66 VanDerWaalsContact O-N 3.11Å; I63-M66 HydrophobicContact CD1-CE 3.95Å; I63-M66 HydrophobicContact CG2-CE 4.21Å; I63-M66 WeakPolarHBondContact O-CB 3.45Å; I63-M66 PolarHBondContact O-N 3.35Å; I63-M66 VanDerWaalsContact O-N 3.12Å; M64-M66 VanDerWaalsContact C-N 3.27Å; M64-M66 PolarHBondContact O-N 3.21Å; M66-T69 PolarHBondContact O-N 3Å; M66-Y70 PolarHBondContact O-N 3.45Å; M66-Y70 VanDerWaalsContact O-N 3.09Å
67T97.7Very high96.1Very high8 Ų819.1 Ų19.15%0.04910%0.099CC..Hα-helixtrans-64.5-41.3176.850.70000111.5I63 M64 Y70 V71 L110I63-T67 PolarHBondContact O-N 3.44Å; I63-T67 PolarHBondContact O-OG1 3.18Å; M64-T67 WeakPolarHBondContact CA-OG1 3.28Å; M64-T67 PolarHBondContact O-N 2.87Å; M64-T67 PolarHBondContact O-OG1 2.95Å; T67-Y70 WeakPolarHBondContact O-CB 3.45Å; T67-Y70 PolarHBondContact O-N 3.42Å; T67-V71 WeakPolarHBondContact O-CG2 3.19Å; T67-V71 PolarHBondContact O-N 2.9Å; T67-L110 HydrophobicContact CG2-CB 4.45Å; T67-L110 HydrophobicContact CG2-CD2 3.7Å; T67-L110 HydrophobicContact CG2-CG 4.07Å
68D97.5Very high96Very high0 Ų020 Ų200%010%0.102CC..Hα-helixtrans-66-39.7177.3-68.6-32.1000112N39 M64 C65 Y70 V71 I72 S111 H306 H309N39-D68 VanDerWaalsContact ND2-CB 3.33Å; N39-D68 WeakPolarHBondContact ND2-CB 3.36Å; M64-D68 WeakPolarHBondContact O-CB 3.32Å; M64-D68 PolarHBondContact O-N 3.46Å; C65-D68 PolarHBondContact O-N 2.88Å; D68-Y70 VanDerWaalsContact C-N 3.29Å; D68-Y70 PolarHBondContact O-N 3.49Å; D68-V71 PolarHBondContact O-N 3.24Å; D68-I72 WeakPolarHBondContact O-CB 3.43Å; D68-I72 VanDerWaalsContact O-CG1 3.27Å; D68-I72 WeakPolarHBondContact O-CG1 3.2Å; D68-I72 PolarHBondContact O-N 3.16Å; D68-S111 WeakPolarHBondContact OD1-CB 3.15Å; D68-S111 PolarHBondContact OD1-OG 2.82Å; D68-H306 HydrophobicContact CB-CB 4.22Å; D68-H306 WeakPolarHBondContact CB-O 3.39Å; D68-H306 IonicContact OD1-CE1 3.37Å; D68-H306 IonicContact OD1-CG 3.09Å; D68-H306 IonicContact OD1-ND1 2.6Å; D68-H306 PolarHBondContact OD1-ND1 2.86Å; D68-H309 IonicContact OD2-CE1 3.73Å; D68-H309 PolarHBondContact OD2-CE1 2.69Å; D68-H309 VanDerWaalsContact OD2-CE1 3.31Å; D68-H309 IonicContact OD2-CG 3.18Å; D68-H309 IonicContact OD2-ND1 3.4Å; D68-H309 PolarHBondContact OD2-ND1 2.77Å
69T97.9Very high95.9Very high20 Ų2020.4 Ų20.412%0.12310%0.104CC..Hα-helixtrans-58-44172-66.30000110.9I36 N39 L40 C65 M66 A73I36-T69 HydrophobicContact CG2-CG2 4.33Å; N39-T69 WeakPolarHBondContact CB-OG1 3.35Å; L40-T69 HydrophobicContact CD2-CG2 3.94Å; L40-T69 HydrophobicContact CG-CG2 4.11Å; C65-T69 WeakPolarHBondContact O-CB 3.5Å; C65-T69 PolarHBondContact O-N 3.02Å; C65-T69 PolarHBondContact O-OG1 3.42Å; M66-T69 PolarHBondContact O-N 3Å; T69-A73 WeakPolarHBondContact O-CB 3.41Å; T69-A73 PolarHBondContact O-N 3.29Å
70Y97.2Very high95.7Very high73 Ų7323.1 Ų23.129%0.28611%0.113SC..Hα-helixtrans-64-46.7176.5172.9-94.8000112.1M66 T67 D68 I72 A73 H74 L103 S107M66-Y70 PolarHBondContact O-N 3.45Å; M66-Y70 VanDerWaalsContact O-N 3.09Å; T67-Y70 WeakPolarHBondContact O-CB 3.45Å; T67-Y70 PolarHBondContact O-N 3.42Å; D68-Y70 VanDerWaalsContact C-N 3.29Å; D68-Y70 PolarHBondContact O-N 3.49Å; Y70-I72 VanDerWaalsContact C-N 3.34Å; Y70-I72 PolarHBondContact O-N 3.49Å; Y70-A73 PolarHBondContact O-N 2.92Å; Y70-H74 HydrophobicContact CE1-CB 4.35Å; Y70-H74 HydrophobicContact CE2-CB 4.3Å; Y70-H74 WeakPolarHBondContact O-CB 3.44Å; Y70-H74 PolarHBondContact O-N 3.23Å; Y70-L103 HydrophobicContact CE1-CB 4.03Å; Y70-L103 WeakPolarHBondContact CE1-O 3.23Å; Y70-L103 WeakPolarHBondContact OH-CB 3.36Å; Y70-S107 VanDerWaalsContact CD1-OG 3.22Å; Y70-S107 WeakPolarHBondContact CD1-OG 3.41Å
71V96.6Very high95.4Very high0 Ų024.4 Ų24.40%012%0.119CC..Hα-helixtrans-60.2-44.2179.4170.90000110.9T67 D68 G75 F104 M303 H306T67-V71 WeakPolarHBondContact O-CG2 3.19Å; T67-V71 PolarHBondContact O-N 2.9Å; D68-V71 PolarHBondContact O-N 3.24Å; V71-G75 VanDerWaalsContact O-CA 3.27Å; V71-G75 WeakPolarHBondContact O-CA 3.29Å; V71-G75 PolarHBondContact O-N 3.38Å; V71-F104 HydrophobicContact CG1-CE2 3.75Å; V71-F104 HydrophobicContact CG1-CZ 4.12Å; V71-M303 HydrophobicContact CG1-CE 4.33Å; V71-H306 HydrophobicContact CG1-CB 4.5Å
72I97.1Very high95Very high0 Ų024.9 Ų24.90%012%0.122CC..Iπ-helixtrans-64.2-50.2175.2-68.8171000110.2I31 L32 I36 N39 D68 Y70 H74 C76 H306 M307I31-I72 HydrophobicContact CG2-CG2 4.25Å; L32-I72 HydrophobicContact CD2-CG2 3.98Å; I36-I72 HydrophobicContact CG1-CG2 3.9Å; N39-I72 WeakPolarHBondContact ND2-CD1 3.12Å; D68-I72 WeakPolarHBondContact O-CB 3.43Å; D68-I72 VanDerWaalsContact O-CG1 3.27Å; D68-I72 WeakPolarHBondContact O-CG1 3.2Å; D68-I72 PolarHBondContact O-N 3.16Å; Y70-I72 VanDerWaalsContact C-N 3.34Å; Y70-I72 PolarHBondContact O-N 3.49Å; I72-H74 PolarHBondContact O-N 3.21Å; I72-C76 WeakPolarHBondContact O-CA 3.43Å; I72-C76 WeakPolarHBondContact O-CB 3.33Å; I72-C76 PolarHBondContact O-N 3.07Å; I72-H306 HydrophobicContact CD1-CB 4.09Å; I72-H306 HydrophobicContact CG1-CB 3.84Å; I72-M307 HydrophobicContact CD1-CB 4.01Å
73A96Very high94.5Very high34 Ų3425.1 Ų25.128%0.28112%0.124SC..Iπ-helixtrans-59.3-47.3-177.900000111.9I36 T69 Y70 L77I36-A73 HydrophobicContact CD1-CB 4.1Å; T69-A73 WeakPolarHBondContact O-CB 3.41Å; T69-A73 PolarHBondContact O-N 3.29Å; Y70-A73 PolarHBondContact O-N 2.92Å; A73-L77 WeakPolarHBondContact O-CB 3.32Å; A73-L77 PolarHBondContact O-N 2.85Å
74H94.2Very high94.1Very high30 Ų3027.5 Ų27.514%0.13914%0.136CC..Iπ-helixtrans-76.9-51.6179.9179.1-96.8000112.3Y70 I72 R78 F104Y70-H74 HydrophobicContact CE1-CB 4.35Å; Y70-H74 HydrophobicContact CE2-CB 4.3Å; Y70-H74 WeakPolarHBondContact O-CB 3.44Å; Y70-H74 PolarHBondContact O-N 3.23Å; I72-H74 PolarHBondContact O-N 3.21Å; H74-R78 WeakPolarHBondContact O-CB 3.49Å; H74-R78 PolarHBondContact O-N 3.18Å; H74-F104 AromaticContact ND1-CD2 3.38Å; H74-F104 WeakPolarHBondContact ND1-CD2 3.49Å; H74-F104 AromaticContact ND1-CG 3.83Å
75G92.9Very high93.6Very high0 Ų029.2 Ų29.20%015%0.146CC..Iπ-helixtrans-65.4-51.9-175.200000112.6V71 R78 Q79V71-G75 VanDerWaalsContact O-CA 3.27Å; V71-G75 WeakPolarHBondContact O-CA 3.29Å; V71-G75 PolarHBondContact O-N 3.38Å; G75-R78 PolarHBondContact O-N 3.33Å; G75-Q79 WeakPolarHBondContact O-CG 3.42Å; G75-Q79 PolarHBondContact O-N 3.48Å
76C94.5Very high92.9Very high0 Ų033.9 Ų33.90%017%0.171CC..Iπ-helixtrans-71.1-36.4-178.7-62.80000112P28 L32 I72 R78 Q79 W80P28-C76 HydrophobicContact CB-CB 3.98Å; P28-C76 WeakPolarHBondContact CB-O 3.44Å; L32-C76 HydrophobicContact CD1-CB 4.03Å; L32-C76 HydrophobicContact CD2-CB 3.9Å; L32-C76 HydrophobicContact CG-CB 3.59Å; I72-C76 WeakPolarHBondContact O-CA 3.43Å; I72-C76 WeakPolarHBondContact O-CB 3.33Å; I72-C76 PolarHBondContact O-N 3.07Å; C76-R78 VanDerWaalsContact C-N 3.32Å; C76-R78 PolarHBondContact O-N 3.47Å; C76-Q79 PolarHBondContact O-N 3.12Å; C76-W80 VanDerWaalsContact O-CB 3.27Å; C76-W80 WeakPolarHBondContact O-CB 3.36Å; C76-W80 PolarHBondContact O-N 3.5Å
77L93Very high92Very high69 Ų6932.7 Ų32.736%0.36117%0.165SC..Hα-helixtrans-61.8-42.6174.6-178.665.5000111.2A73 W80 I81 I91A73-L77 WeakPolarHBondContact O-CB 3.32Å; A73-L77 PolarHBondContact O-N 2.85Å; L77-W80 HydrophobicContact CD1-CE3 3.96Å; L77-W80 HydrophobicContact CD1-CZ3 4.3Å; L77-W80 PolarHBondContact O-N 2.88Å; L77-I81 HydrophobicContact CD1-CD1 4Å; L77-I81 HydrophobicContact CD1-CG1 4.45Å; L77-I81 HydrophobicContact CG-CD1 3.9Å; L77-I81 VanDerWaalsContact O-CG1 3.27Å; L77-I81 WeakPolarHBondContact O-CG1 3.44Å; L77-I81 PolarHBondContact O-N 2.79Å; L77-I91 HydrophobicContact CD2-CD1 4.43Å; L77-I91 HydrophobicContact CG-CD1 4.44Å
78R91.2Very high91.1Very high22 Ų2239.3 Ų39.38%0.08319%0.193CC..Hα-helixtrans-58.6-54174.1177.5-178167.7-92.7-2.1111.1H74 G75 C76 W80 I81 I82 D90 I91 R92H74-R78 WeakPolarHBondContact O-CB 3.49Å; H74-R78 PolarHBondContact O-N 3.18Å; G75-R78 PolarHBondContact O-N 3.33Å; C76-R78 VanDerWaalsContact C-N 3.32Å; C76-R78 PolarHBondContact O-N 3.47Å; R78-W80 VanDerWaalsContact C-N 3.27Å; R78-W80 PolarHBondContact O-N 2.89Å; R78-I81 PolarHBondContact O-N 3.47Å; R78-I82 HydrophobicContact CG-CD1 3.76Å; R78-I82 HydrophobicContact CG-CG1 4.42Å; R78-I82 WeakPolarHBondContact O-CG1 3.38Å; R78-I82 PolarHBondContact O-N 2.92Å; R78-D90 IonicContact CZ-OD2 4Å; R78-D90 IonicContact NE-OD1 3.27Å; R78-D90 PolarHBondContact NE-OD1 2.88Å; R78-D90 IonicContact NE-OD2 3.05Å; R78-D90 PolarHBondContact NE-OD2 3.14Å; R78-D90 IonicContact NH2-OD2 2.86Å; R78-D90 PolarHBondContact NH2-OD2 3.22Å; R78-I91 HydrophobicContact CB-CD1 3.91Å; R78-I91 HydrophobicContact CB-CG1 4.04Å; R78-I91 HydrophobicContact CG-CG1 4.26Å; R78-R92 VanDerWaalsContact NE-CZ 3.3Å
79Q91.2Very high90.5Very high9 Ų942.6 Ų42.64%0.04221%0.213CC..Hα-helixtrans-62.7-37-177.3-62.1-59.92.700112Y24 P28 G75 C76 I82 G83 V299Y24-Q79 HydrophobicContact CD1-CB 4.31Å; Y24-Q79 HydrophobicContact CE1-CB 4.4Å; Y24-Q79 HydrophobicContact CE1-CG 4.43Å; Y24-Q79 HydrophobicContact CG-CB 4.36Å; P28-Q79 HydrophobicContact CB-CB 4.29Å; P28-Q79 HydrophobicContact CG-CB 3.81Å; G75-Q79 WeakPolarHBondContact O-CG 3.42Å; G75-Q79 PolarHBondContact O-N 3.48Å; C76-Q79 PolarHBondContact O-N 3.12Å; Q79-I82 PolarHBondContact O-N 3.19Å; Q79-G83 PolarHBondContact O-N 2.89Å; Q79-V299 HydrophobicContact CG-CG1 4.39Å
80W92.7Very high89.9Confident82 Ų8242.6 Ų42.631%0.31121%0.212SC..Hα-helixtrans-61.5-47.8174.5-175.953.1000112.3Y24 S25 P28 I29 C76 L77 R78 I82 G83 I84Y24-W80 WeakPolarHBondContact O-CA 3.37Å; S25-W80 PolarHBondContact O-NE1 3.02Å; P28-W80 HydrophobicContact CB-CB 4.06Å; I29-W80 HydrophobicContact CB-CG 4.5Å; C76-W80 VanDerWaalsContact O-CB 3.27Å; C76-W80 WeakPolarHBondContact O-CB 3.36Å; C76-W80 PolarHBondContact O-N 3.5Å; L77-W80 HydrophobicContact CD1-CE3 3.96Å; L77-W80 HydrophobicContact CD1-CZ3 4.3Å; L77-W80 PolarHBondContact O-N 2.88Å; R78-W80 VanDerWaalsContact C-N 3.27Å; R78-W80 PolarHBondContact O-N 2.89Å; W80-I82 VanDerWaalsContact C-N 3.35Å; W80-I82 PolarHBondContact O-N 2.82Å; W80-G83 PolarHBondContact O-N 3.28Å; W80-G83 VanDerWaalsContact O-N 3.15Å; W80-I84 HydrophobicContact CZ2-CD1 4.39Å; W80-I84 WeakPolarHBondContact O-CG1 3.31Å; W80-I84 PolarHBondContact O-N 3.25Å
81I90.3Very high89.4Confident29 Ų2940.8 Ų40.815%0.14921%0.207CC..Hα-helixtrans-62.5-42.9178.5-69.4168.1000111L77 R78 G83 I84 T85 V89 I91L77-I81 HydrophobicContact CD1-CD1 4Å; L77-I81 HydrophobicContact CD1-CG1 4.45Å; L77-I81 HydrophobicContact CG-CD1 3.9Å; L77-I81 VanDerWaalsContact O-CG1 3.27Å; L77-I81 WeakPolarHBondContact O-CG1 3.44Å; L77-I81 PolarHBondContact O-N 2.79Å; R78-I81 PolarHBondContact O-N 3.47Å; I81-G83 VanDerWaalsContact C-N 3.3Å; I81-G83 PolarHBondContact O-N 2.93Å; I81-I84 WeakPolarHBondContact O-CG1 3.49Å; I81-I84 PolarHBondContact O-N 2.97Å; I81-T85 HydrophobicContact CG2-CG2 4.32Å; I81-T85 WeakPolarHBondContact O-CB 3.26Å; I81-T85 WeakPolarHBondContact O-CG2 3.36Å; I81-T85 PolarHBondContact O-N 3.4Å; I81-T85 PolarHBondContact O-OG1 3.45Å; I81-V89 HydrophobicContact CG2-CB 4.03Å; I81-V89 HydrophobicContact CG2-CG1 3.84Å; I81-I91 HydrophobicContact CD1-CG2 3.34Å; I81-I91 HydrophobicContact CG2-CG2 4.4Å
82I87.2Confident89Confident15 Ų1541.1 Ų41.18%0.07721%0.208CC..Hα-helixtrans-59.3-43.7174.3-70.7174.6000110.5Y24 R78 Q79 W80 N86 E87Y24-I82 HydrophobicContact CD2-CG2 4.36Å; R78-I82 HydrophobicContact CG-CD1 3.76Å; R78-I82 HydrophobicContact CG-CG1 4.42Å; R78-I82 WeakPolarHBondContact O-CG1 3.38Å; R78-I82 PolarHBondContact O-N 2.92Å; Q79-I82 PolarHBondContact O-N 3.19Å; W80-I82 VanDerWaalsContact C-N 3.35Å; W80-I82 PolarHBondContact O-N 2.82Å; I82-N86 PolarHBondContact O-N 3.24Å; I82-E87 HydrophobicContact CG2-CB 4.36Å; I82-E87 HydrophobicContact CG2-CG 3.8Å; I82-E87 PolarHBondContact O-N 3.3Å
83G87.5Confident88.5Confident4 Ų442.8 Ų42.84%0.04122%0.217CC..Hα-helixtrans-61.1-52.4177.500000113.3S25 Q79 W80 I81 T85 N86S25-G83 PolarHBondContact OG-O 3.46Å; Q79-G83 PolarHBondContact O-N 2.89Å; W80-G83 PolarHBondContact O-N 3.28Å; W80-G83 VanDerWaalsContact O-N 3.15Å; I81-G83 VanDerWaalsContact C-N 3.3Å; I81-G83 PolarHBondContact O-N 2.93Å; G83-T85 VanDerWaalsContact C-N 3.33Å; G83-T85 PolarHBondContact O-N 3.37Å; G83-N86 PolarHBondContact O-N 3.04Å
84I89.9Confident88Confident88 Ų8849.6 Ų49.645%0.45124%0.24SC..Hα-helixtrans-73.3-23.9-176.366.8-180000113.4W80 I81W80-I84 HydrophobicContact CZ2-CD1 4.39Å; W80-I84 WeakPolarHBondContact O-CG1 3.31Å; W80-I84 PolarHBondContact O-N 3.25Å; I81-I84 WeakPolarHBondContact O-CG1 3.49Å; I81-I84 PolarHBondContact O-N 2.97Å
85T86.8Confident87.6Confident35 Ų3554.6 Ų54.622%0.21526%0.261CS..THydrogen-bonded Turntrans-96.32.6179.464.90000113.6I81 G83 K88 V89I81-T85 HydrophobicContact CG2-CG2 4.32Å; I81-T85 WeakPolarHBondContact O-CB 3.26Å; I81-T85 WeakPolarHBondContact O-CG2 3.36Å; I81-T85 PolarHBondContact O-N 3.4Å; I81-T85 PolarHBondContact O-OG1 3.45Å; G83-T85 VanDerWaalsContact C-N 3.33Å; G83-T85 PolarHBondContact O-N 3.37Å; T85-K88 VanDerWaalsContact O-CB 3.32Å; T85-K88 WeakPolarHBondContact O-CB 3.14Å; T85-K88 WeakPolarHBondContact O-CD 3.31Å; T85-K88 WeakPolarHBondContact O-CG 3.39Å; T85-K88 PolarHBondContact O-N 3.29Å; T85-V89 HydrophobicContact CG2-CB 3.95Å; T85-V89 HydrophobicContact CG2-CG2 3.89Å; T85-V89 PolarHBondContact OG1-N 3.49Å
86N82.3Confident87.3Confident98 Ų9856.7 Ų56.752%0.52428%0.284SS..THydrogen-bonded Turntrans50.854.2-172.6-64.7-42.3000111.8I82 G83 K88I82-N86 PolarHBondContact O-N 3.24Å; G83-N86 PolarHBondContact O-N 3.04Å; N86-K88 PolarHBondContact O-N 3.01Å; N86-K88 VanDerWaalsContact O-N 3.1Å
87E78.3Confident87.1Confident70 Ų7056.7 Ų56.733%0.32728%0.284SS..THydrogen-bonded Turntrans64.79.3177.3-49.1-171.4169.900115.2K15 I82 R296K15-E87 WeakPolarHBondContact CD-OE1 3.29Å; K15-E87 WeakPolarHBondContact CD-OE2 3.26Å; K15-E87 IonicContact NZ-OE1 2.99Å; K15-E87 PolarHBondContact NZ-OE1 3.5Å; K15-E87 IonicContact NZ-OE2 2.93Å; K15-E87 PolarHBondContact NZ-OE2 3.03Å; I82-E87 HydrophobicContact CG2-CB 4.36Å; I82-E87 HydrophobicContact CG2-CG 3.8Å; I82-E87 PolarHBondContact O-N 3.3Å; E87-R296 IonicContact OE1-CZ 3.89Å; E87-R296 IonicContact OE1-NH2 3.78Å; E87-R296 PolarHBondContact OE1-NH2 3.37Å
88K79.9Confident87.1Confident148 Ų14853.5 Ų53.564%0.64327%0.267SS*.SBendtrans-76.4-25.9179.7-65177.6-176.3-178.30114.3T85 N86 N168T85-K88 VanDerWaalsContact O-CB 3.32Å; T85-K88 WeakPolarHBondContact O-CB 3.14Å; T85-K88 WeakPolarHBondContact O-CD 3.31Å; T85-K88 WeakPolarHBondContact O-CG 3.39Å; T85-K88 PolarHBondContact O-N 3.29Å; N86-K88 PolarHBondContact O-N 3.01Å; N86-K88 VanDerWaalsContact O-N 3.1Å; K88-N168 PolarHBondContact O-ND2 2.85Å
89V84.1Confident87.3Confident69 Ų6957 Ų5742%0.41829%0.287SS..  trans-126.2124.2-175.2-179.40000110.5I81 T85I81-V89 HydrophobicContact CG2-CB 4.03Å; I81-V89 HydrophobicContact CG2-CG1 3.84Å; T85-V89 HydrophobicContact CG2-CB 3.95Å; T85-V89 HydrophobicContact CG2-CG2 3.89Å; T85-V89 PolarHBondContact OG1-N 3.49Å
90D85.4Confident87.4Confident19 Ų1956.9 Ų56.910%0.10229%0.287CS..  trans-121119.3168.4-168.2-29.1000110.6R78 R92 I93R78-D90 IonicContact CZ-OD2 4Å; R78-D90 IonicContact NE-OD1 3.27Å; R78-D90 PolarHBondContact NE-OD1 2.88Å; R78-D90 IonicContact NE-OD2 3.05Å; R78-D90 PolarHBondContact NE-OD2 3.14Å; R78-D90 IonicContact NH2-OD2 2.86Å; R78-D90 PolarHBondContact NH2-OD2 3.22Å; D90-R92 PolarHBondContact O-N 3.39Å; D90-R92 VanDerWaalsContact O-N 3.15Å; D90-R92 VanDerWaalsContact OD1-CB 3.3Å; D90-R92 WeakPolarHBondContact OD1-CB 3.44Å; D90-R92 VanDerWaalsContact OD1-CG 3.24Å; D90-R92 WeakPolarHBondContact OD1-CG 3.28Å; D90-R92 PolarHBondContact OD1-N 3.07Å; D90-R92 IonicContact OD1-NE 3.18Å; D90-R92 PolarHBondContact OD1-NE 3.45Å; D90-R92 IonicContact OD2-CZ 2.82Å; D90-R92 IonicContact OD2-NE 3.96Å; D90-R92 PolarHBondContact OD2-NE 3.14Å; D90-R92 IonicContact OD2-NH2 2.99Å; D90-R92 PolarHBondContact OD2-NH2 2.71Å; D90-I93 HydrophobicContact CB-CD1 3.83Å; D90-I93 HydrophobicContact CB-CG1 4.25Å; D90-I93 WeakPolarHBondContact O-CB 3.32Å; D90-I93 PolarHBondContact O-N 3.29Å
91I86.8Confident87.4Confident35 Ų3553 Ų5318%0.17927%0.272CS..Hα-helixtrans-61.2-22.7-179.760.1171.6000113.6L77 R78 I81 I93 K94 F95L77-I91 HydrophobicContact CD2-CD1 4.43Å; L77-I91 HydrophobicContact CG-CD1 4.44Å; R78-I91 HydrophobicContact CB-CD1 3.91Å; R78-I91 HydrophobicContact CB-CG1 4.04Å; R78-I91 HydrophobicContact CG-CG1 4.26Å; I81-I91 HydrophobicContact CD1-CG2 3.34Å; I81-I91 HydrophobicContact CG2-CG2 4.4Å; I91-I93 PolarHBondContact O-N 3.08Å; I91-K94 PolarHBondContact O-N 2.87Å; I91-F95 WeakPolarHBondContact O-CD2 3.31Å
92R87.4Confident87.6Confident7 Ų753.1 Ų53.13%0.02627%0.272CS..Hα-helixtrans-62.7-32.7179.3-64.4178.4-60.4172.65.6111.9R78 D90 K94 F95 G96 C97 P100 L101R78-R92 VanDerWaalsContact NE-CZ 3.3Å; D90-R92 PolarHBondContact O-N 3.39Å; D90-R92 VanDerWaalsContact O-N 3.15Å; D90-R92 VanDerWaalsContact OD1-CB 3.3Å; D90-R92 WeakPolarHBondContact OD1-CB 3.44Å; D90-R92 VanDerWaalsContact OD1-CG 3.24Å; D90-R92 WeakPolarHBondContact OD1-CG 3.28Å; D90-R92 PolarHBondContact OD1-N 3.07Å; D90-R92 IonicContact OD1-NE 3.18Å; D90-R92 PolarHBondContact OD1-NE 3.45Å; D90-R92 IonicContact OD2-CZ 2.82Å; D90-R92 IonicContact OD2-NE 3.96Å; D90-R92 PolarHBondContact OD2-NE 3.14Å; D90-R92 IonicContact OD2-NH2 2.99Å; D90-R92 PolarHBondContact OD2-NH2 2.71Å; R92-K94 VanDerWaalsContact C-N 3.31Å; R92-K94 PolarHBondContact O-N 3.46Å; R92-F95 PolarHBondContact O-N 3.03Å; R92-G96 PolarHBondContact O-N 2.7Å; R92-C97 PolarHBondContact O-N 3.3Å; R92-P100 HydrophobicContact CB-CB 4.3Å; R92-P100 HydrophobicContact CG-CB 4.04Å; R92-L101 HydrophobicContact CG-CD1 4.48Å
93I87.5Confident88Confident35 Ų3555.5 Ų55.518%0.17928%0.284CS..Hα-helixtrans-63.9-40.5-177.8-62163.3000110.4D90 I91 F95 G96 V165 N168D90-I93 HydrophobicContact CB-CD1 3.83Å; D90-I93 HydrophobicContact CB-CG1 4.25Å; D90-I93 WeakPolarHBondContact O-CB 3.32Å; D90-I93 PolarHBondContact O-N 3.29Å; I91-I93 PolarHBondContact O-N 3.08Å; I93-F95 PolarHBondContact O-N 3.22Å; I93-G96 PolarHBondContact O-N 2.91Å; I93-G96 VanDerWaalsContact O-N 3.08Å; I93-V165 HydrophobicContact CG2-CG1 3.74Å; I93-V165 HydrophobicContact CG2-CG2 4.1Å; I93-N168 HydrophobicContact CD1-CB 4.43Å; I93-N168 WeakPolarHBondContact CD1-O 3.38Å; I93-N168 WeakPolarHBondContact CD1-OD1 3.08Å
94K85.4Confident88.4Confident177 Ų17755.5 Ų55.577%0.7728%0.283SS*.Hα-helixtrans-60.7-28-179.6-170.6174.7-179.1178.90113.1I91 R92I91-K94 PolarHBondContact O-N 2.87Å; R92-K94 VanDerWaalsContact C-N 3.31Å; R92-K94 PolarHBondContact O-N 3.46Å
95F85Confident88.6Confident135 Ų13551.6 Ų51.659%0.59226%0.263SS*.THydrogen-bonded Turntrans-108.316180-61.1-72.5000113I91 R92 I93 P100I91-F95 WeakPolarHBondContact O-CD2 3.31Å; R92-F95 PolarHBondContact O-N 3.03Å; I93-F95 PolarHBondContact O-N 3.22Å; F95-P100 HydrophobicContact CB-CG 3.56Å; F95-P100 HydrophobicContact CG-CG 4.49Å
96G87Confident89.1Confident45 Ų4551.3 Ų51.346%0.46426%0.259SS..THydrogen-bonded Turntrans70.942.2174.300000114.8R92 I93 G98R92-G96 PolarHBondContact O-N 2.7Å; I93-G96 PolarHBondContact O-N 2.91Å; I93-G96 VanDerWaalsContact O-N 3.08Å; G96-G98 PolarHBondContact O-N 2.96Å
97C90.1Very high89.8Confident0 Ų047.1 Ų47.10%024%0.237CC..SBendtrans47.1-64.2173.3-710000116.8R92 I99 P100 L101 V163 V165 C170R92-C97 PolarHBondContact O-N 3.3Å; C97-I99 PolarHBondContact O-N 2.93Å; C97-P100 VanDerWaalsContact O-CD 3.28Å; C97-P100 WeakPolarHBondContact O-CD 3.39Å; C97-L101 HydrophobicContact CB-CD1 4.15Å; C97-L101 VanDerWaalsContact O-CB 3.3Å; C97-L101 WeakPolarHBondContact O-CB 3.46Å; C97-L101 WeakPolarHBondContact O-CD1 3.15Å; C97-L101 PolarHBondContact O-N 3.48Å; C97-V163 HydrophobicContact CB-CG1 3.97Å; C97-V165 HydrophobicContact CB-CG2 4.46Å; C97-C170 HydrophobicContact CB-CB 3.84Å; C97-C170 WeakPolarHBondContact CB-SG 3.38Å; C97-C170 WeakPolarHBondContact SG-CA 3.19Å; C97-C170 WeakPolarHBondContact SG-CB 3.38Å; C97-C170 CovalentContact SG-SG 2.04Å; C97-C170 PolarHBondContact SG-SG 3.44Å
98G93.9Very high90.6Very high2 Ų244 Ų442%0.02122%0.223CC..Hα-helixtrans-51.4-47.4-174.300000114.8G96 L101 F102 Y159G96-G98 PolarHBondContact O-N 2.96Å; G98-L101 PolarHBondContact O-N 3.46Å; G98-F102 VanDerWaalsContact O-CB 3.29Å; G98-F102 WeakPolarHBondContact O-CB 3.41Å; G98-F102 PolarHBondContact O-N 3.28Å; G98-Y159 WeakPolarHBondContact CA-O 3.02Å
99I94.2Very high91.4Very high96 Ų9637.1 Ų37.149%0.49219%0.193SC..Hα-helixtrans-66.8-52.5180-64.9170.1000111.9C97 L101 F102 L103C97-I99 PolarHBondContact O-N 2.93Å; I99-L101 VanDerWaalsContact C-N 3.27Å; I99-L101 PolarHBondContact O-N 3.3Å; I99-F102 PolarHBondContact O-N 2.86Å; I99-L103 HydrophobicContact CG2-CD1 3.83Å; I99-L103 HydrophobicContact CG2-CG 4.28Å; I99-L103 WeakPolarHBondContact O-CG 3.41Å; I99-L103 PolarHBondContact O-N 3.01Å
100P93.5Very high92Very high6 Ų634.2 Ų34.24%0.03918%0.175CC..Hα-helixtrans-54.4-40.5173-29.233.7000114.1R92 F95 C97 F104R92-P100 HydrophobicContact CB-CB 4.3Å; R92-P100 HydrophobicContact CG-CB 4.04Å; F95-P100 HydrophobicContact CB-CG 3.56Å; F95-P100 HydrophobicContact CG-CG 4.49Å; C97-P100 VanDerWaalsContact O-CD 3.28Å; C97-P100 WeakPolarHBondContact O-CD 3.39Å; P100-F104 WeakPolarHBondContact O-CB 3.17Å; P100-F104 PolarHBondContact O-N 3.15Å
101L92.8Very high92.6Very high0 Ų033.4 Ų33.40%017%0.171CC..Hα-helixtrans-62.7-52.6177.2-92.972.6000111.2L3 I5 R92 C97 G98 I99 F104 T105 Y159 V163 C170L3-L101 HydrophobicContact CB-CD2 4.46Å; L3-L101 HydrophobicContact CD1-CB 3.87Å; L3-L101 HydrophobicContact CD1-CD2 3.65Å; L3-L101 HydrophobicContact CD1-CG 3.41Å; L3-L101 VanDerWaalsContact CD1-CG 3.41Å; L3-L101 HydrophobicContact CD2-CD1 3.77Å; L3-L101 HydrophobicContact CD2-CD2 4.07Å; L3-L101 HydrophobicContact CD2-CG 3.45Å; L3-L101 VanDerWaalsContact CD2-CG 3.45Å; L3-L101 HydrophobicContact CG-CD2 4.23Å; L3-L101 HydrophobicContact CG-CG 3.94Å; I5-L101 HydrophobicContact CG1-CD2 4.4Å; R92-L101 HydrophobicContact CG-CD1 4.48Å; C97-L101 HydrophobicContact CB-CD1 4.15Å; C97-L101 VanDerWaalsContact O-CB 3.3Å; C97-L101 WeakPolarHBondContact O-CB 3.46Å; C97-L101 WeakPolarHBondContact O-CD1 3.15Å; C97-L101 PolarHBondContact O-N 3.48Å; G98-L101 PolarHBondContact O-N 3.46Å; I99-L101 VanDerWaalsContact C-N 3.27Å; I99-L101 PolarHBondContact O-N 3.3Å; L101-F104 PolarHBondContact O-N 3.42Å; L101-T105 PolarHBondContact O-N 3.44Å; L101-T105 PolarHBondContact O-OG1 3.49Å; L101-T105 VanDerWaalsContact O-OG1 3.1Å; L101-Y159 HydrophobicContact CB-CD1 4.16Å; L101-Y159 HydrophobicContact CB-CG 4.06Å; L101-Y159 HydrophobicContact CD2-CD1 3.78Å; L101-Y159 HydrophobicContact CD2-CE1 4.21Å; L101-V163 HydrophobicContact CD2-CB 4.15Å; L101-V163 HydrophobicContact CD2-CG1 3.82Å; L101-V163 HydrophobicContact CD2-CG2 3.86Å; L101-C170 HydrophobicContact CD1-CB 4.34Å
102F95.7Very high93Very high32 Ų3231.8 Ų31.814%0.1416%0.163CC..Hα-helixtrans-54.5-56.7177.4164.3-111.1000111.1G98 I99 F104 T105 F106 A153 N156 I157 V160G98-F102 VanDerWaalsContact O-CB 3.29Å; G98-F102 WeakPolarHBondContact O-CB 3.41Å; G98-F102 PolarHBondContact O-N 3.28Å; I99-F102 PolarHBondContact O-N 2.86Å; F102-F104 VanDerWaalsContact C-N 3.31Å; F102-F104 PolarHBondContact O-N 3.37Å; F102-T105 PolarHBondContact O-N 3.5Å; F102-F106 HydrophobicContact CD2-CB 4.39Å; F102-F106 HydrophobicContact CE2-CB 4.13Å; F102-F106 HydrophobicContact CE2-CG 4.46Å; F102-F106 HydrophobicContact CZ-CB 4.43Å; F102-F106 HydrophobicContact CZ-CG 4.4Å; F102-F106 WeakPolarHBondContact O-CB 3.44Å; F102-F106 PolarHBondContact O-N 3.26Å; F102-A153 HydrophobicContact CZ-CB 4.44Å; F102-N156 HydrophobicContact CD2-CB 3.89Å; F102-N156 WeakPolarHBondContact CD2-O 3.36Å; F102-N156 HydrophobicContact CE2-CB 4.06Å; F102-I157 HydrophobicContact CD2-CD1 4.28Å; F102-I157 HydrophobicContact CE1-CD1 4.41Å; F102-I157 HydrophobicContact CE2-CB 4.34Å; F102-I157 HydrophobicContact CE2-CD1 4Å; F102-I157 HydrophobicContact CZ-CD1 4.07Å; F102-V160 HydrophobicContact CB-CG2 4.18Å; F102-V160 HydrophobicContact CG-CG2 4.38Å
103L95.9Very high93.4Very high64 Ų6434.3 Ų34.334%0.33517%0.172SC..Hα-helixtrans-62.4-39.2-174.7-71.1174.7000112Y70 I99 S107Y70-L103 HydrophobicContact CE1-CB 4.03Å; Y70-L103 WeakPolarHBondContact CE1-O 3.23Å; Y70-L103 WeakPolarHBondContact OH-CB 3.36Å; I99-L103 HydrophobicContact CG2-CD1 3.83Å; I99-L103 HydrophobicContact CG2-CG 4.28Å; I99-L103 WeakPolarHBondContact O-CG 3.41Å; I99-L103 PolarHBondContact O-N 3.01Å; L103-S107 WeakPolarHBondContact O-CB 3.44Å; L103-S107 PolarHBondContact O-N 2.91Å; L103-S107 PolarHBondContact O-OG 3.34Å
104F94.4Very high93.9Very high5 Ų532.6 Ų32.62%0.02216%0.164CC..Hα-helixtrans-66-51.7178.4-178.8-92.8000112.1I2 V71 H74 P100 L101 F102 S107 T108 M303I2-F104 HydrophobicContact CB-CD1 4.33Å; I2-F104 HydrophobicContact CB-CE1 3.62Å; I2-F104 HydrophobicContact CB-CZ 4.05Å; I2-F104 HydrophobicContact CD1-CE1 3.98Å; I2-F104 HydrophobicContact CD1-CE2 4.29Å; I2-F104 HydrophobicContact CD1-CZ 3.47Å; I2-F104 VanDerWaalsContact CD1-CZ 3.47Å; I2-F104 HydrophobicContact CG1-CE1 3.82Å; I2-F104 HydrophobicContact CG1-CZ 3.85Å; I2-F104 HydrophobicContact CG2-CE1 4.37Å; V71-F104 HydrophobicContact CG1-CE2 3.75Å; V71-F104 HydrophobicContact CG1-CZ 4.12Å; H74-F104 AromaticContact ND1-CD2 3.38Å; H74-F104 WeakPolarHBondContact ND1-CD2 3.49Å; H74-F104 AromaticContact ND1-CG 3.83Å; P100-F104 WeakPolarHBondContact O-CB 3.17Å; P100-F104 PolarHBondContact O-N 3.15Å; L101-F104 PolarHBondContact O-N 3.42Å; F102-F104 VanDerWaalsContact C-N 3.31Å; F102-F104 PolarHBondContact O-N 3.37Å; F104-S107 PolarHBondContact O-N 3.34Å; F104-T108 WeakPolarHBondContact O-CB 3.27Å; F104-T108 PolarHBondContact O-N 2.92Å; F104-T108 PolarHBondContact O-OG1 3.48Å; F104-M303 HydrophobicContact CZ-CE 4.06Å
105T94Very high94.3Very high5 Ų524.3 Ų24.33%0.03113%0.128CC..Hα-helixtrans-65.8-46.6-179.4-50.40000110.5L3 L101 F102 S107 T108 D109 N156 Y159L3-T105 WeakPolarHBondContact CD1-OG1 3.37Å; L101-T105 PolarHBondContact O-N 3.44Å; L101-T105 PolarHBondContact O-OG1 3.49Å; L101-T105 VanDerWaalsContact O-OG1 3.1Å; F102-T105 PolarHBondContact O-N 3.5Å; T105-S107 PolarHBondContact O-N 2.89Å; T105-T108 WeakPolarHBondContact O-CB 3.35Å; T105-T108 PolarHBondContact O-N 3.28Å; T105-D109 PolarHBondContact O-N 2.99Å; T105-N156 WeakPolarHBondContact CG2-OD1 3.44Å; T105-Y159 HydrophobicContact CG2-CE2 4.08Å
106F97.3Very high94.8Very high29 Ų2918.1 Ų18.113%0.12710%0.101CC..Hα-helixtrans-54.3-47.6175.1166.3-102.8000112.7F102 T108 D109 L110 V149 L152 A153 N156F102-F106 HydrophobicContact CD2-CB 4.39Å; F102-F106 HydrophobicContact CE2-CB 4.13Å; F102-F106 HydrophobicContact CE2-CG 4.46Å; F102-F106 HydrophobicContact CZ-CB 4.43Å; F102-F106 HydrophobicContact CZ-CG 4.4Å; F102-F106 WeakPolarHBondContact O-CB 3.44Å; F102-F106 PolarHBondContact O-N 3.26Å; F106-T108 VanDerWaalsContact C-N 3.34Å; F106-T108 PolarHBondContact O-N 3.38Å; F106-D109 PolarHBondContact O-N 3.32Å; F106-L110 HydrophobicContact CE1-CD2 4.02Å; F106-L110 HydrophobicContact CE2-CD2 4.48Å; F106-L110 HydrophobicContact CZ-CD2 3.74Å; F106-L110 WeakPolarHBondContact O-CB 3.38Å; F106-L110 PolarHBondContact O-N 2.97Å; F106-V149 HydrophobicContact CE2-CG1 4.4Å; F106-V149 HydrophobicContact CZ-CG1 4.06Å; F106-L152 HydrophobicContact CD2-CB 4Å; F106-L152 HydrophobicContact CE2-CB 4.07Å; F106-A153 HydrophobicContact CD2-CB 4.31Å; F106-A153 HydrophobicContact CE2-CB 4.08Å; F106-N156 HydrophobicContact CB-CB 4.35Å
107S97.5Very high95.2Very high11 Ų1116.7 Ų16.78%0.0778%0.083CC..Hα-helixtrans-69.3-34.9-178.2-590000112.3Y70 L103 F104 T105 S111Y70-S107 VanDerWaalsContact CD1-OG 3.22Å; Y70-S107 WeakPolarHBondContact CD1-OG 3.41Å; L103-S107 WeakPolarHBondContact O-CB 3.44Å; L103-S107 PolarHBondContact O-N 2.91Å; L103-S107 PolarHBondContact O-OG 3.34Å; F104-S107 PolarHBondContact O-N 3.34Å; T105-S107 PolarHBondContact O-N 2.89Å; S107-S111 PolarHBondContact O-N 3.08Å
108T95.7Very high95.4Very high5 Ų516.8 Ų16.83%0.0318%0.083CC..Hα-helixtrans-65.2-48176.1-60.10000110.5F104 T105 F106 S111 T112 Y191F104-T108 WeakPolarHBondContact O-CB 3.27Å; F104-T108 PolarHBondContact O-N 2.92Å; F104-T108 PolarHBondContact O-OG1 3.48Å; T105-T108 WeakPolarHBondContact O-CB 3.35Å; T105-T108 PolarHBondContact O-N 3.28Å; F106-T108 VanDerWaalsContact C-N 3.34Å; F106-T108 PolarHBondContact O-N 3.38Å; T108-S111 PolarHBondContact O-N 3.26Å; T108-T112 PolarHBondContact O-N 2.93Å; T108-T112 PolarHBondContact O-OG1 2.97Å; T108-Y191 HydrophobicContact CG2-CD2 3.9Å; T108-Y191 HydrophobicContact CG2-CE2 3.35Å
109D96.2Very high95.3Very high3 Ų316.7 Ų16.72%0.0168%0.082CC..Hα-helixtrans-62.5-46.1175.1-69.2-18.1000111.2T105 F106 S111 T112 W113 L152 N156T105-D109 PolarHBondContact O-N 2.99Å; F106-D109 PolarHBondContact O-N 3.32Å; D109-S111 VanDerWaalsContact C-N 3.27Å; D109-S111 PolarHBondContact O-N 2.97Å; D109-T112 PolarHBondContact O-N 3.46Å; D109-T112 VanDerWaalsContact O-N 3.1Å; D109-W113 PolarHBondContact O-N 2.91Å; D109-L152 HydrophobicContact CB-CD1 4Å; D109-L152 HydrophobicContact CB-CD2 4.08Å; D109-N156 PolarHBondContact OD2-ND2 3.48Å
110L97.7Very high95.2Very high8 Ų815.2 Ų15.24%0.0427%0.074CC..Hα-helixtrans-58.9-40.9-178.9-179.358.4000111.4T67 F106 T112 W113 I114 L145 V148 V149 L152T67-L110 HydrophobicContact CG2-CB 4.45Å; T67-L110 HydrophobicContact CG2-CD2 3.7Å; T67-L110 HydrophobicContact CG2-CG 4.07Å; F106-L110 HydrophobicContact CE1-CD2 4.02Å; F106-L110 HydrophobicContact CE2-CD2 4.48Å; F106-L110 HydrophobicContact CZ-CD2 3.74Å; F106-L110 WeakPolarHBondContact O-CB 3.38Å; F106-L110 PolarHBondContact O-N 2.97Å; L110-T112 PolarHBondContact O-N 3.19Å; L110-W113 PolarHBondContact O-N 2.98Å; L110-I114 HydrophobicContact CD1-CD1 4.17Å; L110-I114 HydrophobicContact CD1-CG1 4.17Å; L110-I114 HydrophobicContact CG-CD1 3.98Å; L110-I114 HydrophobicContact CG-CG1 4.46Å; L110-I114 WeakPolarHBondContact O-CD1 3.15Å; L110-I114 WeakPolarHBondContact O-CG1 3.34Å; L110-I114 PolarHBondContact O-N 2.89Å; L110-L145 HydrophobicContact CD1-CD1 4.27Å; L110-V148 HydrophobicContact CD1-CG1 4.09Å; L110-V149 HydrophobicContact CD1-CG2 3.79Å; L110-V149 HydrophobicContact CD2-CG2 4.03Å; L110-L152 HydrophobicContact CB-CD1 4.15Å; L110-L152 HydrophobicContact CD1-CD1 4.26Å
111S96.3Very high95.1Very high2 Ų215.7 Ų15.71%0.0148%0.076CC..Hα-helixtrans-57.5-48.9174.7-175.80000111.7D68 S107 T108 D109 W113 I114 I115D68-S111 WeakPolarHBondContact OD1-CB 3.15Å; D68-S111 PolarHBondContact OD1-OG 2.82Å; S107-S111 PolarHBondContact O-N 3.08Å; T108-S111 PolarHBondContact O-N 3.26Å; D109-S111 VanDerWaalsContact C-N 3.27Å; D109-S111 PolarHBondContact O-N 2.97Å; S111-W113 PolarHBondContact O-N 3.28Å; S111-I114 PolarHBondContact O-N 2.96Å; S111-I115 PolarHBondContact O-N 3.38Å
112T95Very high94.9Very high1 Ų116.1 Ų16.11%0.0068%0.078CC..Hα-helixtrans-62.6-43.8177.7-56.10000112.4T108 D109 L110 I114 I115 I116 P195 H263T108-T112 PolarHBondContact O-N 2.93Å; T108-T112 PolarHBondContact O-OG1 2.97Å; D109-T112 PolarHBondContact O-N 3.46Å; D109-T112 VanDerWaalsContact O-N 3.1Å; L110-T112 PolarHBondContact O-N 3.19Å; T112-I114 VanDerWaalsContact C-N 3.3Å; T112-I114 PolarHBondContact O-N 3.38Å; T112-I115 VanDerWaalsContact O-CB 3.31Å; T112-I115 WeakPolarHBondContact O-CB 3.47Å; T112-I115 PolarHBondContact O-N 3.03Å; T112-I115 VanDerWaalsContact O-N 3.11Å; T112-I116 PolarHBondContact O-N 2.92Å; T112-P195 HydrophobicContact CG2-CB 3.61Å; T112-P195 HydrophobicContact CG2-CG 3.65Å; T112-H263 PolarHBondContact OG1-CE1 3.35Å
113W97.4Very high94.6Very high59 Ų5915.3 Ų15.322%0.2238%0.077CC..Hα-helixtrans-72.1-23.5-178.8-79.174.4000113D109 L110 S111 I115 I116 L117 V148 L152 I190 I194D109-W113 PolarHBondContact O-N 2.91Å; L110-W113 PolarHBondContact O-N 2.98Å; S111-W113 PolarHBondContact O-N 3.28Å; W113-I115 VanDerWaalsContact C-N 3.29Å; W113-I115 PolarHBondContact O-N 3.47Å; W113-I116 HydrophobicContact CD2-CD1 3.93Å; W113-I116 HydrophobicContact CE3-CD1 3.96Å; W113-I116 HydrophobicContact CG-CD1 4.28Å; W113-I116 HydrophobicContact CZ3-CD1 4.38Å; W113-I116 WeakPolarHBondContact O-CB 3.46Å; W113-I116 PolarHBondContact O-N 3.05Å; W113-L117 PolarHBondContact O-N 2.72Å; W113-V148 HydrophobicContact CB-CG1 3.75Å; W113-V148 HydrophobicContact CG-CG1 4.42Å; W113-L152 HydrophobicContact CB-CD1 3.94Å; W113-L152 HydrophobicContact CD2-CD2 4.39Å; W113-L152 HydrophobicContact CG-CD1 3.9Å; W113-L152 HydrophobicContact CG-CD2 4.31Å; W113-I190 HydrophobicContact CZ2-CG2 4.36Å; W113-I190 PolarHBondContact NE1-O 3.31Å; W113-I194 HydrophobicContact CH2-CG2 4.38Å; W113-I194 HydrophobicContact CZ2-CG2 4.39Å
114I96.6Very high94.3Very high0 Ų014.6 Ų14.60%08%0.075CC..Hα-helixtrans-64.7-35.2168.8-71.7163.7000111.2L60 I63 M64 L110 S111 T112 I116 L117 L118 L145L60-I114 HydrophobicContact CB-CG2 3.94Å; L60-I114 HydrophobicContact CD2-CG2 4.45Å; L60-I114 WeakPolarHBondContact O-CG2 3.33Å; I63-I114 HydrophobicContact CB-CD1 4.36Å; I63-I114 HydrophobicContact CG2-CD1 3.86Å; M64-I114 HydrophobicContact CB-CB 4.32Å; M64-I114 HydrophobicContact CB-CD1 4.08Å; M64-I114 HydrophobicContact CB-CG2 3.85Å; M64-I114 HydrophobicContact CG-CB 4.37Å; M64-I114 HydrophobicContact CG-CG2 4.25Å; M64-I114 HydrophobicContact SD-CB 4.4Å; M64-I114 HydrophobicContact SD-CG2 4.09Å; L110-I114 HydrophobicContact CD1-CD1 4.17Å; L110-I114 HydrophobicContact CD1-CG1 4.17Å; L110-I114 HydrophobicContact CG-CD1 3.98Å; L110-I114 HydrophobicContact CG-CG1 4.46Å; L110-I114 WeakPolarHBondContact O-CD1 3.15Å; L110-I114 WeakPolarHBondContact O-CG1 3.34Å; L110-I114 PolarHBondContact O-N 2.89Å; S111-I114 PolarHBondContact O-N 2.96Å; T112-I114 VanDerWaalsContact C-N 3.3Å; T112-I114 PolarHBondContact O-N 3.38Å; I114-I116 VanDerWaalsContact C-N 3.28Å; I114-I116 PolarHBondContact O-N 3.08Å; I114-L117 PolarHBondContact O-N 2.6Å; I114-L118 HydrophobicContact CG2-CD1 4.28Å; I114-L118 HydrophobicContact CG2-CG 4.46Å; I114-L118 WeakPolarHBondContact O-CG 3.43Å; I114-L118 PolarHBondContact O-N 2.99Å; I114-L145 HydrophobicContact CD1-CD1 4.41Å; I114-L145 HydrophobicContact CG1-CD1 4.11Å
115I94.2Very high94Very high2 Ų214.7 Ų14.71%0.018%0.077CC..Hα-helixtrans-60.3-41.8172.7-57.3173.9000110.2M64 S111 T112 W113 L118 C119 I199 V256 M259M64-I115 HydrophobicContact SD-CD1 4.5Å; M64-I115 HydrophobicContact SD-CG1 3.75Å; S111-I115 PolarHBondContact O-N 3.38Å; T112-I115 VanDerWaalsContact O-CB 3.31Å; T112-I115 WeakPolarHBondContact O-CB 3.47Å; T112-I115 PolarHBondContact O-N 3.03Å; T112-I115 VanDerWaalsContact O-N 3.11Å; W113-I115 VanDerWaalsContact C-N 3.29Å; W113-I115 PolarHBondContact O-N 3.47Å; I115-L118 WeakPolarHBondContact O-CB 3.45Å; I115-L118 PolarHBondContact O-N 2.87Å; I115-C119 PolarHBondContact O-N 2.93Å; I115-C119 PolarHBondContact O-SG 3.13Å; I115-I199 HydrophobicContact CB-CD1 4.42Å; I115-I199 HydrophobicContact CG2-CD1 3.85Å; I115-I199 HydrophobicContact CG2-CG1 4.49Å; I115-V256 HydrophobicContact CG2-CG1 4.48Å; I115-M259 HydrophobicContact CD1-CB 4.39Å
116I95.2Very high93.5Very high5 Ų515 Ų153%0.0268%0.078CC..Hα-helixtrans-59.7-48.2174-65.6172.5000111T112 W113 I114 L118 C119 I120 P195 F198 I199T112-I116 PolarHBondContact O-N 2.92Å; W113-I116 HydrophobicContact CD2-CD1 3.93Å; W113-I116 HydrophobicContact CE3-CD1 3.96Å; W113-I116 HydrophobicContact CG-CD1 4.28Å; W113-I116 HydrophobicContact CZ3-CD1 4.38Å; W113-I116 WeakPolarHBondContact O-CB 3.46Å; W113-I116 PolarHBondContact O-N 3.05Å; I114-I116 VanDerWaalsContact C-N 3.28Å; I114-I116 PolarHBondContact O-N 3.08Å; I116-L118 VanDerWaalsContact C-N 3.28Å; I116-L118 PolarHBondContact O-N 3.3Å; I116-C119 WeakPolarHBondContact O-CA 3.19Å; I116-C119 VanDerWaalsContact O-CB 3.31Å; I116-C119 WeakPolarHBondContact O-CB 3.2Å; I116-C119 PolarHBondContact O-N 3.48Å; I116-C119 VanDerWaalsContact O-N 3.08Å; I116-I120 HydrophobicContact CG2-CD1 3.86Å; I116-I120 HydrophobicContact CG2-CG1 4.29Å; I116-I120 WeakPolarHBondContact O-CG1 3.36Å; I116-I120 PolarHBondContact O-N 3.5Å; I116-P195 HydrophobicContact CD1-CB 3.96Å; I116-P195 HydrophobicContact CD1-CG 4.07Å; I116-P195 HydrophobicContact CG1-CB 4.48Å; I116-F198 HydrophobicContact CB-CD1 4.39Å; I116-F198 HydrophobicContact CG1-CD1 4.38Å; I116-F198 HydrophobicContact CG2-CD1 3.46Å; I116-F198 VanDerWaalsContact CG2-CD1 3.46Å; I116-F198 HydrophobicContact CG2-CE1 3.5Å; I116-F198 VanDerWaalsContact CG2-CE1 3.5Å; I116-F198 HydrophobicContact CG2-CG 4.17Å; I116-F198 HydrophobicContact CG2-CZ 4.24Å; I116-I199 HydrophobicContact CG1-CD1 4.24Å; I116-I199 HydrophobicContact CG1-CG1 3.98Å
117L95.8Very high93Very high16 Ų1618.1 Ų18.18%0.0849%0.089CC..Hα-helixtrans-58.8-40.4177.7-69.3-179.7000112L60 W113 I114 I120 E121 A144 L145 V148L60-L117 HydrophobicContact CD1-CB 3.99Å; L60-L117 HydrophobicContact CD2-CB 4.22Å; L60-L117 HydrophobicContact CD2-CD1 3.87Å; W113-L117 PolarHBondContact O-N 2.72Å; I114-L117 PolarHBondContact O-N 2.6Å; L117-I120 PolarHBondContact O-N 2.82Å; L117-E121 WeakPolarHBondContact O-CB 3.23Å; L117-E121 PolarHBondContact O-N 3.13Å; L117-A144 HydrophobicContact CD2-CB 3.93Å; L117-L145 HydrophobicContact CD1-CB 4.29Å; L117-L145 HydrophobicContact CD1-CD1 4.15Å; L117-V148 HydrophobicContact CD1-CB 4.34Å; L117-V148 HydrophobicContact CD1-CG2 4.05Å; L117-V148 HydrophobicContact CD2-CG2 3.91Å; L117-V148 HydrophobicContact CG-CG2 4.17Å
118L93.2Very high92.5Very high1 Ų119.7 Ų19.71%0.00510%0.098CC..Hα-helixtrans-60.7-45.2173.9-71.2168.6000111.2T57 L60 I61 I114 I115 I116 E121 R122 V256T57-L118 HydrophobicContact CG2-CD2 3.91Å; L60-L118 HydrophobicContact CB-CD2 3.79Å; L60-L118 HydrophobicContact CB-CG 4.18Å; L60-L118 HydrophobicContact CD1-CD2 3.88Å; L60-L118 HydrophobicContact CD1-CG 4.22Å; I61-L118 HydrophobicContact CG1-CD1 3.88Å; I61-L118 HydrophobicContact CG1-CD2 4.12Å; I114-L118 HydrophobicContact CG2-CD1 4.28Å; I114-L118 HydrophobicContact CG2-CG 4.46Å; I114-L118 WeakPolarHBondContact O-CG 3.43Å; I114-L118 PolarHBondContact O-N 2.99Å; I115-L118 WeakPolarHBondContact O-CB 3.45Å; I115-L118 PolarHBondContact O-N 2.87Å; I116-L118 VanDerWaalsContact C-N 3.28Å; I116-L118 PolarHBondContact O-N 3.3Å; L118-E121 PolarHBondContact O-N 3.46Å; L118-R122 VanDerWaalsContact O-CG 3.29Å; L118-R122 WeakPolarHBondContact O-CG 3.44Å; L118-R122 PolarHBondContact O-N 3.21Å; L118-V256 HydrophobicContact CB-CG2 4.18Å
119C92.3Very high91.5Very high0 Ų021.8 Ų21.80%011%0.112CC..Hα-helixtrans-58.6-48.7175-68.90000112.1I115 I116 R122 A123 V202 V256I115-C119 PolarHBondContact O-N 2.93Å; I115-C119 PolarHBondContact O-SG 3.13Å; I116-C119 WeakPolarHBondContact O-CA 3.19Å; I116-C119 VanDerWaalsContact O-CB 3.31Å; I116-C119 WeakPolarHBondContact O-CB 3.2Å; I116-C119 PolarHBondContact O-N 3.48Å; I116-C119 VanDerWaalsContact O-N 3.08Å; C119-R122 PolarHBondContact O-N 2.99Å; C119-A123 PolarHBondContact O-N 2.89Å; C119-V202 HydrophobicContact CB-CB 4.2Å; C119-V202 HydrophobicContact CB-CG1 3.71Å; C119-V202 WeakPolarHBondContact O-CG1 3.36Å; C119-V256 WeakPolarHBondContact SG-CG1 3.4Å
120I93Very high90.6Very high65 Ų6529.2 Ų29.233%0.33315%0.15SC..Hα-helixtrans-60.4-49.9179.3-65172.9000110.3I116 L117 R122 A123 V124 F198I116-I120 HydrophobicContact CG2-CD1 3.86Å; I116-I120 HydrophobicContact CG2-CG1 4.29Å; I116-I120 WeakPolarHBondContact O-CG1 3.36Å; I116-I120 PolarHBondContact O-N 3.5Å; L117-I120 PolarHBondContact O-N 2.82Å; I120-R122 PolarHBondContact O-N 3.21Å; I120-A123 PolarHBondContact O-N 3.43Å; I120-A123 VanDerWaalsContact O-N 3.12Å; I120-V124 HydrophobicContact CG2-CG2 4.29Å; I120-V124 WeakPolarHBondContact O-CG2 3.35Å; I120-V124 PolarHBondContact O-N 3.35Å; I120-F198 HydrophobicContact CD1-CE1 3.71Å; I120-F198 HydrophobicContact CD1-CZ 3.55Å; I120-F198 HydrophobicContact CG1-CE1 3.4Å; I120-F198 HydrophobicContact CG1-CZ 3.55Å
121E91.6Very high89.8Confident17 Ų1734.6 Ų34.68%0.07917%0.173CC..Hα-helixtrans-55.9-43.9179.2-165.2-166.8-178.600110.1G55 S56 T57 L117 L118 V124 C125G55-E121 WeakPolarHBondContact CA-OE1 3.45Å; S56-E121 PolarHBondContact N-OE1 3.27Å; S56-E121 VanDerWaalsContact OG-CD 3.24Å; S56-E121 PolarHBondContact OG-OE1 3.1Å; T57-E121 PolarHBondContact N-OE2 2.94Å; T57-E121 PolarHBondContact OG1-OE2 3.34Å; L117-E121 WeakPolarHBondContact O-CB 3.23Å; L117-E121 PolarHBondContact O-N 3.13Å; L118-E121 PolarHBondContact O-N 3.46Å; E121-V124 PolarHBondContact O-N 2.88Å; E121-C125 PolarHBondContact O-N 3.08Å; E121-C125 PolarHBondContact O-SG 3.38Å
122R87.9Confident88.9Confident9 Ų936.7 Ų36.73%0.03418%0.182CC..Hα-helixtrans-63.5-46176.6-69.5-42.594.4-171.4-3.7112.5T57 L118 C119 I120 V124 C125 V126 I206 V252T57-R122 PolarHBondContact OG1-NH2 3.23Å; L118-R122 VanDerWaalsContact O-CG 3.29Å; L118-R122 WeakPolarHBondContact O-CG 3.44Å; L118-R122 PolarHBondContact O-N 3.21Å; C119-R122 PolarHBondContact O-N 2.99Å; I120-R122 PolarHBondContact O-N 3.21Å; R122-V124 PolarHBondContact O-N 3.46Å; R122-C125 PolarHBondContact O-N 3.02Å; R122-V126 WeakPolarHBondContact O-CB 3.31Å; R122-V126 WeakPolarHBondContact O-CG2 3.34Å; R122-V126 PolarHBondContact O-N 2.87Å; R122-I206 HydrophobicContact CB-CD1 3.78Å; R122-V252 HydrophobicContact CG-CG1 4.01Å
123A89.8Confident88Confident15 Ų1544 Ų4412%0.12421%0.214CC..Hα-helixtrans-59.3-48178.200000111C119 I120 C125 V126 W127 V202 I206C119-A123 PolarHBondContact O-N 2.89Å; I120-A123 PolarHBondContact O-N 3.43Å; I120-A123 VanDerWaalsContact O-N 3.12Å; A123-C125 VanDerWaalsContact C-N 3.33Å; A123-C125 PolarHBondContact O-N 2.93Å; A123-V126 PolarHBondContact O-N 3.48Å; A123-V126 VanDerWaalsContact O-N 3.1Å; A123-W127 WeakPolarHBondContact O-CB 3.35Å; A123-W127 PolarHBondContact O-N 2.72Å; A123-V202 HydrophobicContact CB-CG1 3.73Å; A123-I206 HydrophobicContact CB-CD1 4.33Å; A123-I206 HydrophobicContact CB-CG1 4.12Å
124V90Very high87.2Confident48 Ų4846.6 Ų46.629%0.29123%0.228SC..Hα-helixtrans-55.3-48.5175.4173.10000110.7I120 E121 R122 V126 W127 T128 W135I120-V124 HydrophobicContact CG2-CG2 4.29Å; I120-V124 WeakPolarHBondContact O-CG2 3.35Å; I120-V124 PolarHBondContact O-N 3.35Å; E121-V124 PolarHBondContact O-N 2.88Å; R122-V124 PolarHBondContact O-N 3.46Å; V124-V126 VanDerWaalsContact C-N 3.29Å; V124-V126 PolarHBondContact O-N 3.35Å; V124-W127 PolarHBondContact O-N 3.25Å; V124-T128 WeakPolarHBondContact O-CB 3.36Å; V124-T128 PolarHBondContact O-N 3.4Å; V124-T128 PolarHBondContact O-OG1 3.32Å; V124-W135 HydrophobicContact CG1-CB 3.55Å; V124-W135 HydrophobicContact CG1-CG 4.25Å
125C86.8Confident86.6Confident8 Ų853.4 Ų53.45%0.05425%0.254CS..Hα-helixtrans-65.4-29.3179.9-56.10000113.8E121 R122 A123 C136 R245E121-C125 PolarHBondContact O-N 3.08Å; E121-C125 PolarHBondContact O-SG 3.38Å; R122-C125 PolarHBondContact O-N 3.02Å; A123-C125 VanDerWaalsContact C-N 3.33Å; A123-C125 PolarHBondContact O-N 2.93Å; C125-C136 WeakPolarHBondContact CA-SG 3.25Å; C125-C136 HydrophobicContact CB-CB 4.48Å; C125-C136 WeakPolarHBondContact CB-SG 3.18Å; C125-C136 PolarHBondContact N-SG 3.02Å; C125-C136 VanDerWaalsContact N-SG 3.45Å; C125-C136 WeakPolarHBondContact SG-CB 3.18Å; C125-C136 CovalentContact SG-SG 2.04Å; C125-C136 PolarHBondContact SG-SG 2.98Å; C125-R245 PolarHBondContact O-NE 3.03Å; C125-R245 PolarHBondContact O-NH2 3.35Å
126V84.2Confident86.2Confident11 Ų1153.6 Ų53.67%0.06726%0.255CS..Hα-helixtrans-80.1-44.1179.1168.50000110.8R122 A123 V124 I206 R209 M210 R245R122-V126 WeakPolarHBondContact O-CB 3.31Å; R122-V126 WeakPolarHBondContact O-CG2 3.34Å; R122-V126 PolarHBondContact O-N 2.87Å; A123-V126 PolarHBondContact O-N 3.48Å; A123-V126 VanDerWaalsContact O-N 3.1Å; V124-V126 VanDerWaalsContact C-N 3.29Å; V124-V126 PolarHBondContact O-N 3.35Å; V126-I206 HydrophobicContact CG2-CG2 4.19Å; V126-R209 HydrophobicContact CG1-CB 3.82Å; V126-R209 HydrophobicContact CG1-CG 3.58Å; V126-M210 HydrophobicContact CG1-CG 4.37Å; V126-R245 PolarHBondContact O-NH2 2.91Å
127W87Confident86Confident95 Ų9557.7 Ų57.736%0.3627%0.273SS..Hα-helixtrans-77.3-25.6-176.3-78.685.5000114.4A123 V124 P129 S205 W208 R209A123-W127 WeakPolarHBondContact O-CB 3.35Å; A123-W127 PolarHBondContact O-N 2.72Å; V124-W127 PolarHBondContact O-N 3.25Å; W127-P129 WeakPolarHBondContact O-CD 3.27Å; W127-S205 VanDerWaalsContact CE2-OG 3.23Å; W127-S205 WeakPolarHBondContact CZ2-OG 3.48Å; W127-S205 PolarHBondContact NE1-OG 3.16Å; W127-W208 AromaticContact CH2-CE3 3.66Å; W127-W208 HydrophobicContact CH2-CE3 3.66Å; W127-W208 HydrophobicContact CH2-CH2 4.27Å; W127-W208 AromaticContact CH2-CZ3 3.2Å; W127-W208 HydrophobicContact CH2-CZ3 3.2Å; W127-W208 AromaticContact CZ2-CE3 3.7Å; W127-W208 HydrophobicContact CZ2-CE3 3.7Å; W127-W208 AromaticContact CZ2-CZ3 3.76Å; W127-W208 HydrophobicContact CZ2-CZ3 3.76Å; W127-W208 AromaticContact CZ3-CZ3 3.93Å; W127-W208 HydrophobicContact CZ3-CZ3 3.93Å; W127-R209 HydrophobicContact CD2-CB 4.47Å; W127-R209 HydrophobicContact CD2-CG 4.29Å; W127-R209 HydrophobicContact CG-CG 4.47Å; W127-R209 HydrophobicContact CZ2-CB 4.29Å; W127-R209 PolarHBondContact O-NH1 2.89Å
128T85.6Confident85.8Confident43 Ų4359.3 Ų59.326%0.26428%0.282SS..  trans-111.161.1-177.9660000112.9V124 I130 K131 F132V124-T128 WeakPolarHBondContact O-CB 3.36Å; V124-T128 PolarHBondContact O-N 3.4Å; V124-T128 PolarHBondContact O-OG1 3.32Å; T128-I130 VanDerWaalsContact C-N 3.26Å; T128-I130 PolarHBondContact O-N 2.73Å; T128-I130 VanDerWaalsContact O-N 3.09Å; T128-K131 CarbonylContact O-C 3.56Å; T128-K131 PolarHBondContact O-N 3.16Å; T128-K131 VanDerWaalsContact O-N 3.15Å; T128-F132 WeakPolarHBondContact O-CA 3.38Å; T128-F132 WeakPolarHBondContact O-CB 3.43Å; T128-F132 PolarHBondContact O-N 3.38Å
129P76.3Confident85.9Confident49 Ų4964.7 Ų64.732%0.31831%0.307SS..THydrogen-bonded Turntrans-57.4-33.7-170.725.2-36.3000115W127 F132 R245W127-P129 WeakPolarHBondContact O-CD 3.27Å; P129-F132 WeakPolarHBondContact O-CD1 3.19Å; P129-R245 VanDerWaalsContact CA-NH1 3.33Å
130I77.5Confident86Confident160 Ų16069.2 Ų69.282%0.82133%0.328SS*.THydrogen-bonded Turntrans-81.5-39-177.9-61.3164.9000110.6T128T128-I130 VanDerWaalsContact C-N 3.26Å; T128-I130 PolarHBondContact O-N 2.73Å; T128-I130 VanDerWaalsContact O-N 3.09Å
131K79.1Confident86.1Confident121 Ų12166.5 Ų66.553%0.52632%0.316SS..THydrogen-bonded Turntrans-99.84-174.3-61.2-173.4179.1-179.30113.5T128 K133 Q134 W135T128-K131 CarbonylContact O-C 3.56Å; T128-K131 PolarHBondContact O-N 3.16Å; T128-K131 VanDerWaalsContact O-N 3.15Å; K131-K133 PolarHBondContact O-N 3.38Å; K131-Q134 WeakPolarHBondContact O-CA 3.11Å; K131-Q134 VanDerWaalsContact O-CB 3.26Å; K131-Q134 WeakPolarHBondContact O-CB 3.28Å; K131-Q134 PolarHBondContact O-N 3.47Å; K131-W135 VanDerWaalsContact O-CD1 3.32Å; K131-W135 PolarHBondContact O-N 3.25Å
132F78.2Confident86.4Confident46 Ų4668.8 Ų68.820%0.20233%0.328CS..Hα-helixtrans-56.1-35.9-171.687.1-85.8000113.3T128 P129 Q134 W135 C136T128-F132 WeakPolarHBondContact O-CA 3.38Å; T128-F132 WeakPolarHBondContact O-CB 3.43Å; T128-F132 PolarHBondContact O-N 3.38Å; P129-F132 WeakPolarHBondContact O-CD1 3.19Å; F132-Q134 PolarHBondContact O-N 2.91Å; F132-W135 PolarHBondContact O-N 3.24Å; F132-C136 WeakPolarHBondContact O-CA 3.24Å; F132-C136 VanDerWaalsContact O-CB 3.24Å; F132-C136 WeakPolarHBondContact O-CB 3.4Å; F132-C136 PolarHBondContact O-N 2.86Å
133K75.8Confident86.9Confident153 Ų15372.9 Ų72.967%0.66535%0.354SS*.Hα-helixtrans-64.7-23.7176.3-69.1-171.2177-176.20113.2K131 K137K131-K133 PolarHBondContact O-N 3.38Å; K133-K137 WeakPolarHBondContact O-CE 3.35Å; K133-K137 VanDerWaalsContact O-CG 3.25Å; K133-K137 WeakPolarHBondContact O-CG 3.37Å
134Q80.8Confident87.2Confident114 Ų11473.9 Ų73.953%0.53336%0.363SS..Hα-helixtrans-80.8-38.2177.1-61.6176.1-25.600111.2K131 F132 K137 H140K131-Q134 WeakPolarHBondContact O-CA 3.11Å; K131-Q134 VanDerWaalsContact O-CB 3.26Å; K131-Q134 WeakPolarHBondContact O-CB 3.28Å; K131-Q134 PolarHBondContact O-N 3.47Å; F132-Q134 PolarHBondContact O-N 2.91Å; Q134-K137 WeakPolarHBondContact O-CE 3.27Å; Q134-K137 WeakPolarHBondContact O-CG 3.28Å; Q134-H140 PolarHBondContact O-CE1 3.32Å
135W84Confident87.6Confident144 Ų14472.5 Ų72.555%0.54535%0.353SS..Hα-helixtrans-94.5-42.7-174.2-66.387.3000113.7V124 K131 F132 K137 H140V124-W135 HydrophobicContact CG1-CB 3.55Å; V124-W135 HydrophobicContact CG1-CG 4.25Å; K131-W135 VanDerWaalsContact O-CD1 3.32Å; K131-W135 PolarHBondContact O-N 3.25Å; F132-W135 PolarHBondContact O-N 3.24Å; W135-K137 PolarHBondContact O-N 2.88Å; W135-H140 PolarHBondContact O-ND1 3.42Å
136C86.3Confident88.2Confident5 Ų576.5 Ų76.53%0.03437%0.373CS..SBendtrans-83.158.9178.6-56.10000110.9G55 C125 F132G55-C136 WeakPolarHBondContact CA-O 3.4Å; G55-C136 PolarHBondContact N-O 3.5Å; C125-C136 WeakPolarHBondContact CA-SG 3.25Å; C125-C136 HydrophobicContact CB-CB 4.48Å; C125-C136 WeakPolarHBondContact CB-SG 3.18Å; C125-C136 PolarHBondContact N-SG 3.02Å; C125-C136 VanDerWaalsContact N-SG 3.45Å; C125-C136 WeakPolarHBondContact SG-CB 3.18Å; C125-C136 CovalentContact SG-SG 2.04Å; C125-C136 PolarHBondContact SG-SG 2.98Å; F132-C136 WeakPolarHBondContact O-CA 3.24Å; F132-C136 VanDerWaalsContact O-CB 3.24Å; F132-C136 WeakPolarHBondContact O-CB 3.4Å; F132-C136 PolarHBondContact O-N 2.86Å
137K90Very high88.9Confident91 Ų9182.5 Ų82.540%0.39640%0.399SS..  trans-105.9159.7173.7-53-177.2176.2-176.40111.3K133 Q134 W135 E139 H140 G141K133-K137 WeakPolarHBondContact O-CE 3.35Å; K133-K137 VanDerWaalsContact O-CG 3.25Å; K133-K137 WeakPolarHBondContact O-CG 3.37Å; Q134-K137 WeakPolarHBondContact O-CE 3.27Å; Q134-K137 WeakPolarHBondContact O-CG 3.28Å; W135-K137 PolarHBondContact O-N 2.88Å; K137-E139 VanDerWaalsContact C-N 3.3Å; K137-E139 WeakPolarHBondContact CB-OE2 3.37Å; K137-E139 PolarHBondContact O-N 3.2Å; K137-H140 PolarHBondContact O-N 3.11Å; K137-G141 PolarHBondContact O-N 3.47Å
138L92.6Very high89.4Confident51 Ų5178.5 Ų78.527%0.26739%0.385SS..Hα-helixtrans-60.6-40.3179.8178.559.4000111.8L50 L59 H140 G141 I142L50-L138 HydrophobicContact CD1-CD1 3.69Å; L50-L138 HydrophobicContact CD1-CD2 3.95Å; L50-L138 HydrophobicContact CD1-CG 4.5Å; L50-L138 HydrophobicContact CG-CD2 4.36Å; L59-L138 HydrophobicContact CB-CD1 4.04Å; L59-L138 HydrophobicContact CD2-CD1 3.87Å; L138-H140 PolarHBondContact O-N 3.47Å; L138-G141 PolarHBondContact O-N 3.41Å; L138-G141 VanDerWaalsContact O-N 3.16Å; L138-I142 HydrophobicContact CD1-CD1 4.19Å; L138-I142 HydrophobicContact CD1-CG1 4.27Å; L138-I142 HydrophobicContact CD2-CD1 4.44Å; L138-I142 HydrophobicContact CG-CD1 3.84Å; L138-I142 HydrophobicContact CG-CG1 4.38Å; L138-I142 WeakPolarHBondContact O-CG1 3.32Å; L138-I142 PolarHBondContact O-N 3.48Å
139E94.5Very high90Very high114 Ų11478.6 Ų78.653%0.53339%0.385SS..Hα-helixtrans-64.5-40.4-175.7-53.189.1159.100112.2K137 G141 I142 T143K137-E139 VanDerWaalsContact C-N 3.3Å; K137-E139 WeakPolarHBondContact CB-OE2 3.37Å; K137-E139 PolarHBondContact O-N 3.2Å; E139-G141 VanDerWaalsContact C-N 3.34Å; E139-I142 PolarHBondContact O-N 3.42Å; E139-T143 WeakPolarHBondContact O-CB 3.49Å; E139-T143 PolarHBondContact O-N 3.48Å; E139-T143 PolarHBondContact O-OG1 2.98Å
140H94.6Very high91.1Very high94 Ų9481.9 Ų81.944%0.43540%0.399SS..Hα-helixtrans-65.8-39.3175.2-62.3112.9000111.4Q134 W135 K137 L138 T143 A144Q134-H140 PolarHBondContact O-CE1 3.32Å; W135-H140 PolarHBondContact O-ND1 3.42Å; K137-H140 PolarHBondContact O-N 3.11Å; L138-H140 PolarHBondContact O-N 3.47Å; H140-T143 PolarHBondContact O-N 3.3Å; H140-A144 WeakPolarHBondContact O-CB 3.46Å; H140-A144 PolarHBondContact O-N 3.01Å
141G95.5Very high92.1Very high8 Ų877 Ų778%0.08238%0.379CS..Hα-helixtrans-67.8-37.3175.600000113.5S56 K137 L138 E139 A144 L145S56-G141 WeakPolarHBondContact OG-CA 3.41Å; K137-G141 PolarHBondContact O-N 3.47Å; L138-G141 PolarHBondContact O-N 3.41Å; L138-G141 VanDerWaalsContact O-N 3.16Å; E139-G141 VanDerWaalsContact C-N 3.34Å; G141-A144 PolarHBondContact O-N 3.45Å; G141-L145 VanDerWaalsContact O-CB 3.3Å; G141-L145 WeakPolarHBondContact O-CB 3.48Å; G141-L145 PolarHBondContact O-N 2.82Å
142I97.7Very high93Very high66 Ų6671.6 Ų71.634%0.33836%0.356SS..Hα-helixtrans-62-47.1171.7-70.5167.5000110.1L59 L138 E139 A144 L145 I146L59-I142 HydrophobicContact CD2-CD1 4.29Å; L59-I142 HydrophobicContact CD2-CG1 3.43Å; L59-I142 VanDerWaalsContact CD2-CG1 3.43Å; L138-I142 HydrophobicContact CD1-CD1 4.19Å; L138-I142 HydrophobicContact CD1-CG1 4.27Å; L138-I142 HydrophobicContact CD2-CD1 4.44Å; L138-I142 HydrophobicContact CG-CD1 3.84Å; L138-I142 HydrophobicContact CG-CG1 4.38Å; L138-I142 WeakPolarHBondContact O-CG1 3.32Å; L138-I142 PolarHBondContact O-N 3.48Å; E139-I142 PolarHBondContact O-N 3.42Å; I142-A144 VanDerWaalsContact C-N 3.35Å; I142-A144 PolarHBondContact O-N 3.29Å; I142-L145 PolarHBondContact O-N 2.85Å; I142-I146 HydrophobicContact CG2-CD1 3.69Å; I142-I146 HydrophobicContact CG2-CG1 4.32Å; I142-I146 WeakPolarHBondContact O-CG1 3.29Å; I142-I146 PolarHBondContact O-N 2.64Å
143T98Very high94Very high94 Ų9470.6 Ų70.658%0.57736%0.356SS*.Hα-helixtrans-59.8-46.1179.1-55.30000111.1E139 H140 L145 I146 F147E139-T143 WeakPolarHBondContact O-CB 3.49Å; E139-T143 PolarHBondContact O-N 3.48Å; E139-T143 PolarHBondContact O-OG1 2.98Å; H140-T143 PolarHBondContact O-N 3.3Å; T143-L145 PolarHBondContact O-N 3.47Å; T143-I146 PolarHBondContact O-N 3.28Å; T143-F147 WeakPolarHBondContact O-CB 3.36Å; T143-F147 PolarHBondContact O-N 2.87Å
144A97.8Very high95Very high37 Ų3765.8 Ų65.831%0.30635%0.35SS..Hα-helixtrans-63.7-39.8176.700000112.4L117 H140 G141 I142 F147 V148L117-A144 HydrophobicContact CD2-CB 3.93Å; H140-A144 WeakPolarHBondContact O-CB 3.46Å; H140-A144 PolarHBondContact O-N 3.01Å; G141-A144 PolarHBondContact O-N 3.45Å; I142-A144 VanDerWaalsContact C-N 3.35Å; I142-A144 PolarHBondContact O-N 3.29Å; A144-F147 PolarHBondContact O-N 2.95Å; A144-V148 WeakPolarHBondContact O-CG2 3.31Å; A144-V148 PolarHBondContact O-N 2.87Å
145L98.4Very high95.8Very high19 Ų1962.9 Ų62.910%0.09934%0.34CS..Hα-helixtrans-64-47.4175.9178.563.2000111.7L59 L60 I63 L110 I114 L117 G141 I142 T143 F147 V148 V149L59-L145 HydrophobicContact CD2-CD2 4.49Å; L60-L145 HydrophobicContact CD2-CB 4.22Å; L60-L145 HydrophobicContact CD2-CD1 4.23Å; L60-L145 HydrophobicContact CD2-CD2 4.43Å; I63-L145 HydrophobicContact CG1-CD2 4.22Å; I63-L145 HydrophobicContact CG2-CD2 4.46Å; L110-L145 HydrophobicContact CD1-CD1 4.27Å; I114-L145 HydrophobicContact CD1-CD1 4.41Å; I114-L145 HydrophobicContact CG1-CD1 4.11Å; L117-L145 HydrophobicContact CD1-CB 4.29Å; L117-L145 HydrophobicContact CD1-CD1 4.15Å; G141-L145 VanDerWaalsContact O-CB 3.3Å; G141-L145 WeakPolarHBondContact O-CB 3.48Å; G141-L145 PolarHBondContact O-N 2.82Å; I142-L145 PolarHBondContact O-N 2.85Å; T143-L145 PolarHBondContact O-N 3.47Å; L145-F147 VanDerWaalsContact C-N 3.3Å; L145-F147 PolarHBondContact O-N 3.37Å; L145-V148 PolarHBondContact O-N 3.48Å; L145-V149 HydrophobicContact CD1-CG2 4.24Å; L145-V149 HydrophobicContact CG-CG2 4.43Å; L145-V149 WeakPolarHBondContact O-CB 3.39Å; L145-V149 VanDerWaalsContact O-CG2 3.29Å; L145-V149 WeakPolarHBondContact O-CG2 3.49Å; L145-V149 PolarHBondContact O-N 3.05Å
146I98.6Very high96.3Very high92 Ų9256 Ų5647%0.47231%0.314SS..Hα-helixtrans-59.4-44.4177.4-69.3169.1000110.1I142 T143 V148 V149 L150I142-I146 HydrophobicContact CG2-CD1 3.69Å; I142-I146 HydrophobicContact CG2-CG1 4.32Å; I142-I146 WeakPolarHBondContact O-CG1 3.29Å; I142-I146 PolarHBondContact O-N 2.64Å; T143-I146 PolarHBondContact O-N 3.28Å; I146-V148 PolarHBondContact O-N 3.2Å; I146-V149 PolarHBondContact O-N 3.32Å; I146-L150 HydrophobicContact CG2-CD1 3.98Å; I146-L150 HydrophobicContact CG2-CG 4.35Å; I146-L150 VanDerWaalsContact O-CG 3.32Å; I146-L150 WeakPolarHBondContact O-CG 3.33Å; I146-L150 PolarHBondContact O-N 2.97Å
147F98.5Very high96.9Very high137 Ų13758.9 Ų58.960%0.60133%0.328SS*.Hα-helixtrans-57.6-50.4176.2176.6-98.5000111.9T143 A144 L145 V149 L150 C151T143-F147 WeakPolarHBondContact O-CB 3.36Å; T143-F147 PolarHBondContact O-N 2.87Å; A144-F147 PolarHBondContact O-N 2.95Å; L145-F147 VanDerWaalsContact C-N 3.3Å; L145-F147 PolarHBondContact O-N 3.37Å; F147-V149 VanDerWaalsContact C-N 3.35Å; F147-V149 PolarHBondContact O-N 3.41Å; F147-L150 PolarHBondContact O-N 3.42Å; F147-C151 PolarHBondContact O-N 3.13Å; F147-C151 PolarHBondContact O-SG 2.94Å; F147-C151 VanDerWaalsContact O-SG 3.34Å
148V98.4Very high97.1Very high11 Ų1155.1 Ų55.17%0.06731%0.312CS..Hα-helixtrans-60.4-43.6177.2167.20000111.6L110 W113 L117 A144 L145 I146 L150 C151 L152L110-V148 HydrophobicContact CD1-CG1 4.09Å; W113-V148 HydrophobicContact CB-CG1 3.75Å; W113-V148 HydrophobicContact CG-CG1 4.42Å; L117-V148 HydrophobicContact CD1-CB 4.34Å; L117-V148 HydrophobicContact CD1-CG2 4.05Å; L117-V148 HydrophobicContact CD2-CG2 3.91Å; L117-V148 HydrophobicContact CG-CG2 4.17Å; A144-V148 WeakPolarHBondContact O-CG2 3.31Å; A144-V148 PolarHBondContact O-N 2.87Å; L145-V148 PolarHBondContact O-N 3.48Å; I146-V148 PolarHBondContact O-N 3.2Å; V148-L150 PolarHBondContact O-N 3.29Å; V148-C151 PolarHBondContact O-N 2.88Å; V148-L152 HydrophobicContact CG1-CD1 3.74Å; V148-L152 HydrophobicContact CG1-CG 4.19Å; V148-L152 WeakPolarHBondContact O-CB 3.43Å; V148-L152 WeakPolarHBondContact O-CG 3.48Å; V148-L152 PolarHBondContact O-N 3.36Å
149V98.6Very high97.3Very high45 Ų4553 Ų5327%0.27330%0.3SS..Hα-helixtrans-58.3-47.4177.1163.90000111F106 L110 L145 I146 F147 A153F106-V149 HydrophobicContact CE2-CG1 4.4Å; F106-V149 HydrophobicContact CZ-CG1 4.06Å; L110-V149 HydrophobicContact CD1-CG2 3.79Å; L110-V149 HydrophobicContact CD2-CG2 4.03Å; L145-V149 HydrophobicContact CD1-CG2 4.24Å; L145-V149 HydrophobicContact CG-CG2 4.43Å; L145-V149 WeakPolarHBondContact O-CB 3.39Å; L145-V149 VanDerWaalsContact O-CG2 3.29Å; L145-V149 WeakPolarHBondContact O-CG2 3.49Å; L145-V149 PolarHBondContact O-N 3.05Å; I146-V149 PolarHBondContact O-N 3.32Å; F147-V149 VanDerWaalsContact C-N 3.35Å; F147-V149 PolarHBondContact O-N 3.41Å; V149-A153 WeakPolarHBondContact O-CB 3.39Å; V149-A153 PolarHBondContact O-N 2.87Å
150L98.6Very high97.3Very high118 Ų11850.9 Ų50.962%0.61830%0.295SS*.Hα-helixtrans-65.2-42.1179.3-68.6175000111.9I146 F147 V148 G154I146-L150 HydrophobicContact CG2-CD1 3.98Å; I146-L150 HydrophobicContact CG2-CG 4.35Å; I146-L150 VanDerWaalsContact O-CG 3.32Å; I146-L150 WeakPolarHBondContact O-CG 3.33Å; I146-L150 PolarHBondContact O-N 2.97Å; F147-L150 PolarHBondContact O-N 3.42Å; V148-L150 PolarHBondContact O-N 3.29Å; L150-G154 PolarHBondContact O-N 3.46Å
151C98.4Very high97.3Very high58 Ų5851.8 Ų51.839%0.39230%0.295SS..Hα-helixtrans-62.1-50.7176.4-70.60000111.8F147 V148 A153 G154 V155F147-C151 PolarHBondContact O-N 3.13Å; F147-C151 PolarHBondContact O-SG 2.94Å; F147-C151 VanDerWaalsContact O-SG 3.34Å; V148-C151 PolarHBondContact O-N 2.88Å; C151-A153 PolarHBondContact O-N 3.27Å; C151-G154 PolarHBondContact O-N 3.03Å; C151-V155 WeakPolarHBondContact O-CG2 3.44Å; C151-V155 PolarHBondContact O-N 3.34Å
152L98Very high97.3Very high6 Ų651.6 Ų51.63%0.03129%0.292CS..Hα-helixtrans-68.3-35.5-178.8-67.9179.9000112.4F106 D109 L110 W113 V148 V155 N156 I190F106-L152 HydrophobicContact CD2-CB 4Å; F106-L152 HydrophobicContact CE2-CB 4.07Å; D109-L152 HydrophobicContact CB-CD1 4Å; D109-L152 HydrophobicContact CB-CD2 4.08Å; L110-L152 HydrophobicContact CB-CD1 4.15Å; L110-L152 HydrophobicContact CD1-CD1 4.26Å; W113-L152 HydrophobicContact CB-CD1 3.94Å; W113-L152 HydrophobicContact CD2-CD2 4.39Å; W113-L152 HydrophobicContact CG-CD1 3.9Å; W113-L152 HydrophobicContact CG-CD2 4.31Å; V148-L152 HydrophobicContact CG1-CD1 3.74Å; V148-L152 HydrophobicContact CG1-CG 4.19Å; V148-L152 WeakPolarHBondContact O-CB 3.43Å; V148-L152 WeakPolarHBondContact O-CG 3.48Å; V148-L152 PolarHBondContact O-N 3.36Å; L152-V155 PolarHBondContact O-N 3.48Å; L152-N156 WeakPolarHBondContact O-CB 3.35Å; L152-N156 PolarHBondContact O-N 3.46Å; L152-N156 PolarHBondContact O-ND2 3.43Å; L152-I190 HydrophobicContact CD2-CG2 4.06Å
153A98.2Very high97.1Very high26 Ų2648.8 Ų48.822%0.21528%0.278CS..Hα-helixtrans-62.2-48.2171.700000110.2F102 F106 V149 C151 V155 N156 I157F102-A153 HydrophobicContact CZ-CB 4.44Å; F106-A153 HydrophobicContact CD2-CB 4.31Å; F106-A153 HydrophobicContact CE2-CB 4.08Å; V149-A153 WeakPolarHBondContact O-CB 3.39Å; V149-A153 PolarHBondContact O-N 2.87Å; C151-A153 PolarHBondContact O-N 3.27Å; A153-V155 VanDerWaalsContact C-N 3.32Å; A153-V155 PolarHBondContact O-N 2.95Å; A153-N156 PolarHBondContact O-N 3.04Å; A153-I157 VanDerWaalsContact O-CB 3.23Å; A153-I157 WeakPolarHBondContact O-CB 2.95Å; A153-I157 PolarHBondContact O-N 3.15Å
154G98Very high96.9Very high52 Ų5248.5 Ų48.554%0.53627%0.267SS..Hα-helixtrans-61-36.5177.700000113.8L150 C151 I157L150-G154 PolarHBondContact O-N 3.46Å; C151-G154 PolarHBondContact O-N 3.03Å; G154-I157 WeakPolarHBondContact O-CG2 3.38Å
155V96.3Very high96.6Very high52 Ų5249.7 Ų49.732%0.31527%0.27SS..Hα-helixtrans-67.6-46.5174.4166.80000111.1C151 L152 A153 H158 W183 I190C151-V155 WeakPolarHBondContact O-CG2 3.44Å; C151-V155 PolarHBondContact O-N 3.34Å; L152-V155 PolarHBondContact O-N 3.48Å; A153-V155 VanDerWaalsContact C-N 3.32Å; A153-V155 PolarHBondContact O-N 2.95Å; V155-H158 PolarHBondContact O-CD2 3Å; V155-H158 VanDerWaalsContact O-CD2 3.31Å; V155-W183 HydrophobicContact CG1-CH2 3.72Å; V155-W183 HydrophobicContact CG1-CZ2 4.27Å; V155-W183 WeakPolarHBondContact O-CH2 3.33Å; V155-I190 HydrophobicContact CG1-CD1 3.51Å; V155-I190 HydrophobicContact CG2-CD1 4.37Å
156N96.1Very high96Very high0 Ų052.6 Ų52.60%028%0.282CS..Hα-helixtrans-88.1-14-171-77.8-73000114.6F102 T105 F106 D109 L152 A153 H158 Y159F102-N156 HydrophobicContact CD2-CB 3.89Å; F102-N156 WeakPolarHBondContact CD2-O 3.36Å; F102-N156 HydrophobicContact CE2-CB 4.06Å; T105-N156 WeakPolarHBondContact CG2-OD1 3.44Å; F106-N156 HydrophobicContact CB-CB 4.35Å; D109-N156 PolarHBondContact OD2-ND2 3.48Å; L152-N156 WeakPolarHBondContact O-CB 3.35Å; L152-N156 PolarHBondContact O-N 3.46Å; L152-N156 PolarHBondContact O-ND2 3.43Å; A153-N156 PolarHBondContact O-N 3.04Å; N156-H158 PolarHBondContact O-N 3.21Å; N156-Y159 VanDerWaalsContact O-CD2 3.26Å; N156-Y159 WeakPolarHBondContact O-CD2 3.44Å; N156-Y159 PolarHBondContact O-N 2.8Å
157I97.3Very high95.4Very high65 Ų6554.9 Ų54.933%0.33330%0.295SS..THydrogen-bonded Turntrans-61-21.6-172.5-165.767.7000113.2F102 A153 G154 Y159 V160 W161F102-I157 HydrophobicContact CD2-CD1 4.28Å; F102-I157 HydrophobicContact CE1-CD1 4.41Å; F102-I157 HydrophobicContact CE2-CB 4.34Å; F102-I157 HydrophobicContact CE2-CD1 4Å; F102-I157 HydrophobicContact CZ-CD1 4.07Å; A153-I157 VanDerWaalsContact O-CB 3.23Å; A153-I157 WeakPolarHBondContact O-CB 2.95Å; A153-I157 PolarHBondContact O-N 3.15Å; G154-I157 WeakPolarHBondContact O-CG2 3.38Å; I157-Y159 PolarHBondContact O-N 3.38Å; I157-Y159 VanDerWaalsContact O-N 3.08Å; I157-V160 HydrophobicContact CD1-CG2 3.87Å; I157-V160 HydrophobicContact CG1-CG2 4.46Å; I157-V160 WeakPolarHBondContact O-CB 2.91Å; I157-V160 WeakPolarHBondContact O-CG2 3.33Å; I157-V160 PolarHBondContact O-N 2.87Å; I157-W161 HydrophobicContact CB-CZ3 4.26Å; I157-W161 HydrophobicContact CG1-CZ3 3.97Å; I157-W161 HydrophobicContact CG2-CH2 3.76Å; I157-W161 HydrophobicContact CG2-CZ3 3.8Å; I157-W161 VanDerWaalsContact O-CZ3 3.22Å; I157-W161 WeakPolarHBondContact O-CZ3 3.22Å
158H96Very high94.7Very high12 Ų1253 Ų536%0.05629%0.291CS..THydrogen-bonded Turntrans-55-30.7179.58074.9000113.7V155 N156 V160 W161 T162 F179 W183V155-H158 PolarHBondContact O-CD2 3Å; V155-H158 VanDerWaalsContact O-CD2 3.31Å; N156-H158 PolarHBondContact O-N 3.21Å; H158-V160 PolarHBondContact O-N 3.21Å; H158-W161 VanDerWaalsContact CA-CH2 3.42Å; H158-W161 VanDerWaalsContact CA-CZ2 3.46Å; H158-W161 HydrophobicContact CB-CH2 4.01Å; H158-W161 HydrophobicContact CB-CZ2 3.68Å; H158-W161 PolarHBondContact O-N 3.25Å; H158-T162 HydrophobicContact CB-CG2 4.12Å; H158-T162 PolarHBondContact ND1-OG1 3.36Å; H158-T162 WeakPolarHBondContact O-CG2 3.07Å; H158-T162 PolarHBondContact O-N 3.42Å; H158-T162 PolarHBondContact O-OG1 3.35Å; H158-T162 VanDerWaalsContact O-OG1 3.1Å; H158-F179 AromaticContact CE1-CE1 3.64Å; H158-F179 AromaticContact CG-CE1 3.84Å; H158-F179 AromaticContact CG-CZ 3.9Å; H158-F179 AromaticContact ND1-CE1 3.47Å; H158-F179 WeakPolarHBondContact ND1-CE1 3.43Å; H158-W183 AromaticContact CD2-CH2 3.58Å; H158-W183 AromaticContact CD2-CZ2 3.68Å; H158-W183 AromaticContact CD2-CZ3 3.96Å; H158-W183 AromaticContact CE1-CE2 3.94Å; H158-W183 AromaticContact NE2-CD2 3.61Å; H158-W183 AromaticContact NE2-CE2 3.14Å; H158-W183 AromaticContact NE2-CE3 3.99Å; H158-W183 AromaticContact NE2-CH2 3.49Å; H158-W183 WeakPolarHBondContact NE2-CH2 3.2Å; H158-W183 AromaticContact NE2-CZ2 3.09Å; H158-W183 WeakPolarHBondContact NE2-CZ2 3.35Å; H158-W183 AromaticContact NE2-CZ3 3.93Å; H158-W183 AromaticContact NE2-NE1 3.65Å
159Y95.2Very high94Very high6 Ų653.4 Ų53.42%0.02430%0.295CS..Hα-helixtrans-56-28.3179.1-75.1-63000112.8L3 I5 G98 L101 T105 N156 I157 W161 V163 W183L3-Y159 HydrophobicContact CD1-CE1 4Å; I5-Y159 HydrophobicContact CD1-CE1 4.4Å; G98-Y159 WeakPolarHBondContact CA-O 3.02Å; L101-Y159 HydrophobicContact CB-CD1 4.16Å; L101-Y159 HydrophobicContact CB-CG 4.06Å; L101-Y159 HydrophobicContact CD2-CD1 3.78Å; L101-Y159 HydrophobicContact CD2-CE1 4.21Å; T105-Y159 HydrophobicContact CG2-CE2 4.08Å; N156-Y159 VanDerWaalsContact O-CD2 3.26Å; N156-Y159 WeakPolarHBondContact O-CD2 3.44Å; N156-Y159 PolarHBondContact O-N 2.8Å; I157-Y159 PolarHBondContact O-N 3.38Å; I157-Y159 VanDerWaalsContact O-N 3.08Å; Y159-W161 VanDerWaalsContact C-N 3.26Å; Y159-W161 PolarHBondContact O-N 3.05Å; Y159-V163 HydrophobicContact CD1-CG2 3.98Å; Y159-W183 AromaticContact CZ-NE1 3.6Å; Y159-W183 PolarHBondContact OH-NE1 3.03Å
160V95.5Very high93.5Very high70 Ų7051.3 Ų51.342%0.42428%0.282SS..Hα-helixtrans-61.3-33.7179.3177.60000112.1F102 I157 H158F102-V160 HydrophobicContact CB-CG2 4.18Å; F102-V160 HydrophobicContact CG-CG2 4.38Å; I157-V160 HydrophobicContact CD1-CG2 3.87Å; I157-V160 HydrophobicContact CG1-CG2 4.46Å; I157-V160 WeakPolarHBondContact O-CB 2.91Å; I157-V160 WeakPolarHBondContact O-CG2 3.33Å; I157-V160 PolarHBondContact O-N 2.87Å; H158-V160 PolarHBondContact O-N 3.21Å
161W95.1Very high93.1Very high114 Ų11445.8 Ų45.843%0.43225%0.254SS..Hα-helixtrans-116.7-19-178.268.288000114.7I157 H158 Y159 K173 Y176I157-W161 HydrophobicContact CB-CZ3 4.26Å; I157-W161 HydrophobicContact CG1-CZ3 3.97Å; I157-W161 HydrophobicContact CG2-CH2 3.76Å; I157-W161 HydrophobicContact CG2-CZ3 3.8Å; I157-W161 VanDerWaalsContact O-CZ3 3.22Å; I157-W161 WeakPolarHBondContact O-CZ3 3.22Å; H158-W161 VanDerWaalsContact CA-CH2 3.42Å; H158-W161 VanDerWaalsContact CA-CZ2 3.46Å; H158-W161 HydrophobicContact CB-CH2 4.01Å; H158-W161 HydrophobicContact CB-CZ2 3.68Å; H158-W161 PolarHBondContact O-N 3.25Å; Y159-W161 VanDerWaalsContact C-N 3.26Å; Y159-W161 PolarHBondContact O-N 3.05Å; W161-K173 VanDerWaalsContact O-CD 3.32Å; W161-K173 WeakPolarHBondContact O-CD 3.29Å; W161-K173 WeakPolarHBondContact O-CE 3.16Å; W161-K173 PolarHBondContact O-NZ 3.39Å; W161-Y176 AromaticContact CD1-CE2 3.91Å; W161-Y176 AromaticContact CD1-CZ 3.85Å
162T95.4Very high92.8Very high3 Ų343.9 Ų43.92%0.01824%0.24CC..Hα-helixtrans-88.9-9.7-176.468.80000114.6H158 K173 Y176 H180H158-T162 HydrophobicContact CB-CG2 4.12Å; H158-T162 PolarHBondContact ND1-OG1 3.36Å; H158-T162 WeakPolarHBondContact O-CG2 3.07Å; H158-T162 PolarHBondContact O-N 3.42Å; H158-T162 PolarHBondContact O-OG1 3.35Å; H158-T162 VanDerWaalsContact O-OG1 3.1Å; T162-K173 PolarHBondContact O-N 2.91Å; T162-Y176 HydrophobicContact CG2-CD1 4.09Å; T162-Y176 HydrophobicContact CG2-CD2 3.8Å; T162-Y176 HydrophobicContact CG2-CE1 4.44Å; T162-Y176 HydrophobicContact CG2-CE2 4.17Å; T162-Y176 HydrophobicContact CG2-CG 3.77Å; T162-H180 VanDerWaalsContact CB-NE2 3.3Å; T162-H180 WeakPolarHBondContact CB-NE2 3.33Å; T162-H180 PolarHBondContact O-NE2 3.23Å; T162-H180 VanDerWaalsContact O-NE2 3.12Å; T162-H180 PolarHBondContact OG1-CE1 2.88Å; T162-H180 VanDerWaalsContact OG1-CE1 3.27Å; T162-H180 PolarHBondContact OG1-NE2 3.05Å
163V93.5Very high92.5Very high7 Ų747 Ų474%0.04225%0.253CS..EExtended strand (participates in β ladder)trans-120.3147.3-179.3-178.90000110.3I5 C97 L101 Y159 C170 A171I5-V163 HydrophobicContact CD1-CG2 3.59Å; I5-V163 HydrophobicContact CG1-CG2 4.38Å; C97-V163 HydrophobicContact CB-CG1 3.97Å; L101-V163 HydrophobicContact CD2-CB 4.15Å; L101-V163 HydrophobicContact CD2-CG1 3.82Å; L101-V163 HydrophobicContact CD2-CG2 3.86Å; Y159-V163 HydrophobicContact CD1-CG2 3.98Å; V163-C170 HydrophobicContact CG1-CB 4.05Å; V163-A171 WeakPolarHBondContact CA-O 3.49Å; V163-A171 WeakPolarHBondContact CG1-O 3.35Å
164Y92.7Very high92.2Very high89 Ų8952.8 Ų52.835%0.34928%0.276SS..EExtended strand (participates in β ladder)trans-143.2168.9175.977.7-67000111.5K166 A171 P172 K173Y164-K166 HydrophobicContact CD2-CB 4.48Å; Y164-K166 HydrophobicContact CE1-CB 4.42Å; Y164-K166 HydrophobicContact CE2-CB 3.81Å; Y164-K166 HydrophobicContact CE2-CG 4.2Å; Y164-K166 WeakPolarHBondContact OH-CD 3.26Å; Y164-A171 VanDerWaalsContact CD1-O 3.32Å; Y164-A171 WeakPolarHBondContact CD1-O 3.47Å; Y164-A171 HydrophobicContact CE1-CB 4.2Å; Y164-A171 PolarHBondContact N-O 3.3Å; Y164-A171 PolarHBondContact O-N 3.12Å; Y164-P172 WeakPolarHBondContact CE1-O 3.43Å; Y164-K173 HydrophobicContact CD1-CB 4.24Å; Y164-K173 HydrophobicContact CD1-CG 3.57Å; Y164-K173 HydrophobicContact CE1-CG 4.27Å; Y164-K173 HydrophobicContact CG-CG 4.12Å
165V91.3Very high92Very high61 Ų6156.8 Ų56.837%0.3728%0.281SS..EExtended strand (participates in β ladder)trans-80.2122.4173.7178.10000108.8I93 C97 S169I93-V165 HydrophobicContact CG2-CG1 3.74Å; I93-V165 HydrophobicContact CG2-CG2 4.1Å; C97-V165 HydrophobicContact CB-CG2 4.46Å; V165-S169 WeakPolarHBondContact CA-O 3.26Å
166K87Confident92Very high80 Ų8058 Ų5835%0.34828%0.28SS..EExtended strand (participates in β ladder)trans-134.3130.2174.1-169.6-164.4177.7-176.40108.5Y164 N168 S169 A171Y164-K166 HydrophobicContact CD2-CB 4.48Å; Y164-K166 HydrophobicContact CE1-CB 4.42Å; Y164-K166 HydrophobicContact CE2-CB 3.81Å; Y164-K166 HydrophobicContact CE2-CG 4.2Å; Y164-K166 WeakPolarHBondContact OH-CD 3.26Å; K166-N168 VanDerWaalsContact C-N 3.27Å; K166-N168 PolarHBondContact O-N 3.44Å; K166-N168 VanDerWaalsContact O-N 3.13Å; K166-S169 PolarHBondContact N-O 2.76Å; K166-S169 CarbonylContact O-C 3.52Å; K166-S169 PolarHBondContact O-N 3.47Å; K166-S169 VanDerWaalsContact O-O 3.06Å; K166-S169 PolarHBondContact O-OG 3.36Å; K166-A171 HydrophobicContact CB-CB 3.59Å; K166-A171 HydrophobicContact CD-CB 4.03Å; K166-A171 HydrophobicContact CG-CB 4.45Å
167D85.1Confident91.6Very high140 Ų14061.5 Ų61.575%0.74930%0.296SS*.THydrogen-bonded Turntrans49.942.5172.6-53.3-36000114.6S169D167-S169 PolarHBondContact O-N 3.11Å
168N83.1Confident91.3Very high97 Ų9762.5 Ų62.552%0.51931%0.309SS..THydrogen-bonded Turntrans59.829.7-176.7-160.455.4000113.9K88 I93 K166K88-N168 PolarHBondContact O-ND2 2.85Å; I93-N168 HydrophobicContact CD1-CB 4.43Å; I93-N168 WeakPolarHBondContact CD1-O 3.38Å; I93-N168 WeakPolarHBondContact CD1-OD1 3.08Å; K166-N168 VanDerWaalsContact C-N 3.27Å; K166-N168 PolarHBondContact O-N 3.44Å; K166-N168 VanDerWaalsContact O-N 3.13Å
169S84.1Confident91.2Very high21 Ų2165.7 Ų65.715%0.14732%0.322CS..EExtended strand (participates in β ladder)trans-141.8175.7168.582.90000111.7D6 V165 K166 D167D6-S169 WeakPolarHBondContact OD2-CB 3.49Å; D6-S169 PolarHBondContact OD2-OG 2.91Å; V165-S169 WeakPolarHBondContact CA-O 3.26Å; K166-S169 PolarHBondContact N-O 2.76Å; K166-S169 CarbonylContact O-C 3.52Å; K166-S169 PolarHBondContact O-N 3.47Å; K166-S169 VanDerWaalsContact O-O 3.06Å; K166-S169 PolarHBondContact O-OG 3.36Å; D167-S169 PolarHBondContact O-N 3.11Å
170C88.6Confident90.9Very high0 Ų066.3 Ų66.30%033%0.326CS..EExtended strand (participates in β ladder)trans-95.3120.3176.5-62.50000109.1I5 D6 C97 L101 V163I5-C170 VanDerWaalsContact CA-O 3.3Å; I5-C170 WeakPolarHBondContact CA-O 3.09Å; D6-C170 PolarHBondContact N-O 3.22Å; C97-C170 HydrophobicContact CB-CB 3.84Å; C97-C170 WeakPolarHBondContact CB-SG 3.38Å; C97-C170 WeakPolarHBondContact SG-CA 3.19Å; C97-C170 WeakPolarHBondContact SG-CB 3.38Å; C97-C170 CovalentContact SG-SG 2.04Å; C97-C170 PolarHBondContact SG-SG 3.44Å; L101-C170 HydrophobicContact CD1-CB 4.34Å; V163-C170 HydrophobicContact CG1-CB 4.05Å
171A89.8Confident90.5Very high3 Ų368.6 Ų68.63%0.02534%0.335CS..EExtended strand (participates in β ladder)trans-125.9154.9-175.900000111.5V163 Y164 K166V163-A171 WeakPolarHBondContact CA-O 3.49Å; V163-A171 WeakPolarHBondContact CG1-O 3.35Å; Y164-A171 VanDerWaalsContact CD1-O 3.32Å; Y164-A171 WeakPolarHBondContact CD1-O 3.47Å; Y164-A171 HydrophobicContact CE1-CB 4.2Å; Y164-A171 PolarHBondContact N-O 3.3Å; Y164-A171 PolarHBondContact O-N 3.12Å; K166-A171 HydrophobicContact CB-CB 3.59Å; K166-A171 HydrophobicContact CD-CB 4.03Å; K166-A171 HydrophobicContact CG-CB 4.45Å
172P91.8Very high90.2Very high18 Ų1870.5 Ų70.512%0.11734%0.343CS..EExtended strand (participates in β ladder)trans-77.6138.7178.228.2-14.4000107.8I5 Y164 Q174 H180I5-P172 HydrophobicContact CG2-CB 3.74Å; I5-P172 HydrophobicContact CG2-CG 3.35Å; Y164-P172 WeakPolarHBondContact CE1-O 3.43Å; P172-Q174 PolarHBondContact O-N 3.1Å; P172-H180 HydrophobicContact CB-CB 4Å; P172-H180 WeakPolarHBondContact CB-CD2 3.47Å
173K92.4Very high90Very high70 Ų7071.3 Ų71.330%0.30435%0.346SS..  trans-60.3143.9172.6-65.9-179.3178.5170.40109.6W161 T162 Y164 E175 Y176 K177W161-K173 VanDerWaalsContact O-CD 3.32Å; W161-K173 WeakPolarHBondContact O-CD 3.29Å; W161-K173 WeakPolarHBondContact O-CE 3.16Å; W161-K173 PolarHBondContact O-NZ 3.39Å; T162-K173 PolarHBondContact O-N 2.91Å; Y164-K173 HydrophobicContact CD1-CB 4.24Å; Y164-K173 HydrophobicContact CD1-CG 3.57Å; Y164-K173 HydrophobicContact CE1-CG 4.27Å; Y164-K173 HydrophobicContact CG-CG 4.12Å; K173-E175 HydrophobicContact CB-CG 4.15Å; K173-E175 PolarHBondContact O-N 3.43Å; K173-E175 VanDerWaalsContact O-N 3.14Å; K173-Y176 HydrophobicContact CB-CD2 4.05Å; K173-Y176 HydrophobicContact CD-CD2 4.35Å; K173-Y176 HydrophobicContact CD-CE2 4.36Å; K173-Y176 CarbonylContact O-C 3.54Å; K173-Y176 PolarHBondContact O-N 2.69Å; K173-K177 PolarHBondContact O-N 3.42Å
174Q91.5Very high89.7Confident148 Ų14873.2 Ų73.269%0.69236%0.358SS*.G310 helixtrans-53.2-39.5-175.5-17464.817.100112.6P172 Y176 K177P172-Q174 PolarHBondContact O-N 3.1Å; Q174-Y176 VanDerWaalsContact C-N 3.27Å; Q174-Y176 PolarHBondContact O-N 2.97Å; Q174-K177 WeakPolarHBondContact O-CB 3.28Å; Q174-K177 PolarHBondContact O-N 2.6Å
175E95Very high89.6Confident136 Ų13675.4 Ų75.464%0.63637%0.367SS*.G310 helixtrans-65.8-22.9178.266.9-165.3172.800114.3K173K173-E175 HydrophobicContact CB-CG 4.15Å; K173-E175 PolarHBondContact O-N 3.43Å; K173-E175 VanDerWaalsContact O-N 3.14Å
176Y94.5Very high89.6Confident77 Ų7776.2 Ų76.230%0.30237%0.368SS..G310 helixtrans-108.912.9178.9-58.6-63.6000112.9W161 T162 K173 Q174 S178 F179 H180W161-Y176 AromaticContact CD1-CE2 3.91Å; W161-Y176 AromaticContact CD1-CZ 3.85Å; T162-Y176 HydrophobicContact CG2-CD1 4.09Å; T162-Y176 HydrophobicContact CG2-CD2 3.8Å; T162-Y176 HydrophobicContact CG2-CE1 4.44Å; T162-Y176 HydrophobicContact CG2-CE2 4.17Å; T162-Y176 HydrophobicContact CG2-CG 3.77Å; K173-Y176 HydrophobicContact CB-CD2 4.05Å; K173-Y176 HydrophobicContact CD-CD2 4.35Å; K173-Y176 HydrophobicContact CD-CE2 4.36Å; K173-Y176 CarbonylContact O-C 3.54Å; K173-Y176 PolarHBondContact O-N 2.69Å; Q174-Y176 VanDerWaalsContact C-N 3.27Å; Q174-Y176 PolarHBondContact O-N 2.97Å; Y176-S178 VanDerWaalsContact C-N 3.35Å; Y176-S178 PolarHBondContact O-N 3.43Å; Y176-F179 WeakPolarHBondContact O-CB 2.98Å; Y176-F179 PolarHBondContact O-N 3.33Å; Y176-F179 VanDerWaalsContact O-N 3.13Å; Y176-H180 PolarHBondContact O-CD2 3.3Å; Y176-H180 VanDerWaalsContact O-CD2 3.31Å; Y176-H180 PolarHBondContact O-N 3.05Å
177K89.7Confident89.8Confident74 Ų7472.8 Ų72.832%0.32235%0.354SS..Hα-helixtrans-58.5-45.2-178-170.1177.9-177.4-178.60112.1K173 Q174 F179 H180 L181K173-K177 PolarHBondContact O-N 3.42Å; Q174-K177 WeakPolarHBondContact O-CB 3.28Å; Q174-K177 PolarHBondContact O-N 2.6Å; K177-F179 VanDerWaalsContact C-N 3.31Å; K177-F179 PolarHBondContact O-N 3.31Å; K177-H180 PolarHBondContact O-N 2.62Å; K177-L181 PolarHBondContact O-N 2.91Å
178S90.7Very high90.1Very high87 Ų8766.4 Ų66.461%0.60832%0.319SS*.Hα-helixtrans-63.3-37.5177.1-53.80000112.1Y176 L181 Y182Y176-S178 VanDerWaalsContact C-N 3.35Å; Y176-S178 PolarHBondContact O-N 3.43Å; S178-L181 WeakPolarHBondContact O-CB 3.36Å; S178-L181 PolarHBondContact O-N 3.06Å; S178-Y182 WeakPolarHBondContact O-CD2 3.48Å; S178-Y182 PolarHBondContact O-N 3.1Å
179F93Very high90.5Very high78 Ų7863.2 Ų63.234%0.34231%0.306SS..Hα-helixtrans-62.6-47.5175.8171.2-93.1000111.2H158 Y176 K177 L181 Y182 W183H158-F179 AromaticContact CE1-CE1 3.64Å; H158-F179 AromaticContact CG-CE1 3.84Å; H158-F179 AromaticContact CG-CZ 3.9Å; H158-F179 AromaticContact ND1-CE1 3.47Å; H158-F179 WeakPolarHBondContact ND1-CE1 3.43Å; Y176-F179 WeakPolarHBondContact O-CB 2.98Å; Y176-F179 PolarHBondContact O-N 3.33Å; Y176-F179 VanDerWaalsContact O-N 3.13Å; K177-F179 VanDerWaalsContact C-N 3.31Å; K177-F179 PolarHBondContact O-N 3.31Å; F179-L181 PolarHBondContact O-N 2.69Å; F179-Y182 PolarHBondContact O-N 2.86Å; F179-W183 HydrophobicContact CE1-CB 4.37Å; F179-W183 HydrophobicContact CE1-CD2 4.21Å; F179-W183 AromaticContact CE1-CE3 3.96Å; F179-W183 HydrophobicContact CE1-CE3 3.96Å; F179-W183 HydrophobicContact CE1-CG 4.39Å; F179-W183 AromaticContact CE2-CE3 3.94Å; F179-W183 HydrophobicContact CE2-CE3 3.94Å; F179-W183 HydrophobicContact CE2-CZ3 4.33Å; F179-W183 HydrophobicContact CZ-CD2 4.02Å; F179-W183 AromaticContact CZ-CE3 3.31Å; F179-W183 HydrophobicContact CZ-CE3 3.31Å; F179-W183 AromaticContact CZ-CZ3 3.73Å; F179-W183 HydrophobicContact CZ-CZ3 3.73Å; F179-W183 WeakPolarHBondContact O-CB 3.38Å; F179-W183 PolarHBondContact O-N 3.45Å
180H89.9Confident91Very high20 Ų2063.3 Ų63.39%0.09331%0.305CS..Hα-helixtrans-68.2-20.4177.9-77.8-76.9000113.9I5 T162 P172 Y176 K177 P184I5-H180 WeakPolarHBondContact CD1-CE1 3.49Å; I5-H180 VanDerWaalsContact CD1-ND1 3.3Å; I5-H180 WeakPolarHBondContact CD1-ND1 3.48Å; T162-H180 VanDerWaalsContact CB-NE2 3.3Å; T162-H180 WeakPolarHBondContact CB-NE2 3.33Å; T162-H180 PolarHBondContact O-NE2 3.23Å; T162-H180 VanDerWaalsContact O-NE2 3.12Å; T162-H180 PolarHBondContact OG1-CE1 2.88Å; T162-H180 VanDerWaalsContact OG1-CE1 3.27Å; T162-H180 PolarHBondContact OG1-NE2 3.05Å; P172-H180 HydrophobicContact CB-CB 4Å; P172-H180 WeakPolarHBondContact CB-CD2 3.47Å; Y176-H180 PolarHBondContact O-CD2 3.3Å; Y176-H180 VanDerWaalsContact O-CD2 3.31Å; Y176-H180 PolarHBondContact O-N 3.05Å; K177-H180 PolarHBondContact O-N 2.62Å; H180-P184 VanDerWaalsContact O-CD 3.23Å; H180-P184 WeakPolarHBondContact O-CD 3.3Å
181L86.7Confident91.1Very high117 Ų11763.4 Ų63.461%0.61331%0.305SS*.Hα-helixtrans-68.6-37.3172.1-174.866.3000112.1K177 S178 F179K177-L181 PolarHBondContact O-N 2.91Å; S178-L181 WeakPolarHBondContact O-CB 3.36Å; S178-L181 PolarHBondContact O-N 3.06Å; F179-L181 PolarHBondContact O-N 2.69Å
182Y88.9Confident91.2Very high155 Ų15563.2 Ų63.261%0.60830%0.304SS*.Hα-helixtrans-93.5-21.1-180-64.9-71000113.7S178 F179 P184 Y185S178-Y182 WeakPolarHBondContact O-CD2 3.48Å; S178-Y182 PolarHBondContact O-N 3.1Å; F179-Y182 PolarHBondContact O-N 2.86Å; Y182-P184 VanDerWaalsContact C-CD 3.41Å; Y182-Y185 WeakPolarHBondContact O-CD2 3.49Å; Y182-Y185 PolarHBondContact O-N 3.08Å
183W91.2Very high91.1Very high20 Ų2066.7 Ų66.78%0.07632%0.317CS..Hα-helixtrans-53.2-40.9-177.4-177.6-103.5000114.9V155 H158 Y159 F179 Y185 I186 D187V155-W183 HydrophobicContact CG1-CH2 3.72Å; V155-W183 HydrophobicContact CG1-CZ2 4.27Å; V155-W183 WeakPolarHBondContact O-CH2 3.33Å; H158-W183 AromaticContact CD2-CH2 3.58Å; H158-W183 AromaticContact CD2-CZ2 3.68Å; H158-W183 AromaticContact CD2-CZ3 3.96Å; H158-W183 AromaticContact CE1-CE2 3.94Å; H158-W183 AromaticContact NE2-CD2 3.61Å; H158-W183 AromaticContact NE2-CE2 3.14Å; H158-W183 AromaticContact NE2-CE3 3.99Å; H158-W183 AromaticContact NE2-CH2 3.49Å; H158-W183 WeakPolarHBondContact NE2-CH2 3.2Å; H158-W183 AromaticContact NE2-CZ2 3.09Å; H158-W183 WeakPolarHBondContact NE2-CZ2 3.35Å; H158-W183 AromaticContact NE2-CZ3 3.93Å; H158-W183 AromaticContact NE2-NE1 3.65Å; Y159-W183 AromaticContact CZ-NE1 3.6Å; Y159-W183 PolarHBondContact OH-NE1 3.03Å; F179-W183 HydrophobicContact CE1-CB 4.37Å; F179-W183 HydrophobicContact CE1-CD2 4.21Å; F179-W183 AromaticContact CE1-CE3 3.96Å; F179-W183 HydrophobicContact CE1-CE3 3.96Å; F179-W183 HydrophobicContact CE1-CG 4.39Å; F179-W183 AromaticContact CE2-CE3 3.94Å; F179-W183 HydrophobicContact CE2-CE3 3.94Å; F179-W183 HydrophobicContact CE2-CZ3 4.33Å; F179-W183 HydrophobicContact CZ-CD2 4.02Å; F179-W183 AromaticContact CZ-CE3 3.31Å; F179-W183 HydrophobicContact CZ-CE3 3.31Å; F179-W183 AromaticContact CZ-CZ3 3.73Å; F179-W183 HydrophobicContact CZ-CZ3 3.73Å; F179-W183 WeakPolarHBondContact O-CB 3.38Å; F179-W183 PolarHBondContact O-N 3.45Å; W183-Y185 PolarHBondContact O-N 3.29Å; W183-Y185 VanDerWaalsContact O-N 3.14Å; W183-I186 HydrophobicContact CE3-CB 4.28Å; W183-I186 HydrophobicContact CE3-CD1 4.21Å; W183-I186 HydrophobicContact CE3-CG2 4.39Å; W183-I186 HydrophobicContact CH2-CG2 4.38Å; W183-I186 HydrophobicContact CZ3-CB 4.44Å; W183-I186 HydrophobicContact CZ3-CD1 4.44Å; W183-I186 HydrophobicContact CZ3-CG2 4.04Å; W183-I186 WeakPolarHBondContact O-CA 3.37Å; W183-I186 WeakPolarHBondContact O-CB 3.27Å; W183-I186 PolarHBondContact O-N 3.04Å; W183-D187 PolarHBondContact O-N 2.84Å
184P87.5Confident91.1Very high47 Ų4767.2 Ų67.231%0.30532%0.323SS..Hα-helixtrans-54.6-35.8179.7-28.736.2000113.8H180 Y182 I186 D187 F188H180-P184 VanDerWaalsContact O-CD 3.23Å; H180-P184 WeakPolarHBondContact O-CD 3.3Å; Y182-P184 VanDerWaalsContact C-CD 3.41Å; P184-I186 VanDerWaalsContact C-N 3.32Å; P184-I186 PolarHBondContact O-N 2.85Å; P184-D187 WeakPolarHBondContact O-CB 3.26Å; P184-D187 PolarHBondContact O-N 3.47Å; P184-F188 HydrophobicContact CB-CE2 3.93Å; P184-F188 HydrophobicContact CB-CZ 3.84Å; P184-F188 WeakPolarHBondContact O-CB 3.37Å; P184-F188 WeakPolarHBondContact O-CD1 3.23Å; P184-F188 WeakPolarHBondContact O-CD2 2.85Å; P184-F188 WeakPolarHBondContact O-CE2 3.29Å; P184-F188 WeakPolarHBondContact O-CG 3.47Å; P184-F188 PolarHBondContact O-N 3.43Å
185Y89.7Confident91.2Very high135 Ų13560.2 Ų60.253%0.52929%0.29SS..Hα-helixtrans-64.8-37.2177.1-60-76.7000112.5Y182 W183 A189 L275Y182-Y185 WeakPolarHBondContact O-CD2 3.49Å; Y182-Y185 PolarHBondContact O-N 3.08Å; W183-Y185 PolarHBondContact O-N 3.29Å; W183-Y185 VanDerWaalsContact O-N 3.14Å; Y185-A189 PolarHBondContact O-N 3.1Å; Y185-A189 VanDerWaalsContact O-N 3.14Å; Y185-L275 HydrophobicContact CD1-CD1 3.84Å; Y185-L275 HydrophobicContact CE1-CD1 3.58Å
186I92.1Very high90.9Very high78 Ų7856 Ų5640%0.427%0.272SS..Hα-helixtrans-71.8-46.3175.8-59.8173.9000109.7W183 P184 F188 A189 I190W183-I186 HydrophobicContact CE3-CB 4.28Å; W183-I186 HydrophobicContact CE3-CD1 4.21Å; W183-I186 HydrophobicContact CE3-CG2 4.39Å; W183-I186 HydrophobicContact CH2-CG2 4.38Å; W183-I186 HydrophobicContact CZ3-CB 4.44Å; W183-I186 HydrophobicContact CZ3-CD1 4.44Å; W183-I186 HydrophobicContact CZ3-CG2 4.04Å; W183-I186 WeakPolarHBondContact O-CA 3.37Å; W183-I186 WeakPolarHBondContact O-CB 3.27Å; W183-I186 PolarHBondContact O-N 3.04Å; P184-I186 VanDerWaalsContact C-N 3.32Å; P184-I186 PolarHBondContact O-N 2.85Å; I186-F188 VanDerWaalsContact C-N 3.3Å; I186-F188 PolarHBondContact O-N 3.19Å; I186-A189 WeakPolarHBondContact O-CB 3.31Å; I186-A189 PolarHBondContact O-N 3.36Å; I186-A189 VanDerWaalsContact O-N 3.13Å; I186-I190 HydrophobicContact CG2-CD1 3.79Å; I186-I190 HydrophobicContact CG2-CG1 4.43Å; I186-I190 WeakPolarHBondContact O-CG1 3.08Å; I186-I190 PolarHBondContact O-N 3.42Å
187D91.4Very high90.8Very high8 Ų854.8 Ų54.84%0.04328%0.277CS..Hα-helixtrans-52.2-49174.7-166.255.9000110.1M1 W183 P184 A189 I190 Y191M1-D187 PolarHBondContact N-OD2 2.89Å; W183-D187 PolarHBondContact O-N 2.84Å; P184-D187 WeakPolarHBondContact O-CB 3.26Å; P184-D187 PolarHBondContact O-N 3.47Å; D187-A189 PolarHBondContact O-N 3.29Å; D187-I190 PolarHBondContact O-N 2.79Å; D187-Y191 WeakPolarHBondContact O-CB 3.22Å; D187-Y191 PolarHBondContact O-N 3.43Å
188F90.1Very high90.9Very high6 Ų654.9 Ų54.93%0.02628%0.278CS..Hα-helixtrans-64.8-38.5178.7-58.1-26000113.5M1 P184 I186 S192 F193 V271 L275M1-F188 HydrophobicContact CE-CD1 3.28Å; M1-F188 HydrophobicContact CE-CE1 3.36Å; P184-F188 HydrophobicContact CB-CE2 3.93Å; P184-F188 HydrophobicContact CB-CZ 3.84Å; P184-F188 WeakPolarHBondContact O-CB 3.37Å; P184-F188 WeakPolarHBondContact O-CD1 3.23Å; P184-F188 WeakPolarHBondContact O-CD2 2.85Å; P184-F188 WeakPolarHBondContact O-CE2 3.29Å; P184-F188 WeakPolarHBondContact O-CG 3.47Å; P184-F188 PolarHBondContact O-N 3.43Å; I186-F188 VanDerWaalsContact C-N 3.3Å; I186-F188 PolarHBondContact O-N 3.19Å; F188-S192 WeakPolarHBondContact O-CA 3.27Å; F188-S192 WeakPolarHBondContact O-CB 3.34Å; F188-S192 PolarHBondContact O-N 3.14Å; F188-F193 HydrophobicContact CB-CD2 4.25Å; F188-F193 HydrophobicContact CB-CE2 4.1Å; F188-F193 PolarHBondContact O-N 3.36Å; F188-F193 VanDerWaalsContact O-N 3.1Å; F188-V271 HydrophobicContact CB-CG1 4.11Å; F188-V271 HydrophobicContact CD1-CG1 4.11Å; F188-V271 HydrophobicContact CD2-CG1 4.43Å; F188-V271 HydrophobicContact CG-CG1 3.95Å; F188-L275 HydrophobicContact CD2-CB 4.46Å; F188-L275 HydrophobicContact CD2-CD1 4.01Å; F188-L275 HydrophobicContact CE2-CB 4.01Å; F188-L275 HydrophobicContact CE2-CD1 3.99Å
189A92.9Very high90.9Very high30 Ų3050.8 Ų50.825%0.24825%0.249CC..Iπ-helixtrans-62-46.4176.300000110.7Y185 I186 D187 F193 I194Y185-A189 PolarHBondContact O-N 3.1Å; Y185-A189 VanDerWaalsContact O-N 3.14Å; I186-A189 WeakPolarHBondContact O-CB 3.31Å; I186-A189 PolarHBondContact O-N 3.36Å; I186-A189 VanDerWaalsContact O-N 3.13Å; D187-A189 PolarHBondContact O-N 3.29Å; A189-F193 PolarHBondContact O-N 3.34Å; A189-I194 HydrophobicContact CB-CD1 4.15Å; A189-I194 HydrophobicContact CB-CG1 4.47Å; A189-I194 WeakPolarHBondContact O-CB 3.42Å; A189-I194 VanDerWaalsContact O-CG1 3.25Å; A189-I194 WeakPolarHBondContact O-CG1 3.33Å; A189-I194 PolarHBondContact O-N 3.04Å
190I93.6Very high90.8Very high22 Ų2251.2 Ų51.211%0.11325%0.254CS..Iπ-helixtrans-73.7-40.9-175.8-65.7177.2000112W113 L152 V155 I186 D187 P195W113-I190 HydrophobicContact CZ2-CG2 4.36Å; W113-I190 PolarHBondContact NE1-O 3.31Å; L152-I190 HydrophobicContact CD2-CG2 4.06Å; V155-I190 HydrophobicContact CG1-CD1 3.51Å; V155-I190 HydrophobicContact CG2-CD1 4.37Å; I186-I190 HydrophobicContact CG2-CD1 3.79Å; I186-I190 HydrophobicContact CG2-CG1 4.43Å; I186-I190 WeakPolarHBondContact O-CG1 3.08Å; I186-I190 PolarHBondContact O-N 3.42Å; D187-I190 PolarHBondContact O-N 2.79Å; I190-P195 VanDerWaalsContact O-CD 3.28Å; I190-P195 WeakPolarHBondContact O-CD 3.44Å; I190-P195 WeakPolarHBondContact O-CG 3.18Å
191Y91.8Very high90.9Very high2 Ų256 Ų561%0.00828%0.28CS..Iπ-helixtrans-79.8-32.1-176.3175.3-109.9000113.1M1 T108 D187 T267 V271 Q302M1-Y191 HydrophobicContact CE-CD1 3.73Å; M1-Y191 HydrophobicContact CE-CE1 4.09Å; M1-Y191 HydrophobicContact SD-CD1 3.72Å; M1-Y191 HydrophobicContact SD-CE1 3.45Å; M1-Y191 WeakPolarHBondContact SD-CE1 3.48Å; T108-Y191 HydrophobicContact CG2-CD2 3.9Å; T108-Y191 HydrophobicContact CG2-CE2 3.35Å; D187-Y191 WeakPolarHBondContact O-CB 3.22Å; D187-Y191 PolarHBondContact O-N 3.43Å; Y191-T267 HydrophobicContact CE1-CG2 4.43Å; Y191-T267 WeakPolarHBondContact OH-CB 3.45Å; Y191-T267 WeakPolarHBondContact OH-CG2 3.41Å; Y191-V271 HydrophobicContact CD1-CG2 4.27Å; Y191-V271 HydrophobicContact CE1-CG2 4.43Å; Y191-Q302 WeakPolarHBondContact OH-CG 3.39Å; Y191-Q302 PolarHBondContact OH-NE2 2.94Å
192S90.1Very high91.1Very high0 Ų051.2 Ų51.20%026%0.256CS..Iπ-helixtrans-129.8-64.1-167.3159.30000113.8F188 P195 L196 M268F188-S192 WeakPolarHBondContact O-CA 3.27Å; F188-S192 WeakPolarHBondContact O-CB 3.34Å; F188-S192 PolarHBondContact O-N 3.14Å; S192-P195 WeakPolarHBondContact O-CD 3.44Å; S192-L196 WeakPolarHBondContact O-CB 3.49Å; S192-L196 PolarHBondContact O-N 3.46Å; S192-M268 WeakPolarHBondContact OG-CE 3.2Å; S192-M268 PolarHBondContact OG-SD 2.89Å
193F90.7Very high91.1Very high90 Ų9044.5 Ų44.540%0.39523%0.23SC..Iπ-helixtrans-69.9-42.8-166.2-66.6-59.3000113.3F188 A189 L196 A197 V271F188-F193 HydrophobicContact CB-CD2 4.25Å; F188-F193 HydrophobicContact CB-CE2 4.1Å; F188-F193 PolarHBondContact O-N 3.36Å; F188-F193 VanDerWaalsContact O-N 3.1Å; A189-F193 PolarHBondContact O-N 3.34Å; F193-L196 PolarHBondContact O-N 3.02Å; F193-A197 PolarHBondContact O-N 3.49Å; F193-V271 HydrophobicContact CE2-CG1 4.26Å; F193-V271 HydrophobicContact CZ-CG1 4.18Å
194I93.1Very high91.1Very high82 Ų8248.7 Ų48.742%0.42125%0.253SS..Hα-helixtrans-65.5-50.3176-65.4168.6000110W113 A189 L196 A197 F198W113-I194 HydrophobicContact CH2-CG2 4.38Å; W113-I194 HydrophobicContact CZ2-CG2 4.39Å; A189-I194 HydrophobicContact CB-CD1 4.15Å; A189-I194 HydrophobicContact CB-CG1 4.47Å; A189-I194 WeakPolarHBondContact O-CB 3.42Å; A189-I194 VanDerWaalsContact O-CG1 3.25Å; A189-I194 WeakPolarHBondContact O-CG1 3.33Å; A189-I194 PolarHBondContact O-N 3.04Å; I194-L196 VanDerWaalsContact C-N 3.29Å; I194-L196 PolarHBondContact O-N 3.33Å; I194-A197 PolarHBondContact O-N 2.94Å; I194-F198 VanDerWaalsContact O-CB 3.31Å; I194-F198 WeakPolarHBondContact O-CB 3.13Å; I194-F198 PolarHBondContact O-N 3.29Å
195P92.8Very high91.3Very high0 Ų048.2 Ų48.20%025%0.251CS..Hα-helixtrans-52.8-43.1172.4-29.635.1000114T112 I116 I190 S192 F198 I199T112-P195 HydrophobicContact CG2-CB 3.61Å; T112-P195 HydrophobicContact CG2-CG 3.65Å; I116-P195 HydrophobicContact CD1-CB 3.96Å; I116-P195 HydrophobicContact CD1-CG 4.07Å; I116-P195 HydrophobicContact CG1-CB 4.48Å; I190-P195 VanDerWaalsContact O-CD 3.28Å; I190-P195 WeakPolarHBondContact O-CD 3.44Å; I190-P195 WeakPolarHBondContact O-CG 3.18Å; S192-P195 WeakPolarHBondContact O-CD 3.44Å; P195-F198 PolarHBondContact O-N 3.31Å; P195-I199 HydrophobicContact CB-CD1 4.38Å; P195-I199 VanDerWaalsContact O-CB 3.28Å; P195-I199 WeakPolarHBondContact O-CB 3.34Å; P195-I199 WeakPolarHBondContact O-CD1 3.29Å; P195-I199 WeakPolarHBondContact O-CG1 3.49Å; P195-I199 PolarHBondContact O-N 2.84Å
196L89.4Confident91.2Very high49 Ų4941.9 Ų41.926%0.25723%0.226SC..Hα-helixtrans-59.4-56178.5-179.159000111.9S192 F193 I194 F198 I199 L200 F264S192-L196 WeakPolarHBondContact O-CB 3.49Å; S192-L196 PolarHBondContact O-N 3.46Å; F193-L196 PolarHBondContact O-N 3.02Å; I194-L196 VanDerWaalsContact C-N 3.29Å; I194-L196 PolarHBondContact O-N 3.33Å; L196-F198 VanDerWaalsContact C-N 3.28Å; L196-F198 PolarHBondContact O-N 3Å; L196-I199 PolarHBondContact O-N 3.13Å; L196-L200 HydrophobicContact CD1-CD1 3.64Å; L196-L200 HydrophobicContact CD1-CG 3.97Å; L196-L200 HydrophobicContact CG-CD1 3.92Å; L196-L200 WeakPolarHBondContact O-CB 3.13Å; L196-L200 VanDerWaalsContact O-CG 3.28Å; L196-L200 WeakPolarHBondContact O-CG 3.35Å; L196-L200 PolarHBondContact O-N 2.86Å; L196-F264 HydrophobicContact CB-CD1 4.15Å; L196-F264 HydrophobicContact CB-CE1 3.4Å; L196-F264 HydrophobicContact CB-CE2 4.17Å; L196-F264 HydrophobicContact CB-CZ 3.45Å; L196-F264 VanDerWaalsContact CB-CZ 3.45Å; L196-F264 HydrophobicContact CD1-CD1 3.76Å; L196-F264 HydrophobicContact CD1-CD2 3.49Å; L196-F264 VanDerWaalsContact CD1-CD2 3.49Å; L196-F264 HydrophobicContact CD1-CE1 3.73Å; L196-F264 HydrophobicContact CD1-CE2 3.4Å; L196-F264 HydrophobicContact CD1-CG 3.72Å; L196-F264 HydrophobicContact CD1-CZ 3.58Å; L196-F264 HydrophobicContact CD2-CD1 4.43Å; L196-F264 HydrophobicContact CD2-CE1 4.46Å; L196-F264 HydrophobicContact CG-CD1 4.32Å; L196-F264 HydrophobicContact CG-CE1 4.02Å; L196-F264 HydrophobicContact CG-CE2 4.38Å; L196-F264 HydrophobicContact CG-CZ 4.09Å
197A91.6Very high91Very high51 Ų5141.7 Ų41.742%0.42123%0.225SC..Hα-helixtrans-57.8-46.6-178.900000110.3F193 I194 L201F193-A197 PolarHBondContact O-N 3.49Å; I194-A197 PolarHBondContact O-N 2.94Å; A197-L201 WeakPolarHBondContact O-CB 3.23Å; A197-L201 WeakPolarHBondContact O-CD1 3.45Å; A197-L201 WeakPolarHBondContact O-CG 3.45Å; A197-L201 PolarHBondContact O-N 3.36Å
198F92.7Very high91Very high76 Ų7648.2 Ų48.233%0.33325%0.249SC..Hα-helixtrans-64.6-49.1-177.8-164.1-80.9000112.2I116 I120 I194 P195 L196 L200 L201 V202I116-F198 HydrophobicContact CB-CD1 4.39Å; I116-F198 HydrophobicContact CG1-CD1 4.38Å; I116-F198 HydrophobicContact CG2-CD1 3.46Å; I116-F198 VanDerWaalsContact CG2-CD1 3.46Å; I116-F198 HydrophobicContact CG2-CE1 3.5Å; I116-F198 VanDerWaalsContact CG2-CE1 3.5Å; I116-F198 HydrophobicContact CG2-CG 4.17Å; I116-F198 HydrophobicContact CG2-CZ 4.24Å; I120-F198 HydrophobicContact CD1-CE1 3.71Å; I120-F198 HydrophobicContact CD1-CZ 3.55Å; I120-F198 HydrophobicContact CG1-CE1 3.4Å; I120-F198 HydrophobicContact CG1-CZ 3.55Å; I194-F198 VanDerWaalsContact O-CB 3.31Å; I194-F198 WeakPolarHBondContact O-CB 3.13Å; I194-F198 PolarHBondContact O-N 3.29Å; P195-F198 PolarHBondContact O-N 3.31Å; L196-F198 VanDerWaalsContact C-N 3.28Å; L196-F198 PolarHBondContact O-N 3Å; F198-L200 PolarHBondContact O-N 3.44Å; F198-L201 PolarHBondContact O-N 2.88Å; F198-V202 HydrophobicContact CD1-CG2 3.8Å; F198-V202 HydrophobicContact CE1-CG2 3.42Å; F198-V202 VanDerWaalsContact CE1-CG2 3.42Å; F198-V202 HydrophobicContact CZ-CG2 3.99Å; F198-V202 WeakPolarHBondContact O-CB 3.17Å; F198-V202 VanDerWaalsContact O-CG2 3.31Å; F198-V202 WeakPolarHBondContact O-CG2 3.33Å; F198-V202 PolarHBondContact O-N 3.43Å
199I90.5Very high90.8Very high0 Ų050.8 Ų50.80%026%0.259CS..Hα-helixtrans-65.6-40.9-177.6-65164.7000111.1I115 I116 P195 L196 V202 N203 T260 F264I115-I199 HydrophobicContact CB-CD1 4.42Å; I115-I199 HydrophobicContact CG2-CD1 3.85Å; I115-I199 HydrophobicContact CG2-CG1 4.49Å; I116-I199 HydrophobicContact CG1-CD1 4.24Å; I116-I199 HydrophobicContact CG1-CG1 3.98Å; P195-I199 HydrophobicContact CB-CD1 4.38Å; P195-I199 VanDerWaalsContact O-CB 3.28Å; P195-I199 WeakPolarHBondContact O-CB 3.34Å; P195-I199 WeakPolarHBondContact O-CD1 3.29Å; P195-I199 WeakPolarHBondContact O-CG1 3.49Å; P195-I199 PolarHBondContact O-N 2.84Å; L196-I199 PolarHBondContact O-N 3.13Å; I199-V202 PolarHBondContact O-N 3.14Å; I199-N203 WeakPolarHBondContact CG2-ND2 3.32Å; I199-N203 VanDerWaalsContact O-CB 3.32Å; I199-N203 WeakPolarHBondContact O-CB 3.3Å; I199-N203 PolarHBondContact O-N 3.1Å; I199-N203 PolarHBondContact O-ND2 3.36Å; I199-T260 HydrophobicContact CB-CG2 4.14Å; I199-T260 HydrophobicContact CD1-CG2 4.45Å; I199-T260 HydrophobicContact CG2-CG2 3.32Å; I199-T260 VanDerWaalsContact CG2-OG1 3.24Å; I199-T260 WeakPolarHBondContact CG2-OG1 2.99Å; I199-F264 HydrophobicContact CD1-CE2 4.39Å; I199-F264 HydrophobicContact CD1-CZ 4.42Å
200L89.1Confident90.4Very high87 Ų8750.9 Ų50.946%0.45526%0.255SS..Hα-helixtrans-61-50.4175.8-73.6176000111.3L196 F198 V202 N203 I204L196-L200 HydrophobicContact CD1-CD1 3.64Å; L196-L200 HydrophobicContact CD1-CG 3.97Å; L196-L200 HydrophobicContact CG-CD1 3.92Å; L196-L200 WeakPolarHBondContact O-CB 3.13Å; L196-L200 VanDerWaalsContact O-CG 3.28Å; L196-L200 WeakPolarHBondContact O-CG 3.35Å; L196-L200 PolarHBondContact O-N 2.86Å; F198-L200 PolarHBondContact O-N 3.44Å; L200-V202 VanDerWaalsContact C-N 3.32Å; L200-V202 PolarHBondContact O-N 2.95Å; L200-N203 PolarHBondContact O-N 2.98Å; L200-I204 WeakPolarHBondContact O-CB 3.42Å; L200-I204 WeakPolarHBondContact O-CD1 3.5Å; L200-I204 WeakPolarHBondContact O-CG1 3.45Å; L200-I204 PolarHBondContact O-N 3.44Å
201L92.8Very high90Very high120 Ų12056.8 Ų56.863%0.62828%0.279SS*.Hα-helixtrans-59-44.1179.7-71.5171.4000111.7A197 F198 S205A197-L201 WeakPolarHBondContact O-CB 3.23Å; A197-L201 WeakPolarHBondContact O-CD1 3.45Å; A197-L201 WeakPolarHBondContact O-CG 3.45Å; A197-L201 PolarHBondContact O-N 3.36Å; F198-L201 PolarHBondContact O-N 2.88Å; L201-S205 VanDerWaalsContact O-CB 3.28Å; L201-S205 WeakPolarHBondContact O-CB 3.37Å; L201-S205 PolarHBondContact O-N 3.45Å
202V92Very high89.7Confident18 Ų1859.6 Ų59.611%0.10930%0.297CS..Hα-helixtrans-69.1-42.6-179.61750000112.1C119 A123 F198 I199 L200 S205 I206C119-V202 HydrophobicContact CB-CB 4.2Å; C119-V202 HydrophobicContact CB-CG1 3.71Å; C119-V202 WeakPolarHBondContact O-CG1 3.36Å; A123-V202 HydrophobicContact CB-CG1 3.73Å; F198-V202 HydrophobicContact CD1-CG2 3.8Å; F198-V202 HydrophobicContact CE1-CG2 3.42Å; F198-V202 VanDerWaalsContact CE1-CG2 3.42Å; F198-V202 HydrophobicContact CZ-CG2 3.99Å; F198-V202 WeakPolarHBondContact O-CB 3.17Å; F198-V202 VanDerWaalsContact O-CG2 3.31Å; F198-V202 WeakPolarHBondContact O-CG2 3.33Å; F198-V202 PolarHBondContact O-N 3.43Å; I199-V202 PolarHBondContact O-N 3.14Å; L200-V202 VanDerWaalsContact C-N 3.32Å; L200-V202 PolarHBondContact O-N 2.95Å; V202-S205 WeakPolarHBondContact O-CB 3.3Å; V202-S205 PolarHBondContact O-N 3.47Å; V202-I206 HydrophobicContact CG1-CD1 4Å; V202-I206 WeakPolarHBondContact O-CG1 3.23Å; V202-I206 PolarHBondContact O-N 3.11Å
203N88.5Confident89.1Confident13 Ų1362.5 Ų62.57%0.0732%0.315CS..Hα-helixtrans-67.5-39177.8-77.5-37.6000112.3I199 L200 S205 I206 I207 L253I199-N203 WeakPolarHBondContact CG2-ND2 3.32Å; I199-N203 VanDerWaalsContact O-CB 3.32Å; I199-N203 WeakPolarHBondContact O-CB 3.3Å; I199-N203 PolarHBondContact O-N 3.1Å; I199-N203 PolarHBondContact O-ND2 3.36Å; L200-N203 PolarHBondContact O-N 2.98Å; N203-S205 VanDerWaalsContact C-N 3.3Å; N203-S205 PolarHBondContact O-N 3.19Å; N203-I206 PolarHBondContact O-N 3.42Å; N203-I207 VanDerWaalsContact O-CG1 3.28Å; N203-I207 WeakPolarHBondContact O-CG1 3.06Å; N203-I207 PolarHBondContact O-N 2.98Å; N203-L253 VanDerWaalsContact OD1-CD1 3.26Å; N203-L253 WeakPolarHBondContact OD1-CD1 3.27Å
204I90.6Very high88.3Confident109 Ų10961 Ų6156%0.55931%0.311SS*.Hα-helixtrans-58.6-46.3172.4-70.2165.1000109.9L200 I206 I207 W208L200-I204 WeakPolarHBondContact O-CB 3.42Å; L200-I204 WeakPolarHBondContact O-CD1 3.5Å; L200-I204 WeakPolarHBondContact O-CG1 3.45Å; L200-I204 PolarHBondContact O-N 3.44Å; I204-I206 PolarHBondContact O-N 3.48Å; I204-I207 PolarHBondContact O-N 2.95Å; I204-W208 WeakPolarHBondContact O-CB 3.39Å; I204-W208 PolarHBondContact O-N 3.33Å
205S91.2Very high87.3Confident36 Ų3660.9 Ų60.925%0.25231%0.314SS..Hα-helixtrans-59.9-42.8177.6173.70000112.8W127 L201 V202 N203 R209W127-S205 VanDerWaalsContact CE2-OG 3.23Å; W127-S205 WeakPolarHBondContact CZ2-OG 3.48Å; W127-S205 PolarHBondContact NE1-OG 3.16Å; L201-S205 VanDerWaalsContact O-CB 3.28Å; L201-S205 WeakPolarHBondContact O-CB 3.37Å; L201-S205 PolarHBondContact O-N 3.45Å; V202-S205 WeakPolarHBondContact O-CB 3.3Å; V202-S205 PolarHBondContact O-N 3.47Å; N203-S205 VanDerWaalsContact C-N 3.3Å; N203-S205 PolarHBondContact O-N 3.19Å; S205-R209 WeakPolarHBondContact O-CB 3.19Å; S205-R209 PolarHBondContact O-N 3.37Å
206I88Confident86.1Confident2 Ų264 Ų641%0.0134%0.336CS..Hα-helixtrans-62.7-49.8175.5-68.7164.4000110.9R122 A123 V126 V202 N203 I204 W208 R209 M210 L253R122-I206 HydrophobicContact CB-CD1 3.78Å; A123-I206 HydrophobicContact CB-CD1 4.33Å; A123-I206 HydrophobicContact CB-CG1 4.12Å; V126-I206 HydrophobicContact CG2-CG2 4.19Å; V202-I206 HydrophobicContact CG1-CD1 4Å; V202-I206 WeakPolarHBondContact O-CG1 3.23Å; V202-I206 PolarHBondContact O-N 3.11Å; N203-I206 PolarHBondContact O-N 3.42Å; I204-I206 PolarHBondContact O-N 3.48Å; I206-W208 VanDerWaalsContact C-N 3.34Å; I206-W208 PolarHBondContact O-N 2.93Å; I206-R209 PolarHBondContact O-N 3.48Å; I206-M210 HydrophobicContact CG2-CG 4.42Å; I206-M210 HydrophobicContact CG2-SD 3.92Å; I206-M210 WeakPolarHBondContact O-CG 3.27Å; I206-M210 PolarHBondContact O-N 2.94Å; I206-L253 HydrophobicContact CB-CD1 4.37Å; I206-L253 HydrophobicContact CD1-CD1 4.11Å; I206-L253 HydrophobicContact CG2-CD1 3.96Å; I206-L253 HydrophobicContact CG2-CD2 3.73Å; I206-L253 HydrophobicContact CG2-CG 4.4Å
207I88.6Confident85Confident75 Ų7564.7 Ų64.739%0.38534%0.342SS..Hα-helixtrans-60.7-45.4-179.1-68.3165.6000110.5N203 I204 R209 M210 K211 L253N203-I207 VanDerWaalsContact O-CG1 3.28Å; N203-I207 WeakPolarHBondContact O-CG1 3.06Å; N203-I207 PolarHBondContact O-N 2.98Å; I204-I207 PolarHBondContact O-N 2.95Å; I207-R209 PolarHBondContact O-N 2.97Å; I207-M210 PolarHBondContact O-N 3.43Å; I207-K211 HydrophobicContact CG2-CD 4.3Å; I207-K211 WeakPolarHBondContact O-CG 3.31Å; I207-K211 PolarHBondContact O-N 3.32Å; I207-L253 HydrophobicContact CG1-CD2 4.36Å
208W90.3Very high83.7Confident145 Ų14569.2 Ų69.255%0.54935%0.352SS..Hα-helixtrans-57.7-49.7177.3179.778.7000111.2W127 I204 I206 M210 K211 T212W127-W208 AromaticContact CH2-CE3 3.66Å; W127-W208 HydrophobicContact CH2-CE3 3.66Å; W127-W208 HydrophobicContact CH2-CH2 4.27Å; W127-W208 AromaticContact CH2-CZ3 3.2Å; W127-W208 HydrophobicContact CH2-CZ3 3.2Å; W127-W208 AromaticContact CZ2-CE3 3.7Å; W127-W208 HydrophobicContact CZ2-CE3 3.7Å; W127-W208 AromaticContact CZ2-CZ3 3.76Å; W127-W208 HydrophobicContact CZ2-CZ3 3.76Å; W127-W208 AromaticContact CZ3-CZ3 3.93Å; W127-W208 HydrophobicContact CZ3-CZ3 3.93Å; I204-W208 WeakPolarHBondContact O-CB 3.39Å; I204-W208 PolarHBondContact O-N 3.33Å; I206-W208 VanDerWaalsContact C-N 3.34Å; I206-W208 PolarHBondContact O-N 2.93Å; W208-M210 PolarHBondContact O-N 2.91Å; W208-K211 PolarHBondContact O-N 2.89Å; W208-T212 PolarHBondContact O-N 3.43Å; W208-T212 PolarHBondContact O-OG1 3.19Å; W208-T212 VanDerWaalsContact O-OG1 3.08Å
209R86.8Confident82.2Confident59 Ų5972 Ų7222%0.22337%0.366CS..Hα-helixtrans-64.9-37.2-179.3-177.854.9-178.1-100.82.2113.1V126 W127 S205 I206 I207 T213V126-R209 HydrophobicContact CG1-CB 3.82Å; V126-R209 HydrophobicContact CG1-CG 3.58Å; W127-R209 HydrophobicContact CD2-CB 4.47Å; W127-R209 HydrophobicContact CD2-CG 4.29Å; W127-R209 HydrophobicContact CG-CG 4.47Å; W127-R209 HydrophobicContact CZ2-CB 4.29Å; W127-R209 PolarHBondContact O-NH1 2.89Å; S205-R209 WeakPolarHBondContact O-CB 3.19Å; S205-R209 PolarHBondContact O-N 3.37Å; I206-R209 PolarHBondContact O-N 3.48Å; I207-R209 PolarHBondContact O-N 2.97Å; R209-T213 WeakPolarHBondContact O-CB 3.21Å; R209-T213 PolarHBondContact O-N 3.49Å; R209-T213 VanDerWaalsContact O-N 3.09Å; R209-T213 PolarHBondContact O-OG1 3.31Å
210M83.9Confident80.8Confident33 Ų3375.8 Ų75.816%0.16339%0.389CS..Hα-helixtrans-63.6-44.5175.2-72.2179.769.800111.3V126 I206 I207 W208 T212 T213 N214 E246 A250 L253V126-M210 HydrophobicContact CG1-CG 4.37Å; I206-M210 HydrophobicContact CG2-CG 4.42Å; I206-M210 HydrophobicContact CG2-SD 3.92Å; I206-M210 WeakPolarHBondContact O-CG 3.27Å; I206-M210 PolarHBondContact O-N 2.94Å; I207-M210 PolarHBondContact O-N 3.43Å; W208-M210 PolarHBondContact O-N 2.91Å; M210-T212 PolarHBondContact O-N 3.3Å; M210-T213 PolarHBondContact O-N 3.09Å; M210-N214 VanDerWaalsContact O-CG 3.27Å; M210-N214 PolarHBondContact O-N 2.89Å; M210-N214 VanDerWaalsContact O-N 3.16Å; M210-E246 HydrophobicContact CE-CG 3.95Å; M210-A250 HydrophobicContact CE-CB 4.21Å; M210-L253 HydrophobicContact SD-CD2 4.03Å
211K85.5Confident79.3Confident145 Ų14577.7 Ų77.763%0.6340%0.396SS*.Hα-helixtrans-61-46.7176.9-73.1-179.5178.4-1770112I207 W208 T213 N214 V215I207-K211 HydrophobicContact CG2-CD 4.3Å; I207-K211 WeakPolarHBondContact O-CG 3.31Å; I207-K211 PolarHBondContact O-N 3.32Å; W208-K211 PolarHBondContact O-N 2.89Å; K211-T213 PolarHBondContact O-N 3.41Å; K211-N214 PolarHBondContact O-N 3.47Å; K211-V215 WeakPolarHBondContact O-CG2 3.41Å; K211-V215 PolarHBondContact O-N 2.84Å
212T85.3Confident77.7Confident61 Ų6179 Ų7937%0.37440%0.403SS..Hα-helixtrans-62.8-41.7-179.8-53.10000112.2W208 M210 N214 V215 S216W208-T212 PolarHBondContact O-N 3.43Å; W208-T212 PolarHBondContact O-OG1 3.19Å; W208-T212 VanDerWaalsContact O-OG1 3.08Å; M210-T212 PolarHBondContact O-N 3.3Å; T212-N214 VanDerWaalsContact C-N 3.34Å; T212-N214 PolarHBondContact O-N 3.02Å; T212-V215 PolarHBondContact O-N 3.24Å; T212-S216 PolarHBondContact O-N 2.97Å; T212-S216 VanDerWaalsContact O-N 3.12Å; T212-S216 PolarHBondContact O-OG 3.46Å
213T78.2Confident76.1Confident62 Ų6282 Ų8238%0.3843%0.426SS..Hα-helixtrans-67.5-35.1-179.3-510000112.1R209 M210 K211 S216 T217R209-T213 WeakPolarHBondContact O-CB 3.21Å; R209-T213 PolarHBondContact O-N 3.49Å; R209-T213 VanDerWaalsContact O-N 3.09Å; R209-T213 PolarHBondContact O-OG1 3.31Å; M210-T213 PolarHBondContact O-N 3.09Å; K211-T213 PolarHBondContact O-N 3.41Å; T213-S216 PolarHBondContact O-N 2.89Å; T213-T217 PolarHBondContact O-N 3.02Å; T213-T217 PolarHBondContact O-OG1 2.87Å
214N73.7Confident74.6Confident58 Ų5886.1 Ų86.131%0.3145%0.447SS..Hα-helixtrans-70.5-34.8177.9-70.2-6.6000112.2M210 K211 T212 K218 E246M210-N214 VanDerWaalsContact O-CG 3.27Å; M210-N214 PolarHBondContact O-N 2.89Å; M210-N214 VanDerWaalsContact O-N 3.16Å; K211-N214 PolarHBondContact O-N 3.47Å; T212-N214 VanDerWaalsContact C-N 3.34Å; T212-N214 PolarHBondContact O-N 3.02Å; N214-K218 WeakPolarHBondContact O-CG 3.28Å; N214-K218 PolarHBondContact O-N 3.35Å; N214-E246 PolarHBondContact ND2-OE1 3.25Å; N214-E246 PolarHBondContact OD1-OE1 3.31Å
215V72.3Confident73.1Confident80 Ų8088 Ų8849%0.48546%0.456SS..Hα-helixtrans-65.4-48.7172.9173.20000110.6K211 T212 T217 K218 H219K211-V215 WeakPolarHBondContact O-CG2 3.41Å; K211-V215 PolarHBondContact O-N 2.84Å; T212-V215 PolarHBondContact O-N 3.24Å; V215-T217 VanDerWaalsContact C-N 3.32Å; V215-T217 PolarHBondContact O-N 3.36Å; V215-K218 PolarHBondContact O-N 3.06Å; V215-H219 PolarHBondContact O-CD2 2.93Å; V215-H219 VanDerWaalsContact O-CD2 3.22Å; V215-H219 PolarHBondContact O-N 3.44Å
216S67Low71.3Confident66 Ų6692.3 Ų92.346%0.46248%0.483SS..Hα-helixtrans-60.2-40.1178.8-57.60000112.8T212 T213 K218 H219 T220T212-S216 PolarHBondContact O-N 2.97Å; T212-S216 VanDerWaalsContact O-N 3.12Å; T212-S216 PolarHBondContact O-OG 3.46Å; T213-S216 PolarHBondContact O-N 2.89Å; S216-K218 PolarHBondContact O-N 2.85Å; S216-H219 PolarHBondContact O-N 3.35Å; S216-T220 PolarHBondContact O-N 3Å; S216-T220 PolarHBondContact O-OG1 3.33Å
217T66.6Low69.6Low63 Ų63102.5 Ų102.539%0.38752%0.522SS..Hα-helixtrans-66.2-38179.9-530000112T213 V215 T220 Q221T213-T217 PolarHBondContact O-N 3.02Å; T213-T217 PolarHBondContact O-OG1 2.87Å; V215-T217 VanDerWaalsContact C-N 3.32Å; V215-T217 PolarHBondContact O-N 3.36Å; T217-T220 PolarHBondContact O-N 3.31Å; T217-Q221 PolarHBondContact O-N 3.44Å
218K63.9Low68Low146 Ų146105.6 Ų105.664%0.63554%0.535SS*.Hα-helixtrans-64.5-39.9175.5-74.5179.8179.3-1730112.3N214 V215 S216 Q221 N222N214-K218 WeakPolarHBondContact O-CG 3.28Å; N214-K218 PolarHBondContact O-N 3.35Å; V215-K218 PolarHBondContact O-N 3.06Å; S216-K218 PolarHBondContact O-N 2.85Å; K218-Q221 PolarHBondContact O-N 3.3Å; K218-N222 PolarHBondContact O-N 3.5Å
219H62.6Low66.7Low134 Ų134104.2 Ų104.262%0.6254%0.542SS*.Hα-helixtrans-64.7-39.7176.2-76.5-67.2000112.5V215 S216V215-H219 PolarHBondContact O-CD2 2.93Å; V215-H219 VanDerWaalsContact O-CD2 3.22Å; V215-H219 PolarHBondContact O-N 3.44Å; S216-H219 PolarHBondContact O-N 3.35Å
220T60.4Low65.5Low80 Ų80108.5 Ų108.549%0.49157%0.569SS.*Hα-helixtrans-70.6-34.7177.6-50.20000112.8S216 T217 N222 S223 I224S216-T220 PolarHBondContact O-N 3Å; S216-T220 PolarHBondContact O-OG1 3.33Å; T217-T220 PolarHBondContact O-N 3.31Å; T220-N222 VanDerWaalsContact C-N 3.34Å; T220-N222 PolarHBondContact O-N 3.4Å; T220-S223 PolarHBondContact O-N 2.85Å; T220-S223 PolarHBondContact O-OG 3.18Å; T220-S223 VanDerWaalsContact O-OG 3.12Å; T220-I224 HydrophobicContact CG2-CD1 4.1Å; T220-I224 WeakPolarHBondContact O-CG1 3.23Å
221Q57.2Low64.6Low126 Ų126111.5 Ų111.559%0.58958%0.584SS**Hα-helixtrans-66.9-34.3176.9-80.3-177.5-30.900112.9T217 K218 S223T217-Q221 PolarHBondContact O-N 3.44Å; K218-Q221 PolarHBondContact O-N 3.3Å; Q221-S223 VanDerWaalsContact C-N 3.29Å; Q221-S223 PolarHBondContact O-N 3.02Å
222N58.3Low63.9Low147 Ų147107.4 Ų107.479%0.78657%0.574SS**Hα-helixtrans-73.8-17.4178.3-74.2-0.8000113.7K218 T220K218-N222 PolarHBondContact O-N 3.5Å; T220-N222 VanDerWaalsContact C-N 3.34Å; T220-N222 PolarHBondContact O-N 3.4Å
223S59.8Low63.5Low83 Ų83109.8 Ų109.858%0.5859%0.585SS**Hα-helixtrans-95.7-10.2-17865.80000114.8T220 Q221 I225T220-S223 PolarHBondContact O-N 2.85Å; T220-S223 PolarHBondContact O-OG 3.18Å; T220-S223 VanDerWaalsContact O-OG 3.12Å; Q221-S223 VanDerWaalsContact C-N 3.29Å; Q221-S223 PolarHBondContact O-N 3.02Å; S223-I225 PolarHBondContact O-N 2.79Å
224I55.9Low63.5Low99 Ų99109.6 Ų109.651%0.50859%0.586SS.*  trans-91.589.6-178.7-58.3168000109.6T220 L235T220-I224 HydrophobicContact CG2-CD1 4.1Å; T220-I224 WeakPolarHBondContact O-CG1 3.23Å; I224-L235 HydrophobicContact CD1-CD2 4.29Å
225I59.9Low63.7Low147 Ų147110.7 Ų110.775%0.75459%0.591SS**  trans-58.4135.4160.5-62171.4000107.7S223 R227S223-I225 PolarHBondContact O-N 2.79Å; I225-R227 PolarHBondContact O-N 3.25Å
226P53.5Low64Low128 Ų128113.3 Ų113.383%0.83160%0.596SS**  trans-72.897.8-164.328.8-33.6000111.1
227R51.8Low64.5Low215 Ų215115.3 Ų115.381%0.81160%0.598SS**  trans-115.5114.4167.6-146.1175.7-174.7173.71.8109.7I225I225-R227 PolarHBondContact O-N 3.25Å
228E56.1Low65Low141 Ų141117.6 Ų117.666%0.65961%0.607SS**  trans70.9126.1161.2-73.9171.3162.600121.2L230 I231 S232E228-L230 PolarHBondContact O-N 3.05Å; E228-I231 PolarHBondContact O-N 3.09Å; E228-S232 PolarHBondContact O-N 3.26Å
229T62.6Low65.6Low115 Ų115112.9 Ų112.971%0.70659%0.592SS**Hα-helixtrans-67-19.1-170.939.90000116.1S232T229-S232 VanDerWaalsContact C-OG 3.29Å; T229-S232 WeakPolarHBondContact CA-OG 3.45Å; T229-S232 PolarHBondContact O-OG 3.19Å
230L61.8Low66.4Low149 Ų149111.6 Ų111.678%0.7859%0.589SS**Hα-helixtrans-84.5-38.5178.3-90.2156.1000112.3E228 S232E228-L230 PolarHBondContact O-N 3.05Å; L230-S232 VanDerWaalsContact C-N 3.29Å
231I64.8Low67.2Low96 Ų96113.8 Ų113.849%0.49259%0.592SS.*Hα-helixtrans-70-33.2176-68.3175000109.6E228 D233 S234 L235E228-I231 PolarHBondContact O-N 3.09Å; I231-D233 VanDerWaalsContact C-N 3.34Å; I231-D233 PolarHBondContact O-N 3.18Å; I231-S234 PolarHBondContact O-N 3.41Å; I231-S234 PolarHBondContact O-OG 3.1Å; I231-L235 HydrophobicContact CB-CD1 4.5Å; I231-L235 HydrophobicContact CG2-CD1 3.24Å; I231-L235 WeakPolarHBondContact O-CD1 3.36Å; I231-L235 PolarHBondContact O-N 3.02Å
232S70.4Confident68Low60 Ų60110.4 Ų110.442%0.4258%0.582SS.*Hα-helixtrans-60-37.5178.162.20000114.2E228 T229 L230 K236E228-S232 PolarHBondContact O-N 3.26Å; T229-S232 VanDerWaalsContact C-OG 3.29Å; T229-S232 WeakPolarHBondContact CA-OG 3.45Å; T229-S232 PolarHBondContact O-OG 3.19Å; L230-S232 VanDerWaalsContact C-N 3.29Å; S232-K236 WeakPolarHBondContact O-CB 2.97Å; S232-K236 PolarHBondContact O-N 2.73Å
233D77.7Confident68.9Low111 Ų111105.9 Ų105.959%0.59456%0.56SS**Hα-helixtrans-70.6-43-178.4-82.6-10.5000112.3I231 K236 Q237I231-D233 VanDerWaalsContact C-N 3.34Å; I231-D233 PolarHBondContact O-N 3.18Å; D233-K236 PolarHBondContact O-N 3.17Å; D233-Q237 WeakPolarHBondContact O-CB 3.44Å; D233-Q237 PolarHBondContact O-N 2.98Å
234S78Confident69.8Low58 Ų58104.5 Ų104.541%0.40655%0.553SS.*Hα-helixtrans-60.9-47.8174.570.60000111.6I231 Q237 I238I231-S234 PolarHBondContact O-N 3.41Å; I231-S234 PolarHBondContact O-OG 3.1Å; S234-Q237 PolarHBondContact O-N 2.84Å; S234-I238 VanDerWaalsContact O-CG1 3.27Å; S234-I238 WeakPolarHBondContact O-CG1 3.05Å; S234-I238 PolarHBondContact O-N 3.33Å
235L76.7Confident70.7Confident81 Ų81102.9 Ų102.942%0.42454%0.541SS..Hα-helixtrans-64.4-40.2175.5-89.797000112.6I224 I231 Q237 I238 S239I224-L235 HydrophobicContact CD1-CD2 4.29Å; I231-L235 HydrophobicContact CB-CD1 4.5Å; I231-L235 HydrophobicContact CG2-CD1 3.24Å; I231-L235 WeakPolarHBondContact O-CD1 3.36Å; I231-L235 PolarHBondContact O-N 3.02Å; L235-Q237 VanDerWaalsContact C-N 3.34Å; L235-I238 PolarHBondContact O-N 3.44Å; L235-S239 VanDerWaalsContact O-CB 3.31Å; L235-S239 WeakPolarHBondContact O-CB 3.45Å; L235-S239 PolarHBondContact O-N 3.12Å
236K78.9Confident71.4Confident135 Ų13599.1 Ų99.159%0.58752%0.52SS*.Hα-helixtrans-63.2-41.5176.2-171.2175.7-175.8-179.10110.7S232 D233 S239 L240S232-K236 WeakPolarHBondContact O-CB 2.97Å; S232-K236 PolarHBondContact O-N 2.73Å; D233-K236 PolarHBondContact O-N 3.17Å; K236-S239 PolarHBondContact O-N 2.76Å; K236-L240 HydrophobicContact CG-CD1 4.27Å; K236-L240 WeakPolarHBondContact O-CB 3.5Å; K236-L240 VanDerWaalsContact O-CG 3.25Å; K236-L240 WeakPolarHBondContact O-CG 3.48Å; K236-L240 PolarHBondContact O-N 3.34Å
237Q77.5Confident72.8Confident108 Ų10898.7 Ų98.751%0.50551%0.507SS..Hα-helixtrans-66.1-39.6175.5-159.2-165.431.400112D233 S234 L235 K241D233-Q237 WeakPolarHBondContact O-CB 3.44Å; D233-Q237 PolarHBondContact O-N 2.98Å; S234-Q237 PolarHBondContact O-N 2.84Å; L235-Q237 VanDerWaalsContact C-N 3.34Å; Q237-K241 VanDerWaalsContact CD-NZ 3.32Å; Q237-K241 HydrophobicContact CG-CD 4.5Å; Q237-K241 WeakPolarHBondContact O-CB 3.16Å; Q237-K241 VanDerWaalsContact O-CG 3.28Å; Q237-K241 WeakPolarHBondContact O-CG 3.41Å; Q237-K241 PolarHBondContact O-N 3.22Å
238I76.2Confident74.1Confident110 Ų11091.7 Ų91.756%0.56448%0.481SS*.Hα-helixtrans-63.8-43.4174.6-69.4165.1000110.5S234 L235 K241 S242S234-I238 VanDerWaalsContact O-CG1 3.27Å; S234-I238 WeakPolarHBondContact O-CG1 3.05Å; S234-I238 PolarHBondContact O-N 3.33Å; L235-I238 PolarHBondContact O-N 3.44Å; I238-K241 PolarHBondContact O-N 2.89Å; I238-S242 PolarHBondContact O-N 2.98Å
239S76.7Confident75.2Confident48 Ų4885.5 Ų85.534%0.33645%0.453SS..Hα-helixtrans-65.4-41.7176.7-179.70000112.6L235 K236 K241 S242 T243L235-S239 VanDerWaalsContact O-CB 3.31Å; L235-S239 WeakPolarHBondContact O-CB 3.45Å; L235-S239 PolarHBondContact O-N 3.12Å; K236-S239 PolarHBondContact O-N 2.76Å; S239-K241 VanDerWaalsContact C-N 3.33Å; S239-K241 PolarHBondContact O-N 2.94Å; S239-S242 WeakPolarHBondContact CA-OG 3.45Å; S239-S242 PolarHBondContact O-N 3.45Å; S239-S242 PolarHBondContact O-OG 3.48Å; S239-T243 WeakPolarHBondContact O-CB 3.12Å; S239-T243 VanDerWaalsContact O-CG2 3.31Å; S239-T243 WeakPolarHBondContact O-CG2 3.24Å; S239-T243 PolarHBondContact O-N 2.96Å; S239-T243 PolarHBondContact O-OG1 3.39Å
240L79.3Confident76.2Confident106 Ų10681.9 Ų81.956%0.55544%0.435SS*.Hα-helixtrans-63.8-39.1174.1-73.2169.5000111.6K236 T243 A244K236-L240 HydrophobicContact CG-CD1 4.27Å; K236-L240 WeakPolarHBondContact O-CB 3.5Å; K236-L240 VanDerWaalsContact O-CG 3.25Å; K236-L240 WeakPolarHBondContact O-CG 3.48Å; K236-L240 PolarHBondContact O-N 3.34Å; L240-T243 WeakPolarHBondContact CA-OG1 3.18Å; L240-T243 PolarHBondContact O-OG1 2.95Å; L240-A244 VanDerWaalsContact O-CB 3.27Å; L240-A244 WeakPolarHBondContact O-CB 3.22Å; L240-A244 PolarHBondContact O-N 3.27Å
241K77.7Confident77.4Confident127 Ų12778.3 Ų78.355%0.55241%0.411SS*.Hα-helixtrans-68.1-38.6175.1-74.3170.1-177.7166.20111.9Q237 I238 S239 R245Q237-K241 VanDerWaalsContact CD-NZ 3.32Å; Q237-K241 HydrophobicContact CG-CD 4.5Å; Q237-K241 WeakPolarHBondContact O-CB 3.16Å; Q237-K241 VanDerWaalsContact O-CG 3.28Å; Q237-K241 WeakPolarHBondContact O-CG 3.41Å; Q237-K241 PolarHBondContact O-N 3.22Å; I238-K241 PolarHBondContact O-N 2.89Å; S239-K241 VanDerWaalsContact C-N 3.33Å; S239-K241 PolarHBondContact O-N 2.94Å; K241-R245 WeakPolarHBondContact O-CB 3.43Å; K241-R245 PolarHBondContact O-N 3.02Å; K241-R245 VanDerWaalsContact O-N 3.16Å
242S74.5Confident78.3Confident54 Ų5475 Ų7538%0.37840%0.395SS..Hα-helixtrans-68.8-44.2178.171.60000111.7I238 S239 R245 E246I238-S242 PolarHBondContact O-N 2.98Å; S239-S242 WeakPolarHBondContact CA-OG 3.45Å; S239-S242 PolarHBondContact O-N 3.45Å; S239-S242 PolarHBondContact O-OG 3.48Å; S242-R245 WeakPolarHBondContact O-CB 3.5Å; S242-R245 PolarHBondContact O-N 2.81Å; S242-E246 PolarHBondContact O-N 3.43Å
243T77.9Confident79.1Confident53 Ų5373 Ų7333%0.32538%0.38SS..Hα-helixtrans-65.4-45.3177.750.40000112.2S239 L240 R245 E246 Q247S239-T243 WeakPolarHBondContact O-CB 3.12Å; S239-T243 VanDerWaalsContact O-CG2 3.31Å; S239-T243 WeakPolarHBondContact O-CG2 3.24Å; S239-T243 PolarHBondContact O-N 2.96Å; S239-T243 PolarHBondContact O-OG1 3.39Å; L240-T243 WeakPolarHBondContact CA-OG1 3.18Å; L240-T243 PolarHBondContact O-OG1 2.95Å; T243-R245 VanDerWaalsContact C-N 3.27Å; T243-R245 PolarHBondContact O-N 2.82Å; T243-E246 PolarHBondContact O-N 3.34Å; T243-Q247 WeakPolarHBondContact O-CB 3.42Å; T243-Q247 WeakPolarHBondContact O-CG 3.18Å; T243-Q247 PolarHBondContact O-N 3.13Å
244A78.9Confident79.7Confident53 Ų5373.6 Ų73.644%0.43837%0.374SS..Hα-helixtrans-60.7-37.4175.700000112.2L240 R248L240-A244 VanDerWaalsContact O-CB 3.27Å; L240-A244 WeakPolarHBondContact O-CB 3.22Å; L240-A244 PolarHBondContact O-N 3.27Å; A244-R248 WeakPolarHBondContact O-CB 3.13Å; A244-R248 PolarHBondContact O-N 3.23Å
245R73.9Confident80.4Confident66 Ų6671.2 Ų71.225%0.24936%0.357CS..Hα-helixtrans-66.4-46.1173.4171.1178.4156.3-131.8-9.4111.6C125 V126 P129 K241 S242 T243 Q247 R248 S249C125-R245 PolarHBondContact O-NE 3.03Å; C125-R245 PolarHBondContact O-NH2 3.35Å; V126-R245 PolarHBondContact O-NH2 2.91Å; P129-R245 VanDerWaalsContact CA-NH1 3.33Å; K241-R245 WeakPolarHBondContact O-CB 3.43Å; K241-R245 PolarHBondContact O-N 3.02Å; K241-R245 VanDerWaalsContact O-N 3.16Å; S242-R245 WeakPolarHBondContact O-CB 3.5Å; S242-R245 PolarHBondContact O-N 2.81Å; T243-R245 VanDerWaalsContact C-N 3.27Å; T243-R245 PolarHBondContact O-N 2.82Å; R245-Q247 VanDerWaalsContact C-N 3.35Å; R245-Q247 PolarHBondContact O-N 3.47Å; R245-R248 PolarHBondContact O-N 3.38Å; R245-S249 PolarHBondContact O-N 3.01Å; R245-S249 PolarHBondContact O-OG 3.19Å
246E75.5Confident81Confident68 Ų6867.5 Ų67.532%0.31834%0.338SS..Hα-helixtrans-60.2-46.1178.2-170.6-178.3175.600110.9M210 N214 S242 T243 R248 S249 A250M210-E246 HydrophobicContact CE-CG 3.95Å; N214-E246 PolarHBondContact ND2-OE1 3.25Å; N214-E246 PolarHBondContact OD1-OE1 3.31Å; S242-E246 PolarHBondContact O-N 3.43Å; T243-E246 PolarHBondContact O-N 3.34Å; E246-R248 VanDerWaalsContact C-N 3.32Å; E246-R248 PolarHBondContact O-N 3.31Å; E246-S249 PolarHBondContact O-N 3.3Å; E246-A250 WeakPolarHBondContact O-CB 3.41Å; E246-A250 PolarHBondContact O-N 2.89Å
247Q81Confident81.5Confident118 Ų11863.2 Ų63.255%0.55132%0.322SS*.Hα-helixtrans-60.6-40.4175.3-71.4179.4-500112.2T243 R245 A250 R251T243-Q247 WeakPolarHBondContact O-CB 3.42Å; T243-Q247 WeakPolarHBondContact O-CG 3.18Å; T243-Q247 PolarHBondContact O-N 3.13Å; R245-Q247 VanDerWaalsContact C-N 3.35Å; R245-Q247 PolarHBondContact O-N 3.47Å; Q247-A250 PolarHBondContact O-N 3.31Å; Q247-R251 WeakPolarHBondContact O-CG 2.9Å; Q247-R251 PolarHBondContact O-N 3.14Å; Q247-R251 PolarHBondContact O-NH1 3.02Å
248R80.6Confident82.3Confident69 Ų6960.1 Ų60.126%0.2631%0.312SS..Hα-helixtrans-64.6-46.7175.6-178.6179.2177-149.2-3.4111.5V54 A244 R245 E246 A250 R251 V252V54-R248 PolarHBondContact O-NH2 2.85Å; A244-R248 WeakPolarHBondContact O-CB 3.13Å; A244-R248 PolarHBondContact O-N 3.23Å; R245-R248 PolarHBondContact O-N 3.38Å; E246-R248 VanDerWaalsContact C-N 3.32Å; E246-R248 PolarHBondContact O-N 3.31Å; R248-A250 VanDerWaalsContact C-N 3.33Å; R248-R251 PolarHBondContact O-N 2.99Å; R248-V252 WeakPolarHBondContact O-CG2 3.28Å; R248-V252 PolarHBondContact O-N 3.21Å; R248-V252 VanDerWaalsContact O-N 3.15Å
249S79Confident83Confident10 Ų1055 Ų557%0.0729%0.286CS..Hα-helixtrans-60.7-43.5176.4-69.60000111.2R245 E246 R251 V252 L253R245-S249 PolarHBondContact O-N 3.01Å; R245-S249 PolarHBondContact O-OG 3.19Å; E246-S249 PolarHBondContact O-N 3.3Å; S249-R251 PolarHBondContact O-N 3.43Å; S249-V252 PolarHBondContact O-N 3.45Å; S249-L253 WeakPolarHBondContact O-CB 2.93Å; S249-L253 PolarHBondContact O-N 3.4Å
250A84Confident83.6Confident40 Ų4053 Ų5333%0.33127%0.272SS..Hα-helixtrans-62.5-41.5177.600000112.6M210 E246 Q247 R248 R254M210-A250 HydrophobicContact CE-CB 4.21Å; E246-A250 WeakPolarHBondContact O-CB 3.41Å; E246-A250 PolarHBondContact O-N 2.89Å; Q247-A250 PolarHBondContact O-N 3.31Å; R248-A250 VanDerWaalsContact C-N 3.33Å; A250-R254 WeakPolarHBondContact O-CB 3.48Å; A250-R254 PolarHBondContact O-N 2.91Å
251R85.8Confident84.2Confident73 Ų7352.3 Ų52.328%0.27527%0.268SS..Hα-helixtrans-62.1-49.4176.4-76.2-169.6-59-884.5112Q247 R248 S249 R254 T255Q247-R251 WeakPolarHBondContact O-CG 2.9Å; Q247-R251 PolarHBondContact O-N 3.14Å; Q247-R251 PolarHBondContact O-NH1 3.02Å; R248-R251 PolarHBondContact O-N 2.99Å; S249-R251 PolarHBondContact O-N 3.43Å; R251-R254 PolarHBondContact O-N 3.45Å; R251-T255 PolarHBondContact O-N 3.3Å; R251-T255 VanDerWaalsContact O-N 3.16Å; R251-T255 PolarHBondContact O-OG1 3.45Å
252V84.2Confident85Confident26 Ų2647.7 Ų47.716%0.15825%0.252CS..Hα-helixtrans-68.2-40.4179.8-1790000110.8T57 R122 R248 S249 R254 T255 V256T57-V252 HydrophobicContact CG2-CG1 4.32Å; R122-V252 HydrophobicContact CG-CG1 4.01Å; R248-V252 WeakPolarHBondContact O-CG2 3.28Å; R248-V252 PolarHBondContact O-N 3.21Å; R248-V252 VanDerWaalsContact O-N 3.15Å; S249-V252 PolarHBondContact O-N 3.45Å; V252-R254 VanDerWaalsContact C-N 3.31Å; V252-R254 PolarHBondContact O-N 2.75Å; V252-T255 WeakPolarHBondContact O-CB 3.34Å; V252-T255 PolarHBondContact O-N 3.02Å; V252-T255 VanDerWaalsContact O-N 3.16Å; V252-V256 HydrophobicContact CG1-CG2 4.19Å; V252-V256 WeakPolarHBondContact O-CG2 3.26Å; V252-V256 PolarHBondContact O-N 3.45Å
253L87.8Confident85.8Confident20 Ų2045.2 Ų45.211%0.10523%0.234CC..Hα-helixtrans-57-44.8174.6178.665.1000111.1N203 I206 I207 M210 S249 T255 V256 V257N203-L253 VanDerWaalsContact OD1-CD1 3.26Å; N203-L253 WeakPolarHBondContact OD1-CD1 3.27Å; I206-L253 HydrophobicContact CB-CD1 4.37Å; I206-L253 HydrophobicContact CD1-CD1 4.11Å; I206-L253 HydrophobicContact CG2-CD1 3.96Å; I206-L253 HydrophobicContact CG2-CD2 3.73Å; I206-L253 HydrophobicContact CG2-CG 4.4Å; I207-L253 HydrophobicContact CG1-CD2 4.36Å; M210-L253 HydrophobicContact SD-CD2 4.03Å; S249-L253 WeakPolarHBondContact O-CB 2.93Å; S249-L253 PolarHBondContact O-N 3.4Å; L253-T255 PolarHBondContact O-N 3.1Å; L253-V256 PolarHBondContact O-N 3.24Å; L253-V257 HydrophobicContact CD1-CG2 3.95Å; L253-V257 HydrophobicContact CG-CG2 4.24Å; L253-V257 WeakPolarHBondContact O-CB 3.3Å; L253-V257 VanDerWaalsContact O-CG2 3.27Å; L253-V257 WeakPolarHBondContact O-CG2 3.38Å; L253-V257 PolarHBondContact O-N 2.75Å
254R90.6Very high86.4Confident123 Ų12343.7 Ų43.746%0.46422%0.223SC..Hα-helixtrans-58.3-47.4175.2179.7175.459.8-162.92.4111.8A250 R251 V252 V257 C258 T316A250-R254 WeakPolarHBondContact O-CB 3.48Å; A250-R254 PolarHBondContact O-N 2.91Å; R251-R254 PolarHBondContact O-N 3.45Å; V252-R254 VanDerWaalsContact C-N 3.31Å; V252-R254 PolarHBondContact O-N 2.75Å; R254-V257 PolarHBondContact O-N 2.61Å; R254-C258 WeakPolarHBondContact O-CB 3.18Å; R254-C258 PolarHBondContact O-N 2.82Å; R254-C258 PolarHBondContact O-SG 3.42Å; R254-T316 HydrophobicContact CG-CG2 4.04Å; R254-T316 PolarHBondContact NE-O 3.22Å; R254-T316 PolarHBondContact NH2-O 2.7Å
255T91.5Very high87.2Confident8 Ų847.1 Ų47.15%0.04923%0.233CC..Hα-helixtrans-58-49.1176.1-57.60000111.4R251 V252 L253 C258 M259 I312 Y313 T316R251-T255 PolarHBondContact O-N 3.3Å; R251-T255 VanDerWaalsContact O-N 3.16Å; R251-T255 PolarHBondContact O-OG1 3.45Å; V252-T255 WeakPolarHBondContact O-CB 3.34Å; V252-T255 PolarHBondContact O-N 3.02Å; V252-T255 VanDerWaalsContact O-N 3.16Å; L253-T255 PolarHBondContact O-N 3.1Å; T255-C258 PolarHBondContact O-N 3.08Å; T255-M259 HydrophobicContact CG2-CE 3.76Å; T255-M259 HydrophobicContact CG2-SD 4.01Å; T255-M259 VanDerWaalsContact O-CG 3.26Å; T255-M259 WeakPolarHBondContact O-CG 3.32Å; T255-M259 PolarHBondContact O-N 2.77Å; T255-I312 HydrophobicContact CG2-CG2 4.2Å; T255-Y313 HydrophobicContact CG2-CD1 3.8Å; T255-Y313 HydrophobicContact CG2-CE1 3.87Å; T255-T316 WeakPolarHBondContact CB-OG1 3.07Å; T255-T316 WeakPolarHBondContact OG1-CB 3.47Å; T255-T316 PolarHBondContact OG1-OG1 3.43Å
256V88.7Confident88.2Confident3 Ų345.3 Ų45.32%0.01823%0.228CC..Hα-helixtrans-64-44.3-178.9168.70000111.7I115 L118 C119 V252 L253 M259 T260I115-V256 HydrophobicContact CG2-CG1 4.48Å; L118-V256 HydrophobicContact CB-CG2 4.18Å; C119-V256 WeakPolarHBondContact SG-CG1 3.4Å; V252-V256 HydrophobicContact CG1-CG2 4.19Å; V252-V256 WeakPolarHBondContact O-CG2 3.26Å; V252-V256 PolarHBondContact O-N 3.45Å; L253-V256 PolarHBondContact O-N 3.24Å; V256-M259 WeakPolarHBondContact O-CB 3.48Å; V256-M259 PolarHBondContact O-N 2.87Å; V256-T260 WeakPolarHBondContact O-CB 3.47Å; V256-T260 PolarHBondContact O-N 2.89Å; V256-T260 PolarHBondContact O-OG1 3.15Å
257V90.7Very high89Confident44 Ų4442.1 Ų42.127%0.26721%0.213SC..Hα-helixtrans-63.2-42.9177169.20000110.9L253 R254 T260 I261L253-V257 HydrophobicContact CD1-CG2 3.95Å; L253-V257 HydrophobicContact CG-CG2 4.24Å; L253-V257 WeakPolarHBondContact O-CB 3.3Å; L253-V257 VanDerWaalsContact O-CG2 3.27Å; L253-V257 WeakPolarHBondContact O-CG2 3.38Å; L253-V257 PolarHBondContact O-N 2.75Å; R254-V257 PolarHBondContact O-N 2.61Å; V257-T260 WeakPolarHBondContact O-CB 3.45Å; V257-T260 PolarHBondContact O-N 2.94Å; V257-I261 HydrophobicContact CG1-CD1 3.76Å; V257-I261 HydrophobicContact CG1-CG1 4.44Å; V257-I261 VanDerWaalsContact O-CG1 3.3Å; V257-I261 WeakPolarHBondContact O-CG1 3.32Å; V257-I261 PolarHBondContact O-N 2.86Å
258C93.2Very high89.6Confident44 Ų4437.7 Ų37.730%0.29719%0.193SC..Hα-helixtrans-61.1-45.4174.5-71.50000111.8R254 T255 T260 I261 S262 I312 T316R254-C258 WeakPolarHBondContact O-CB 3.18Å; R254-C258 PolarHBondContact O-N 2.82Å; R254-C258 PolarHBondContact O-SG 3.42Å; T255-C258 PolarHBondContact O-N 3.08Å; C258-T260 VanDerWaalsContact C-N 3.3Å; C258-T260 PolarHBondContact O-N 3.22Å; C258-I261 PolarHBondContact O-N 3.25Å; C258-S262 WeakPolarHBondContact O-CB 3.44Å; C258-S262 PolarHBondContact O-N 2.92Å; C258-S262 PolarHBondContact O-OG 2.92Å; C258-I312 HydrophobicContact CB-CG2 3.69Å; C258-T316 HydrophobicContact CB-CG2 4.21Å
259M91.8Very high90.2Very high1 Ų136.5 Ų36.51%0.00519%0.194CC..Hα-helixtrans-59.5-42.5175.1-70.7166.4161.200112.3M64 I115 T255 V256 S262 H263 H309 I312 Y313M64-M259 HydrophobicContact CE-CE 3.7Å; M64-M259 HydrophobicContact CE-SD 4.19Å; I115-M259 HydrophobicContact CD1-CB 4.39Å; T255-M259 HydrophobicContact CG2-CE 3.76Å; T255-M259 HydrophobicContact CG2-SD 4.01Å; T255-M259 VanDerWaalsContact O-CG 3.26Å; T255-M259 WeakPolarHBondContact O-CG 3.32Å; T255-M259 PolarHBondContact O-N 2.77Å; V256-M259 WeakPolarHBondContact O-CB 3.48Å; V256-M259 PolarHBondContact O-N 2.87Å; M259-S262 PolarHBondContact O-N 2.99Å; M259-H263 WeakPolarHBondContact O-CB 3.42Å; M259-H263 PolarHBondContact O-N 3.34Å; M259-H309 HydrophobicContact CE-CB 4.37Å; M259-I312 HydrophobicContact CB-CD1 4.47Å; M259-I312 HydrophobicContact CG-CD1 3.97Å; M259-I312 HydrophobicContact CG-CG2 4.07Å; M259-Y313 HydrophobicContact CE-CD1 3.96Å; M259-Y313 HydrophobicContact CE-CE1 3.04Å; M259-Y313 HydrophobicContact CE-CE2 4.28Å; M259-Y313 WeakPolarHBondContact CE-OH 3.46Å
260T89.6Confident90.8Very high7 Ų736 Ų364%0.04319%0.191CC..Hα-helixtrans-59.6-52.5178.3-56.80000110.2I199 V256 V257 C258 S262 H263 F264I199-T260 HydrophobicContact CB-CG2 4.14Å; I199-T260 HydrophobicContact CD1-CG2 4.45Å; I199-T260 HydrophobicContact CG2-CG2 3.32Å; I199-T260 VanDerWaalsContact CG2-OG1 3.24Å; I199-T260 WeakPolarHBondContact CG2-OG1 2.99Å; V256-T260 WeakPolarHBondContact O-CB 3.47Å; V256-T260 PolarHBondContact O-N 2.89Å; V256-T260 PolarHBondContact O-OG1 3.15Å; V257-T260 WeakPolarHBondContact O-CB 3.45Å; V257-T260 PolarHBondContact O-N 2.94Å; C258-T260 VanDerWaalsContact C-N 3.3Å; C258-T260 PolarHBondContact O-N 3.22Å; T260-S262 PolarHBondContact O-N 3.12Å; T260-H263 PolarHBondContact O-N 3.5Å; T260-F264 HydrophobicContact CG2-CD2 3.77Å; T260-F264 HydrophobicContact CG2-CE2 3.52Å; T260-F264 WeakPolarHBondContact O-CD2 3.42Å; T260-F264 PolarHBondContact O-N 3.19Å
261I92.1Very high91.2Very high92 Ų9234.1 Ų34.147%0.47218%0.175SC..Hα-helixtrans-61.3-47.7179.9-67.7166.9000110.2V257 C258 H263 F264 L265V257-I261 HydrophobicContact CG1-CD1 3.76Å; V257-I261 HydrophobicContact CG1-CG1 4.44Å; V257-I261 VanDerWaalsContact O-CG1 3.3Å; V257-I261 WeakPolarHBondContact O-CG1 3.32Å; V257-I261 PolarHBondContact O-N 2.86Å; C258-I261 PolarHBondContact O-N 3.25Å; I261-H263 PolarHBondContact O-N 3.11Å; I261-F264 PolarHBondContact O-N 3.49Å; I261-L265 HydrophobicContact CG2-CD1 3.62Å; I261-L265 HydrophobicContact CG2-CG 4.22Å; I261-L265 WeakPolarHBondContact O-CB 3.24Å; I261-L265 VanDerWaalsContact O-CG 3.27Å; I261-L265 WeakPolarHBondContact O-CG 2.99Å; I261-L265 PolarHBondContact O-N 3.26Å
262S93.7Very high91.5Very high30 Ų3035.4 Ų35.421%0.2118%0.183CC..Hα-helixtrans-59.4-45.2177.3-68.50000112C258 M259 T260 L265 L266C258-S262 WeakPolarHBondContact O-CB 3.44Å; C258-S262 PolarHBondContact O-N 2.92Å; C258-S262 PolarHBondContact O-OG 2.92Å; M259-S262 PolarHBondContact O-N 2.99Å; T260-S262 PolarHBondContact O-N 3.12Å; S262-L265 PolarHBondContact O-N 2.98Å; S262-L266 WeakPolarHBondContact O-CB 3.43Å; S262-L266 WeakPolarHBondContact O-CD1 3.2Å; S262-L266 WeakPolarHBondContact O-CG 3.33Å; S262-L266 PolarHBondContact O-N 3.4Å
263H91.6Very high91.8Very high1 Ų135 Ų351%0.00518%0.179CC..Hα-helixtrans-55.1-56.7176.1-179.880.1000110.7T112 M259 T260 I261 L265 L266 T267 N305T112-H263 PolarHBondContact OG1-CE1 3.35Å; M259-H263 WeakPolarHBondContact O-CB 3.42Å; M259-H263 PolarHBondContact O-N 3.34Å; T260-H263 PolarHBondContact O-N 3.5Å; I261-H263 PolarHBondContact O-N 3.11Å; H263-L265 PolarHBondContact O-N 3.27Å; H263-L266 PolarHBondContact O-N 2.94Å; H263-T267 PolarHBondContact NE2-OG1 2.76Å; H263-T267 VanDerWaalsContact O-CB 3.31Å; H263-T267 WeakPolarHBondContact O-CB 3.31Å; H263-T267 VanDerWaalsContact O-CG2 3.23Å; H263-T267 WeakPolarHBondContact O-CG2 3.45Å; H263-T267 PolarHBondContact O-N 3.46Å; H263-T267 PolarHBondContact O-OG1 3.16Å; H263-N305 WeakPolarHBondContact CA-OD1 3.34Å; H263-N305 PolarHBondContact N-OD1 2.92Å; H263-N305 PolarHBondContact ND1-ND2 3.36Å
264F90.7Very high91.8Very high22 Ų2235.6 Ų35.610%0.09618%0.18CC..Hα-helixtrans-65-42.5-177.3-68.5-61.7000113.7L196 I199 T260 I261 L266 M268L196-F264 HydrophobicContact CB-CD1 4.15Å; L196-F264 HydrophobicContact CB-CE1 3.4Å; L196-F264 HydrophobicContact CB-CE2 4.17Å; L196-F264 HydrophobicContact CB-CZ 3.45Å; L196-F264 VanDerWaalsContact CB-CZ 3.45Å; L196-F264 HydrophobicContact CD1-CD1 3.76Å; L196-F264 HydrophobicContact CD1-CD2 3.49Å; L196-F264 VanDerWaalsContact CD1-CD2 3.49Å; L196-F264 HydrophobicContact CD1-CE1 3.73Å; L196-F264 HydrophobicContact CD1-CE2 3.4Å; L196-F264 HydrophobicContact CD1-CG 3.72Å; L196-F264 HydrophobicContact CD1-CZ 3.58Å; L196-F264 HydrophobicContact CD2-CD1 4.43Å; L196-F264 HydrophobicContact CD2-CE1 4.46Å; L196-F264 HydrophobicContact CG-CD1 4.32Å; L196-F264 HydrophobicContact CG-CE1 4.02Å; L196-F264 HydrophobicContact CG-CE2 4.38Å; L196-F264 HydrophobicContact CG-CZ 4.09Å; I199-F264 HydrophobicContact CD1-CE2 4.39Å; I199-F264 HydrophobicContact CD1-CZ 4.42Å; T260-F264 HydrophobicContact CG2-CD2 3.77Å; T260-F264 HydrophobicContact CG2-CE2 3.52Å; T260-F264 WeakPolarHBondContact O-CD2 3.42Å; T260-F264 PolarHBondContact O-N 3.19Å; I261-F264 PolarHBondContact O-N 3.49Å; F264-L266 PolarHBondContact O-N 3.14Å; F264-M268 HydrophobicContact CB-CG 4.27Å; F264-M268 HydrophobicContact CD1-CE 3.48Å; F264-M268 VanDerWaalsContact CD1-CE 3.48Å; F264-M268 HydrophobicContact CD1-CG 4.26Å; F264-M268 HydrophobicContact CD1-SD 4.05Å; F264-M268 HydrophobicContact CE1-CE 3.99Å; F264-M268 VanDerWaalsContact O-CB 3.22Å; F264-M268 WeakPolarHBondContact O-CB 3.48Å; F264-M268 WeakPolarHBondContact O-CG 3.3Å; F264-M268 PolarHBondContact O-N 3.14Å
265L94.4Very high91.6Very high124 Ų12431.9 Ų31.965%0.64917%0.169SC*.Hα-helixtrans-61.4-33.6178.5-71.5176.1000112.4I261 S262 H263I261-L265 HydrophobicContact CG2-CD1 3.62Å; I261-L265 HydrophobicContact CG2-CG 4.22Å; I261-L265 WeakPolarHBondContact O-CB 3.24Å; I261-L265 VanDerWaalsContact O-CG 3.27Å; I261-L265 WeakPolarHBondContact O-CG 2.99Å; I261-L265 PolarHBondContact O-N 3.26Å; S262-L265 PolarHBondContact O-N 2.98Å; H263-L265 PolarHBondContact O-N 3.27Å
266L95.2Very high91.3Very high29 Ų2936 Ų3615%0.15219%0.186CC..Hα-helixtrans-94-24.7-175.2-66.4173000113.5S262 H263 F264 L301 Q302 I304 N305 T308S262-L266 WeakPolarHBondContact O-CB 3.43Å; S262-L266 WeakPolarHBondContact O-CD1 3.2Å; S262-L266 WeakPolarHBondContact O-CG 3.33Å; S262-L266 PolarHBondContact O-N 3.4Å; H263-L266 PolarHBondContact O-N 2.94Å; F264-L266 PolarHBondContact O-N 3.14Å; L266-L301 WeakPolarHBondContact CB-O 3.48Å; L266-L301 HydrophobicContact CD2-CB 4.43Å; L266-L301 HydrophobicContact CD2-CD2 3.92Å; L266-L301 CarbonylContact O-C 3.27Å; L266-L301 VanDerWaalsContact O-C 3.27Å; L266-L301 WeakPolarHBondContact O-CB 3.31Å; L266-Q302 PolarHBondContact O-N 3.01Å; L266-I304 HydrophobicContact CD1-CG2 4.05Å; L266-I304 HydrophobicContact CD2-CG2 4.29Å; L266-N305 HydrophobicContact CB-CB 3.9Å; L266-N305 HydrophobicContact CD1-CB 4.07Å; L266-T308 HydrophobicContact CD1-CG2 3.52Å
267T93.1Very high91.1Very high0 Ų038.2 Ų38.20%020%0.197CC..Hα-helixtrans-107.1-23.6-174.971.20000114Y191 H263 P269 V270 V271 Q302 N305Y191-T267 HydrophobicContact CE1-CG2 4.43Å; Y191-T267 WeakPolarHBondContact OH-CB 3.45Å; Y191-T267 WeakPolarHBondContact OH-CG2 3.41Å; H263-T267 PolarHBondContact NE2-OG1 2.76Å; H263-T267 VanDerWaalsContact O-CB 3.31Å; H263-T267 WeakPolarHBondContact O-CB 3.31Å; H263-T267 VanDerWaalsContact O-CG2 3.23Å; H263-T267 WeakPolarHBondContact O-CG2 3.45Å; H263-T267 PolarHBondContact O-N 3.46Å; H263-T267 PolarHBondContact O-OG1 3.16Å; T267-P269 VanDerWaalsContact C-CD 3.46Å; T267-V270 WeakPolarHBondContact O-CG1 3.34Å; T267-V270 PolarHBondContact O-N 3.42Å; T267-V271 WeakPolarHBondContact O-CG2 3.33Å; T267-V271 PolarHBondContact O-N 2.95Å; T267-Q302 HydrophobicContact CG2-CG 4.39Å; T267-N305 HydrophobicContact CG2-CB 3.93Å
268M92.6Very high90.5Very high25 Ų2539.2 Ų39.212%0.12321%0.205CC..Hα-helixtrans-60.7-39175.7-72.8-46.28800113.9S192 F264 V270 V271 F272S192-M268 WeakPolarHBondContact OG-CE 3.2Å; S192-M268 PolarHBondContact OG-SD 2.89Å; F264-M268 HydrophobicContact CB-CG 4.27Å; F264-M268 HydrophobicContact CD1-CE 3.48Å; F264-M268 VanDerWaalsContact CD1-CE 3.48Å; F264-M268 HydrophobicContact CD1-CG 4.26Å; F264-M268 HydrophobicContact CD1-SD 4.05Å; F264-M268 HydrophobicContact CE1-CE 3.99Å; F264-M268 VanDerWaalsContact O-CB 3.22Å; F264-M268 WeakPolarHBondContact O-CB 3.48Å; F264-M268 WeakPolarHBondContact O-CG 3.3Å; F264-M268 PolarHBondContact O-N 3.14Å; M268-V270 VanDerWaalsContact C-N 3.27Å; M268-V270 PolarHBondContact O-N 2.96Å; M268-V271 HydrophobicContact CE-CG2 4.15Å; M268-V271 WeakPolarHBondContact O-CB 3.36Å; M268-V271 PolarHBondContact O-N 3.36Å; M268-V271 VanDerWaalsContact O-N 3.14Å; M268-F272 HydrophobicContact CB-CD2 4.2Å; M268-F272 HydrophobicContact CB-CE2 4.12Å; M268-F272 VanDerWaalsContact O-CD2 3.24Å; M268-F272 WeakPolarHBondContact O-CD2 3.47Å; M268-F272 PolarHBondContact O-N 3.36Å
269P94.5Very high89.9Confident44 Ų4443.7 Ų43.729%0.28622%0.22SC..Hα-helixtrans-57.3-39.4-179.3-28.537.6000113.4T267 F272 F273 T298 L301T267-P269 VanDerWaalsContact C-CD 3.46Å; P269-F272 PolarHBondContact O-N 3.45Å; P269-F273 WeakPolarHBondContact O-CB 3.24Å; P269-F273 PolarHBondContact O-N 3.26Å; P269-T298 HydrophobicContact CB-CG2 3.63Å; P269-L301 HydrophobicContact CB-CD1 4.28Å; P269-L301 HydrophobicContact CG-CD1 4.17Å
270V91.8Very high89.4Confident0 Ų049.2 Ų49.20%024%0.244CC..Hα-helixtrans-72.9-35178.659.70000111.9M1 T267 M268 F273 Y274 V299 Q302M1-V270 HydrophobicContact CG-CB 4.5Å; M1-V270 HydrophobicContact CG-CG1 4.18Å; M1-V270 HydrophobicContact CG-CG2 3.59Å; M1-V270 HydrophobicContact SD-CB 4.18Å; M1-V270 HydrophobicContact SD-CG1 3.37Å; M1-V270 WeakPolarHBondContact SD-CG1 3.27Å; M1-V270 HydrophobicContact SD-CG2 3.89Å; T267-V270 WeakPolarHBondContact O-CG1 3.34Å; T267-V270 PolarHBondContact O-N 3.42Å; M268-V270 VanDerWaalsContact C-N 3.27Å; M268-V270 PolarHBondContact O-N 2.96Å; V270-F273 PolarHBondContact O-N 3.49Å; V270-Y274 HydrophobicContact CG2-CD2 3.67Å; V270-Y274 HydrophobicContact CG2-CE2 3.51Å; V270-Y274 WeakPolarHBondContact O-CD2 3.45Å; V270-Y274 PolarHBondContact O-N 3Å; V270-Y274 VanDerWaalsContact O-N 3.16Å; V270-V299 HydrophobicContact CG2-CG2 4.34Å; V270-Q302 HydrophobicContact CG1-CB 3.93Å; V270-Q302 HydrophobicContact CG1-CG 4.25Å
271V91.9Very high89Confident0 Ų049.5 Ų49.50%025%0.246CC..Hα-helixtrans-60.1-50.1172.21760000110.4M1 F188 Y191 F193 T267 M268 F273 L275M1-V271 HydrophobicContact CE-CB 4.15Å; M1-V271 HydrophobicContact CE-CG2 3.41Å; M1-V271 VanDerWaalsContact CE-CG2 3.41Å; M1-V271 HydrophobicContact SD-CG2 4.08Å; F188-V271 HydrophobicContact CB-CG1 4.11Å; F188-V271 HydrophobicContact CD1-CG1 4.11Å; F188-V271 HydrophobicContact CD2-CG1 4.43Å; F188-V271 HydrophobicContact CG-CG1 3.95Å; Y191-V271 HydrophobicContact CD1-CG2 4.27Å; Y191-V271 HydrophobicContact CE1-CG2 4.43Å; F193-V271 HydrophobicContact CE2-CG1 4.26Å; F193-V271 HydrophobicContact CZ-CG1 4.18Å; T267-V271 WeakPolarHBondContact O-CG2 3.33Å; T267-V271 PolarHBondContact O-N 2.95Å; M268-V271 HydrophobicContact CE-CG2 4.15Å; M268-V271 WeakPolarHBondContact O-CB 3.36Å; M268-V271 PolarHBondContact O-N 3.36Å; M268-V271 VanDerWaalsContact O-N 3.14Å; V271-F273 PolarHBondContact O-N 3.38Å; V271-L275 VanDerWaalsContact O-CB 3.31Å; V271-L275 WeakPolarHBondContact O-CB 3.38Å; V271-L275 PolarHBondContact O-N 3.22Å
272F91.8Very high88.2Confident100 Ų10048.3 Ų48.344%0.43924%0.24SC..Hα-helixtrans-64.8-40180-77.7-61.8000112.4M268 P269 L275 F276M268-F272 HydrophobicContact CB-CD2 4.2Å; M268-F272 HydrophobicContact CB-CE2 4.12Å; M268-F272 VanDerWaalsContact O-CD2 3.24Å; M268-F272 WeakPolarHBondContact O-CD2 3.47Å; M268-F272 PolarHBondContact O-N 3.36Å; P269-F272 PolarHBondContact O-N 3.45Å; F272-L275 PolarHBondContact O-N 3.18Å; F272-F276 HydrophobicContact CD1-CD2 4.44Å; F272-F276 AromaticContact CD1-CE2 3.84Å; F272-F276 HydrophobicContact CD1-CE2 3.84Å; F272-F276 WeakPolarHBondContact O-CD2 3.35Å; F272-F276 PolarHBondContact O-N 3.44Å
273F90.4Very high87.3Confident19 Ų1953.1 Ų53.18%0.08326%0.264CS..Hα-helixtrans-55.7-57.1176.4174.9-100.9000111.3P269 V270 V271 L275 F276 E277 C291 I294 E295 T298P269-F273 WeakPolarHBondContact O-CB 3.24Å; P269-F273 PolarHBondContact O-N 3.26Å; V270-F273 PolarHBondContact O-N 3.49Å; V271-F273 PolarHBondContact O-N 3.38Å; F273-L275 VanDerWaalsContact C-N 3.32Å; F273-L275 PolarHBondContact O-N 3.49Å; F273-F276 CarbonylContact O-C 3.6Å; F273-F276 PolarHBondContact O-N 2.9Å; F273-E277 HydrophobicContact CZ-CG 4.33Å; F273-E277 WeakPolarHBondContact O-CB 3.31Å; F273-E277 PolarHBondContact O-N 3.35Å; F273-C291 HydrophobicContact CE2-CB 4.18Å; F273-C291 WeakPolarHBondContact CE2-O 3.41Å; F273-C291 HydrophobicContact CZ-CB 4.46Å; F273-C291 WeakPolarHBondContact CZ-O 3.06Å; F273-I294 HydrophobicContact CB-CG2 4.47Å; F273-I294 HydrophobicContact CD2-CB 4.04Å; F273-I294 HydrophobicContact CD2-CG2 3.47Å; F273-I294 VanDerWaalsContact CD2-CG2 3.47Å; F273-I294 HydrophobicContact CE2-CB 4.12Å; F273-I294 HydrophobicContact CE2-CG2 4.07Å; F273-I294 HydrophobicContact CG-CG2 4.21Å; F273-E295 HydrophobicContact CD1-CB 4.19Å; F273-E295 HydrophobicContact CD1-CG 4.21Å; F273-E295 HydrophobicContact CE1-CB 3.47Å; F273-E295 VanDerWaalsContact CE1-CB 3.47Å; F273-E295 HydrophobicContact CE1-CG 3.57Å; F273-E295 HydrophobicContact CE2-CB 4.3Å; F273-E295 HydrophobicContact CZ-CB 3.54Å; F273-E295 HydrophobicContact CZ-CG 4.14Å; F273-T298 HydrophobicContact CB-CG2 4.43Å
274Y87Confident86.6Confident32 Ų3256 Ų5613%0.12528%0.279CS..Hα-helixtrans-70.1-25.2-178.2-72.8-64.9000113.8M1 V270 F276 E277 E295M1-Y274 HydrophobicContact CG-CD2 4.11Å; M1-Y274 HydrophobicContact CG-CE2 4.2Å; M1-Y274 WeakPolarHBondContact O-CE2 3.4Å; M1-Y274 PolarHBondContact O-OH 2.88Å; V270-Y274 HydrophobicContact CG2-CD2 3.67Å; V270-Y274 HydrophobicContact CG2-CE2 3.51Å; V270-Y274 WeakPolarHBondContact O-CD2 3.45Å; V270-Y274 PolarHBondContact O-N 3Å; V270-Y274 VanDerWaalsContact O-N 3.16Å; Y274-F276 VanDerWaalsContact C-N 3.26Å; Y274-F276 PolarHBondContact O-N 3.44Å; Y274-E277 WeakPolarHBondContact CD1-OE2 3.3Å; Y274-E295 PolarHBondContact OH-OE1 3.38Å
275L86.8Confident85.7Confident44 Ų4461.9 Ų61.923%0.2331%0.305CS..Hα-helixtrans-66.6-30.2173.9-173.467.4000112.5Y185 F188 V271 F272 F273Y185-L275 HydrophobicContact CD1-CD1 3.84Å; Y185-L275 HydrophobicContact CE1-CD1 3.58Å; F188-L275 HydrophobicContact CD2-CB 4.46Å; F188-L275 HydrophobicContact CD2-CD1 4.01Å; F188-L275 HydrophobicContact CE2-CB 4.01Å; F188-L275 HydrophobicContact CE2-CD1 3.99Å; V271-L275 VanDerWaalsContact O-CB 3.31Å; V271-L275 WeakPolarHBondContact O-CB 3.38Å; V271-L275 PolarHBondContact O-N 3.22Å; F272-L275 PolarHBondContact O-N 3.18Å; F273-L275 VanDerWaalsContact C-N 3.32Å; F273-L275 PolarHBondContact O-N 3.49Å
276F86.6Confident85Confident94 Ų9462.9 Ų62.941%0.41231%0.311SS..Hα-helixtrans-113.7-1.7-174.7-64.8-63.7000114.4F272 F273 Y274 S278 K279 F280F272-F276 HydrophobicContact CD1-CD2 4.44Å; F272-F276 AromaticContact CD1-CE2 3.84Å; F272-F276 HydrophobicContact CD1-CE2 3.84Å; F272-F276 WeakPolarHBondContact O-CD2 3.35Å; F272-F276 PolarHBondContact O-N 3.44Å; F273-F276 CarbonylContact O-C 3.6Å; F273-F276 PolarHBondContact O-N 2.9Å; Y274-F276 VanDerWaalsContact C-N 3.26Å; Y274-F276 PolarHBondContact O-N 3.44Å; F276-S278 VanDerWaalsContact C-N 3.34Å; F276-S278 PolarHBondContact O-N 3.33Å; F276-K279 PolarHBondContact O-N 3.05Å; F276-K279 VanDerWaalsContact O-N 3.13Å; F276-F280 HydrophobicContact CB-CD2 3.65Å; F276-F280 HydrophobicContact CB-CE2 3.78Å; F276-F280 HydrophobicContact CD1-CE2 4.21Å; F276-F280 HydrophobicContact CG-CD2 4.48Å; F276-F280 HydrophobicContact CG-CE2 4.12Å; F276-F280 WeakPolarHBondContact O-CD2 3.39Å; F276-F280 PolarHBondContact O-N 3.38Å; F276-F280 VanDerWaalsContact O-N 3.09Å
277E82.7Confident84.3Confident51 Ų5168 Ų6824%0.23833%0.328CS..Hα-helixtrans-54.9-46.8-178.6-177.8-172.9-168.200112.1F273 Y274 K279 F280 C281 I282F273-E277 HydrophobicContact CZ-CG 4.33Å; F273-E277 WeakPolarHBondContact O-CB 3.31Å; F273-E277 PolarHBondContact O-N 3.35Å; Y274-E277 WeakPolarHBondContact CD1-OE2 3.3Å; E277-K279 PolarHBondContact O-N 3.25Å; E277-F280 PolarHBondContact O-N 3.17Å; E277-C281 HydrophobicContact CG-CB 3.9Å; E277-C281 WeakPolarHBondContact O-CA 3.43Å; E277-C281 VanDerWaalsContact O-CB 3.24Å; E277-C281 WeakPolarHBondContact O-CB 3.39Å; E277-C281 PolarHBondContact O-N 3.33Å; E277-I282 PolarHBondContact O-N 3.44Å
278S79.6Confident83.7Confident64 Ų6470.3 Ų70.345%0.44834%0.34SS..Iπ-helixtrans-58.2-37.2-178.9650000112.3F276F276-S278 VanDerWaalsContact C-N 3.34Å; F276-S278 PolarHBondContact O-N 3.33Å
279K80.3Confident83.1Confident139 Ų13972.2 Ų72.260%0.60435%0.35SS*.Iπ-helixtrans-80.9-36.4-175.8-173177.6-179.4-179.90113.3F276 E277F276-K279 PolarHBondContact O-N 3.05Å; F276-K279 VanDerWaalsContact O-N 3.13Å; E277-K279 PolarHBondContact O-N 3.25Å
280F81.3Confident82.7Confident116 Ų11673.2 Ų73.251%0.50936%0.356SS..Iπ-helixtrans-103.8-29.7-173.8-66.5-68.8000114.2F276 E277F276-F280 HydrophobicContact CB-CD2 3.65Å; F276-F280 HydrophobicContact CB-CE2 3.78Å; F276-F280 HydrophobicContact CD1-CE2 4.21Å; F276-F280 HydrophobicContact CG-CD2 4.48Å; F276-F280 HydrophobicContact CG-CE2 4.12Å; F276-F280 WeakPolarHBondContact O-CD2 3.39Å; F276-F280 PolarHBondContact O-N 3.38Å; F276-F280 VanDerWaalsContact O-N 3.09Å; E277-F280 PolarHBondContact O-N 3.17Å
281C80.9Confident82.5Confident14 Ų1473.8 Ų73.810%0.09536%0.359CS..Iπ-helixtrans-104.3-40.4-170.1-54.70000112.6E277 C291E277-C281 HydrophobicContact CG-CB 3.9Å; E277-C281 WeakPolarHBondContact O-CA 3.43Å; E277-C281 VanDerWaalsContact O-CB 3.24Å; E277-C281 WeakPolarHBondContact O-CB 3.39Å; E277-C281 PolarHBondContact O-N 3.33Å; C281-C291 WeakPolarHBondContact CA-SG 3.28Å; C281-C291 HydrophobicContact CB-CB 3.59Å; C281-C291 WeakPolarHBondContact CB-SG 3.39Å; C281-C291 WeakPolarHBondContact SG-CB 3.38Å; C281-C291 CovalentContact SG-SG 2.03Å; C281-C291 PolarHBondContact SG-SG 3.38Å
282I74.3Confident82Confident66 Ų6674.2 Ų74.234%0.33836%0.362SS..Iπ-helixtrans-78.5-44.5-177.3-57.3-176000110.8E277 N284E277-I282 PolarHBondContact O-N 3.44Å; I282-N284 VanDerWaalsContact C-N 3.29Å; I282-N284 PolarHBondContact O-N 2.89Å
283D75.5Confident81.7Confident131 Ų13172.1 Ų72.170%0.70136%0.358SS*.SBendtrans-75.4-16.1-176.1-67.1-21.3000113.4
284N76.9Confident81.7Confident62 Ų6274.9 Ų74.933%0.33237%0.372SS..  trans-128.298.4-172.5-160.6-19.7000113.1I282 D286 W287I282-N284 VanDerWaalsContact C-N 3.29Å; I282-N284 PolarHBondContact O-N 2.89Å; N284-D286 PolarHBondContact O-N 3.45Å; N284-D286 VanDerWaalsContact O-N 3.16Å; N284-D286 PolarHBondContact OD1-N 3.37Å; N284-W287 PolarHBondContact ND2-NE1 3.15Å; N284-W287 PolarHBondContact O-N 3.06Å; N284-W287 VanDerWaalsContact O-N 3.07Å
285K73Confident81.8Confident145 Ų14574.9 Ų74.963%0.6337%0.373SS*.G310 helixtrans-58.2-30.3-176.1-68.4-172.2178-171.90114W287 I288K285-W287 PolarHBondContact O-N 3.34Å; K285-I288 HydrophobicContact CB-CD1 4.19Å; K285-I288 HydrophobicContact CG-CD1 4.34Å; K285-I288 WeakPolarHBondContact O-CD1 3.33Å; K285-I288 WeakPolarHBondContact O-CG1 3.49Å; K285-I288 PolarHBondContact O-N 3.22Å
286D78.8Confident81.9Confident145 Ų14573.3 Ų73.378%0.77536%0.364SS*.G310 helixtrans-66.8-21.4-179.3-63.9-26.4000112.6N284N284-D286 PolarHBondContact O-N 3.45Å; N284-D286 VanDerWaalsContact O-N 3.16Å; N284-D286 PolarHBondContact OD1-N 3.37Å
287W80.1Confident82.2Confident136 Ų13671.9 Ų71.952%0.51536%0.363SS..G310 helixtrans-96.8-2.8-175.4-71.277.7000114.1N284 K285 N289 V290 C291N284-W287 PolarHBondContact ND2-NE1 3.15Å; N284-W287 PolarHBondContact O-N 3.06Å; N284-W287 VanDerWaalsContact O-N 3.07Å; K285-W287 PolarHBondContact O-N 3.34Å; W287-N289 PolarHBondContact O-N 3.22Å; W287-V290 HydrophobicContact CE3-CB 4.12Å; W287-V290 HydrophobicContact CE3-CG1 3.99Å; W287-V290 HydrophobicContact CE3-CG2 4.43Å; W287-V290 HydrophobicContact CZ3-CG1 4.18Å; W287-V290 PolarHBondContact O-N 3.48Å; W287-V290 VanDerWaalsContact O-N 3.08Å; W287-C291 WeakPolarHBondContact O-CB 3.48Å; W287-C291 PolarHBondContact O-N 3.35Å; W287-C291 PolarHBondContact O-SG 3.03Å
288I80Confident82.7Confident49 Ų4969.9 Ų69.925%0.25135%0.354SS..Hα-helixtrans-55-48.6-173.8-68.1170.3000111.6K285 V290 C291 D292K285-I288 HydrophobicContact CB-CD1 4.19Å; K285-I288 HydrophobicContact CG-CD1 4.34Å; K285-I288 WeakPolarHBondContact O-CD1 3.33Å; K285-I288 WeakPolarHBondContact O-CG1 3.49Å; K285-I288 PolarHBondContact O-N 3.22Å; I288-V290 VanDerWaalsContact C-N 3.33Å; I288-V290 PolarHBondContact O-N 2.9Å; I288-C291 PolarHBondContact O-N 3.15Å; I288-D292 VanDerWaalsContact O-CB 3.3Å; I288-D292 WeakPolarHBondContact O-CB 3.36Å; I288-D292 PolarHBondContact O-N 3.47Å
289N80.6Confident83.3Confident65 Ų6566.9 Ų66.935%0.34833%0.333SS..Hα-helixtrans-65.9-35.2-179-69.1-12.7000112.7W287 T293W287-N289 PolarHBondContact O-N 3.22Å; N289-T293 PolarHBondContact O-N 2.8Å; N289-T293 VanDerWaalsContact O-N 3.12Å; N289-T293 PolarHBondContact O-OG1 3.29Å
290V86Confident83.9Confident65 Ų6561 Ų6139%0.39431%0.309SS..Hα-helixtrans-69.4-46.4177.4177.60000109.6W287 I288 D292 T293 I294W287-V290 HydrophobicContact CE3-CB 4.12Å; W287-V290 HydrophobicContact CE3-CG1 3.99Å; W287-V290 HydrophobicContact CE3-CG2 4.43Å; W287-V290 HydrophobicContact CZ3-CG1 4.18Å; W287-V290 PolarHBondContact O-N 3.48Å; W287-V290 VanDerWaalsContact O-N 3.08Å; I288-V290 VanDerWaalsContact C-N 3.33Å; I288-V290 PolarHBondContact O-N 2.9Å; V290-D292 PolarHBondContact O-N 2.86Å; V290-T293 WeakPolarHBondContact O-CB 3.2Å; V290-T293 PolarHBondContact O-N 3.04Å; V290-T293 VanDerWaalsContact O-N 3.12Å; V290-I294 HydrophobicContact CG1-CD1 3.82Å; V290-I294 HydrophobicContact CG1-CG1 4.44Å; V290-I294 WeakPolarHBondContact O-CG1 3.38Å; V290-I294 PolarHBondContact O-N 3.34Å
291C87.1Confident84.6Confident12 Ų1258 Ų588%0.08130%0.297CS..Hα-helixtrans-60.4-45.1176.8-74.60000112.4F273 C281 W287 I288 T293 I294 E295F273-C291 HydrophobicContact CE2-CB 4.18Å; F273-C291 WeakPolarHBondContact CE2-O 3.41Å; F273-C291 HydrophobicContact CZ-CB 4.46Å; F273-C291 WeakPolarHBondContact CZ-O 3.06Å; C281-C291 WeakPolarHBondContact CA-SG 3.28Å; C281-C291 HydrophobicContact CB-CB 3.59Å; C281-C291 WeakPolarHBondContact CB-SG 3.39Å; C281-C291 WeakPolarHBondContact SG-CB 3.38Å; C281-C291 CovalentContact SG-SG 2.03Å; C281-C291 PolarHBondContact SG-SG 3.38Å; W287-C291 WeakPolarHBondContact O-CB 3.48Å; W287-C291 PolarHBondContact O-N 3.35Å; W287-C291 PolarHBondContact O-SG 3.03Å; I288-C291 PolarHBondContact O-N 3.15Å; C291-T293 PolarHBondContact O-N 3.39Å; C291-I294 PolarHBondContact O-N 2.94Å; C291-I294 VanDerWaalsContact O-N 3.12Å; C291-E295 PolarHBondContact O-N 3.41Å
292D83.1Confident85.3Confident10 Ų1057.3 Ų57.35%0.05329%0.293CS..Hα-helixtrans-63.2-29176.4-171.947.6000111.9K15 I288 V290 R296K15-D292 WeakPolarHBondContact CD-OD2 3.43Å; K15-D292 VanDerWaalsContact CE-OD1 3.29Å; K15-D292 WeakPolarHBondContact CE-OD1 3.24Å; K15-D292 IonicContact NZ-OD1 2.76Å; K15-D292 PolarHBondContact NZ-OD1 2.92Å; I288-D292 VanDerWaalsContact O-CB 3.3Å; I288-D292 WeakPolarHBondContact O-CB 3.36Å; I288-D292 PolarHBondContact O-N 3.47Å; V290-D292 PolarHBondContact O-N 2.86Å; D292-R296 VanDerWaalsContact CG-CZ 3.49Å; D292-R296 VanDerWaalsContact CG-NH2 3.34Å; D292-R296 WeakPolarHBondContact O-CG 3.27Å; D292-R296 PolarHBondContact O-N 2.65Å; D292-R296 PolarHBondContact O-NH1 2.93Å; D292-R296 IonicContact OD1-CZ 2.69Å; D292-R296 VanDerWaalsContact OD1-CZ 3.27Å; D292-R296 IonicContact OD1-NH1 3.13Å; D292-R296 PolarHBondContact OD1-NH1 2.04Å; D292-R296 VanDerWaalsContact OD1-NH1 3.13Å; D292-R296 IonicContact OD1-NH2 3.73Å; D292-R296 PolarHBondContact OD1-NH2 3.25Å; D292-R296 IonicContact OD2-CZ 3.31Å; D292-R296 IonicContact OD2-NH1 2.63Å; D292-R296 PolarHBondContact OD2-NH1 2.64Å; D292-R296 IonicContact OD2-NH2 2.79Å; D292-R296 PolarHBondContact OD2-NH2 2.87Å
293T85.5Confident86.2Confident56 Ų5654.3 Ų54.334%0.34428%0.277SS..Hα-helixtrans-70.8-49170.3-53.40000111.5L20 N289 V290 C291 E295 R296 V297L20-T293 WeakPolarHBondContact CD2-OG1 3.43Å; N289-T293 PolarHBondContact O-N 2.8Å; N289-T293 VanDerWaalsContact O-N 3.12Å; N289-T293 PolarHBondContact O-OG1 3.29Å; V290-T293 WeakPolarHBondContact O-CB 3.2Å; V290-T293 PolarHBondContact O-N 3.04Å; V290-T293 VanDerWaalsContact O-N 3.12Å; C291-T293 PolarHBondContact O-N 3.39Å; T293-E295 VanDerWaalsContact C-N 3.32Å; T293-E295 PolarHBondContact O-N 3.4Å; T293-R296 PolarHBondContact O-N 2.87Å; T293-V297 HydrophobicContact CG2-CG2 4.44Å; T293-V297 WeakPolarHBondContact O-CG2 3.48Å; T293-V297 PolarHBondContact O-N 3.18Å
294I89.8Confident87.2Confident77 Ų7750.5 Ų50.540%0.39526%0.256SS..Hα-helixtrans-62.1-42.3-178.1-65.4167.7000110.1F273 V290 C291 R296 V297 T298F273-I294 HydrophobicContact CB-CG2 4.47Å; F273-I294 HydrophobicContact CD2-CB 4.04Å; F273-I294 HydrophobicContact CD2-CG2 3.47Å; F273-I294 VanDerWaalsContact CD2-CG2 3.47Å; F273-I294 HydrophobicContact CE2-CB 4.12Å; F273-I294 HydrophobicContact CE2-CG2 4.07Å; F273-I294 HydrophobicContact CG-CG2 4.21Å; V290-I294 HydrophobicContact CG1-CD1 3.82Å; V290-I294 HydrophobicContact CG1-CG1 4.44Å; V290-I294 WeakPolarHBondContact O-CG1 3.38Å; V290-I294 PolarHBondContact O-N 3.34Å; C291-I294 PolarHBondContact O-N 2.94Å; C291-I294 VanDerWaalsContact O-N 3.12Å; I294-R296 PolarHBondContact O-N 2.97Å; I294-V297 PolarHBondContact O-N 2.62Å; I294-T298 HydrophobicContact CG2-CG2 3.94Å; I294-T298 WeakPolarHBondContact O-CB 3.4Å; I294-T298 WeakPolarHBondContact O-CG2 3.34Å; I294-T298 PolarHBondContact O-N 2.89Å; I294-T298 PolarHBondContact O-OG1 3.36Å
295E88.2Confident88.1Confident31 Ų3147.6 Ų47.615%0.14524%0.241CC..Hα-helixtrans-53.6-54.4174.5-170.6-176.8-172.800110.6F273 Y274 C291 T293 V297 T298 V299F273-E295 HydrophobicContact CD1-CB 4.19Å; F273-E295 HydrophobicContact CD1-CG 4.21Å; F273-E295 HydrophobicContact CE1-CB 3.47Å; F273-E295 VanDerWaalsContact CE1-CB 3.47Å; F273-E295 HydrophobicContact CE1-CG 3.57Å; F273-E295 HydrophobicContact CE2-CB 4.3Å; F273-E295 HydrophobicContact CZ-CB 3.54Å; F273-E295 HydrophobicContact CZ-CG 4.14Å; Y274-E295 PolarHBondContact OH-OE1 3.38Å; C291-E295 PolarHBondContact O-N 3.41Å; T293-E295 VanDerWaalsContact C-N 3.32Å; T293-E295 PolarHBondContact O-N 3.4Å; E295-V297 PolarHBondContact O-N 3.25Å; E295-T298 PolarHBondContact O-N 2.98Å; E295-T298 PolarHBondContact O-OG1 3.29Å; E295-V299 HydrophobicContact CG-CG2 4.3Å; E295-V299 WeakPolarHBondContact O-CB 3.06Å; E295-V299 VanDerWaalsContact O-CG2 3.28Å; E295-V299 WeakPolarHBondContact O-CG2 3.38Å; E295-V299 PolarHBondContact O-N 3.3Å
296R89.3Confident89.2Confident12 Ų1240.7 Ų40.75%0.04521%0.211CC..Hα-helixtrans-61.8-42.8-177.5-64.7-165.8-174.484-1.2112.4L23 Y24 E87 D292 T293 I294 I300L23-R296 HydrophobicContact CD2-CB 3.96Å; Y24-R296 HydrophobicContact CD1-CB 4.2Å; Y24-R296 HydrophobicContact CD1-CG 4.24Å; Y24-R296 HydrophobicContact CD2-CG 4.13Å; Y24-R296 HydrophobicContact CE1-CB 3.68Å; Y24-R296 HydrophobicContact CE1-CG 3.78Å; Y24-R296 HydrophobicContact CE2-CB 4.46Å; Y24-R296 HydrophobicContact CE2-CG 3.64Å; Y24-R296 HydrophobicContact CG-CG 4.42Å; Y24-R296 VanDerWaalsContact CZ-CG 3.46Å; E87-R296 IonicContact OE1-CZ 3.89Å; E87-R296 IonicContact OE1-NH2 3.78Å; E87-R296 PolarHBondContact OE1-NH2 3.37Å; D292-R296 VanDerWaalsContact CG-CZ 3.49Å; D292-R296 VanDerWaalsContact CG-NH2 3.34Å; D292-R296 WeakPolarHBondContact O-CG 3.27Å; D292-R296 PolarHBondContact O-N 2.65Å; D292-R296 PolarHBondContact O-NH1 2.93Å; D292-R296 IonicContact OD1-CZ 2.69Å; D292-R296 VanDerWaalsContact OD1-CZ 3.27Å; D292-R296 IonicContact OD1-NH1 3.13Å; D292-R296 PolarHBondContact OD1-NH1 2.04Å; D292-R296 VanDerWaalsContact OD1-NH1 3.13Å; D292-R296 IonicContact OD1-NH2 3.73Å; D292-R296 PolarHBondContact OD1-NH2 3.25Å; D292-R296 IonicContact OD2-CZ 3.31Å; D292-R296 IonicContact OD2-NH1 2.63Å; D292-R296 PolarHBondContact OD2-NH1 2.64Å; D292-R296 IonicContact OD2-NH2 2.79Å; D292-R296 PolarHBondContact OD2-NH2 2.87Å; T293-R296 PolarHBondContact O-N 2.87Å; I294-R296 PolarHBondContact O-N 2.97Å; R296-I300 WeakPolarHBondContact O-CB 3.01Å; R296-I300 WeakPolarHBondContact O-CD1 3.17Å; R296-I300 VanDerWaalsContact O-CG1 3.26Å; R296-I300 WeakPolarHBondContact O-CG1 3.48Å; R296-I300 PolarHBondContact O-N 3.37Å
297V92.7Very high89.9Confident64 Ų6434.8 Ų34.839%0.38818%0.179SC..Hα-helixtrans-61.8-48.1177.3170.80000110.7L23 T293 I294 E295 I300 L301L23-V297 HydrophobicContact CD2-CG2 3.91Å; T293-V297 HydrophobicContact CG2-CG2 4.44Å; T293-V297 WeakPolarHBondContact O-CG2 3.48Å; T293-V297 PolarHBondContact O-N 3.18Å; I294-V297 PolarHBondContact O-N 2.62Å; E295-V297 PolarHBondContact O-N 3.25Å; V297-I300 PolarHBondContact O-N 3.2Å; V297-L301 HydrophobicContact CG1-CD1 4.29Å; V297-L301 WeakPolarHBondContact O-CG 3.27Å; V297-L301 PolarHBondContact O-N 3.09Å
298T93.1Very high90.6Very high8 Ų829.2 Ų29.25%0.04916%0.16CC..Hα-helixtrans-68.8-37.3-176.959.10000112.4P269 F273 I294 E295 L301 Q302P269-T298 HydrophobicContact CB-CG2 3.63Å; F273-T298 HydrophobicContact CB-CG2 4.43Å; I294-T298 HydrophobicContact CG2-CG2 3.94Å; I294-T298 WeakPolarHBondContact O-CB 3.4Å; I294-T298 WeakPolarHBondContact O-CG2 3.34Å; I294-T298 PolarHBondContact O-N 2.89Å; I294-T298 PolarHBondContact O-OG1 3.36Å; E295-T298 PolarHBondContact O-N 2.98Å; E295-T298 PolarHBondContact O-OG1 3.29Å; T298-L301 PolarHBondContact O-N 3.13Å; T298-Q302 PolarHBondContact O-N 3.47Å
299V92.2Very high91.2Very high1 Ų126.9 Ų26.91%0.00615%0.148CC..Hα-helixtrans-63.6-40.8171.5169.30000111.4I2 Q79 V270 E295 Q302 M303I2-V299 HydrophobicContact CD1-CG1 3.83Å; I2-V299 HydrophobicContact CG1-CG1 4.16Å; Q79-V299 HydrophobicContact CG-CG1 4.39Å; V270-V299 HydrophobicContact CG2-CG2 4.34Å; E295-V299 HydrophobicContact CG-CG2 4.3Å; E295-V299 WeakPolarHBondContact O-CB 3.06Å; E295-V299 VanDerWaalsContact O-CG2 3.28Å; E295-V299 WeakPolarHBondContact O-CG2 3.38Å; E295-V299 PolarHBondContact O-N 3.3Å; V299-Q302 WeakPolarHBondContact O-CB 3.44Å; V299-Q302 PolarHBondContact O-N 2.83Å; V299-M303 WeakPolarHBondContact O-CG 3.04Å; V299-M303 PolarHBondContact O-N 3.25Å
300I94.1Very high91.7Very high17 Ų1725.7 Ų25.79%0.08714%0.14CC..Hα-helixtrans-64.3-42.8175.4-75.3161.9000111.2L23 Y24 A27 I31 R296 V297 Q302 M303 I304L23-I300 HydrophobicContact CD1-CD1 4.05Å; L23-I300 HydrophobicContact CD2-CD1 3.53Å; L23-I300 HydrophobicContact CG-CD1 3.38Å; Y24-I300 HydrophobicContact CD1-CD1 4.01Å; Y24-I300 HydrophobicContact CD1-CG1 4.33Å; Y24-I300 HydrophobicContact CE1-CD1 4.13Å; Y24-I300 HydrophobicContact CE1-CG1 4.13Å; A27-I300 HydrophobicContact CB-CD1 3.7Å; A27-I300 HydrophobicContact CB-CG1 4.16Å; A27-I300 HydrophobicContact CB-CG2 4.11Å; I31-I300 HydrophobicContact CD1-CG2 4.24Å; R296-I300 WeakPolarHBondContact O-CB 3.01Å; R296-I300 WeakPolarHBondContact O-CD1 3.17Å; R296-I300 VanDerWaalsContact O-CG1 3.26Å; R296-I300 WeakPolarHBondContact O-CG1 3.48Å; R296-I300 PolarHBondContact O-N 3.37Å; V297-I300 PolarHBondContact O-N 3.2Å; I300-Q302 VanDerWaalsContact C-N 3.29Å; I300-Q302 PolarHBondContact O-N 2.88Å; I300-M303 PolarHBondContact O-N 3.35Å; I300-M303 VanDerWaalsContact O-N 3.11Å; I300-I304 HydrophobicContact CG2-CD1 3.86Å; I300-I304 HydrophobicContact CG2-CG1 4.34Å; I300-I304 VanDerWaalsContact O-CG1 3.31Å; I300-I304 WeakPolarHBondContact O-CG1 3.33Å; I300-I304 PolarHBondContact O-N 3.47Å
301L95.4Very high92.1Very high51 Ų5127.1 Ų27.127%0.26714%0.141SC..Hα-helixtrans-57.9-44.5174.3-69.3172.6000111L266 P269 V297 T298 M303 I304 N305L266-L301 WeakPolarHBondContact CB-O 3.48Å; L266-L301 HydrophobicContact CD2-CB 4.43Å; L266-L301 HydrophobicContact CD2-CD2 3.92Å; L266-L301 CarbonylContact O-C 3.27Å; L266-L301 VanDerWaalsContact O-C 3.27Å; L266-L301 WeakPolarHBondContact O-CB 3.31Å; P269-L301 HydrophobicContact CB-CD1 4.28Å; P269-L301 HydrophobicContact CG-CD1 4.17Å; V297-L301 HydrophobicContact CG1-CD1 4.29Å; V297-L301 WeakPolarHBondContact O-CG 3.27Å; V297-L301 PolarHBondContact O-N 3.09Å; T298-L301 PolarHBondContact O-N 3.13Å; L301-M303 VanDerWaalsContact C-N 3.34Å; L301-M303 PolarHBondContact O-N 3.32Å; L301-I304 WeakPolarHBondContact O-CB 3.31Å; L301-I304 PolarHBondContact O-N 3.44Å; L301-N305 PolarHBondContact O-N 3.22Å; L301-N305 VanDerWaalsContact O-N 3.12Å
302Q94.7Very high92.5Very high0 Ų027.4 Ų27.40%014%0.141CC..Hα-helixtrans-57.7-44.7173.5-175.1-176.53200112M1 Y191 L266 T267 V270 T298 V299 I300 I304 N305 H306M1-Q302 PolarHBondContact SD-NE2 3.47Å; M1-Q302 VanDerWaalsContact SD-NE2 3.45Å; Y191-Q302 WeakPolarHBondContact OH-CG 3.39Å; Y191-Q302 PolarHBondContact OH-NE2 2.94Å; L266-Q302 PolarHBondContact O-N 3.01Å; T267-Q302 HydrophobicContact CG2-CG 4.39Å; V270-Q302 HydrophobicContact CG1-CB 3.93Å; V270-Q302 HydrophobicContact CG1-CG 4.25Å; T298-Q302 PolarHBondContact O-N 3.47Å; V299-Q302 WeakPolarHBondContact O-CB 3.44Å; V299-Q302 PolarHBondContact O-N 2.83Å; I300-Q302 VanDerWaalsContact C-N 3.29Å; I300-Q302 PolarHBondContact O-N 2.88Å; Q302-I304 PolarHBondContact O-N 2.95Å; Q302-N305 VanDerWaalsContact O-CB 3.23Å; Q302-N305 WeakPolarHBondContact O-CB 3.26Å; Q302-N305 PolarHBondContact O-N 2.93Å; Q302-H306 PolarHBondContact O-CD2 3.37Å
303M94.4Very high92.9Very high4 Ų426.9 Ų26.92%0.0214%0.139CC..Hα-helixtrans-66.1-36.6177.7-66.1-57.390.100112.6I2 I31 V71 F104 V299 I300 L301 N305 H306I2-M303 HydrophobicContact CD1-CE 3.52Å; I2-M303 HydrophobicContact CD1-SD 3.84Å; I2-M303 HydrophobicContact CG1-CE 4.46Å; I31-M303 HydrophobicContact CD1-CB 3.99Å; V71-M303 HydrophobicContact CG1-CE 4.33Å; F104-M303 HydrophobicContact CZ-CE 4.06Å; V299-M303 WeakPolarHBondContact O-CG 3.04Å; V299-M303 PolarHBondContact O-N 3.25Å; I300-M303 PolarHBondContact O-N 3.35Å; I300-M303 VanDerWaalsContact O-N 3.11Å; L301-M303 VanDerWaalsContact C-N 3.34Å; L301-M303 PolarHBondContact O-N 3.32Å; M303-N305 PolarHBondContact O-N 3.48Å; M303-H306 PolarHBondContact O-N 3.13Å
304I96.1Very high93.2Very high50 Ų5025.6 Ų25.626%0.25613%0.132SC..Hα-helixtrans-59.4-37.8174.6-69.9167.1000110.3I31 L266 I300 L301 Q302 H306 M307 T308I31-I304 HydrophobicContact CD1-CG1 3.78Å; I31-I304 HydrophobicContact CG1-CG1 4.23Å; L266-I304 HydrophobicContact CD1-CG2 4.05Å; L266-I304 HydrophobicContact CD2-CG2 4.29Å; I300-I304 HydrophobicContact CG2-CD1 3.86Å; I300-I304 HydrophobicContact CG2-CG1 4.34Å; I300-I304 VanDerWaalsContact O-CG1 3.31Å; I300-I304 WeakPolarHBondContact O-CG1 3.33Å; I300-I304 PolarHBondContact O-N 3.47Å; L301-I304 WeakPolarHBondContact O-CB 3.31Å; L301-I304 PolarHBondContact O-N 3.44Å; Q302-I304 PolarHBondContact O-N 2.95Å; I304-H306 VanDerWaalsContact C-N 3.29Å; I304-H306 PolarHBondContact O-N 3.31Å; I304-M307 PolarHBondContact O-N 2.68Å; I304-T308 HydrophobicContact CG2-CG2 3.98Å; I304-T308 WeakPolarHBondContact O-CG2 3.36Å; I304-T308 PolarHBondContact O-N 3.26Å; I304-T308 VanDerWaalsContact O-N 3.09Å
305N95.5Very high93.3Very high1 Ų127.3 Ų27.31%0.00515%0.149CC..Hα-helixtrans-50.1-49.4176.917956.4000112H263 L266 T267 L301 Q302 M303 M307 T308H263-N305 WeakPolarHBondContact CA-OD1 3.34Å; H263-N305 PolarHBondContact N-OD1 2.92Å; H263-N305 PolarHBondContact ND1-ND2 3.36Å; L266-N305 HydrophobicContact CB-CB 3.9Å; L266-N305 HydrophobicContact CD1-CB 4.07Å; T267-N305 HydrophobicContact CG2-CB 3.93Å; L301-N305 PolarHBondContact O-N 3.22Å; L301-N305 VanDerWaalsContact O-N 3.12Å; Q302-N305 VanDerWaalsContact O-CB 3.23Å; Q302-N305 WeakPolarHBondContact O-CB 3.26Å; Q302-N305 PolarHBondContact O-N 2.93Å; M303-N305 PolarHBondContact O-N 3.48Å; N305-M307 PolarHBondContact O-N 3.15Å; N305-T308 PolarHBondContact O-N 3.44Å; N305-T308 PolarHBondContact O-OG1 2.9Å
306H95.7Very high93.5Very high0 Ų026.2 Ų26.20%015%0.145CC..Hα-helixtrans-65.9-19.4-177.8-66.8-74.8000113.7N39 D68 V71 I72 Q302 M303 I304N39-H306 PolarHBondContact ND2-O 3.2Å; D68-H306 HydrophobicContact CB-CB 4.22Å; D68-H306 WeakPolarHBondContact CB-O 3.39Å; D68-H306 IonicContact OD1-CE1 3.37Å; D68-H306 IonicContact OD1-CG 3.09Å; D68-H306 IonicContact OD1-ND1 2.6Å; D68-H306 PolarHBondContact OD1-ND1 2.86Å; V71-H306 HydrophobicContact CG1-CB 4.5Å; I72-H306 HydrophobicContact CD1-CB 4.09Å; I72-H306 HydrophobicContact CG1-CB 3.84Å; Q302-H306 PolarHBondContact O-CD2 3.37Å; M303-H306 PolarHBondContact O-N 3.13Å; I304-H306 VanDerWaalsContact C-N 3.29Å; I304-H306 PolarHBondContact O-N 3.31Å
307M94.9Very high93.5Very high22 Ų2226.1 Ų26.111%0.10815%0.146CC..Hα-helixtrans-90.1-23.3174.3171.317678.700112.6I31 I34 I72 I304 N305 H309 F311I31-M307 HydrophobicContact CG1-CE 4.47Å; I31-M307 HydrophobicContact CG2-CB 4.36Å; I31-M307 HydrophobicContact CG2-SD 4.26Å; I34-M307 HydrophobicContact CB-SD 3.57Å; I34-M307 VanDerWaalsContact CB-SD 3.57Å; I34-M307 HydrophobicContact CG2-CE 4.48Å; I34-M307 HydrophobicContact CG2-CG 4.24Å; I34-M307 HydrophobicContact CG2-SD 3.45Å; I34-M307 WeakPolarHBondContact CG2-SD 3.04Å; I72-M307 HydrophobicContact CD1-CB 4.01Å; I304-M307 PolarHBondContact O-N 2.68Å; N305-M307 PolarHBondContact O-N 3.15Å; M307-H309 PolarHBondContact O-N 3.44Å; M307-F311 HydrophobicContact CE-CE2 4.47Å; M307-F311 HydrophobicContact CG-CE2 4.02Å; M307-F311 HydrophobicContact SD-CE2 4.49Å
308T94.8Very high93.3Very high18 Ų1826.7 Ų26.711%0.1115%0.153CC..Hα-helixtrans-63.6-27.5-171.163.20000114.2L266 I304 N305 F310 F311 I312L266-T308 HydrophobicContact CD1-CG2 3.52Å; I304-T308 HydrophobicContact CG2-CG2 3.98Å; I304-T308 WeakPolarHBondContact O-CG2 3.36Å; I304-T308 PolarHBondContact O-N 3.26Å; I304-T308 VanDerWaalsContact O-N 3.09Å; N305-T308 PolarHBondContact O-N 3.44Å; N305-T308 PolarHBondContact O-OG1 2.9Å; T308-F310 VanDerWaalsContact C-N 3.31Å; T308-F310 PolarHBondContact O-N 3.45Å; T308-F311 WeakPolarHBondContact O-CB 3.34Å; T308-F311 PolarHBondContact O-N 3.01Å; T308-I312 WeakPolarHBondContact O-CG1 3.32Å; T308-I312 PolarHBondContact O-N 3.03Å
309H92.2Very high93.1Very high0 Ų028.3 Ų28.30%016%0.163CC..Hα-helixtrans-56-41.8-173.3-66.9158.3000113.1D68 M259 M307 F311 I312 Y313D68-H309 IonicContact OD2-CE1 3.73Å; D68-H309 PolarHBondContact OD2-CE1 2.69Å; D68-H309 VanDerWaalsContact OD2-CE1 3.31Å; D68-H309 IonicContact OD2-CG 3.18Å; D68-H309 IonicContact OD2-ND1 3.4Å; D68-H309 PolarHBondContact OD2-ND1 2.77Å; M259-H309 HydrophobicContact CE-CB 4.37Å; M307-H309 PolarHBondContact O-N 3.44Å; H309-F311 VanDerWaalsContact C-N 3.32Å; H309-F311 PolarHBondContact O-N 3.34Å; H309-I312 PolarHBondContact O-N 2.81Å; H309-Y313 HydrophobicContact CB-CE2 3.78Å; H309-Y313 WeakPolarHBondContact O-CD2 2.94Å; H309-Y313 WeakPolarHBondContact O-CE2 2.99Å; H309-Y313 VanDerWaalsContact O-CG 3.26Å; H309-Y313 PolarHBondContact O-N 3.12Å
310F91.8Very high93.1Very high40 Ų4028.3 Ų28.318%0.17516%0.163CC..Hα-helixtrans-54-46.8174.7172.6-99.6000112.6G38 L41 S42 T308 Y313 S314 F320G38-F310 VanDerWaalsContact O-CD2 3.31Å; G38-F310 WeakPolarHBondContact O-CD2 3.22Å; L41-F310 HydrophobicContact CD2-CE2 4.17Å; S42-F310 WeakPolarHBondContact OG-CD2 3.4Å; T308-F310 VanDerWaalsContact C-N 3.31Å; T308-F310 PolarHBondContact O-N 3.45Å; F310-Y313 PolarHBondContact O-N 3.02Å; F310-S314 PolarHBondContact O-N 3.29Å; F310-S314 VanDerWaalsContact O-N 3.1Å; F310-S314 PolarHBondContact O-OG 3.46Å; F310-F320 HydrophobicContact CD2-CE1 4.48Å; F310-F320 HydrophobicContact CD2-CZ 4.08Å; F310-F320 HydrophobicContact CE2-CE1 4.26Å; F310-F320 HydrophobicContact CE2-CZ 4.08Å
311F93.9Very high93Very high96 Ų9631 Ų3142%0.42118%0.176SC..Hα-helixtrans-67.9-41.2178.7-60.5-74.3000111.3I34 M307 T308 H309 Y313 S314 C315I34-F311 HydrophobicContact CG2-CE2 4.05Å; I34-F311 HydrophobicContact CG2-CZ 3.69Å; M307-F311 HydrophobicContact CE-CE2 4.47Å; M307-F311 HydrophobicContact CG-CE2 4.02Å; M307-F311 HydrophobicContact SD-CE2 4.49Å; T308-F311 WeakPolarHBondContact O-CB 3.34Å; T308-F311 PolarHBondContact O-N 3.01Å; H309-F311 VanDerWaalsContact C-N 3.32Å; H309-F311 PolarHBondContact O-N 3.34Å; F311-Y313 PolarHBondContact O-N 2.93Å; F311-S314 WeakPolarHBondContact O-CB 3.34Å; F311-S314 PolarHBondContact O-N 3.12Å; F311-C315 PolarHBondContact O-N 2.85Å; F311-C315 PolarHBondContact O-SG 3.48Å; F311-C315 VanDerWaalsContact O-SG 3.41Å
312I94.6Very high92.9Very high17 Ų1732 Ų329%0.08719%0.188CC..Hα-helixtrans-61.7-44.3177.2-64171.4000110.6T255 C258 M259 T308 H309 S314 C315 T316T255-I312 HydrophobicContact CG2-CG2 4.2Å; C258-I312 HydrophobicContact CB-CG2 3.69Å; M259-I312 HydrophobicContact CB-CD1 4.47Å; M259-I312 HydrophobicContact CG-CD1 3.97Å; M259-I312 HydrophobicContact CG-CG2 4.07Å; T308-I312 WeakPolarHBondContact O-CG1 3.32Å; T308-I312 PolarHBondContact O-N 3.03Å; H309-I312 PolarHBondContact O-N 2.81Å; I312-S314 VanDerWaalsContact C-N 3.32Å; I312-S314 PolarHBondContact O-N 2.03Å; I312-C315 PolarHBondContact O-N 3.39Å; I312-T316 HydrophobicContact CG2-CG2 4.03Å; I312-T316 VanDerWaalsContact O-CB 3.29Å; I312-T316 WeakPolarHBondContact O-CB 3.45Å; I312-T316 WeakPolarHBondContact O-CG2 3.48Å; I312-T316 PolarHBondContact O-N 3Å; I312-T316 PolarHBondContact O-OG1 3.43Å
313Y92.8Very high92.8Very high0 Ų032.2 Ų32.20%019%0.189CC..Hα-helixtrans-60.9-43.6176-60.7-49.7000112W46 I61 M64 T255 M259 H309 F310 F311 C315 T316 S317 F320W46-Y313 AromaticContact CZ2-CD1 3.92Å; W46-Y313 HydrophobicContact CZ2-CD1 3.92Å; W46-Y313 HydrophobicContact CZ2-CE1 4.23Å; W46-Y313 HydrophobicContact CZ2-CG 4.46Å; W46-Y313 AromaticContact NE1-CD1 3.85Å; W46-Y313 AromaticContact NE1-CD2 3.79Å; W46-Y313 AromaticContact NE1-CE1 3.87Å; W46-Y313 AromaticContact NE1-CE2 3.87Å; W46-Y313 AromaticContact NE1-CG 3.82Å; W46-Y313 AromaticContact NE1-CZ 3.94Å; I61-Y313 HydrophobicContact CD1-CE1 4.14Å; I61-Y313 HydrophobicContact CG2-CE1 3.85Å; I61-Y313 HydrophobicContact CG2-CE2 4.12Å; I61-Y313 VanDerWaalsContact CG2-CZ 3.45Å; I61-Y313 WeakPolarHBondContact CG2-OH 3.33Å; M64-Y313 WeakPolarHBondContact CE-OH 3.47Å; T255-Y313 HydrophobicContact CG2-CD1 3.8Å; T255-Y313 HydrophobicContact CG2-CE1 3.87Å; M259-Y313 HydrophobicContact CE-CD1 3.96Å; M259-Y313 HydrophobicContact CE-CE1 3.04Å; M259-Y313 HydrophobicContact CE-CE2 4.28Å; M259-Y313 WeakPolarHBondContact CE-OH 3.46Å; H309-Y313 HydrophobicContact CB-CE2 3.78Å; H309-Y313 WeakPolarHBondContact O-CD2 2.94Å; H309-Y313 WeakPolarHBondContact O-CE2 2.99Å; H309-Y313 VanDerWaalsContact O-CG 3.26Å; H309-Y313 PolarHBondContact O-N 3.12Å; F310-Y313 PolarHBondContact O-N 3.02Å; F311-Y313 PolarHBondContact O-N 2.93Å; Y313-C315 VanDerWaalsContact C-N 3.3Å; Y313-C315 PolarHBondContact O-N 3.48Å; Y313-T316 PolarHBondContact O-N 2.91Å; Y313-S317 WeakPolarHBondContact O-CB 3.32Å; Y313-S317 PolarHBondContact O-N 3.18Å; Y313-F320 HydrophobicContact CD2-CE2 4.31Å; Y313-F320 HydrophobicContact CG-CD2 4.35Å; Y313-F320 HydrophobicContact CG-CE2 4.45Å
314S91.7Very high92.7Very high29 Ų2933.1 Ų33.120%0.20319%0.194CC..Hα-helixtrans-60.3-39.4-179.9-590000112.1F310 F311 I312 F320F310-S314 PolarHBondContact O-N 3.29Å; F310-S314 VanDerWaalsContact O-N 3.1Å; F310-S314 PolarHBondContact O-OG 3.46Å; F311-S314 WeakPolarHBondContact O-CB 3.34Å; F311-S314 PolarHBondContact O-N 3.12Å; I312-S314 VanDerWaalsContact C-N 3.32Å; I312-S314 PolarHBondContact O-N 2.03Å; S314-F320 WeakPolarHBondContact OG-CE1 3.4Å
315C91.9Very high92.6Very high112 Ų11234.4 Ų34.476%0.75720%0.201SC*.Hα-helixtrans-84.2-32.3-179.8-64.60000113.7F311 I312 Y313F311-C315 PolarHBondContact O-N 2.85Å; F311-C315 PolarHBondContact O-SG 3.48Å; F311-C315 VanDerWaalsContact O-SG 3.41Å; I312-C315 PolarHBondContact O-N 3.39Å; Y313-C315 VanDerWaalsContact C-N 3.3Å; Y313-C315 PolarHBondContact O-N 3.48Å
316T91Very high92.4Very high8 Ų840.9 Ų40.95%0.04923%0.226CC..Hα-helixtrans-103.2-20.2-169.564.80000114.3R254 T255 C258 I312 Y313R254-T316 HydrophobicContact CG-CG2 4.04Å; R254-T316 PolarHBondContact NE-O 3.22Å; R254-T316 PolarHBondContact NH2-O 2.7Å; T255-T316 WeakPolarHBondContact CB-OG1 3.07Å; T255-T316 WeakPolarHBondContact OG1-CB 3.47Å; T255-T316 PolarHBondContact OG1-OG1 3.43Å; C258-T316 HydrophobicContact CB-CG2 4.21Å; I312-T316 HydrophobicContact CG2-CG2 4.03Å; I312-T316 VanDerWaalsContact O-CB 3.29Å; I312-T316 WeakPolarHBondContact O-CB 3.45Å; I312-T316 WeakPolarHBondContact O-CG2 3.48Å; I312-T316 PolarHBondContact O-N 3Å; I312-T316 PolarHBondContact O-OG1 3.43Å; Y313-T316 PolarHBondContact O-N 2.91Å
317S89.8Confident92.1Very high11 Ų1142.5 Ų42.58%0.07723%0.234CC..  trans-118.9102.2-174.4-179.40000111.7Y313 V319 F320 L321Y313-S317 WeakPolarHBondContact O-CB 3.32Å; Y313-S317 PolarHBondContact O-N 3.18Å; S317-V319 PolarHBondContact O-N 3.01Å; S317-F320 WeakPolarHBondContact O-CB 3.31Å; S317-F320 PolarHBondContact O-N 3.36Å; S317-F320 VanDerWaalsContact O-N 3.13Å; S317-F320 WeakPolarHBondContact OG-CB 3.35Å; S317-F320 PolarHBondContact OG-N 3.44Å; S317-F320 VanDerWaalsContact OG-N 3.13Å; S317-L321 PolarHBondContact O-N 2.89Å
318S89.4Confident91.7Very high75 Ų7545.3 Ų45.352%0.52426%0.255SS..Hα-helixtrans-59.9-28.5172.556.60000112.7S322S318-S322 WeakPolarHBondContact O-CB 3.29Å; S318-S322 PolarHBondContact O-N 3.43Å
319V88.8Confident91.3Very high43 Ų4352.5 Ų52.526%0.26129%0.285SS..Hα-helixtrans-67.5-45.8176.3177.40000110.7S317 S322 D323S317-V319 PolarHBondContact O-N 3.01Å; V319-S322 PolarHBondContact O-N 3.48Å; V319-D323 PolarHBondContact O-N 2.99Å
320F91.8Very high90.6Very high1 Ų158.1 Ų58.10%0.00432%0.315CS..Hα-helixtrans-61.2-48.5175.9179.8-93.9000110.9S42 I45 W46 F310 Y313 S314 S317 S322 D323 L324S42-F320 WeakPolarHBondContact OG-CE2 3.47Å; S42-F320 VanDerWaalsContact OG-CZ 3.29Å; S42-F320 WeakPolarHBondContact OG-CZ 3.38Å; I45-F320 HydrophobicContact CB-CD2 4.41Å; I45-F320 HydrophobicContact CB-CE2 4.15Å; I45-F320 HydrophobicContact CD1-CD2 4.2Å; I45-F320 HydrophobicContact CD1-CE2 3.59Å; I45-F320 HydrophobicContact CD1-CZ 3.76Å; I45-F320 HydrophobicContact CG1-CE2 4.48Å; I45-F320 HydrophobicContact CG2-CD2 3.82Å; I45-F320 HydrophobicContact CG2-CE2 4.07Å; W46-F320 AromaticContact CE2-CD2 4Å; W46-F320 HydrophobicContact CZ2-CB 4.41Å; W46-F320 HydrophobicContact CZ2-CD2 4.27Å; W46-F320 AromaticContact NE1-CD2 3.64Å; W46-F320 AromaticContact NE1-CE2 3.91Å; F310-F320 HydrophobicContact CD2-CE1 4.48Å; F310-F320 HydrophobicContact CD2-CZ 4.08Å; F310-F320 HydrophobicContact CE2-CE1 4.26Å; F310-F320 HydrophobicContact CE2-CZ 4.08Å; Y313-F320 HydrophobicContact CD2-CE2 4.31Å; Y313-F320 HydrophobicContact CG-CD2 4.35Å; Y313-F320 HydrophobicContact CG-CE2 4.45Å; S314-F320 WeakPolarHBondContact OG-CE1 3.4Å; S317-F320 WeakPolarHBondContact O-CB 3.31Å; S317-F320 PolarHBondContact O-N 3.36Å; S317-F320 VanDerWaalsContact O-N 3.13Å; S317-F320 WeakPolarHBondContact OG-CB 3.35Å; S317-F320 PolarHBondContact OG-N 3.44Å; S317-F320 VanDerWaalsContact OG-N 3.13Å; F320-S322 VanDerWaalsContact C-N 3.33Å; F320-S322 PolarHBondContact O-N 2.7Å; F320-D323 PolarHBondContact O-N 3.19Å; F320-L324 HydrophobicContact CE1-CD2 4.15Å; F320-L324 WeakPolarHBondContact O-CB 3.47Å; F320-L324 PolarHBondContact O-N 3.39Å
321L92.2Very high89.2Confident72 Ų7263.6 Ų63.638%0.37734%0.341SS..Hα-helixtrans-62.2-38.7-179.3-172.563.2000112.5S317 L324 N325S317-L321 PolarHBondContact O-N 2.89Å; L321-L324 HydrophobicContact CD1-CD2 4.46Å; L321-L324 PolarHBondContact O-N 3.2Å; L321-N325 WeakPolarHBondContact O-CB 3.1Å; L321-N325 PolarHBondContact O-N 3.11Å; L321-N325 PolarHBondContact O-ND2 2.86Å
322S92.5Very high87.1Confident72 Ų7262.5 Ų62.550%0.50334%0.343SS..Hα-helixtrans-62-43.7175.7-179.60000112.2S318 V319 F320 R326S318-S322 WeakPolarHBondContact O-CB 3.29Å; S318-S322 PolarHBondContact O-N 3.43Å; V319-S322 PolarHBondContact O-N 3.48Å; F320-S322 VanDerWaalsContact C-N 3.33Å; F320-S322 PolarHBondContact O-N 2.7Å; S322-R326 PolarHBondContact O-N 3.05Å
323D92.8Very high84.7Confident6 Ų668.8 Ų68.83%0.03238%0.376CS..Hα-helixtrans-71.9-39.3178.1-74.2-17.9000112.7I45 R49 V319 F320 N325 R326 L327I45-D323 HydrophobicContact CG2-CB 3.85Å; R49-D323 IonicContact CZ-OD1 2.8Å; R49-D323 IonicContact CZ-OD2 3.48Å; R49-D323 IonicContact NE-OD2 3.22Å; R49-D323 PolarHBondContact NE-OD2 3.39Å; R49-D323 IonicContact NH2-OD1 2.64Å; R49-D323 PolarHBondContact NH2-OD1 3.04Å; R49-D323 IonicContact NH2-OD2 3.08Å; R49-D323 PolarHBondContact NH2-OD2 3.1Å; V319-D323 PolarHBondContact O-N 2.99Å; F320-D323 PolarHBondContact O-N 3.19Å; D323-N325 VanDerWaalsContact C-N 3.31Å; D323-N325 PolarHBondContact O-N 3.37Å; D323-R326 WeakPolarHBondContact O-CB 3.48Å; D323-R326 PolarHBondContact O-N 2.93Å; D323-R326 VanDerWaalsContact O-N 3.15Å; D323-R326 IonicContact OD1-CZ 3.36Å; D323-R326 IonicContact OD1-NH1 3.63Å; D323-R326 IonicContact OD1-NH2 2.72Å; D323-R326 PolarHBondContact OD1-NH2 2.99Å; D323-L327 WeakPolarHBondContact O-CG 3.44Å; D323-L327 PolarHBondContact O-N 3.3Å
324L92.9Very high82.1Confident22 Ų2277.2 Ų77.212%0.11541%0.413CS..Hα-helixtrans-56.4-49.2173.1178.361.7000110.2L41 I45 F320 L321 R326 L327 C328L41-L324 HydrophobicContact CD1-CD1 4.42Å; L41-L324 HydrophobicContact CD2-CD1 3.45Å; L41-L324 VanDerWaalsContact CD2-CD1 3.45Å; L41-L324 HydrophobicContact CG-CD1 4.07Å; I45-L324 HydrophobicContact CD1-CB 4.13Å; I45-L324 HydrophobicContact CD1-CD1 4.2Å; F320-L324 HydrophobicContact CE1-CD2 4.15Å; F320-L324 WeakPolarHBondContact O-CB 3.47Å; F320-L324 PolarHBondContact O-N 3.39Å; L321-L324 HydrophobicContact CD1-CD2 4.46Å; L321-L324 PolarHBondContact O-N 3.2Å; L324-R326 VanDerWaalsContact C-N 3.29Å; L324-R326 PolarHBondContact O-N 2.63Å; L324-L327 WeakPolarHBondContact O-CB 3.36Å; L324-L327 PolarHBondContact O-N 2.65Å; L324-L327 VanDerWaalsContact O-N 3.13Å; L324-C328 PolarHBondContact O-N 3.34Å; L324-C328 PolarHBondContact O-SG 3.12Å; L324-C328 VanDerWaalsContact O-SG 3.33Å
325N92.8Very high79.6Confident78 Ų7881 Ų8142%0.41744%0.438SS..Hα-helixtrans-60.7-37.6176.2-73.7-22.9000112.4L321 D323 C328 K329L321-N325 WeakPolarHBondContact O-CB 3.1Å; L321-N325 PolarHBondContact O-N 3.11Å; L321-N325 PolarHBondContact O-ND2 2.86Å; D323-N325 VanDerWaalsContact C-N 3.31Å; D323-N325 PolarHBondContact O-N 3.37Å; N325-C328 PolarHBondContact O-N 2.86Å; N325-K329 WeakPolarHBondContact O-CB 3.2Å; N325-K329 VanDerWaalsContact O-CG 3.27Å; N325-K329 WeakPolarHBondContact O-CG 3.3Å; N325-K329 PolarHBondContact O-N 3.29Å
326R91.2Very high77.1Confident136 Ų13681.2 Ų81.251%0.51344%0.44SS..Hα-helixtrans-66.7-39.4175.2-174.3175.963.4-145.4-11.1111.9S322 D323 L324 K329 N330S322-R326 PolarHBondContact O-N 3.05Å; D323-R326 WeakPolarHBondContact O-CB 3.48Å; D323-R326 PolarHBondContact O-N 2.93Å; D323-R326 VanDerWaalsContact O-N 3.15Å; D323-R326 IonicContact OD1-CZ 3.36Å; D323-R326 IonicContact OD1-NH1 3.63Å; D323-R326 IonicContact OD1-NH2 2.72Å; D323-R326 PolarHBondContact OD1-NH2 2.99Å; L324-R326 VanDerWaalsContact C-N 3.29Å; L324-R326 PolarHBondContact O-N 2.63Å; R326-K329 PolarHBondContact O-N 2.76Å; R326-N330 VanDerWaalsContact O-CB 3.27Å; R326-N330 WeakPolarHBondContact O-CB 3.28Å; R326-N330 PolarHBondContact O-N 3.13Å
327L89.4Confident74.6Confident34 Ų3487.8 Ų87.818%0.17847%0.47CS..Hα-helixtrans-63.4-45.7175-70.8175.3000111.3L41 I45 D323 L324 K329 N330 H331L41-L327 HydrophobicContact CD1-CD1 3.82Å; I45-L327 HydrophobicContact CD1-CD1 3.95Å; I45-L327 HydrophobicContact CG1-CD1 3.44Å; I45-L327 VanDerWaalsContact CG1-CD1 3.44Å; D323-L327 WeakPolarHBondContact O-CG 3.44Å; D323-L327 PolarHBondContact O-N 3.3Å; L324-L327 WeakPolarHBondContact O-CB 3.36Å; L324-L327 PolarHBondContact O-N 2.65Å; L324-L327 VanDerWaalsContact O-N 3.13Å; L327-K329 PolarHBondContact O-N 3.33Å; L327-N330 PolarHBondContact O-N 3.4Å; L327-H331 PolarHBondContact O-N 3.4Å; L327-H331 VanDerWaalsContact O-N 3.11Å
328C88.2Confident72.3Confident82 Ų8292.2 Ų92.255%0.55450%0.501SS*.Hα-helixtrans-64-38.9177.4-64.10000112.4L324 N325 H331L324-C328 PolarHBondContact O-N 3.34Å; L324-C328 PolarHBondContact O-SG 3.12Å; L324-C328 VanDerWaalsContact O-SG 3.33Å; N325-C328 PolarHBondContact O-N 2.86Å; C328-H331 CarbonylContact O-C 3.47Å
329K86.6Confident70.2Confident168 Ų16894.1 Ų94.173%0.7351%0.509SS*.Hα-helixtrans-72.8-34.6178-74.4179.6179.6-172.40113.5N325 R326 L327 H331 P332N325-K329 WeakPolarHBondContact O-CB 3.2Å; N325-K329 VanDerWaalsContact O-CG 3.27Å; N325-K329 WeakPolarHBondContact O-CG 3.3Å; N325-K329 PolarHBondContact O-N 3.29Å; R326-K329 PolarHBondContact O-N 2.76Å; L327-K329 PolarHBondContact O-N 3.33Å; K329-H331 VanDerWaalsContact C-N 3.32Å; K329-P332 WeakPolarHBondContact O-CD 3.44Å
330N76.7Confident67.8Low118 Ų11898.7 Ų98.763%0.63153%0.532SS*.Hα-helixtrans-81.1-13179.4-69.7-2.2000113R326 L327 P332R326-N330 VanDerWaalsContact O-CB 3.27Å; R326-N330 WeakPolarHBondContact O-CB 3.28Å; R326-N330 PolarHBondContact O-N 3.13Å; L327-N330 PolarHBondContact O-N 3.4Å; N330-P332 VanDerWaalsContact O-CD 3.29Å; N330-P332 WeakPolarHBondContact O-CD 3.23Å
331H63.1Low65.2Low155 Ų155103.8 Ų103.872%0.71856%0.563SS**  trans-11169.6166.9-96.1-82.3000110L327 C328 K329 L333L327-H331 PolarHBondContact O-N 3.4Å; L327-H331 VanDerWaalsContact O-N 3.11Å; C328-H331 CarbonylContact O-C 3.47Å; K329-H331 VanDerWaalsContact C-N 3.32Å; H331-L333 PolarHBondContact O-N 3.24Å
332P48.3Very low62.9Low73 Ų73106.3 Ų106.347%0.47458%0.582SS.*  trans-55.7122.4156.427.2-29.4000105.6K329 N330 K334K329-P332 WeakPolarHBondContact O-CD 3.44Å; N330-P332 VanDerWaalsContact O-CD 3.29Å; N330-P332 WeakPolarHBondContact O-CD 3.23Å; P332-K334 VanDerWaalsContact C-N 3.28Å; P332-K334 PolarHBondContact O-N 3.08Å
333L44.6Very low60.5Low150 Ų150108.8 Ų108.879%0.78559%0.59SS**  trans-48.4101.1166.5-84.4134.6000106.6H331 C335H331-L333 PolarHBondContact O-N 3.24Å; L333-C335 PolarHBondContact O-N 3.48Å
334K39.1Very low58Low177 Ų177112.1 Ų112.177%0.7761%0.61SS**G310 helixtrans-64.24176.8-86.4-172.7175-177.20112.3P332 C336P332-K334 VanDerWaalsContact C-N 3.28Å; P332-K334 PolarHBondContact O-N 3.08Å; K334-C336 VanDerWaalsContact C-N 3.26Å; K334-C336 PolarHBondContact O-N 3.07Å
335C39.5Very low55.3Low108 Ų108121.6 Ų121.673%0.7364%0.644SS**G310 helixtrans-64.6-22.7172.7-78.50000114.3L333L333-C335 PolarHBondContact O-N 3.48Å
336C38.5Very low52.7Low117 Ų117123.9 Ų123.979%0.79166%0.656SS**G310 helixtrans-1149.9-176.9-680000115.8K334K334-C336 VanDerWaalsContact C-N 3.26Å; K334-C336 PolarHBondContact O-N 3.07Å
337Q37.7Very low50.4Low145 Ų145122.3 Ų122.368%0.67866%0.656SS**SBendtrans-105.28.9175.1-81.5-170.5-17.100114.9V339Q337-V339 VanDerWaalsContact C-N 3.28Å; Q337-V339 PolarHBondContact O-N 3.16Å
338S41.3Very low48Very low105 Ų105125.8 Ų125.873%0.73468%0.675SS**SBendtrans-90.830.5167.980.10000113.4
339V45.7Very low45.6Very low114 Ų114126.1 Ų126.169%0.69168%0.675SS**SBendtrans-146.9110.7162.5-170.10000106.8Q337Q337-V339 VanDerWaalsContact C-N 3.28Å; Q337-V339 PolarHBondContact O-N 3.16Å
340N38.3Very low43.3Very low139 Ų139122.3 Ų122.374%0.74367%0.669SS**SBendtrans116.732.4172.2-61.1-14000118.7
341T38.5Very low41.5Very low108 Ų108121.5 Ų121.566%0.66366%0.664SS**  trans-121.121.6159.935.90000115.1N343T341-N343 VanDerWaalsContact C-N 3.34Å
342T43Very low40.2Very low125 Ų125120.6 Ų120.677%0.76767%0.665SS**SBendtrans-80.6-14.7162-27.10000112.5
343N41.5Very low39.6Very low125 Ų125123.2 Ų123.267%0.66867%0.674SS**SBendtrans-100-8.9-174.7-107.4-5.6000116.5T341T341-N343 VanDerWaalsContact C-N 3.34Å
344T41.2Very low39.5Very low75 Ų75121.4 Ų121.446%0.4667%0.669SS.*SBendtrans-93.6-14.4179.8-1.40000114.2L346T344-L346 PolarHBondContact O-N 3.47Å
345R36.3Very low39.3Very low221 Ų221119.8 Ų119.883%0.83467%0.669SS**THydrogen-bonded Turntrans-72.2-17.4170-88.3-172.9179.1-179.70.3113.5T349R345-T349 PolarHBondContact O-OG1 3.27Å
346L37.6Very low38.9Very low127 Ų127118.3 Ų118.367%0.66566%0.66SS**THydrogen-bonded Turntrans-85.2-26.4176.5-99.2140.2000113.2T344T344-L346 PolarHBondContact O-N 3.47Å
347I43.2Very low38.7Very low102 Ų102120.7 Ų120.752%0.52366%0.659SS.*Hα-helixtrans-82.9-35.4-174.8-60.1176.3000111.9T349 C350I347-T349 VanDerWaalsContact C-N 3.34Å; I347-T349 PolarHBondContact O-N 3.32Å; I347-C350 PolarHBondContact O-N 3.25Å
348N38.2Very low38.3Very low107 Ų107120.3 Ų120.357%0.57267%0.667SS**Hα-helixtrans-77.8-18-178-73.6-0.4000114.1C350N348-C350 VanDerWaalsContact C-N 3.33Å
349T39.7Very low37.7Very low90 Ų90121.7 Ų121.755%0.55267%0.67SS**Hα-helixtrans-74.4-26.6174.1-29.60000111.6R345 I347R345-T349 PolarHBondContact O-OG1 3.27Å; I347-T349 VanDerWaalsContact C-N 3.34Å; I347-T349 PolarHBondContact O-N 3.32Å
350C37.6Very low36.7Very low88 Ų88124.1 Ų124.160%0.59568%0.68SS**Hα-helixtrans-77.3-34.4176-940000113.2I347 N348I347-C350 PolarHBondContact O-N 3.25Å; N348-C350 VanDerWaalsContact C-N 3.33Å
351N37.8Very low36.4Very low101 Ų101123.2 Ų123.254%0.5468%0.683SS.*Hα-helixtrans-76.3-27.6-176.1-73.1-5.4000113.4L353N351-L353 VanDerWaalsContact C-N 3.31Å; N351-L353 PolarHBondContact O-N 2.84Å
352N35.8Very low36Very low135 Ų135123 Ų12372%0.72269%0.686SS**THydrogen-bonded Turntrans-82.8-4.9179.6-74.5-10.9000114.4
353L37.4Very low35.4Very low129 Ų129126.3 Ų126.368%0.67569%0.692SS**THydrogen-bonded Turntrans-93.6-9.8175.3-96.5152.3000113.2N351 S356N351-L353 VanDerWaalsContact C-N 3.31Å; N351-L353 PolarHBondContact O-N 2.84Å; L353-S356 PolarHBondContact O-OG 3.08Å
354V40.7Very low35Very low112 Ų112125.5 Ų125.568%0.67970%0.703SS**THydrogen-bonded Turntrans-92.3-26.3-179.3-1790000112.2S356V354-S356 VanDerWaalsContact C-N 3.33Å; V354-S356 PolarHBondContact O-N 2.98Å
355D35.2Very low34.5Very low142 Ų142127.4 Ų127.476%0.75972%0.719SS**SBendtrans-90.36.7-178.8-70.5-23000114H357D355-H357 VanDerWaalsContact C-N 3.26Å; D355-H357 PolarHBondContact O-N 2.98Å
356S31.3Very low34.3Very low77 Ų77122.7 Ų122.754%0.53872%0.717SS.*  trans-82.368.5169.3580000111.5L353 V354L353-S356 PolarHBondContact O-OG 3.08Å; V354-S356 VanDerWaalsContact C-N 3.33Å; V354-S356 PolarHBondContact O-N 2.98Å
357H34.6Very low34.4Very low167 Ų167128.3 Ų128.377%0.77375%0.745SS**  trans-136.5127.6154.6-84.9-65000110D355D355-H357 VanDerWaalsContact C-N 3.26Å; D355-H357 PolarHBondContact O-N 2.98Å
358T29.6Very low33.9Very low138 Ų138129.6 Ų129.685%0.84776%0.756SS**  trans77.269.2171.859.80000118.3
359V28.8Very low33.7Very low133 Ų133130.8 Ų130.881%0.80677%0.766SS**  trans-130.5108138.1-179.10000109.5C361V359-C361 PolarHBondContact O-N 2.66Å
360N25.2Very low33.4Very low166 Ų166133.1 Ų133.189%0.88878%0.778SS**  trans-69.5113.5161.2-86.7-20.4000108.5
361C31.3Very low33.1Very low120 Ų120135.7 Ų135.781%0.81179%0.789SS**  trans-114.3100.4157-93.60000108V359V359-C361 PolarHBondContact O-N 2.66Å
362S29.9Very low32.8Very low104 Ų104137.9 Ų137.973%0.72780%0.804SS**  trans-65.5131.716540.20000111.1
363Q29.7Very low32.7Very low194 Ų194138.1 Ų138.191%0.90781%0.81SS**  trans64103.2145-63.8-179.9-16.100119
364A34.7Very low32.3Very low107 Ų107138.7 Ų138.788%0.88482%0.819SS**  trans-124.9129.5135.700000107.7
365S29Very low31.7Very low116 Ų116140.8 Ų140.881%0.81183%0.83SS**  trans-78.6165-163.342.20000115.1
366P33.9Very low31.4Very low121 Ų121140.7 Ų140.779%0.78684%0.836SS**  trans-93.4141.5-177.135.6-30.1000113.3
367I38.4Very low31.4Very low245 Ų245146.5 Ų146.5100%1.25686%0.863SS**  trans-140.40134.7-63.2-173.1000106.7

Retrieved 367 of 367 residues in 77 ms (Link to these results)