A0A077YZI6_TRITR Loading...

7TM GPCR Srsx domain containing protein

AlphaFold DB , UniProt , Accession A0A077YZI6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 313 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
1M54.8Low57.3Low131 Ų13182.3 Ų82.365%0.64550%0.501SS*.  0119.60-163.2174.5-179.300107.3Q5 T9M1-Q5 HydrophobicContact CE-CB 4.25Å; M1-Q5 HydrophobicContact CG-CB 3.88Å; M1-T9 HydrophobicContact CE-CG2 3.57Å; M1-T9 VanDerWaalsContact CE-OG1 3.24Å; M1-T9 WeakPolarHBondContact CE-OG1 3.4Å
2N61.4Low57.2Low118 Ų11876.4 Ų76.463%0.63147%0.465SS*.  trans-69.5150.5-176.5-79.1-3.2000110.7T4 Q5 F6N2-T4 PolarHBondContact O-N 3.32Å; N2-Q5 WeakPolarHBondContact O-CA 3.46Å; N2-Q5 WeakPolarHBondContact O-CB 3.43Å; N2-Q5 PolarHBondContact O-N 3.27Å; N2-F6 PolarHBondContact O-N 3.32Å
3G56.8Low57.3Low42 Ų4275.8 Ų75.843%0.43347%0.467SS..Hα-helixtrans-55-28.7-176.700000114.4A7G3-A7 WeakPolarHBondContact O-CB 3.48Å; G3-A7 PolarHBondContact O-N 3.25Å
4T60Low57.3Low101 Ų10174.1 Ų74.162%0.6245%0.447SS*.Hα-helixtrans-69.4-41.4172.550.50000113N2 F6 A7 N8N2-T4 PolarHBondContact O-N 3.32Å; T4-F6 VanDerWaalsContact C-N 3.34Å; T4-A7 PolarHBondContact O-N 3.23Å; T4-N8 PolarHBondContact O-N 3.26Å
5Q55Low57.4Low106 Ų10672.3 Ų72.350%0.49544%0.439SS..Hα-helixtrans-64-42.3173.8-70.8178-35.300110.6M1 N2 N8 T9M1-Q5 HydrophobicContact CE-CB 4.25Å; M1-Q5 HydrophobicContact CG-CB 3.88Å; N2-Q5 WeakPolarHBondContact O-CA 3.46Å; N2-Q5 WeakPolarHBondContact O-CB 3.43Å; N2-Q5 PolarHBondContact O-N 3.27Å; Q5-N8 PolarHBondContact O-N 2.79Å; Q5-T9 PolarHBondContact O-N 3.12Å; Q5-T9 PolarHBondContact O-OG1 2.8Å
6F56.1Low57.7Low18 Ų1877.3 Ų77.38%0.07946%0.463CS..Hα-helixtrans-62.3-43.4176.7-173.7-92.4000112.3N2 T4 N8 T9 T10 V12 W14 P85 T87N2-F6 PolarHBondContact O-N 3.32Å; T4-F6 VanDerWaalsContact C-N 3.34Å; F6-N8 VanDerWaalsContact C-N 3.32Å; F6-N8 PolarHBondContact O-N 3.11Å; F6-T9 WeakPolarHBondContact CA-OG1 3.14Å; F6-T9 PolarHBondContact O-N 3.06Å; F6-T9 PolarHBondContact O-OG1 3.16Å; F6-T10 HydrophobicContact CD1-CG2 4.23Å; F6-T10 HydrophobicContact CD2-CG2 4.22Å; F6-T10 HydrophobicContact CE1-CG2 3.93Å; F6-T10 WeakPolarHBondContact CE1-OG1 3Å; F6-T10 HydrophobicContact CE2-CG2 3.93Å; F6-T10 HydrophobicContact CG-CG2 4.39Å; F6-T10 HydrophobicContact CZ-CG2 3.79Å; F6-T10 WeakPolarHBondContact O-CB 3.49Å; F6-T10 PolarHBondContact O-N 2.76Å; F6-T10 PolarHBondContact O-OG1 3.13Å; F6-V12 HydrophobicContact CE1-CB 4.42Å; F6-W14 AromaticContact CD1-NE1 3.57Å; F6-W14 AromaticContact CE1-NE1 3.55Å; F6-P85 HydrophobicContact CB-CB 4.02Å; F6-P85 HydrophobicContact CB-CG 4.16Å; F6-P85 HydrophobicContact CD1-CB 4.08Å; F6-P85 HydrophobicContact CD2-CB 3.71Å; F6-P85 HydrophobicContact CD2-CG 4.01Å; F6-P85 HydrophobicContact CE1-CB 4.44Å; F6-P85 HydrophobicContact CE2-CB 4.09Å; F6-P85 WeakPolarHBondContact CE2-O 3.24Å; F6-P85 HydrophobicContact CG-CB 3.67Å; F6-P85 HydrophobicContact CG-CG 4.18Å; F6-P85 HydrophobicContact CZ-CB 4.41Å; F6-T87 HydrophobicContact CE1-CG2 4.02Å; F6-T87 HydrophobicContact CZ-CG2 3.49Å; F6-T87 VanDerWaalsContact CZ-CG2 3.49Å
7A59.7Low58.5Low21 Ų2173.4 Ų73.417%0.17444%0.439CS..Hα-helixtrans-62-39.9176.100000111.9G3 T4 G11 V12G3-A7 WeakPolarHBondContact O-CB 3.48Å; G3-A7 PolarHBondContact O-N 3.25Å; T4-A7 PolarHBondContact O-N 3.23Å; A7-G11 CarbonylContact O-C 3.58Å; A7-G11 WeakPolarHBondContact O-CA 3.4Å; A7-G11 PolarHBondContact O-N 3.36Å; A7-V12 WeakPolarHBondContact CA-O 3.38Å
8N59Low59.8Low145 Ų14576.4 Ų76.478%0.77544%0.441SS*.Hα-helixtrans-66.8-37.3176.3-74.3-5.1000112.5T4 Q5 F6T4-N8 PolarHBondContact O-N 3.26Å; Q5-N8 PolarHBondContact O-N 2.79Å; F6-N8 VanDerWaalsContact C-N 3.32Å; F6-N8 PolarHBondContact O-N 3.11Å
9T53.8Low61.2Low96 Ų9676.5 Ų76.559%0.58944%0.439SS*.Hα-helixtrans-79.9-32.8-179.346.40000114M1 Q5 F6M1-T9 HydrophobicContact CE-CG2 3.57Å; M1-T9 VanDerWaalsContact CE-OG1 3.24Å; M1-T9 WeakPolarHBondContact CE-OG1 3.4Å; Q5-T9 PolarHBondContact O-N 3.12Å; Q5-T9 PolarHBondContact O-OG1 2.8Å; F6-T9 WeakPolarHBondContact CA-OG1 3.14Å; F6-T9 PolarHBondContact O-N 3.06Å; F6-T9 PolarHBondContact O-OG1 3.16Å
10T56.4Low62.6Low57 Ų5777.7 Ų77.735%0.3544%0.444SS..Hα-helixtrans-104-14.5-175.161.40000113.5F6 V12 T87F6-T10 HydrophobicContact CD1-CG2 4.23Å; F6-T10 HydrophobicContact CD2-CG2 4.22Å; F6-T10 HydrophobicContact CE1-CG2 3.93Å; F6-T10 WeakPolarHBondContact CE1-OG1 3Å; F6-T10 HydrophobicContact CE2-CG2 3.93Å; F6-T10 HydrophobicContact CG-CG2 4.39Å; F6-T10 HydrophobicContact CZ-CG2 3.79Å; F6-T10 WeakPolarHBondContact O-CB 3.49Å; F6-T10 PolarHBondContact O-N 2.76Å; F6-T10 PolarHBondContact O-OG1 3.13Å; T10-V12 PolarHBondContact O-N 3.28Å; T10-V12 WeakPolarHBondContact OG1-CB 3.38Å; T10-V12 PolarHBondContact OG1-N 3.13Å; T10-V12 VanDerWaalsContact OG1-N 3.1Å; T10-T87 HydrophobicContact CG2-CG2 4.25Å
11G57.3Low63.8Low70 Ų7074.2 Ų74.272%0.72243%0.425SS*.SBendtrans70.82.4-165.300000113.6A7A7-G11 CarbonylContact O-C 3.58Å; A7-G11 WeakPolarHBondContact O-CA 3.4Å; A7-G11 PolarHBondContact O-N 3.36Å
12V56Low65.5Low12 Ų1268.1 Ų68.17%0.07339%0.394CS..  trans-100.898.2-174.4-177.20000109.9F6 A7 T10 S171F6-V12 HydrophobicContact CE1-CB 4.42Å; A7-V12 WeakPolarHBondContact CA-O 3.38Å; T10-V12 PolarHBondContact O-N 3.28Å; T10-V12 WeakPolarHBondContact OG1-CB 3.38Å; T10-V12 PolarHBondContact OG1-N 3.13Å; T10-V12 VanDerWaalsContact OG1-N 3.1Å; V12-S171 VanDerWaalsContact CG1-N 3.33Å
13S58.5Low67Low69 Ų6966 Ų6648%0.48338%0.382SS..  trans-77.4133172.91130000111
14W57.3Low68.7Low51 Ų5167.2 Ų67.219%0.19338%0.378CS..  trans-84.4114.3165.7-66.659.1000106.4F6 N16 L80 P85 F86 P172F6-W14 AromaticContact CD1-NE1 3.57Å; F6-W14 AromaticContact CE1-NE1 3.55Å; W14-N16 PolarHBondContact O-N 3.47Å; W14-L80 HydrophobicContact CH2-CD2 4.22Å; W14-L80 HydrophobicContact CZ3-CB 3.92Å; W14-L80 HydrophobicContact CZ3-CD2 4.18Å; W14-L80 HydrophobicContact CZ3-CG 4.48Å; W14-L80 WeakPolarHBondContact CZ3-O 3.43Å; W14-P85 HydrophobicContact CZ2-CB 4.03Å; W14-F86 HydrophobicContact CH2-CD1 4.48Å; W14-F86 HydrophobicContact CH2-CE1 4.49Å; W14-P172 HydrophobicContact CH2-CB 4.49Å; W14-P172 HydrophobicContact CH2-CG 3.13Å; W14-P172 VanDerWaalsContact CZ2-CD 3.46Å; W14-P172 HydrophobicContact CZ2-CG 3.24Å; W14-P172 HydrophobicContact CZ3-CG 3.88Å
15S58.8Low70.3Confident47 Ų4762.8 Ų62.833%0.32935%0.351SS..  trans-65.2126.3-179.799.10000109E17 Y175S15-E17 PolarHBondContact O-N 3.43Å; S15-E17 WeakPolarHBondContact OG-CG 3.13Å; S15-Y175 WeakPolarHBondContact CB-OH 3.15Å; S15-Y175 PolarHBondContact OG-OH 3.15Å
16N62Low72.2Confident152 Ų15259.2 Ų59.281%0.81334%0.335SS*.  trans-72.162.6174-83.6-20.2000109.3W14 R18W14-N16 PolarHBondContact O-N 3.47Å; N16-R18 PolarHBondContact O-N 3.26Å
17E72.4Confident74.1Confident12 Ų1263.7 Ų63.76%0.05636%0.359CS..  trans-60125.8169.9-53.8-165150.400107.3S15 L19 L22 R77 R81 R269S15-E17 PolarHBondContact O-N 3.43Å; S15-E17 WeakPolarHBondContact OG-CG 3.13Å; E17-L19 PolarHBondContact O-N 3.46Å; E17-L22 HydrophobicContact CB-CD1 4.46Å; E17-L22 HydrophobicContact CB-CG 4.38Å; E17-L22 WeakPolarHBondContact OE2-CD2 3.42Å; E17-R77 IonicContact OE1-CZ 3.63Å; E17-R77 IonicContact OE1-NH1 3.3Å; E17-R77 PolarHBondContact OE1-NH1 3.32Å; E17-R77 VanDerWaalsContact OE2-CD 3.23Å; E17-R77 WeakPolarHBondContact OE2-CD 3.39Å; E17-R77 IonicContact OE2-CZ 3.9Å; E17-R77 IonicContact OE2-NE 2.6Å; E17-R77 IonicContact OE2-NH1 2.64Å; E17-R77 PolarHBondContact OE2-NH1 3.44Å; E17-R81 PolarHBondContact O-NH2 3.03Å; E17-R269 IonicContact OE1-CZ 3.63Å; E17-R269 IonicContact OE1-NH1 3.45Å; E17-R269 PolarHBondContact OE1-NH1 3.28Å; E17-R269 IonicContact OE1-NH2 2.8Å
18R81.7Confident75.7Confident127 Ų12763.5 Ų63.548%0.47936%0.355SS..  trans-62.1140.8-179.8-66-179.7178.7-179.2-2.8108.9N16 D20 T21 L22N16-R18 PolarHBondContact O-N 3.26Å; R18-D20 PolarHBondContact O-N 3.21Å; R18-T21 WeakPolarHBondContact O-CB 3.31Å; R18-T21 PolarHBondContact O-N 2.84Å; R18-T21 PolarHBondContact O-OG1 3.21Å; R18-L22 PolarHBondContact O-N 3.49Å
19L86.5Confident77.5Confident78 Ų7856.6 Ų56.641%0.40832%0.318SS..Hα-helixtrans-56.5-41.6178.6177.6144.2000110.6E17 T21 L22 I23 L78E17-L19 PolarHBondContact O-N 3.46Å; L19-T21 VanDerWaalsContact C-N 3.29Å; L19-T21 PolarHBondContact O-N 2.99Å; L19-L22 PolarHBondContact O-N 3.2Å; L19-L22 VanDerWaalsContact O-N 3.12Å; L19-I23 HydrophobicContact CD2-CD1 3.4Å; L19-I23 HydrophobicContact CD2-CG1 4.25Å; L19-I23 HydrophobicContact CG-CD1 4.17Å; L19-I23 WeakPolarHBondContact O-CG1 3.45Å; L19-I23 PolarHBondContact O-N 3.42Å; L19-L78 HydrophobicContact CG-CD2 4.32Å
20D88.6Confident79.5Confident101 Ų10155 Ų5554%0.5431%0.308SS..Hα-helixtrans-57-42.3176.1-46-33000111.8R18 L22 I23 I24R18-D20 PolarHBondContact O-N 3.21Å; D20-L22 VanDerWaalsContact C-N 3.35Å; D20-L22 PolarHBondContact O-N 3.12Å; D20-I23 PolarHBondContact O-N 2.95Å; D20-I24 WeakPolarHBondContact O-CB 3.36Å; D20-I24 WeakPolarHBondContact O-CD1 2.71Å; D20-I24 WeakPolarHBondContact O-CG1 3.41Å; D20-I24 PolarHBondContact O-N 3.26Å
21T87.5Confident81.4Confident5 Ų554 Ų543%0.03131%0.306CS..Hα-helixtrans-61.3-45.2177.9-41.60000110.9R18 L19 I24 L25 S266R18-T21 WeakPolarHBondContact O-CB 3.31Å; R18-T21 PolarHBondContact O-N 2.84Å; R18-T21 PolarHBondContact O-OG1 3.21Å; L19-T21 VanDerWaalsContact C-N 3.29Å; L19-T21 PolarHBondContact O-N 2.99Å; T21-I24 PolarHBondContact O-N 2.69Å; T21-L25 HydrophobicContact CG2-CD1 4.24Å; T21-L25 WeakPolarHBondContact O-CB 3.43Å; T21-L25 WeakPolarHBondContact O-CG 3.46Å; T21-L25 PolarHBondContact O-N 3.1Å; T21-S266 WeakPolarHBondContact CG2-OG 3.48Å; T21-S266 PolarHBondContact OG1-OG 2.94Å
22L89.7Confident83.3Confident2 Ų250.7 Ų50.71%0.0127%0.271CS..Hα-helixtrans-65.1-43.5-179.7-69.4173.3000111.6E17 R18 L19 D20 L25 I26 R77 L78E17-L22 HydrophobicContact CB-CD1 4.46Å; E17-L22 HydrophobicContact CB-CG 4.38Å; E17-L22 WeakPolarHBondContact OE2-CD2 3.42Å; R18-L22 PolarHBondContact O-N 3.49Å; L19-L22 PolarHBondContact O-N 3.2Å; L19-L22 VanDerWaalsContact O-N 3.12Å; D20-L22 VanDerWaalsContact C-N 3.35Å; D20-L22 PolarHBondContact O-N 3.12Å; L22-L25 PolarHBondContact O-N 3.04Å; L22-I26 WeakPolarHBondContact O-CG1 3.2Å; L22-I26 PolarHBondContact O-N 3.01Å; L22-R77 HydrophobicContact CD1-CB 4.1Å; L22-R77 HydrophobicContact CD2-CB 4.1Å; L22-L78 HydrophobicContact CB-CD1 4.49Å; L22-L78 HydrophobicContact CB-CD2 3.87Å; L22-L78 HydrophobicContact CB-CG 4.08Å; L22-L78 HydrophobicContact CD1-CD2 3.66Å; L22-L78 HydrophobicContact CD1-CG 3.99Å; L22-L78 HydrophobicContact CG-CD2 4.43Å
23I93.1Very high85.2Confident73 Ų7352.3 Ų52.337%0.37428%0.279SS..Hα-helixtrans-61.8-46.2176.1-67.2178.9000110.4L19 D20 L25 I26 L27L19-I23 HydrophobicContact CD2-CD1 3.4Å; L19-I23 HydrophobicContact CD2-CG1 4.25Å; L19-I23 HydrophobicContact CG-CD1 4.17Å; L19-I23 WeakPolarHBondContact O-CG1 3.45Å; L19-I23 PolarHBondContact O-N 3.42Å; D20-I23 PolarHBondContact O-N 2.95Å; I23-L25 VanDerWaalsContact C-N 3.33Å; I23-L25 PolarHBondContact O-N 3.38Å; I23-I26 PolarHBondContact O-N 3.42Å; I23-L27 HydrophobicContact CG2-CD1 4.09Å; I23-L27 HydrophobicContact CG2-CG 4.42Å; I23-L27 WeakPolarHBondContact O-CG 3.36Å; I23-L27 PolarHBondContact O-N 3.2Å
24I93.3Very high87.1Confident69 Ų6954.7 Ų54.735%0.35429%0.285SS..Hα-helixtrans-60.8-43178.1-69.7164.8000111D20 T21 I26 L27 I28 T270D20-I24 WeakPolarHBondContact O-CB 3.36Å; D20-I24 WeakPolarHBondContact O-CD1 2.71Å; D20-I24 WeakPolarHBondContact O-CG1 3.41Å; D20-I24 PolarHBondContact O-N 3.26Å; T21-I24 PolarHBondContact O-N 2.69Å; I24-I26 VanDerWaalsContact C-N 3.33Å; I24-I26 PolarHBondContact O-N 3.44Å; I24-L27 PolarHBondContact O-N 3.37Å; I24-I28 HydrophobicContact CG2-CD1 3.68Å; I24-I28 HydrophobicContact CG2-CG1 4.25Å; I24-I28 WeakPolarHBondContact O-CB 3.44Å; I24-I28 VanDerWaalsContact O-CG1 3.29Å; I24-I28 WeakPolarHBondContact O-CG1 3.5Å; I24-I28 PolarHBondContact O-N 3.5Å; I24-T270 HydrophobicContact CG2-CG2 3.59Å
25L92.7Very high88.9Confident7 Ų753.2 Ų53.24%0.03728%0.282CS..Hα-helixtrans-62.6-39.4177.5-71.5172.4000112.2T21 L22 I23 S29 L70 N273T21-L25 HydrophobicContact CG2-CD1 4.24Å; T21-L25 WeakPolarHBondContact O-CB 3.43Å; T21-L25 WeakPolarHBondContact O-CG 3.46Å; T21-L25 PolarHBondContact O-N 3.1Å; L22-L25 PolarHBondContact O-N 3.04Å; I23-L25 VanDerWaalsContact C-N 3.33Å; I23-L25 PolarHBondContact O-N 3.38Å; L25-S29 WeakPolarHBondContact O-CB 3.39Å; L25-S29 PolarHBondContact O-N 3.48Å; L25-S29 PolarHBondContact O-OG 3.44Å; L25-L70 HydrophobicContact CD2-CD2 4.47Å; L25-N273 HydrophobicContact CD2-CB 3.67Å; L25-N273 WeakPolarHBondContact CD2-ND2 3.32Å
26I94.9Very high90.6Very high32 Ų3251 Ų5116%0.16427%0.266CS..Hα-helixtrans-61.7-49.3173.7-67.9165.6000110L22 I23 I24 I28 S29 V30 S74 I75 L78L22-I26 WeakPolarHBondContact O-CG1 3.2Å; L22-I26 PolarHBondContact O-N 3.01Å; I23-I26 PolarHBondContact O-N 3.42Å; I24-I26 VanDerWaalsContact C-N 3.33Å; I24-I26 PolarHBondContact O-N 3.44Å; I26-I28 PolarHBondContact O-N 3.34Å; I26-S29 PolarHBondContact O-N 3.31Å; I26-V30 HydrophobicContact CG2-CG2 4.24Å; I26-V30 WeakPolarHBondContact O-CB 3.46Å; I26-V30 VanDerWaalsContact O-CG2 3.29Å; I26-V30 WeakPolarHBondContact O-CG2 3.43Å; I26-V30 PolarHBondContact O-N 3.13Å; I26-S74 VanDerWaalsContact CG1-CB 3.46Å; I26-I75 HydrophobicContact CD1-CG1 4.01Å; I26-L78 HydrophobicContact CD1-CD1 3.61Å
27L96.3Very high92.3Very high112 Ų11245.3 Ų45.359%0.58624%0.243SC*.Hα-helixtrans-60.4-44.8-179.8-69.1174.5000112.2I23 I24 S29 V30 A31I23-L27 HydrophobicContact CG2-CD1 4.09Å; I23-L27 HydrophobicContact CG2-CG 4.42Å; I23-L27 WeakPolarHBondContact O-CG 3.36Å; I23-L27 PolarHBondContact O-N 3.2Å; I24-L27 PolarHBondContact O-N 3.37Å; L27-S29 PolarHBondContact O-N 2.74Å; L27-V30 PolarHBondContact O-N 2.96Å; L27-A31 WeakPolarHBondContact O-CB 3.3Å; L27-A31 PolarHBondContact O-N 3.47Å
28I94.6Very high93.3Very high17 Ų1748.8 Ų48.89%0.08726%0.257CS..Hα-helixtrans-59.8-47.2175.9-71.4172.3000110.4I24 I26 V30 A31 A32 T270 N273 L274 V277I24-I28 HydrophobicContact CG2-CD1 3.68Å; I24-I28 HydrophobicContact CG2-CG1 4.25Å; I24-I28 WeakPolarHBondContact O-CB 3.44Å; I24-I28 VanDerWaalsContact O-CG1 3.29Å; I24-I28 WeakPolarHBondContact O-CG1 3.5Å; I24-I28 PolarHBondContact O-N 3.5Å; I26-I28 PolarHBondContact O-N 3.34Å; I28-V30 PolarHBondContact O-N 2.9Å; I28-A31 PolarHBondContact O-N 2.84Å; I28-A32 WeakPolarHBondContact O-CB 3.45Å; I28-A32 PolarHBondContact O-N 2.67Å; I28-T270 HydrophobicContact CD1-CG2 3.85Å; I28-N273 HydrophobicContact CG2-CB 4.38Å; I28-N273 WeakPolarHBondContact CG2-O 3.48Å; I28-L274 HydrophobicContact CD1-CD1 4.24Å; I28-L274 HydrophobicContact CG1-CD1 4.48Å; I28-V277 HydrophobicContact CG2-CG2 3.81Å; I28-V277 WeakPolarHBondContact O-CG2 3.29Å
29S95.4Very high93.8Very high0 Ų042.8 Ų42.80%023%0.234CC..Hα-helixtrans-68.6-36.5-177.6-52.20000112.6L25 I26 L27 A32 L33 L70L25-S29 WeakPolarHBondContact O-CB 3.39Å; L25-S29 PolarHBondContact O-N 3.48Å; L25-S29 PolarHBondContact O-OG 3.44Å; I26-S29 PolarHBondContact O-N 3.31Å; L27-S29 PolarHBondContact O-N 2.74Å; S29-A32 PolarHBondContact O-N 2.81Å; S29-L33 WeakPolarHBondContact O-CG 3.16Å; S29-L33 PolarHBondContact O-N 2.86Å; S29-L70 WeakPolarHBondContact OG-CD2 3.29Å; S29-L70 WeakPolarHBondContact OG-CG 3.37Å
30V97.3Very high94.2Very high62 Ų6241.4 Ų41.438%0.37623%0.227SC..Hα-helixtrans-66.5-44174.3170.40000110.2I26 L27 I28 A32 L33 I34 I71I26-V30 HydrophobicContact CG2-CG2 4.24Å; I26-V30 WeakPolarHBondContact O-CB 3.46Å; I26-V30 VanDerWaalsContact O-CG2 3.29Å; I26-V30 WeakPolarHBondContact O-CG2 3.43Å; I26-V30 PolarHBondContact O-N 3.13Å; L27-V30 PolarHBondContact O-N 2.96Å; I28-V30 PolarHBondContact O-N 2.9Å; V30-A32 VanDerWaalsContact C-N 3.31Å; V30-A32 PolarHBondContact O-N 3.36Å; V30-L33 PolarHBondContact O-N 2.96Å; V30-I34 HydrophobicContact CG1-CD1 4.11Å; V30-I34 WeakPolarHBondContact O-CG1 3.25Å; V30-I34 PolarHBondContact O-N 3.15Å; V30-I34 VanDerWaalsContact O-N 3.11Å; V30-I71 HydrophobicContact CG2-CD1 3.79Å; V30-I71 HydrophobicContact CG2-CG1 4.26Å
31A96.4Very high94.4Very high37 Ų3739.9 Ų39.931%0.30622%0.221SC..Hα-helixtrans-60.6-42.5174.600000111.4L27 I28 L33 I34 V35 V277L27-A31 WeakPolarHBondContact O-CB 3.3Å; L27-A31 PolarHBondContact O-N 3.47Å; I28-A31 PolarHBondContact O-N 2.84Å; A31-L33 PolarHBondContact O-N 3.46Å; A31-I34 PolarHBondContact O-N 3.27Å; A31-V35 WeakPolarHBondContact O-CG2 3.16Å; A31-V35 PolarHBondContact O-N 3.46Å; A31-V277 HydrophobicContact CB-CG1 4.5Å; A31-V277 HydrophobicContact CB-CG2 4.09Å
32A96Very high94.5Very high0 Ų039.9 Ų39.90%022%0.221CC..Hα-helixtrans-58-49.9176.600000110.6I28 S29 V30 I34 V35 D36 S67 L276 V277I28-A32 WeakPolarHBondContact O-CB 3.45Å; I28-A32 PolarHBondContact O-N 2.67Å; S29-A32 PolarHBondContact O-N 2.81Å; V30-A32 VanDerWaalsContact C-N 3.31Å; V30-A32 PolarHBondContact O-N 3.36Å; A32-I34 VanDerWaalsContact C-N 3.29Å; A32-I34 PolarHBondContact O-N 3.03Å; A32-V35 PolarHBondContact O-N 3.28Å; A32-V35 VanDerWaalsContact O-N 3.1Å; A32-D36 VanDerWaalsContact O-CB 3.31Å; A32-D36 WeakPolarHBondContact O-CB 3.45Å; A32-D36 VanDerWaalsContact O-CG 3.23Å; A32-D36 PolarHBondContact O-N 2.87Å; A32-S67 WeakPolarHBondContact CB-OG 3.28Å; A32-L276 HydrophobicContact CB-CB 3.89Å; A32-L276 WeakPolarHBondContact CB-O 3.46Å; A32-V277 HydrophobicContact CB-CG2 3.79Å
33L96.9Very high94.6Very high46 Ų4640.9 Ų40.924%0.24123%0.226CC..Hα-helixtrans-58.6-37.2177.2-73.7176.3000114.1S29 V30 A31 G37 C64 I68 I71S29-L33 WeakPolarHBondContact O-CG 3.16Å; S29-L33 PolarHBondContact O-N 2.86Å; V30-L33 PolarHBondContact O-N 2.96Å; A31-L33 PolarHBondContact O-N 3.46Å; L33-G37 PolarHBondContact O-N 3.14Å; L33-C64 HydrophobicContact CD2-CB 4Å; L33-I68 HydrophobicContact CD1-CG1 4Å; L33-I68 HydrophobicContact CD2-CD1 4.41Å; L33-I68 HydrophobicContact CD2-CG1 3.93Å; L33-I71 HydrophobicContact CD1-CD1 3.41Å; L33-I71 VanDerWaalsContact CD1-CD1 3.41Å; L33-I71 HydrophobicContact CG-CD1 4.43Å
34I96.9Very high94.4Very high118 Ų11846.4 Ų46.461%0.60524%0.243SC*.Hα-helixtrans-66.3-46.8177-66.8166000110V30 A31 A32 Y38V30-I34 HydrophobicContact CG1-CD1 4.11Å; V30-I34 WeakPolarHBondContact O-CG1 3.25Å; V30-I34 PolarHBondContact O-N 3.15Å; V30-I34 VanDerWaalsContact O-N 3.11Å; A31-I34 PolarHBondContact O-N 3.27Å; A32-I34 VanDerWaalsContact C-N 3.29Å; A32-I34 PolarHBondContact O-N 3.03Å; I34-Y38 WeakPolarHBondContact O-CB 3.43Å; I34-Y38 PolarHBondContact O-N 3.35Å
35V95.4Very high94.2Very high21 Ų2151.2 Ų51.213%0.12726%0.257CS..Hα-helixtrans-66.8-44.2179.81790000111A31 A32 Y38 L39 P280 L281A31-V35 WeakPolarHBondContact O-CG2 3.16Å; A31-V35 PolarHBondContact O-N 3.46Å; A32-V35 PolarHBondContact O-N 3.28Å; A32-V35 VanDerWaalsContact O-N 3.1Å; V35-Y38 WeakPolarHBondContact O-CB 3.26Å; V35-Y38 PolarHBondContact O-N 2.99Å; V35-L39 WeakPolarHBondContact O-CB 3.45Å; V35-L39 PolarHBondContact O-N 3.49Å; V35-P280 HydrophobicContact CB-CG 4.48Å; V35-P280 HydrophobicContact CG1-CB 3.83Å; V35-P280 HydrophobicContact CG1-CG 3.95Å; V35-L281 HydrophobicContact CB-CD2 4.39Å; V35-L281 HydrophobicContact CG1-CB 4.49Å; V35-L281 HydrophobicContact CG1-CD2 3.69Å; V35-L281 HydrophobicContact CG1-CG 3.84Å; V35-L281 HydrophobicContact CG2-CD2 3.67Å; V35-L281 HydrophobicContact CG2-CG 3.97Å
36D96Very high93.7Very high0 Ų052.5 Ų52.50%026%0.262CS..Hα-helixtrans-62.9-43.8177.1-72.9-26.2000111.6A32 Y38 L39 L40 T60 D63 C64 P280A32-D36 VanDerWaalsContact O-CB 3.31Å; A32-D36 WeakPolarHBondContact O-CB 3.45Å; A32-D36 VanDerWaalsContact O-CG 3.23Å; A32-D36 PolarHBondContact O-N 2.87Å; D36-Y38 VanDerWaalsContact C-N 3.31Å; D36-Y38 PolarHBondContact O-N 3.31Å; D36-L39 PolarHBondContact O-N 2.79Å; D36-L40 WeakPolarHBondContact O-CB 3.25Å; D36-L40 WeakPolarHBondContact O-CG 3.39Å; D36-L40 PolarHBondContact O-N 3.11Å; D36-T60 HydrophobicContact CB-CG2 3.57Å; D36-T60 WeakPolarHBondContact O-CG2 3.07Å; D36-T60 WeakPolarHBondContact OD1-CG2 3.22Å; D36-D63 WeakPolarHBondContact OD2-CB 3.39Å; D36-C64 WeakPolarHBondContact CB-SG 3.39Å; D36-P280 WeakPolarHBondContact OD1-CB 3.39Å; D36-P280 VanDerWaalsContact OD1-CG 3.26Å; D36-P280 WeakPolarHBondContact OD1-CG 3.4Å
37G95.9Very high92.9Very high32 Ų3258.8 Ų58.833%0.3329%0.291SS..Hα-helixtrans-58.9-44.3174.200000111.5L33 V41L33-G37 PolarHBondContact O-N 3.14Å; G37-V41 VanDerWaalsContact O-CG2 3.26Å; G37-V41 WeakPolarHBondContact O-CG2 3.15Å; G37-V41 PolarHBondContact O-N 2.82Å
38Y94.1Very high92Very high86 Ų8656.9 Ų56.934%0.33728%0.279SS..Hα-helixtrans-62.9-46.1174.8178.7-107.7000112.2I34 V35 D36 V41 L42 T284I34-Y38 WeakPolarHBondContact O-CB 3.43Å; I34-Y38 PolarHBondContact O-N 3.35Å; V35-Y38 WeakPolarHBondContact O-CB 3.26Å; V35-Y38 PolarHBondContact O-N 2.99Å; D36-Y38 VanDerWaalsContact C-N 3.31Å; D36-Y38 PolarHBondContact O-N 3.31Å; Y38-V41 PolarHBondContact O-N 3.31Å; Y38-L42 HydrophobicContact CD1-CD1 3.97Å; Y38-L42 HydrophobicContact CD1-CG 4.4Å; Y38-L42 HydrophobicContact CE1-CD1 3.36Å; Y38-L42 HydrophobicContact CE1-CG 4Å; Y38-L42 HydrophobicContact CE2-CD1 4.49Å; Y38-L42 HydrophobicContact CE2-CD2 4.36Å; Y38-L42 HydrophobicContact CE2-CG 4.29Å; Y38-L42 WeakPolarHBondContact O-CG 3.34Å; Y38-L42 PolarHBondContact O-N 3.21Å; Y38-T284 HydrophobicContact CD1-CG2 4.2Å; Y38-T284 HydrophobicContact CE1-CG2 4.41Å
39L92.6Very high91Very high0 Ų062.6 Ų62.60%031%0.305CS..Hα-helixtrans-61.5-44.9178.7177.556.4000111.6V35 D36 V41 L42 I43 I56 T60 P280 T284 L290V35-L39 WeakPolarHBondContact O-CB 3.45Å; V35-L39 PolarHBondContact O-N 3.49Å; D36-L39 PolarHBondContact O-N 2.79Å; L39-V41 PolarHBondContact O-N 3.31Å; L39-L42 WeakPolarHBondContact O-CB 3.01Å; L39-L42 PolarHBondContact O-N 3.46Å; L39-I43 HydrophobicContact CD1-CD1 3.97Å; L39-I43 HydrophobicContact CD1-CG1 4.24Å; L39-I43 HydrophobicContact CG-CD1 3.97Å; L39-I43 VanDerWaalsContact O-CG1 3.28Å; L39-I43 WeakPolarHBondContact O-CG1 3.45Å; L39-I43 PolarHBondContact O-N 2.79Å; L39-I56 HydrophobicContact CD2-CG2 4.26Å; L39-T60 HydrophobicContact CB-CG2 4.29Å; L39-T60 HydrophobicContact CD2-CG2 4.03Å; L39-T60 WeakPolarHBondContact CD2-OG1 2.98Å; L39-T60 HydrophobicContact CG-CG2 4.25Å; L39-P280 HydrophobicContact CD2-CB 3.78Å; L39-T284 HydrophobicContact CB-CG2 4.07Å; L39-T284 HydrophobicContact CD1-CG2 3.83Å; L39-T284 HydrophobicContact CG-CG2 4.4Å; L39-L290 HydrophobicContact CD1-CD1 3.43Å; L39-L290 VanDerWaalsContact CD1-CD1 3.43Å
40L94.1Very high90.5Very high50 Ų5068.1 Ų68.126%0.26233%0.326SS..Hα-helixtrans-61.3-42.2175.2-74.8171.9000112D36 L42 I43 Y44 A57 T60 V61D36-L40 WeakPolarHBondContact O-CB 3.25Å; D36-L40 WeakPolarHBondContact O-CG 3.39Å; D36-L40 PolarHBondContact O-N 3.11Å; L40-L42 VanDerWaalsContact C-N 3.34Å; L40-L42 PolarHBondContact O-N 3.23Å; L40-I43 PolarHBondContact O-N 3.31Å; L40-Y44 VanDerWaalsContact O-CB 3.29Å; L40-Y44 WeakPolarHBondContact O-CB 3.31Å; L40-Y44 PolarHBondContact O-N 2.98Å; L40-A57 HydrophobicContact CD2-CB 4.46Å; L40-T60 HydrophobicContact CD1-CG2 4.14Å; L40-T60 HydrophobicContact CD2-CG2 4.06Å; L40-T60 HydrophobicContact CG-CG2 3.64Å; L40-V61 HydrophobicContact CD1-CG2 4.28Å; L40-V61 HydrophobicContact CD2-CG2 4.05Å
41V92.9Very high90Very high68 Ų6865.6 Ų65.641%0.41231%0.312SS..Hα-helixtrans-62.1-42175.4169.50000111.1G37 Y38 L39 Y44 R45G37-V41 VanDerWaalsContact O-CG2 3.26Å; G37-V41 WeakPolarHBondContact O-CG2 3.15Å; G37-V41 PolarHBondContact O-N 2.82Å; Y38-V41 PolarHBondContact O-N 3.31Å; L39-V41 PolarHBondContact O-N 3.31Å; V41-Y44 PolarHBondContact O-N 3.11Å; V41-R45 HydrophobicContact CG1-CG 4.38Å; V41-R45 WeakPolarHBondContact O-CB 3.37Å; V41-R45 VanDerWaalsContact O-CG 3.29Å; V41-R45 WeakPolarHBondContact O-CG 3.5Å; V41-R45 PolarHBondContact O-N 3.07Å
42L90.4Very high89.4Confident6 Ų664.5 Ų64.53%0.03130%0.301CS..Hα-helixtrans-63.1-45176.3-73.1-177.5000112.2Y38 L39 L40 R45 K46 L290Y38-L42 HydrophobicContact CD1-CD1 3.97Å; Y38-L42 HydrophobicContact CD1-CG 4.4Å; Y38-L42 HydrophobicContact CE1-CD1 3.36Å; Y38-L42 HydrophobicContact CE1-CG 4Å; Y38-L42 HydrophobicContact CE2-CD1 4.49Å; Y38-L42 HydrophobicContact CE2-CD2 4.36Å; Y38-L42 HydrophobicContact CE2-CG 4.29Å; Y38-L42 WeakPolarHBondContact O-CG 3.34Å; Y38-L42 PolarHBondContact O-N 3.21Å; L39-L42 WeakPolarHBondContact O-CB 3.01Å; L39-L42 PolarHBondContact O-N 3.46Å; L40-L42 VanDerWaalsContact C-N 3.34Å; L40-L42 PolarHBondContact O-N 3.23Å; L42-R45 PolarHBondContact O-N 3.47Å; L42-K46 PolarHBondContact O-N 3.15Å; L42-L290 HydrophobicContact CB-CD2 4.02Å
43I90.9Very high89.1Confident22 Ų2264.7 Ų64.711%0.11330%0.302CS..Hα-helixtrans-62.7-46.5177.7-66.3166.6000110.1L39 L40 R45 K46 L53 I56 A57 L290L39-I43 HydrophobicContact CD1-CD1 3.97Å; L39-I43 HydrophobicContact CD1-CG1 4.24Å; L39-I43 HydrophobicContact CG-CD1 3.97Å; L39-I43 VanDerWaalsContact O-CG1 3.28Å; L39-I43 WeakPolarHBondContact O-CG1 3.45Å; L39-I43 PolarHBondContact O-N 2.79Å; L40-I43 PolarHBondContact O-N 3.31Å; I43-R45 PolarHBondContact O-N 3.17Å; I43-K46 PolarHBondContact O-N 3Å; I43-L53 HydrophobicContact CG1-CD2 4.4Å; I43-L53 HydrophobicContact CG2-CB 4.43Å; I43-I56 HydrophobicContact CD1-CB 4.44Å; I43-I56 HydrophobicContact CD1-CG2 3.84Å; I43-A57 HydrophobicContact CD1-CB 4.4Å; I43-A57 HydrophobicContact CG2-CB 4.36Å; I43-L290 HydrophobicContact CG1-CD2 4.19Å
44Y89.3Confident88.8Confident190 Ų19063.9 Ų63.975%0.74530%0.3SS*.Hα-helixtrans-61.9-44.7179.4-177.2-98.6000112.1L40 V41 K46 Q47L40-Y44 VanDerWaalsContact O-CB 3.29Å; L40-Y44 WeakPolarHBondContact O-CB 3.31Å; L40-Y44 PolarHBondContact O-N 2.98Å; V41-Y44 PolarHBondContact O-N 3.11Å; Y44-K46 VanDerWaalsContact C-N 3.26Å; Y44-K46 PolarHBondContact O-N 3.47Å; Y44-Q47 PolarHBondContact O-N 3.17Å
45R88.7Confident88.6Confident169 Ų16958.3 Ų58.364%0.63827%0.271SS*.Hα-helixtrans-63.9-28.9179.6-79.1-178.2176.2-171.11113.5V41 L42 I43 Q47V41-R45 HydrophobicContact CG1-CG 4.38Å; V41-R45 WeakPolarHBondContact O-CB 3.37Å; V41-R45 VanDerWaalsContact O-CG 3.29Å; V41-R45 WeakPolarHBondContact O-CG 3.5Å; V41-R45 PolarHBondContact O-N 3.07Å; L42-R45 PolarHBondContact O-N 3.47Å; I43-R45 PolarHBondContact O-N 3.17Å; R45-Q47 VanDerWaalsContact C-N 3.3Å; R45-Q47 PolarHBondContact O-N 3.23Å
46K83.2Confident88.4Confident34 Ų3457.3 Ų57.315%0.14827%0.265CS..Hα-helixtrans-67-30.5179.2-88.7-175.9164.6-73.70113.5L42 I43 Y44 E48 S289 L290L42-K46 PolarHBondContact O-N 3.15Å; I43-K46 PolarHBondContact O-N 3Å; Y44-K46 VanDerWaalsContact C-N 3.26Å; Y44-K46 PolarHBondContact O-N 3.47Å; K46-E48 HydrophobicContact CB-CB 4.43Å; K46-E48 HydrophobicContact CB-CG 4.44Å; K46-E48 IonicContact NZ-OE1 3.29Å; K46-E48 PolarHBondContact NZ-OE1 3.35Å; K46-E48 VanDerWaalsContact NZ-OE1 3.11Å; K46-E48 PolarHBondContact O-N 2.91Å; K46-S289 WeakPolarHBondContact CE-O 3.49Å; K46-S289 PolarHBondContact NZ-O 3.41Å; K46-L290 HydrophobicContact CD-CD2 4.16Å
47Q77.2Confident88.3Confident165 Ų16558.4 Ų58.477%0.77128%0.275SS*.  trans52.36.2-172.5-62.2-175.5-12.100115.2Y44 R45 Q49Y44-Q47 PolarHBondContact O-N 3.17Å; R45-Q47 VanDerWaalsContact C-N 3.3Å; R45-Q47 PolarHBondContact O-N 3.23Å; Q47-Q49 PolarHBondContact O-N 3.49Å
48E76.8Confident88.3Confident71 Ų7157.1 Ų57.133%0.33226%0.261SS..  trans-74.3115.4178.6-72.2-176.5-125.200109.4K46 R50 L53K46-E48 HydrophobicContact CB-CB 4.43Å; K46-E48 HydrophobicContact CB-CG 4.44Å; K46-E48 IonicContact NZ-OE1 3.29Å; K46-E48 PolarHBondContact NZ-OE1 3.35Å; K46-E48 VanDerWaalsContact NZ-OE1 3.11Å; K46-E48 PolarHBondContact O-N 2.91Å; E48-R50 VanDerWaalsContact C-N 3.33Å; E48-R50 PolarHBondContact O-N 3.09Å; E48-R50 IonicContact OE2-CZ 3.19Å; E48-R50 IonicContact OE2-NE 3.11Å; E48-R50 PolarHBondContact OE2-NE 3.34Å; E48-R50 IonicContact OE2-NH2 2.79Å; E48-R50 PolarHBondContact OE2-NH2 2.83Å; E48-L53 HydrophobicContact CB-CD1 3.99Å; E48-L53 WeakPolarHBondContact O-CD1 3.26Å
49Q75.1Confident88.3Confident137 Ų13753.1 Ų53.164%0.6425%0.245SC*.  trans-83.177.1176.6-62.3-1694.600110.7Q47 I137Q47-Q49 PolarHBondContact O-N 3.49Å; Q49-I137 HydrophobicContact CB-CD1 3.92Å; Q49-I137 HydrophobicContact CB-CG1 4.5Å; Q49-I137 HydrophobicContact CB-CG2 4.31Å; Q49-I137 WeakPolarHBondContact O-CD1 3.48Å; Q49-I137 WeakPolarHBondContact O-CG1 3.28Å
50R84.2Confident88.4Confident116 Ų11653.1 Ų53.144%0.43825%0.245SC..  trans-100.6143.6169.8-58.9-174.9-170.3-1430.6110.1E48 D52 L53 C54E48-R50 VanDerWaalsContact C-N 3.33Å; E48-R50 PolarHBondContact O-N 3.09Å; E48-R50 IonicContact OE2-CZ 3.19Å; E48-R50 IonicContact OE2-NE 3.11Å; E48-R50 PolarHBondContact OE2-NE 3.34Å; E48-R50 IonicContact OE2-NH2 2.79Å; E48-R50 PolarHBondContact OE2-NH2 2.83Å; R50-D52 VanDerWaalsContact C-N 3.29Å; R50-D52 PolarHBondContact O-N 3.13Å; R50-L53 HydrophobicContact CB-CB 4.36Å; R50-L53 HydrophobicContact CB-CD1 4.11Å; R50-L53 HydrophobicContact CB-CG 4.16Å; R50-L53 HydrophobicContact CG-CD1 4.26Å; R50-L53 PolarHBondContact O-N 2.94Å; R50-C54 PolarHBondContact O-N 3.02Å; R50-C54 VanDerWaalsContact O-N 3.15Å
51A86.2Confident88.6Confident9 Ų953.4 Ų53.47%0.07425%0.249CC..Hα-helixtrans-55.9-46.317600000111.3L53 C54 M55 F135 T140A51-L53 PolarHBondContact O-N 3.23Å; A51-C54 VanDerWaalsContact O-CB 3.29Å; A51-C54 WeakPolarHBondContact O-CB 3.47Å; A51-C54 PolarHBondContact O-N 3.12Å; A51-C54 VanDerWaalsContact O-N 3.08Å; A51-M55 HydrophobicContact CB-CE 4.42Å; A51-M55 PolarHBondContact O-N 3.34Å; A51-F135 HydrophobicContact CB-CB 4.49Å; A51-F135 WeakPolarHBondContact CB-O 3.35Å; A51-T140 HydrophobicContact CB-CG2 4.16Å; A51-T140 WeakPolarHBondContact CB-OG1 3.03Å; A51-T140 WeakPolarHBondContact O-CG2 3.49Å
52D85.5Confident88.8Confident15 Ų1550.2 Ų50.28%0.0823%0.23CC..Hα-helixtrans-54-51.6176.6-162.2-5.5000113.1R50 C54 M55 I56 R121 L237R50-D52 VanDerWaalsContact C-N 3.29Å; R50-D52 PolarHBondContact O-N 3.13Å; D52-C54 PolarHBondContact O-N 3.39Å; D52-M55 PolarHBondContact O-N 2.84Å; D52-I56 WeakPolarHBondContact O-CG1 3.29Å; D52-I56 PolarHBondContact O-N 3.42Å; D52-I56 WeakPolarHBondContact OD1-CD1 3.29Å; D52-R121 VanDerWaalsContact CG-NH1 3.32Å; D52-R121 IonicContact OD1-CZ 3.27Å; D52-R121 IonicContact OD1-NH1 2.84Å; D52-R121 IonicContact OD1-NH2 2.8Å; D52-R121 PolarHBondContact OD1-NH2 3.04Å; D52-R121 IonicContact OD2-CZ 2.81Å; D52-R121 VanDerWaalsContact OD2-CZ 3.27Å; D52-R121 IonicContact OD2-NH1 3.66Å; D52-R121 PolarHBondContact OD2-NH1 2.85Å; D52-R121 IonicContact OD2-NH2 2.81Å; D52-R121 PolarHBondContact OD2-NH2 3.39Å; D52-L237 WeakPolarHBondContact OD2-CD1 3.44Å
53L88.6Confident89Confident4 Ų449.9 Ų49.92%0.02123%0.228CC..Hα-helixtrans-60.8-33177.9-68.9174.4000112.4I43 E48 R50 A51 A57I43-L53 HydrophobicContact CG1-CD2 4.4Å; I43-L53 HydrophobicContact CG2-CB 4.43Å; E48-L53 HydrophobicContact CB-CD1 3.99Å; E48-L53 WeakPolarHBondContact O-CD1 3.26Å; R50-L53 HydrophobicContact CB-CB 4.36Å; R50-L53 HydrophobicContact CB-CD1 4.11Å; R50-L53 HydrophobicContact CB-CG 4.16Å; R50-L53 HydrophobicContact CG-CD1 4.26Å; R50-L53 PolarHBondContact O-N 2.94Å; A51-L53 PolarHBondContact O-N 3.23Å; L53-A57 VanDerWaalsContact O-CB 3.26Å; L53-A57 WeakPolarHBondContact O-CB 3.36Å; L53-A57 PolarHBondContact O-N 2.67Å
54C91.8Very high89.3Confident29 Ų2949.9 Ų49.920%0.19623%0.23CC..Hα-helixtrans-67.9-39.6174.7-171.20000111.8R50 A51 D52 G58 T140 K141R50-C54 PolarHBondContact O-N 3.02Å; R50-C54 VanDerWaalsContact O-N 3.15Å; A51-C54 VanDerWaalsContact O-CB 3.29Å; A51-C54 WeakPolarHBondContact O-CB 3.47Å; A51-C54 PolarHBondContact O-N 3.12Å; A51-C54 VanDerWaalsContact O-N 3.08Å; D52-C54 PolarHBondContact O-N 3.39Å; C54-G58 PolarHBondContact O-N 3.27Å; C54-T140 HydrophobicContact CB-CG2 4.13Å; C54-K141 VanDerWaalsContact SG-CG 3.56Å
55M91.9Very high89.7Confident0 Ų043 Ų430%021%0.206CC..Hα-helixtrans-70.4-42.3175.9-70.8179.1-78.300111.7A51 D52 A57 G58 F59 L116 L117 E120 F135 T140 V144A51-M55 HydrophobicContact CB-CE 4.42Å; A51-M55 PolarHBondContact O-N 3.34Å; D52-M55 PolarHBondContact O-N 2.84Å; M55-A57 VanDerWaalsContact C-N 3.31Å; M55-A57 PolarHBondContact O-N 3.48Å; M55-G58 PolarHBondContact O-N 2.87Å; M55-F59 WeakPolarHBondContact O-CB 3.49Å; M55-F59 PolarHBondContact O-N 3.45Å; M55-L116 HydrophobicContact CG-CD2 4.02Å; M55-L116 HydrophobicContact CG-CG 4.44Å; M55-L116 HydrophobicContact SD-CD2 4.07Å; M55-L116 HydrophobicContact SD-CG 3.85Å; M55-L117 HydrophobicContact CB-CD2 3.61Å; M55-L117 HydrophobicContact CB-CG 4.13Å; M55-L117 HydrophobicContact SD-CD2 4.27Å; M55-E120 HydrophobicContact CE-CB 3.76Å; M55-E120 HydrophobicContact CE-CG 3.43Å; M55-E120 VanDerWaalsContact CE-CG 3.43Å; M55-E120 HydrophobicContact SD-CB 3.95Å; M55-E120 HydrophobicContact SD-CG 4.28Å; M55-F135 HydrophobicContact CE-CD1 4.2Å; M55-F135 HydrophobicContact SD-CD1 4.24Å; M55-F135 HydrophobicContact SD-CE1 4.04Å; M55-T140 HydrophobicContact CE-CG2 4.13Å; M55-T140 HydrophobicContact CG-CG2 3.46Å; M55-T140 VanDerWaalsContact CG-CG2 3.46Å; M55-T140 HydrophobicContact SD-CG2 4.09Å; M55-V144 HydrophobicContact CG-CG2 4.2Å
56I91.3Very high90.1Very high0 Ų035 Ų350%018%0.176CC..Hα-helixtrans-61.3-41.8174.2-63.4169000110.1L39 I43 D52 G58 F59 T60 Y283L39-I56 HydrophobicContact CD2-CG2 4.26Å; I43-I56 HydrophobicContact CD1-CB 4.44Å; I43-I56 HydrophobicContact CD1-CG2 3.84Å; D52-I56 WeakPolarHBondContact O-CG1 3.29Å; D52-I56 PolarHBondContact O-N 3.42Å; D52-I56 WeakPolarHBondContact OD1-CD1 3.29Å; I56-G58 PolarHBondContact O-N 3.36Å; I56-F59 WeakPolarHBondContact O-CB 3.35Å; I56-F59 PolarHBondContact O-N 3.04Å; I56-T60 WeakPolarHBondContact O-CB 3.34Å; I56-T60 PolarHBondContact O-N 3.07Å; I56-T60 PolarHBondContact O-OG1 2.93Å; I56-Y283 HydrophobicContact CD1-CD1 4.24Å; I56-Y283 HydrophobicContact CD1-CE1 4.38Å; I56-Y283 HydrophobicContact CG1-CD1 4.48Å; I56-Y283 HydrophobicContact CG1-CE1 4.33Å; I56-Y283 HydrophobicContact CG2-CG 4.47Å
57A94Very high90.7Very high24 Ų2433.4 Ų33.420%0.19817%0.169CC..Hα-helixtrans-61.2-44.5174.100000111.6L40 I43 L53 M55 T60 V61L40-A57 HydrophobicContact CD2-CB 4.46Å; I43-A57 HydrophobicContact CD1-CB 4.4Å; I43-A57 HydrophobicContact CG2-CB 4.36Å; L53-A57 VanDerWaalsContact O-CB 3.26Å; L53-A57 WeakPolarHBondContact O-CB 3.36Å; L53-A57 PolarHBondContact O-N 2.67Å; M55-A57 VanDerWaalsContact C-N 3.31Å; M55-A57 PolarHBondContact O-N 3.48Å; A57-T60 PolarHBondContact O-N 3.12Å; A57-V61 WeakPolarHBondContact O-CG2 3.46Å; A57-V61 PolarHBondContact O-N 2.8Å
58G95.7Very high91.7Very high5 Ų528.2 Ų28.25%0.05215%0.146CC..Hα-helixtrans-57.6-49.3174.300000112.2C54 M55 I56 T60 V61 S62C54-G58 PolarHBondContact O-N 3.27Å; M55-G58 PolarHBondContact O-N 2.87Å; I56-G58 PolarHBondContact O-N 3.36Å; G58-T60 VanDerWaalsContact C-N 3.35Å; G58-T60 PolarHBondContact O-N 2.93Å; G58-V61 PolarHBondContact O-N 3.24Å; G58-S62 PolarHBondContact O-N 3.09Å; G58-S62 PolarHBondContact O-OG 3.4Å; G58-S62 VanDerWaalsContact O-OG 3.05Å
59F94.1Very high92.6Very high1 Ų124.8 Ų24.80%0.00413%0.13CC..Hα-helixtrans-54.3-48.9174174.8-85.4000111.8M55 I56 V61 S62 D63 L110 M114 L117 A279 Y283M55-F59 WeakPolarHBondContact O-CB 3.49Å; M55-F59 PolarHBondContact O-N 3.45Å; I56-F59 WeakPolarHBondContact O-CB 3.35Å; I56-F59 PolarHBondContact O-N 3.04Å; F59-V61 PolarHBondContact O-N 2.82Å; F59-S62 WeakPolarHBondContact O-CB 3.4Å; F59-S62 PolarHBondContact O-N 3.49Å; F59-D63 WeakPolarHBondContact O-CB 3.36Å; F59-D63 PolarHBondContact O-N 3.32Å; F59-L110 HydrophobicContact CE2-CG 4.28Å; F59-M114 HydrophobicContact CD2-CG 4.06Å; F59-M114 HydrophobicContact CE2-CE 3.48Å; F59-M114 VanDerWaalsContact CE2-CE 3.48Å; F59-M114 HydrophobicContact CE2-CG 3.67Å; F59-M114 HydrophobicContact CE2-SD 4.45Å; F59-M114 HydrophobicContact CZ-CE 3.98Å; F59-L117 HydrophobicContact CB-CD1 4.46Å; F59-L117 HydrophobicContact CD2-CD1 4.35Å; F59-A279 HydrophobicContact CE1-CB 4.02Å; F59-A279 HydrophobicContact CZ-CB 3.71Å; F59-Y283 HydrophobicContact CD1-CE2 4.04Å; F59-Y283 HydrophobicContact CE1-CD2 4.34Å; F59-Y283 AromaticContact CE1-CE2 3.89Å; F59-Y283 HydrophobicContact CE1-CE2 3.89Å; F59-Y283 HydrophobicContact CZ-CE2 4.27Å
60T95.1Very high93.6Very high0 Ų018.9 Ų18.90%010%0.103CC..Hα-helixtrans-67-38.2-177-47.60000111.6D36 L39 L40 I56 A57 G58 D63 C64D36-T60 HydrophobicContact CB-CG2 3.57Å; D36-T60 WeakPolarHBondContact O-CG2 3.07Å; D36-T60 WeakPolarHBondContact OD1-CG2 3.22Å; L39-T60 HydrophobicContact CB-CG2 4.29Å; L39-T60 HydrophobicContact CD2-CG2 4.03Å; L39-T60 WeakPolarHBondContact CD2-OG1 2.98Å; L39-T60 HydrophobicContact CG-CG2 4.25Å; L40-T60 HydrophobicContact CD1-CG2 4.14Å; L40-T60 HydrophobicContact CD2-CG2 4.06Å; L40-T60 HydrophobicContact CG-CG2 3.64Å; I56-T60 WeakPolarHBondContact O-CB 3.34Å; I56-T60 PolarHBondContact O-N 3.07Å; I56-T60 PolarHBondContact O-OG1 2.93Å; A57-T60 PolarHBondContact O-N 3.12Å; G58-T60 VanDerWaalsContact C-N 3.35Å; G58-T60 PolarHBondContact O-N 2.93Å; T60-D63 PolarHBondContact O-N 3Å; T60-C64 PolarHBondContact O-N 3.24Å
61V97.1Very high94.2Very high57 Ų5714.4 Ų14.435%0.3459%0.087SC..Hα-helixtrans-65.7-41.1173.4172.60000110.8L40 A57 G58 F59 D63 C64 L65 F148L40-V61 HydrophobicContact CD1-CG2 4.28Å; L40-V61 HydrophobicContact CD2-CG2 4.05Å; A57-V61 WeakPolarHBondContact O-CG2 3.46Å; A57-V61 PolarHBondContact O-N 2.8Å; G58-V61 PolarHBondContact O-N 3.24Å; F59-V61 PolarHBondContact O-N 2.82Å; V61-D63 VanDerWaalsContact C-N 3.3Å; V61-D63 PolarHBondContact O-N 3.44Å; V61-C64 WeakPolarHBondContact O-CB 3.33Å; V61-C64 PolarHBondContact O-N 3.46Å; V61-L65 WeakPolarHBondContact O-CG 3.42Å; V61-L65 PolarHBondContact O-N 3.25Å; V61-F148 HydrophobicContact CB-CZ 4.05Å; V61-F148 HydrophobicContact CG1-CE1 4.06Å; V61-F148 HydrophobicContact CG1-CZ 3.72Å
62S96.9Very high94.7Very high0 Ų018.1 Ų18.10%010%0.102CC..Hα-helixtrans-61-40.6174.3-640000112.1G58 F59 L65 A66 G106 T109 F148G58-S62 PolarHBondContact O-N 3.09Å; G58-S62 PolarHBondContact O-OG 3.4Å; G58-S62 VanDerWaalsContact O-OG 3.05Å; F59-S62 WeakPolarHBondContact O-CB 3.4Å; F59-S62 PolarHBondContact O-N 3.49Å; S62-L65 PolarHBondContact O-N 3.03Å; S62-A66 PolarHBondContact O-N 3.05Å; S62-G106 WeakPolarHBondContact O-CA 3.34Å; S62-T109 WeakPolarHBondContact CB-OG1 3.35Å; S62-T109 WeakPolarHBondContact OG-CB 3.29Å; S62-T109 PolarHBondContact OG-OG1 3.48Å; S62-F148 WeakPolarHBondContact OG-CZ 3.32Å
63D95.7Very high95Very high0 Ų017.9 Ų17.90%010%0.101CC..Hα-helixtrans-66.4-41.8177.8-148.515000111.9D36 F59 T60 V61 L65 A66 S67 L110 L276D36-D63 WeakPolarHBondContact OD2-CB 3.39Å; F59-D63 WeakPolarHBondContact O-CB 3.36Å; F59-D63 PolarHBondContact O-N 3.32Å; T60-D63 PolarHBondContact O-N 3Å; V61-D63 VanDerWaalsContact C-N 3.3Å; V61-D63 PolarHBondContact O-N 3.44Å; D63-L65 PolarHBondContact O-N 3.21Å; D63-A66 PolarHBondContact O-N 2.94Å; D63-S67 VanDerWaalsContact O-CB 3.29Å; D63-S67 WeakPolarHBondContact O-CB 3.37Å; D63-S67 PolarHBondContact O-N 3.48Å; D63-S67 PolarHBondContact O-OG 3.48Å; D63-L110 HydrophobicContact CB-CD1 4.01Å; D63-L110 WeakPolarHBondContact OD1-CD1 3.16Å; D63-L276 WeakPolarHBondContact OD1-CD2 3.44Å; D63-L276 VanDerWaalsContact OD2-O 3.05Å
64C97.5Very high95.2Very high22 Ų2217.8 Ų17.815%0.14910%0.101CC..Hα-helixtrans-55.7-48.4169.6-83.70000112.4L33 D36 T60 V61 S67 I68L33-C64 HydrophobicContact CD2-CB 4Å; D36-C64 WeakPolarHBondContact CB-SG 3.39Å; T60-C64 PolarHBondContact O-N 3.24Å; V61-C64 WeakPolarHBondContact O-CB 3.33Å; V61-C64 PolarHBondContact O-N 3.46Å; C64-S67 PolarHBondContact O-N 3.49Å; C64-I68 WeakPolarHBondContact O-CB 3.09Å; C64-I68 VanDerWaalsContact O-CG1 3.27Å; C64-I68 WeakPolarHBondContact O-CG1 3.48Å; C64-I68 PolarHBondContact O-N 2.93Å
65L97.8Very high95.3Very high45 Ų4519.8 Ų19.824%0.23611%0.108CC..Hα-helixtrans-64-42.4179.8-67.6174.9000111.5V61 S62 D63 G69 V102 I105 F148V61-L65 WeakPolarHBondContact O-CG 3.42Å; V61-L65 PolarHBondContact O-N 3.25Å; S62-L65 PolarHBondContact O-N 3.03Å; D63-L65 PolarHBondContact O-N 3.21Å; L65-G69 PolarHBondContact O-N 3.46Å; L65-V102 HydrophobicContact CB-CG1 4.2Å; L65-V102 HydrophobicContact CD2-CG1 3.98Å; L65-V102 WeakPolarHBondContact O-CG1 3.29Å; L65-I105 HydrophobicContact CD1-CG2 4.16Å; L65-F148 HydrophobicContact CD1-CE1 3.91Å
66A96Very high95.3Very high1 Ų121.9 Ų21.91%0.00812%0.118CC..Hα-helixtrans-61.9-45.7175.500000111.1S62 D63 G69 L70 Y103 L276S62-A66 PolarHBondContact O-N 3.05Å; D63-A66 PolarHBondContact O-N 2.94Å; A66-G69 PolarHBondContact O-N 2.93Å; A66-L70 WeakPolarHBondContact O-CB 3.35Å; A66-L70 PolarHBondContact O-N 3.26Å; A66-Y103 WeakPolarHBondContact O-CD2 3.38Å; A66-L276 HydrophobicContact CB-CD2 4.35Å
67S97.2Very high95.3Very high0 Ų024.2 Ų24.20%013%0.127CC..Hα-helixtrans-64.1-45179.3-64.90000112.4A32 D63 C64 G69 L70 I71A32-S67 WeakPolarHBondContact CB-OG 3.28Å; D63-S67 VanDerWaalsContact O-CB 3.29Å; D63-S67 WeakPolarHBondContact O-CB 3.37Å; D63-S67 PolarHBondContact O-N 3.48Å; D63-S67 PolarHBondContact O-OG 3.48Å; C64-S67 PolarHBondContact O-N 3.49Å; S67-G69 VanDerWaalsContact C-N 3.34Å; S67-G69 PolarHBondContact O-N 2.86Å; S67-L70 PolarHBondContact O-N 3.35Å; S67-I71 VanDerWaalsContact O-CG1 3.29Å; S67-I71 WeakPolarHBondContact O-CG1 3.39Å; S67-I71 PolarHBondContact O-N 3.32Å
68I97.7Very high95.1Very high56 Ų5625.1 Ų25.129%0.28713%0.129SC..Hα-helixtrans-57-50.3172.8-71.5164.4000110L33 C64 L70 I71 F72 V102L33-I68 HydrophobicContact CD1-CG1 4Å; L33-I68 HydrophobicContact CD2-CD1 4.41Å; L33-I68 HydrophobicContact CD2-CG1 3.93Å; C64-I68 WeakPolarHBondContact O-CB 3.09Å; C64-I68 VanDerWaalsContact O-CG1 3.27Å; C64-I68 WeakPolarHBondContact O-CG1 3.48Å; C64-I68 PolarHBondContact O-N 2.93Å; I68-L70 VanDerWaalsContact C-N 3.27Å; I68-L70 PolarHBondContact O-N 3.29Å; I68-I71 PolarHBondContact O-N 3.3Å; I68-F72 HydrophobicContact CG2-CD2 3.84Å; I68-F72 HydrophobicContact CG2-CE2 3.9Å; I68-F72 VanDerWaalsContact O-CD2 3.31Å; I68-F72 WeakPolarHBondContact O-CD2 3.23Å; I68-F72 PolarHBondContact O-N 2.87Å; I68-F72 VanDerWaalsContact O-N 3.15Å; I68-V102 HydrophobicContact CG2-CG1 4.29Å
69G96.3Very high94.9Very high0 Ų028.8 Ų28.80%015%0.146CC..Hα-helixtrans-56.6-41.4178.600000113L65 A66 S67 T73L65-G69 PolarHBondContact O-N 3.46Å; A66-G69 PolarHBondContact O-N 2.93Å; S67-G69 VanDerWaalsContact C-N 3.34Å; S67-G69 PolarHBondContact O-N 2.86Å; G69-T73 VanDerWaalsContact O-CB 3.25Å; G69-T73 WeakPolarHBondContact O-CB 3.34Å; G69-T73 PolarHBondContact O-N 2.64Å; G69-T73 PolarHBondContact O-OG1 2.91Å
70L94.7Very high94.6Very high13 Ų1329 Ų297%0.06815%0.147CC..Hα-helixtrans-71.5-38.9-179.7-174.356.8000112.7L25 S29 A66 S67 I68 S74 Y103 N273 L276L25-L70 HydrophobicContact CD2-CD2 4.47Å; S29-L70 WeakPolarHBondContact OG-CD2 3.29Å; S29-L70 WeakPolarHBondContact OG-CG 3.37Å; A66-L70 WeakPolarHBondContact O-CB 3.35Å; A66-L70 PolarHBondContact O-N 3.26Å; S67-L70 PolarHBondContact O-N 3.35Å; I68-L70 VanDerWaalsContact C-N 3.27Å; I68-L70 PolarHBondContact O-N 3.29Å; L70-S74 VanDerWaalsContact O-CB 3.28Å; L70-S74 WeakPolarHBondContact O-CB 3.18Å; L70-S74 PolarHBondContact O-N 2.91Å; L70-S74 PolarHBondContact O-OG 3.21Å; L70-Y103 HydrophobicContact CB-CD2 4.37Å; L70-Y103 HydrophobicContact CB-CE2 4.19Å; L70-N273 HydrophobicContact CD2-CB 4.13Å; L70-N273 WeakPolarHBondContact CD2-OD1 3.14Å; L70-L276 HydrophobicContact CD2-CD1 3.84Å
71I96.8Very high94Very high22 Ų2235 Ų3511%0.11317%0.17CC..Hα-helixtrans-58.3-57.1174.2-70.2166.2000109.9V30 L33 S67 I68 T73 S74 I75V30-I71 HydrophobicContact CG2-CD1 3.79Å; V30-I71 HydrophobicContact CG2-CG1 4.26Å; L33-I71 HydrophobicContact CD1-CD1 3.41Å; L33-I71 VanDerWaalsContact CD1-CD1 3.41Å; L33-I71 HydrophobicContact CG-CD1 4.43Å; S67-I71 VanDerWaalsContact O-CG1 3.29Å; S67-I71 WeakPolarHBondContact O-CG1 3.39Å; S67-I71 PolarHBondContact O-N 3.32Å; I68-I71 PolarHBondContact O-N 3.3Å; I71-T73 VanDerWaalsContact C-N 3.32Å; I71-T73 PolarHBondContact O-N 2.96Å; I71-S74 PolarHBondContact O-N 3.36Å; I71-S74 VanDerWaalsContact O-N 3.14Å; I71-I75 HydrophobicContact CG2-CD1 3.62Å; I71-I75 HydrophobicContact CG2-CG1 4.38Å; I71-I75 WeakPolarHBondContact O-CG1 3.43Å; I71-I75 PolarHBondContact O-N 2.94Å
72F96.7Very high93.3Very high87 Ų8740.6 Ų40.638%0.38219%0.193SC..Hα-helixtrans-66.1-35.7-176.5-78.5-75.2000112.3I68 S74 Q76 F98 Y99I68-F72 HydrophobicContact CG2-CD2 3.84Å; I68-F72 HydrophobicContact CG2-CE2 3.9Å; I68-F72 VanDerWaalsContact O-CD2 3.31Å; I68-F72 WeakPolarHBondContact O-CD2 3.23Å; I68-F72 PolarHBondContact O-N 2.87Å; I68-F72 VanDerWaalsContact O-N 3.15Å; F72-S74 VanDerWaalsContact C-N 3.34Å; F72-Q76 WeakPolarHBondContact O-CB 3.43Å; F72-Q76 PolarHBondContact O-N 2.87Å; F72-F98 HydrophobicContact CD1-CZ 4.24Å; F72-F98 HydrophobicContact CD2-CE2 4.45Å; F72-F98 HydrophobicContact CD2-CZ 4.05Å; F72-F98 HydrophobicContact CE1-CZ 4.15Å; F72-F98 HydrophobicContact CE2-CE2 4.45Å; F72-F98 AromaticContact CE2-CZ 3.98Å; F72-F98 HydrophobicContact CE2-CZ 3.98Å; F72-F98 HydrophobicContact CG-CZ 4.2Å; F72-F98 HydrophobicContact CZ-CZ 4.03Å; F72-Y99 VanDerWaalsContact CB-CB 3.44Å; F72-Y99 HydrophobicContact CB-CD1 3.57Å; F72-Y99 HydrophobicContact CB-CD2 4.2Å; F72-Y99 HydrophobicContact CB-CE1 4.33Å; F72-Y99 HydrophobicContact CB-CG 3.48Å; F72-Y99 VanDerWaalsContact CB-CG 3.48Å; F72-Y99 HydrophobicContact CG-CD1 4.35Å; F72-Y99 HydrophobicContact CG-CG 4.48Å
73T93.1Very high92.7Very high10 Ų1045.2 Ų45.26%0.06122%0.215CC..Hα-helixtrans-61.9-44.1173-60.40000111.1G69 I71 Q76 R77 Y99G69-T73 VanDerWaalsContact O-CB 3.25Å; G69-T73 WeakPolarHBondContact O-CB 3.34Å; G69-T73 PolarHBondContact O-N 2.64Å; G69-T73 PolarHBondContact O-OG1 2.91Å; I71-T73 VanDerWaalsContact C-N 3.32Å; I71-T73 PolarHBondContact O-N 2.96Å; T73-Q76 PolarHBondContact O-N 3.43Å; T73-R77 VanDerWaalsContact O-CG 3.3Å; T73-R77 WeakPolarHBondContact O-CG 3.13Å; T73-R77 PolarHBondContact O-N 3.37Å; T73-Y99 VanDerWaalsContact OG1-CD2 3.24Å; T73-Y99 WeakPolarHBondContact OG1-CD2 3.26Å; T73-Y99 WeakPolarHBondContact OG1-CE2 3.15Å
74S92.7Very high92Very high2 Ų253.3 Ų53.31%0.01425%0.253CS..Hα-helixtrans-69.1-42.6-179-57.30000111.8I26 L70 I71 F72 R77 L78I26-S74 VanDerWaalsContact CG1-CB 3.46Å; L70-S74 VanDerWaalsContact O-CB 3.28Å; L70-S74 WeakPolarHBondContact O-CB 3.18Å; L70-S74 PolarHBondContact O-N 2.91Å; L70-S74 PolarHBondContact O-OG 3.21Å; I71-S74 PolarHBondContact O-N 3.36Å; I71-S74 VanDerWaalsContact O-N 3.14Å; F72-S74 VanDerWaalsContact C-N 3.34Å; S74-R77 PolarHBondContact O-N 3.48Å; S74-L78 WeakPolarHBondContact O-CG 3.39Å; S74-L78 PolarHBondContact O-N 3.06Å
75I93.8Very high91.2Very high70 Ų7054.1 Ų54.136%0.35926%0.258SS..Hα-helixtrans-59.8-47173.7-68.4170.7000110.4I26 I71 R77 L78 L79I26-I75 HydrophobicContact CD1-CG1 4.01Å; I71-I75 HydrophobicContact CG2-CD1 3.62Å; I71-I75 HydrophobicContact CG2-CG1 4.38Å; I71-I75 WeakPolarHBondContact O-CG1 3.43Å; I71-I75 PolarHBondContact O-N 2.94Å; I75-R77 VanDerWaalsContact C-N 3.28Å; I75-R77 PolarHBondContact O-N 3.33Å; I75-L78 WeakPolarHBondContact O-CB 3.47Å; I75-L78 PolarHBondContact O-N 3.45Å; I75-L78 VanDerWaalsContact O-N 3.16Å; I75-L79 HydrophobicContact CG2-CD1 4.15Å; I75-L79 HydrophobicContact CG2-CG 4.48Å; I75-L79 WeakPolarHBondContact O-CG 3.26Å; I75-L79 PolarHBondContact O-N 3.08Å
76Q92.1Very high90.7Very high44 Ų4455.7 Ų55.721%0.20626%0.263CS..Hα-helixtrans-57.7-44.1177-179.87132.300111.3F72 T73 L78 L79 L80 Y99F72-Q76 WeakPolarHBondContact O-CB 3.43Å; F72-Q76 PolarHBondContact O-N 2.87Å; T73-Q76 PolarHBondContact O-N 3.43Å; Q76-L78 VanDerWaalsContact C-N 3.29Å; Q76-L78 PolarHBondContact O-N 3.27Å; Q76-L79 PolarHBondContact O-N 2.91Å; Q76-L80 HydrophobicContact CG-CD1 3.94Å; Q76-L80 HydrophobicContact CG-CG 4.22Å; Q76-L80 WeakPolarHBondContact O-CB 3.34Å; Q76-L80 VanDerWaalsContact O-CG 3.26Å; Q76-L80 WeakPolarHBondContact O-CG 3.35Å; Q76-L80 PolarHBondContact O-N 3.3Å; Q76-Y99 VanDerWaalsContact CB-OH 3.24Å; Q76-Y99 WeakPolarHBondContact CB-OH 3.48Å; Q76-Y99 WeakPolarHBondContact CG-OH 3.31Å
77R91.2Very high90.3Very high49 Ų4958 Ų5819%0.18528%0.277CS..Hα-helixtrans-66.5-31.6-179.5-73.1179-173.6177.96.5112.7E17 L22 T73 S74 I75E17-R77 IonicContact OE1-CZ 3.63Å; E17-R77 IonicContact OE1-NH1 3.3Å; E17-R77 PolarHBondContact OE1-NH1 3.32Å; E17-R77 VanDerWaalsContact OE2-CD 3.23Å; E17-R77 WeakPolarHBondContact OE2-CD 3.39Å; E17-R77 IonicContact OE2-CZ 3.9Å; E17-R77 IonicContact OE2-NE 2.6Å; E17-R77 IonicContact OE2-NH1 2.64Å; E17-R77 PolarHBondContact OE2-NH1 3.44Å; L22-R77 HydrophobicContact CD1-CB 4.1Å; L22-R77 HydrophobicContact CD2-CB 4.1Å; T73-R77 VanDerWaalsContact O-CG 3.3Å; T73-R77 WeakPolarHBondContact O-CG 3.13Å; T73-R77 PolarHBondContact O-N 3.37Å; S74-R77 PolarHBondContact O-N 3.48Å; I75-R77 VanDerWaalsContact C-N 3.28Å; I75-R77 PolarHBondContact O-N 3.33Å
78L89.9Confident90.1Very high44 Ų4459.1 Ų59.123%0.2328%0.284CS..Hα-helixtrans-65-50.1170.3-71.6171.5000111L19 L22 I26 S74 I75 Q76 L80 R81L19-L78 HydrophobicContact CG-CD2 4.32Å; L22-L78 HydrophobicContact CB-CD1 4.49Å; L22-L78 HydrophobicContact CB-CD2 3.87Å; L22-L78 HydrophobicContact CB-CG 4.08Å; L22-L78 HydrophobicContact CD1-CD2 3.66Å; L22-L78 HydrophobicContact CD1-CG 3.99Å; L22-L78 HydrophobicContact CG-CD2 4.43Å; I26-L78 HydrophobicContact CD1-CD1 3.61Å; S74-L78 WeakPolarHBondContact O-CG 3.39Å; S74-L78 PolarHBondContact O-N 3.06Å; I75-L78 WeakPolarHBondContact O-CB 3.47Å; I75-L78 PolarHBondContact O-N 3.45Å; I75-L78 VanDerWaalsContact O-N 3.16Å; Q76-L78 VanDerWaalsContact C-N 3.29Å; Q76-L78 PolarHBondContact O-N 3.27Å; L78-L80 VanDerWaalsContact C-N 3.27Å; L78-L80 PolarHBondContact O-N 3.14Å; L78-R81 WeakPolarHBondContact O-CB 3.28Å; L78-R81 PolarHBondContact O-N 2.67Å
79L90.3Very high89.9Confident81 Ų8157 Ų5742%0.42428%0.275SS..Hα-helixtrans-60-37.6178.6-66.7173.2000112.5I75 Q76 R81 E82I75-L79 HydrophobicContact CG2-CD1 4.15Å; I75-L79 HydrophobicContact CG2-CG 4.48Å; I75-L79 WeakPolarHBondContact O-CG 3.26Å; I75-L79 PolarHBondContact O-N 3.08Å; Q76-L79 PolarHBondContact O-N 2.91Å; L79-R81 PolarHBondContact O-N 3.32Å; L79-E82 PolarHBondContact O-N 3.03Å; L79-E82 VanDerWaalsContact O-N 3.13Å
80L88.1Confident89.8Confident5 Ų557 Ų573%0.02628%0.275CS..THydrogen-bonded Turntrans-62.9-19.4177.9-80.8175.2000113.6W14 Q76 L78 E82 M83 F86 P172 A173W14-L80 HydrophobicContact CH2-CD2 4.22Å; W14-L80 HydrophobicContact CZ3-CB 3.92Å; W14-L80 HydrophobicContact CZ3-CD2 4.18Å; W14-L80 HydrophobicContact CZ3-CG 4.48Å; W14-L80 WeakPolarHBondContact CZ3-O 3.43Å; Q76-L80 HydrophobicContact CG-CD1 3.94Å; Q76-L80 HydrophobicContact CG-CG 4.22Å; Q76-L80 WeakPolarHBondContact O-CB 3.34Å; Q76-L80 VanDerWaalsContact O-CG 3.26Å; Q76-L80 WeakPolarHBondContact O-CG 3.35Å; Q76-L80 PolarHBondContact O-N 3.3Å; L78-L80 VanDerWaalsContact C-N 3.27Å; L78-L80 PolarHBondContact O-N 3.14Å; L80-E82 VanDerWaalsContact C-N 3.29Å; L80-M83 HydrophobicContact CD2-SD 4.12Å; L80-F86 HydrophobicContact CD2-CE1 3.95Å; L80-F86 HydrophobicContact CD2-CZ 4.02Å; L80-P172 HydrophobicContact CD1-CB 4.33Å; L80-P172 WeakPolarHBondContact CD1-O 3.41Å; L80-P172 HydrophobicContact CD2-CB 3.87Å; L80-P172 HydrophobicContact CD2-CG 3.93Å; L80-A173 HydrophobicContact CD1-CB 4.26Å
81R82.2Confident89.8Confident127 Ų12758 Ų5848%0.47928%0.28SS..THydrogen-bonded Turntrans-72.1-24.1175.6-71.8170.4145.4-109.2-5.3113.1E17 L78 L79E17-R81 PolarHBondContact O-NH2 3.03Å; L78-R81 WeakPolarHBondContact O-CB 3.28Å; L78-R81 PolarHBondContact O-N 2.67Å; L79-R81 PolarHBondContact O-N 3.32Å
82E83.7Confident89.7Confident175 Ų17560.2 Ų60.282%0.81829%0.292SS*.THydrogen-bonded Turntrans-92.5-15.1-179.9-61.6-179.7176.300112.3L79 L80L79-E82 PolarHBondContact O-N 3.03Å; L79-E82 VanDerWaalsContact O-N 3.13Å; L80-E82 VanDerWaalsContact C-N 3.29Å
83M84.1Confident89.6Confident97 Ų9756.1 Ų56.148%0.47827%0.274SS..SBendtrans-85.8149.6-179.2-65.3-177.6-178.900111.8L80 F86L80-M83 HydrophobicContact CD2-SD 4.12Å; M83-F86 HydrophobicContact SD-CE1 4.34Å
84E80.6Confident89.7Confident169 Ų16955.7 Ų55.779%0.7927%0.271SS*.PPolyproline II helixtrans-61.6148.4169.3-65.1-16615300111.1F86E84-F86 VanDerWaalsContact O-CD1 3.31Å; E84-F86 WeakPolarHBondContact O-CD1 3.49Å; E84-F86 PolarHBondContact O-N 2.81Å
85P79.6Confident89.8Confident40 Ų4060.7 Ų60.726%0.2630%0.297SS..PPolyproline II helixtrans-70.3122.7-177.427.9-34000111.5F6 W14F6-P85 HydrophobicContact CB-CB 4.02Å; F6-P85 HydrophobicContact CB-CG 4.16Å; F6-P85 HydrophobicContact CD1-CB 4.08Å; F6-P85 HydrophobicContact CD2-CB 3.71Å; F6-P85 HydrophobicContact CD2-CG 4.01Å; F6-P85 HydrophobicContact CE1-CB 4.44Å; F6-P85 HydrophobicContact CE2-CB 4.09Å; F6-P85 WeakPolarHBondContact CE2-O 3.24Å; F6-P85 HydrophobicContact CG-CB 3.67Å; F6-P85 HydrophobicContact CG-CG 4.18Å; F6-P85 HydrophobicContact CZ-CB 4.41Å; W14-P85 HydrophobicContact CZ2-CB 4.03Å
86F87.8Confident89.8Confident78 Ų7865.1 Ų65.134%0.34231%0.314SS..  trans-130.5168.2173.965.5-81.9000111.4W14 L80 M83 E84 V88 P172W14-F86 HydrophobicContact CH2-CD1 4.48Å; W14-F86 HydrophobicContact CH2-CE1 4.49Å; L80-F86 HydrophobicContact CD2-CE1 3.95Å; L80-F86 HydrophobicContact CD2-CZ 4.02Å; M83-F86 HydrophobicContact SD-CE1 4.34Å; E84-F86 VanDerWaalsContact O-CD1 3.31Å; E84-F86 WeakPolarHBondContact O-CD1 3.49Å; E84-F86 PolarHBondContact O-N 2.81Å; F86-V88 HydrophobicContact CD2-CG1 3.76Å; F86-V88 HydrophobicContact CE2-CG1 3.45Å; F86-V88 VanDerWaalsContact CE2-CG1 3.45Å; F86-P172 HydrophobicContact CD1-CG 4.29Å; F86-P172 HydrophobicContact CD2-CB 4.15Å; F86-P172 HydrophobicContact CD2-CG 4.35Å; F86-P172 HydrophobicContact CE1-CB 4.05Å; F86-P172 HydrophobicContact CE1-CG 3.99Å; F86-P172 HydrophobicContact CE2-CB 3.5Å; F86-P172 HydrophobicContact CE2-CG 4.09Å; F86-P172 HydrophobicContact CG-CG 4.46Å; F86-P172 HydrophobicContact CZ-CB 3.42Å; F86-P172 VanDerWaalsContact CZ-CB 3.42Å; F86-P172 HydrophobicContact CZ-CG 3.89Å; F86-P172 WeakPolarHBondContact O-CD 3.35Å
87T88.7Confident89.9Confident48 Ų4864 Ų6429%0.29431%0.308SS..  trans-112.1152.7172.160.30000111.4F6 T10 K169 I170F6-T87 HydrophobicContact CE1-CG2 4.02Å; F6-T87 HydrophobicContact CZ-CG2 3.49Å; F6-T87 VanDerWaalsContact CZ-CG2 3.49Å; T10-T87 HydrophobicContact CG2-CG2 4.25Å; T87-K169 HydrophobicContact CG2-CB 4.12Å; T87-I170 WeakPolarHBondContact CA-O 3.33Å
88V92.7Very high90Very high24 Ų2467.2 Ų67.215%0.14532%0.323CS..BIsolated β-bridgetrans-126.7160.2174.3-62.30000111.1F86 C93 I170 P172F86-V88 HydrophobicContact CD2-CG1 3.76Å; F86-V88 HydrophobicContact CE2-CG1 3.45Å; F86-V88 VanDerWaalsContact CE2-CG1 3.45Å; V88-C93 HydrophobicContact CG2-CB 4.04Å; V88-I170 HydrophobicContact CG2-CD1 4.42Å; V88-I170 HydrophobicContact CG2-CG1 3.86Å; V88-I170 PolarHBondContact N-O 3.19Å; V88-I170 VanDerWaalsContact O-CG1 3.32Å; V88-I170 WeakPolarHBondContact O-CG1 3.35Å; V88-I170 PolarHBondContact O-N 3.4Å; V88-P172 HydrophobicContact CG1-CB 4.15Å; V88-P172 HydrophobicContact CG2-CB 4.45Å
89S93.6Very high90.3Very high13 Ų1365.9 Ų65.99%0.09132%0.315CS..  trans-76.6150.716875.60000110.6L91 D92 C93 R166S89-L91 VanDerWaalsContact C-N 3.28Å; S89-L91 PolarHBondContact O-N 2.81Å; S89-D92 PolarHBondContact O-N 2.84Å; S89-D92 WeakPolarHBondContact OG-CB 3.36Å; S89-D92 PolarHBondContact OG-N 3.48Å; S89-D92 PolarHBondContact OG-OD2 3.38Å; S89-C93 VanDerWaalsContact O-CB 3.24Å; S89-C93 WeakPolarHBondContact O-CB 3.35Å; S89-C93 PolarHBondContact O-N 3.26Å; S89-R166 WeakPolarHBondContact CB-O 3.32Å
90P94Very high90.5Very high0 Ų062.4 Ų62.40%030%0.297CS..Hα-helixtrans-54.1-41.4173.2-32.137.3000113.9C93 L94 A162 I165 H168 I170P90-C93 VanDerWaalsContact O-CB 3.31Å; P90-C93 WeakPolarHBondContact O-CB 3.46Å; P90-C93 PolarHBondContact O-N 3.27Å; P90-L94 PolarHBondContact O-N 3Å; P90-A162 HydrophobicContact CB-CB 3.99Å; P90-I165 HydrophobicContact CB-CD1 4.26Å; P90-I165 HydrophobicContact CB-CG1 4.12Å; P90-I165 HydrophobicContact CG-CD1 4Å; P90-I165 HydrophobicContact CG-CG1 4.03Å; P90-H168 WeakPolarHBondContact CD-O 3.21Å; P90-H168 HydrophobicContact CG-CB 4.46Å; P90-I170 HydrophobicContact CB-CD1 4.34Å; P90-I170 HydrophobicContact CG-CD1 4.22Å; P90-I170 HydrophobicContact CG-CG1 4.38Å; P90-I170 HydrophobicContact CG-CG2 3.97Å
91L94.3Very high90.8Very high34 Ų3463.1 Ų63.118%0.17830%0.302CS..Hα-helixtrans-71.1-45.2-179-173.466.1000111.8S89 C93 L94 L95 Y159 F163 R166S89-L91 VanDerWaalsContact C-N 3.28Å; S89-L91 PolarHBondContact O-N 2.81Å; L91-C93 PolarHBondContact O-N 3.11Å; L91-L94 PolarHBondContact O-N 3.2Å; L91-L94 VanDerWaalsContact O-N 3.13Å; L91-L95 HydrophobicContact CD1-CD1 4.24Å; L91-L95 HydrophobicContact CD1-CG 4.36Å; L91-L95 HydrophobicContact CD2-CD1 4.3Å; L91-L95 HydrophobicContact CG-CD1 3.81Å; L91-L95 HydrophobicContact CG-CG 4.32Å; L91-L95 WeakPolarHBondContact O-CG 3.41Å; L91-L95 PolarHBondContact O-N 3.44Å; L91-Y159 HydrophobicContact CD1-CD1 4.3Å; L91-F163 HydrophobicContact CD1-CB 4.2Å; L91-F163 HydrophobicContact CD2-CD2 3.78Å; L91-R166 HydrophobicContact CB-CB 4.42Å
92D94.6Very high91.5Very high68 Ų6858.8 Ų58.836%0.36429%0.289SS..Hα-helixtrans-61.1-36.4175.1-71.8-46.1000111.4S89 L94 L95 K96S89-D92 PolarHBondContact O-N 2.84Å; S89-D92 WeakPolarHBondContact OG-CB 3.36Å; S89-D92 PolarHBondContact OG-N 3.48Å; S89-D92 PolarHBondContact OG-OD2 3.38Å; D92-L94 VanDerWaalsContact C-N 3.31Å; D92-L94 PolarHBondContact O-N 2.93Å; D92-L95 PolarHBondContact O-N 3.32Å; D92-K96 HydrophobicContact CB-CD 4.48Å; D92-K96 VanDerWaalsContact O-CB 3.29Å; D92-K96 WeakPolarHBondContact O-CB 3.23Å; D92-K96 WeakPolarHBondContact O-CG 3.46Å; D92-K96 PolarHBondContact O-N 3.01Å
93C94.2Very high92.1Very high0 Ų053.4 Ų53.40%026%0.262CS..Hα-helixtrans-56.9-44.1175.41610000111.6V88 S89 P90 L91 R97 I170 C174V88-C93 HydrophobicContact CG2-CB 4.04Å; S89-C93 VanDerWaalsContact O-CB 3.24Å; S89-C93 WeakPolarHBondContact O-CB 3.35Å; S89-C93 PolarHBondContact O-N 3.26Å; P90-C93 VanDerWaalsContact O-CB 3.31Å; P90-C93 WeakPolarHBondContact O-CB 3.46Å; P90-C93 PolarHBondContact O-N 3.27Å; L91-C93 PolarHBondContact O-N 3.11Å; C93-R97 VanDerWaalsContact O-CB 3.31Å; C93-R97 WeakPolarHBondContact O-CB 3.11Å; C93-R97 WeakPolarHBondContact O-CD 3.37Å; C93-R97 WeakPolarHBondContact O-CG 3.42Å; C93-I170 HydrophobicContact CB-CD1 3.95Å; C93-C174 HydrophobicContact CB-CB 4.45Å; C93-C174 WeakPolarHBondContact CB-SG 3.16Å; C93-C174 VanDerWaalsContact SG-CA 3.58Å; C93-C174 WeakPolarHBondContact SG-CB 3.34Å; C93-C174 CovalentContact SG-SG 2Å; C93-C174 PolarHBondContact SG-SG 3.05Å
94L95Very high92.6Very high1 Ų148.9 Ų48.91%0.00524%0.24CC..Hα-helixtrans-78.1-39.3177.6-64.9-178.9000113.3P90 L91 D92 L100 M104 Y159 A162 Y179P90-L94 PolarHBondContact O-N 3Å; L91-L94 PolarHBondContact O-N 3.2Å; L91-L94 VanDerWaalsContact O-N 3.13Å; D92-L94 VanDerWaalsContact C-N 3.31Å; D92-L94 PolarHBondContact O-N 2.93Å; L94-L100 HydrophobicContact CD2-CB 4.22Å; L94-L100 HydrophobicContact CD2-CD1 3.95Å; L94-M104 HydrophobicContact CD2-CE 3.51Å; L94-Y159 HydrophobicContact CB-CD1 4.01Å; L94-Y159 HydrophobicContact CB-CE1 3.48Å; L94-Y159 VanDerWaalsContact CB-CE1 3.48Å; L94-Y159 HydrophobicContact CD1-CD1 4.16Å; L94-Y159 HydrophobicContact CD1-CE1 4.39Å; L94-Y159 HydrophobicContact CD1-CG 4.35Å; L94-Y159 PolarHBondContact O-OH 2.84Å; L94-A162 HydrophobicContact CD1-CB 3.53Å; L94-A162 HydrophobicContact CG-CB 4.41Å; L94-Y179 HydrophobicContact CD1-CD2 4.29Å; L94-Y179 HydrophobicContact CD2-CD1 4.36Å; L94-Y179 HydrophobicContact CD2-CD2 4.03Å; L94-Y179 HydrophobicContact CD2-CE1 4.31Å; L94-Y179 HydrophobicContact CD2-CE2 4.01Å; L94-Y179 HydrophobicContact CD2-CG 4.23Å; L94-Y179 HydrophobicContact CG-CD2 4.41Å
95L94.7Very high93.4Very high108 Ų10842.8 Ų42.857%0.56521%0.212SC*.Hα-helixtrans-70.3-39.8-177-73.3174.5000112.6L91 D92 R97 Y159L91-L95 HydrophobicContact CD1-CD1 4.24Å; L91-L95 HydrophobicContact CD1-CG 4.36Å; L91-L95 HydrophobicContact CD2-CD1 4.3Å; L91-L95 HydrophobicContact CG-CD1 3.81Å; L91-L95 HydrophobicContact CG-CG 4.32Å; L91-L95 WeakPolarHBondContact O-CG 3.41Å; L91-L95 PolarHBondContact O-N 3.44Å; D92-L95 PolarHBondContact O-N 3.32Å; L95-R97 VanDerWaalsContact C-N 3.29Å; L95-R97 PolarHBondContact O-N 3.22Å; L95-Y159 HydrophobicContact CD2-CD1 4.35Å; L95-Y159 HydrophobicContact CD2-CE1 3.76Å; L95-Y159 HydrophobicContact CG-CE1 4.16Å
96K94.2Very high94.2Very high163 Ų16340.9 Ų40.971%0.70920%0.2SC*.SBendtrans-82.1-6.4-177.3-62.7-177.4-179.1-179.40113.5D92D92-K96 HydrophobicContact CB-CD 4.48Å; D92-K96 VanDerWaalsContact O-CB 3.29Å; D92-K96 WeakPolarHBondContact O-CB 3.23Å; D92-K96 WeakPolarHBondContact O-CG 3.46Å; D92-K96 PolarHBondContact O-N 3.01Å
97R94.2Very high94.4Very high21 Ų2138.3 Ų38.38%0.07919%0.19CC..  trans-128.481.5-173-64175.8166.4105.24110.9C93 L95 Y99 L100 P101 P172 C174C93-R97 VanDerWaalsContact O-CB 3.31Å; C93-R97 WeakPolarHBondContact O-CB 3.11Å; C93-R97 WeakPolarHBondContact O-CD 3.37Å; C93-R97 WeakPolarHBondContact O-CG 3.42Å; L95-R97 VanDerWaalsContact C-N 3.29Å; L95-R97 PolarHBondContact O-N 3.22Å; R97-Y99 HydrophobicContact CB-CD1 4.31Å; R97-Y99 HydrophobicContact CB-CE1 3.78Å; R97-Y99 HydrophobicContact CB-CE2 4.09Å; R97-Y99 WeakPolarHBondContact CD-OH 3.2Å; R97-Y99 HydrophobicContact CG-CE1 3.98Å; R97-Y99 WeakPolarHBondContact CG-OH 3.33Å; R97-Y99 PolarHBondContact NE-OH 3.08Å; R97-Y99 PolarHBondContact O-N 3.41Å; R97-L100 HydrophobicContact CB-CD1 3.83Å; R97-L100 HydrophobicContact CB-CG 3.98Å; R97-L100 PolarHBondContact O-N 3.5Å; R97-P101 WeakPolarHBondContact O-CD 3.39Å; R97-P172 PolarHBondContact NH1-O 2.86Å; R97-P172 PolarHBondContact NH2-O 3.34Å; R97-C174 VanDerWaalsContact CZ-SG 3.57Å; R97-C174 PolarHBondContact NH1-SG 3.31Å
98F93.7Very high94.6Very high116 Ų11636.8 Ų36.851%0.50918%0.18SC..THydrogen-bonded Turntrans-54.4-28.5-178.678.8-89.7000113.8F72 L100 P101 V102F72-F98 HydrophobicContact CD1-CZ 4.24Å; F72-F98 HydrophobicContact CD2-CE2 4.45Å; F72-F98 HydrophobicContact CD2-CZ 4.05Å; F72-F98 HydrophobicContact CE1-CZ 4.15Å; F72-F98 HydrophobicContact CE2-CE2 4.45Å; F72-F98 AromaticContact CE2-CZ 3.98Å; F72-F98 HydrophobicContact CE2-CZ 3.98Å; F72-F98 HydrophobicContact CG-CZ 4.2Å; F72-F98 HydrophobicContact CZ-CZ 4.03Å; F98-L100 VanDerWaalsContact C-N 3.26Å; F98-L100 PolarHBondContact O-N 3.44Å; F98-P101 WeakPolarHBondContact O-CD 3.29Å; F98-P101 VanDerWaalsContact O-CG 3.23Å; F98-P101 WeakPolarHBondContact O-CG 3.49Å; F98-V102 HydrophobicContact CD2-CG2 4.42Å; F98-V102 VanDerWaalsContact O-CG2 3.31Å; F98-V102 WeakPolarHBondContact O-CG2 3.47Å; F98-V102 PolarHBondContact O-N 2.92Å
99Y94.9Very high94.8Very high15 Ų1535.7 Ų35.76%0.05917%0.173CC..Hα-helixtrans-69.7-21.2-17955.8-99.8000113.5F72 T73 Q76 R97 Y103F72-Y99 VanDerWaalsContact CB-CB 3.44Å; F72-Y99 HydrophobicContact CB-CD1 3.57Å; F72-Y99 HydrophobicContact CB-CD2 4.2Å; F72-Y99 HydrophobicContact CB-CE1 4.33Å; F72-Y99 HydrophobicContact CB-CG 3.48Å; F72-Y99 VanDerWaalsContact CB-CG 3.48Å; F72-Y99 HydrophobicContact CG-CD1 4.35Å; F72-Y99 HydrophobicContact CG-CG 4.48Å; T73-Y99 VanDerWaalsContact OG1-CD2 3.24Å; T73-Y99 WeakPolarHBondContact OG1-CD2 3.26Å; T73-Y99 WeakPolarHBondContact OG1-CE2 3.15Å; Q76-Y99 VanDerWaalsContact CB-OH 3.24Å; Q76-Y99 WeakPolarHBondContact CB-OH 3.48Å; Q76-Y99 WeakPolarHBondContact CG-OH 3.31Å; R97-Y99 HydrophobicContact CB-CD1 4.31Å; R97-Y99 HydrophobicContact CB-CE1 3.78Å; R97-Y99 HydrophobicContact CB-CE2 4.09Å; R97-Y99 WeakPolarHBondContact CD-OH 3.2Å; R97-Y99 HydrophobicContact CG-CE1 3.98Å; R97-Y99 WeakPolarHBondContact CG-OH 3.33Å; R97-Y99 PolarHBondContact NE-OH 3.08Å; R97-Y99 PolarHBondContact O-N 3.41Å; Y99-Y103 VanDerWaalsContact O-CB 3.29Å; Y99-Y103 WeakPolarHBondContact O-CB 3.19Å; Y99-Y103 PolarHBondContact O-N 3.04Å
100L95.1Very high94.8Very high9 Ų935 Ų355%0.04717%0.169CC..Hα-helixtrans-66.3-56.8177.2-69.1177.4000112L94 R97 F98 V102 Y103 M104 C174L94-L100 HydrophobicContact CD2-CB 4.22Å; L94-L100 HydrophobicContact CD2-CD1 3.95Å; R97-L100 HydrophobicContact CB-CD1 3.83Å; R97-L100 HydrophobicContact CB-CG 3.98Å; R97-L100 PolarHBondContact O-N 3.5Å; F98-L100 VanDerWaalsContact C-N 3.26Å; F98-L100 PolarHBondContact O-N 3.44Å; L100-V102 VanDerWaalsContact C-N 3.26Å; L100-V102 PolarHBondContact O-N 3.42Å; L100-Y103 WeakPolarHBondContact O-CB 3.46Å; L100-Y103 PolarHBondContact O-N 3.46Å; L100-M104 HydrophobicContact CB-CE 3.98Å; L100-M104 VanDerWaalsContact O-CG 3.28Å; L100-M104 WeakPolarHBondContact O-CG 3.4Å; L100-M104 PolarHBondContact O-N 3.22Å; L100-C174 HydrophobicContact CD1-CB 3.73Å
101P95.3Very high94.7Very high19 Ų1935.7 Ų35.712%0.12318%0.175CC..Hα-helixtrans-62.5-33.9176.125.5-35.7000112.3R97 F98 Y103 M104 I105 A155 Y159R97-P101 WeakPolarHBondContact O-CD 3.39Å; F98-P101 WeakPolarHBondContact O-CD 3.29Å; F98-P101 VanDerWaalsContact O-CG 3.23Å; F98-P101 WeakPolarHBondContact O-CG 3.49Å; P101-Y103 PolarHBondContact O-N 2.84Å; P101-M104 PolarHBondContact O-N 3.49Å; P101-I105 WeakPolarHBondContact O-CB 3.34Å; P101-I105 VanDerWaalsContact O-CG1 3.23Å; P101-I105 WeakPolarHBondContact O-CG1 3.49Å; P101-I105 PolarHBondContact O-N 3.24Å; P101-A155 HydrophobicContact CB-CB 4.33Å; P101-Y159 HydrophobicContact CB-CE2 4.11Å; P101-Y159 HydrophobicContact CG-CE2 4.41Å
102V96.7Very high94.7Very high36 Ų3636.3 Ų36.322%0.21818%0.177CC..Hα-helixtrans-59.9-46.9173.8171.20000111.1L65 I68 F98 L100 M104 I105 G106L65-V102 HydrophobicContact CB-CG1 4.2Å; L65-V102 HydrophobicContact CD2-CG1 3.98Å; L65-V102 WeakPolarHBondContact O-CG1 3.29Å; I68-V102 HydrophobicContact CG2-CG1 4.29Å; F98-V102 HydrophobicContact CD2-CG2 4.42Å; F98-V102 VanDerWaalsContact O-CG2 3.31Å; F98-V102 WeakPolarHBondContact O-CG2 3.47Å; F98-V102 PolarHBondContact O-N 2.92Å; L100-V102 VanDerWaalsContact C-N 3.26Å; L100-V102 PolarHBondContact O-N 3.42Å; V102-M104 PolarHBondContact O-N 2.76Å; V102-I105 PolarHBondContact O-N 2.65Å; V102-G106 PolarHBondContact O-N 3.46Å
103Y95.3Very high94.6Very high63 Ų6333 Ų3325%0.24716%0.16CC..Hα-helixtrans-60.2-43.5174.3-177.5-104.7000112.3A66 L70 Y99 L100 P101 G106 N107A66-Y103 WeakPolarHBondContact O-CD2 3.38Å; L70-Y103 HydrophobicContact CB-CD2 4.37Å; L70-Y103 HydrophobicContact CB-CE2 4.19Å; Y99-Y103 VanDerWaalsContact O-CB 3.29Å; Y99-Y103 WeakPolarHBondContact O-CB 3.19Å; Y99-Y103 PolarHBondContact O-N 3.04Å; L100-Y103 WeakPolarHBondContact O-CB 3.46Å; L100-Y103 PolarHBondContact O-N 3.46Å; P101-Y103 PolarHBondContact O-N 2.84Å; Y103-G106 PolarHBondContact O-N 3.02Å; Y103-N107 WeakPolarHBondContact O-CB 3.15Å; Y103-N107 PolarHBondContact O-N 3.33Å
104M94.7Very high94.4Very high2 Ų233.6 Ų33.61%0.0116%0.162CC..Hα-helixtrans-62.4-49.7179.6-67.7-172.5-132.700111.5L94 L100 P101 V102 G106 N107 T108 C158 Y179L94-M104 HydrophobicContact CD2-CE 3.51Å; L100-M104 HydrophobicContact CB-CE 3.98Å; L100-M104 VanDerWaalsContact O-CG 3.28Å; L100-M104 WeakPolarHBondContact O-CG 3.4Å; L100-M104 PolarHBondContact O-N 3.22Å; P101-M104 PolarHBondContact O-N 3.49Å; V102-M104 PolarHBondContact O-N 2.76Å; M104-G106 PolarHBondContact O-N 3.1Å; M104-N107 PolarHBondContact O-N 3.48Å; M104-T108 VanDerWaalsContact O-CB 3.3Å; M104-T108 WeakPolarHBondContact O-CB 3.42Å; M104-T108 PolarHBondContact O-N 3.15Å; M104-T108 PolarHBondContact O-OG1 3.02Å; M104-T108 VanDerWaalsContact O-OG1 3.12Å; M104-C158 HydrophobicContact SD-CB 3.92Å; M104-Y179 HydrophobicContact CE-CE1 4.4Å; M104-Y179 HydrophobicContact CE-CE2 3.79Å; M104-Y179 VanDerWaalsContact CE-CZ 3.5Å; M104-Y179 WeakPolarHBondContact CE-OH 3.47Å; M104-Y179 HydrophobicContact SD-CE2 4.41Å
105I97.2Very high94.3Very high40 Ų4034.9 Ų34.921%0.20517%0.169CC..Hα-helixtrans-59.2-50.3176.3-65.3165000109.3L65 P101 V102 N107 T108 T109 F148 A155L65-I105 HydrophobicContact CD1-CG2 4.16Å; P101-I105 WeakPolarHBondContact O-CB 3.34Å; P101-I105 VanDerWaalsContact O-CG1 3.23Å; P101-I105 WeakPolarHBondContact O-CG1 3.49Å; P101-I105 PolarHBondContact O-N 3.24Å; V102-I105 PolarHBondContact O-N 2.65Å; I105-N107 PolarHBondContact O-N 2.84Å; I105-T108 PolarHBondContact O-N 3.11Å; I105-T109 HydrophobicContact CG2-CG2 4.01Å; I105-T109 VanDerWaalsContact O-CB 3.25Å; I105-T109 WeakPolarHBondContact O-CB 3.45Å; I105-T109 WeakPolarHBondContact O-CG2 3.37Å; I105-T109 PolarHBondContact O-N 2.82Å; I105-T109 PolarHBondContact O-OG1 2.87Å; I105-F148 HydrophobicContact CG2-CD1 4.44Å; I105-A155 HydrophobicContact CD1-CB 4.39Å; I105-A155 HydrophobicContact CG1-CB 4.04Å
106G96.2Very high94.2Very high0 Ų030.3 Ų30.30%015%0.145CC..Hα-helixtrans-54.5-53.9178.600000112.6S62 V102 Y103 M104 T109 L110S62-G106 WeakPolarHBondContact O-CA 3.34Å; V102-G106 PolarHBondContact O-N 3.46Å; Y103-G106 PolarHBondContact O-N 3.02Å; M104-G106 PolarHBondContact O-N 3.1Å; G106-T109 PolarHBondContact O-N 2.88Å; G106-T109 PolarHBondContact O-OG1 3.23Å; G106-L110 WeakPolarHBondContact O-CB 3.39Å; G106-L110 PolarHBondContact O-N 2.95Å
107N92.9Very high94Very high25 Ų2522.6 Ų22.613%0.13411%0.112CC..Hα-helixtrans-68.1-40.3-176.7-170.931.3000113.2Y103 M104 I105 L110 A111 K248Y103-N107 WeakPolarHBondContact O-CB 3.15Å; Y103-N107 PolarHBondContact O-N 3.33Å; M104-N107 PolarHBondContact O-N 3.48Å; I105-N107 PolarHBondContact O-N 2.84Å; N107-L110 PolarHBondContact O-N 3.32Å; N107-A111 PolarHBondContact O-N 2.89Å; N107-K248 PolarHBondContact OD1-NZ 3.18Å; N107-K248 VanDerWaalsContact OD1-NZ 3.1Å
108T94.1Very high93.7Very high16 Ų1621.6 Ų21.610%0.09811%0.108CC..Hα-helixtrans-66.7-44.8177.8-64.60000110.7M104 I105 L110 A111 M112 E154M104-T108 VanDerWaalsContact O-CB 3.3Å; M104-T108 WeakPolarHBondContact O-CB 3.42Å; M104-T108 PolarHBondContact O-N 3.15Å; M104-T108 PolarHBondContact O-OG1 3.02Å; M104-T108 VanDerWaalsContact O-OG1 3.12Å; I105-T108 PolarHBondContact O-N 3.11Å; T108-L110 VanDerWaalsContact C-N 3.34Å; T108-L110 PolarHBondContact O-N 3.39Å; T108-A111 PolarHBondContact O-N 3.23Å; T108-M112 VanDerWaalsContact O-CG 3.32Å; T108-M112 WeakPolarHBondContact O-CG 3.45Å; T108-M112 PolarHBondContact O-N 3.34Å; T108-M112 VanDerWaalsContact O-N 3.09Å; T108-E154 HydrophobicContact CG2-CB 4.29Å; T108-E154 HydrophobicContact CG2-CG 4.46Å; T108-E154 PolarHBondContact OG1-OE2 2.88Å
109T95.7Very high93.6Very high0 Ų019 Ų190%010%0.098CC..Hα-helixtrans-67.1-35.4177.655.50000112.4S62 I105 G106 M112 T113 C147 F148S62-T109 WeakPolarHBondContact CB-OG1 3.35Å; S62-T109 WeakPolarHBondContact OG-CB 3.29Å; S62-T109 PolarHBondContact OG-OG1 3.48Å; I105-T109 HydrophobicContact CG2-CG2 4.01Å; I105-T109 VanDerWaalsContact O-CB 3.25Å; I105-T109 WeakPolarHBondContact O-CB 3.45Å; I105-T109 WeakPolarHBondContact O-CG2 3.37Å; I105-T109 PolarHBondContact O-N 2.82Å; I105-T109 PolarHBondContact O-OG1 2.87Å; G106-T109 PolarHBondContact O-N 2.88Å; G106-T109 PolarHBondContact O-OG1 3.23Å; T109-M112 PolarHBondContact O-N 3.28Å; T109-T113 WeakPolarHBondContact O-CB 3.45Å; T109-T113 VanDerWaalsContact O-CG2 3.29Å; T109-T113 WeakPolarHBondContact O-CG2 3.46Å; T109-T113 PolarHBondContact O-N 3.41Å; T109-T113 PolarHBondContact O-OG1 3.5Å; T109-C147 WeakPolarHBondContact CG2-O 2.85Å; T109-F148 HydrophobicContact CG2-CB 4.4Å; T109-F148 HydrophobicContact CG2-CD1 3.78Å; T109-F148 HydrophobicContact CG2-CE1 4.18Å; T109-F148 HydrophobicContact CG2-CG 4.11Å
110L93.4Very high93.4Very high0 Ų018.3 Ų18.30%010%0.096CC..Hα-helixtrans-63.3-44.4174.8-177.6149.4000111.4F59 D63 G106 N107 T108 M112 T113 M114 Y275 L276F59-L110 HydrophobicContact CE2-CG 4.28Å; D63-L110 HydrophobicContact CB-CD1 4.01Å; D63-L110 WeakPolarHBondContact OD1-CD1 3.16Å; G106-L110 WeakPolarHBondContact O-CB 3.39Å; G106-L110 PolarHBondContact O-N 2.95Å; N107-L110 PolarHBondContact O-N 3.32Å; T108-L110 VanDerWaalsContact C-N 3.34Å; T108-L110 PolarHBondContact O-N 3.39Å; L110-M112 VanDerWaalsContact C-N 3.34Å; L110-M112 PolarHBondContact O-N 3.02Å; L110-T113 WeakPolarHBondContact CA-OG1 3.47Å; L110-T113 PolarHBondContact O-N 3.21Å; L110-T113 PolarHBondContact O-OG1 2.82Å; L110-M114 HydrophobicContact CD2-CE 3.31Å; L110-M114 HydrophobicContact CD2-SD 3.83Å; L110-M114 HydrophobicContact CG-CE 4.06Å; L110-M114 WeakPolarHBondContact O-CB 3.21Å; L110-M114 VanDerWaalsContact O-CG 3.26Å; L110-M114 WeakPolarHBondContact O-CG 3.29Å; L110-M114 PolarHBondContact O-N 3.28Å; L110-Y275 HydrophobicContact CD1-CE2 3.82Å; L110-Y275 HydrophobicContact CD2-CE2 3.72Å; L110-Y275 WeakPolarHBondContact CD2-OH 3.24Å; L110-Y275 HydrophobicContact CG-CE2 4.39Å; L110-L276 HydrophobicContact CD1-CD2 4.4Å
111A91.5Very high92.9Very high14 Ų1417.9 Ų17.912%0.1169%0.094CC..Hα-helixtrans-62.3-41.4174.600000112.3N107 T108 L115N107-A111 PolarHBondContact O-N 2.89Å; T108-A111 PolarHBondContact O-N 3.23Å; A111-L115 PolarHBondContact O-N 3.5Å
112M94.4Very high92.5Very high46 Ų4619.7 Ų19.723%0.22710%0.1CC..Hα-helixtrans-70.3-38.5179.1-66-62.8172.300112.8T108 T109 L110 L115 L116 C147 L195T108-M112 VanDerWaalsContact O-CG 3.32Å; T108-M112 WeakPolarHBondContact O-CG 3.45Å; T108-M112 PolarHBondContact O-N 3.34Å; T108-M112 VanDerWaalsContact O-N 3.09Å; T109-M112 PolarHBondContact O-N 3.28Å; L110-M112 VanDerWaalsContact C-N 3.34Å; L110-M112 PolarHBondContact O-N 3.02Å; M112-L115 WeakPolarHBondContact O-CB 3.25Å; M112-L115 PolarHBondContact O-N 3.29Å; M112-L116 WeakPolarHBondContact O-CB 3.37Å; M112-L116 PolarHBondContact O-N 3.39Å; M112-C147 HydrophobicContact CB-CB 3.92Å; M112-L195 HydrophobicContact CE-CD1 3.41Å; M112-L195 VanDerWaalsContact CE-CD1 3.41Å; M112-L195 HydrophobicContact CE-CD2 4.13Å; M112-L195 HydrophobicContact CE-CG 4.43Å; M112-L195 HydrophobicContact SD-CD1 4.14Å; M112-L195 HydrophobicContact SD-CD2 4.13Å
113T93.5Very high92.1Very high0 Ų018.9 Ų18.90%010%0.095CC..Hα-helixtrans-70.4-35.7176.550.50000111.8T109 L110 L116 L117 C147T109-T113 WeakPolarHBondContact O-CB 3.45Å; T109-T113 VanDerWaalsContact O-CG2 3.29Å; T109-T113 WeakPolarHBondContact O-CG2 3.46Å; T109-T113 PolarHBondContact O-N 3.41Å; T109-T113 PolarHBondContact O-OG1 3.5Å; L110-T113 WeakPolarHBondContact CA-OG1 3.47Å; L110-T113 PolarHBondContact O-N 3.21Å; L110-T113 PolarHBondContact O-OG1 2.82Å; T113-L116 PolarHBondContact O-N 3.01Å; T113-L117 WeakPolarHBondContact O-CB 3.31Å; T113-L117 WeakPolarHBondContact O-CG 3.43Å; T113-L117 PolarHBondContact O-N 3.45Å; T113-C147 HydrophobicContact CG2-CB 4.2Å
114M90.3Very high91.5Very high12 Ų1216.8 Ų16.86%0.0599%0.09CC..Hα-helixtrans-59.5-45.7168.5-75.3178.4178.800111.7F59 L110 L117 S118 T244 K248 Y275F59-M114 HydrophobicContact CD2-CG 4.06Å; F59-M114 HydrophobicContact CE2-CE 3.48Å; F59-M114 VanDerWaalsContact CE2-CE 3.48Å; F59-M114 HydrophobicContact CE2-CG 3.67Å; F59-M114 HydrophobicContact CE2-SD 4.45Å; F59-M114 HydrophobicContact CZ-CE 3.98Å; L110-M114 HydrophobicContact CD2-CE 3.31Å; L110-M114 HydrophobicContact CD2-SD 3.83Å; L110-M114 HydrophobicContact CG-CE 4.06Å; L110-M114 WeakPolarHBondContact O-CB 3.21Å; L110-M114 VanDerWaalsContact O-CG 3.26Å; L110-M114 WeakPolarHBondContact O-CG 3.29Å; L110-M114 PolarHBondContact O-N 3.28Å; M114-L117 PolarHBondContact O-N 3.39Å; M114-S118 PolarHBondContact O-N 2.98Å; M114-T244 HydrophobicContact CE-CG2 3.43Å; M114-T244 VanDerWaalsContact CE-CG2 3.43Å; M114-K248 HydrophobicContact CE-CD 4.45Å; M114-K248 HydrophobicContact SD-CD 4.28Å; M114-Y275 HydrophobicContact CE-CD2 4.03Å; M114-Y275 HydrophobicContact CE-CE2 3.95Å
115L91.7Very high91Very high27 Ų2717 Ų1714%0.1419%0.091CC..Hα-helixtrans-60.8-46.817517866.2000110.7A111 M112 L117 S118 I119 L195 V198 L202A111-L115 PolarHBondContact O-N 3.5Å; M112-L115 WeakPolarHBondContact O-CB 3.25Å; M112-L115 PolarHBondContact O-N 3.29Å; L115-L117 VanDerWaalsContact C-N 3.33Å; L115-L117 PolarHBondContact O-N 2.97Å; L115-S118 WeakPolarHBondContact O-CB 3.42Å; L115-S118 PolarHBondContact O-N 3.47Å; L115-S118 PolarHBondContact O-OG 3.27Å; L115-I119 HydrophobicContact CD1-CD1 4.28Å; L115-I119 HydrophobicContact CD1-CG1 4.39Å; L115-I119 HydrophobicContact CD2-CD1 4.47Å; L115-I119 HydrophobicContact CG-CD1 3.94Å; L115-I119 HydrophobicContact CG-CG1 4.45Å; L115-I119 WeakPolarHBondContact O-CG1 3.16Å; L115-I119 PolarHBondContact O-N 2.94Å; L115-L195 HydrophobicContact CD2-CD2 3.7Å; L115-V198 HydrophobicContact CD1-CB 4.46Å; L115-V198 HydrophobicContact CD1-CG1 3.81Å; L115-L202 HydrophobicContact CD1-CD1 3.86Å
116L92.9Very high90.3Very high13 Ų1317.6 Ų17.67%0.06810%0.098CC..Hα-helixtrans-59.6-42.8179.3-173.565.6000111.9M55 M112 T113 S118 I119 E120 F135 W143 V144M55-L116 HydrophobicContact CG-CD2 4.02Å; M55-L116 HydrophobicContact CG-CG 4.44Å; M55-L116 HydrophobicContact SD-CD2 4.07Å; M55-L116 HydrophobicContact SD-CG 3.85Å; M112-L116 WeakPolarHBondContact O-CB 3.37Å; M112-L116 PolarHBondContact O-N 3.39Å; T113-L116 PolarHBondContact O-N 3.01Å; L116-S118 VanDerWaalsContact C-N 3.34Å; L116-S118 PolarHBondContact O-N 3.48Å; L116-I119 PolarHBondContact O-N 3.43Å; L116-E120 WeakPolarHBondContact O-CB 3.38Å; L116-E120 PolarHBondContact O-N 2.91Å; L116-F135 HydrophobicContact CD1-CE1 3.91Å; L116-F135 HydrophobicContact CD1-CZ 4.27Å; L116-F135 HydrophobicContact CG-CE1 4.37Å; L116-W143 HydrophobicContact CD1-CB 3.9Å; L116-W143 HydrophobicContact CD1-CD2 4.49Å; L116-W143 HydrophobicContact CD1-CG 4.11Å; L116-W143 HydrophobicContact CD2-CB 3.65Å; L116-W143 HydrophobicContact CG-CB 4.44Å; L116-V144 HydrophobicContact CD2-CG2 4.15Å
117L90Very high89.7Confident1 Ų119.2 Ų19.21%0.00511%0.11CC..Hα-helixtrans-59.4-44.2172.6-77166000111M55 F59 T113 M114 L115 I119 E120 R121 Y283M55-L117 HydrophobicContact CB-CD2 3.61Å; M55-L117 HydrophobicContact CB-CG 4.13Å; M55-L117 HydrophobicContact SD-CD2 4.27Å; F59-L117 HydrophobicContact CB-CD1 4.46Å; F59-L117 HydrophobicContact CD2-CD1 4.35Å; T113-L117 WeakPolarHBondContact O-CB 3.31Å; T113-L117 WeakPolarHBondContact O-CG 3.43Å; T113-L117 PolarHBondContact O-N 3.45Å; M114-L117 PolarHBondContact O-N 3.39Å; L115-L117 VanDerWaalsContact C-N 3.33Å; L115-L117 PolarHBondContact O-N 2.97Å; L117-I119 PolarHBondContact O-N 3.29Å; L117-E120 PolarHBondContact O-N 3.29Å; L117-R121 WeakPolarHBondContact O-CG 3.35Å; L117-R121 PolarHBondContact O-N 3.46Å; L117-Y283 WeakPolarHBondContact CD1-OH 3.32Å
118S88.9Confident89.1Confident0 Ų020.7 Ų20.70%013%0.126CC..Hα-helixtrans-64.3-39.3178.176.60000113.1M114 L115 L116 R121 F122 L202 Y203M114-S118 PolarHBondContact O-N 2.98Å; L115-S118 WeakPolarHBondContact O-CB 3.42Å; L115-S118 PolarHBondContact O-N 3.47Å; L115-S118 PolarHBondContact O-OG 3.27Å; L116-S118 VanDerWaalsContact C-N 3.34Å; L116-S118 PolarHBondContact O-N 3.48Å; S118-R121 PolarHBondContact O-N 3.04Å; S118-F122 WeakPolarHBondContact O-CB 3.42Å; S118-F122 PolarHBondContact O-N 3.4Å; S118-L202 WeakPolarHBondContact OG-CD1 3.34Å; S118-Y203 PolarHBondContact N-OH 2.98Å
119I91.7Very high88.5Confident60 Ų6024 Ų2431%0.30815%0.149SC..Hα-helixtrans-65.2-43.2175.3-65.9169.3000109.7L115 L116 L117 R121 F122 T123 F135 L202L115-I119 HydrophobicContact CD1-CD1 4.28Å; L115-I119 HydrophobicContact CD1-CG1 4.39Å; L115-I119 HydrophobicContact CD2-CD1 4.47Å; L115-I119 HydrophobicContact CG-CD1 3.94Å; L115-I119 HydrophobicContact CG-CG1 4.45Å; L115-I119 WeakPolarHBondContact O-CG1 3.16Å; L115-I119 PolarHBondContact O-N 2.94Å; L116-I119 PolarHBondContact O-N 3.43Å; L117-I119 PolarHBondContact O-N 3.29Å; I119-R121 PolarHBondContact O-N 2.92Å; I119-F122 PolarHBondContact O-N 3.23Å; I119-T123 HydrophobicContact CG2-CG2 4.13Å; I119-T123 WeakPolarHBondContact O-CB 3.35Å; I119-T123 VanDerWaalsContact O-CG2 3.29Å; I119-T123 WeakPolarHBondContact O-CG2 3.36Å; I119-T123 PolarHBondContact O-N 2.83Å; I119-T123 PolarHBondContact O-OG1 3.45Å; I119-T123 VanDerWaalsContact O-OG1 3.05Å; I119-F135 HydrophobicContact CB-CZ 4.49Å; I119-F135 HydrophobicContact CG2-CE2 4.27Å; I119-F135 HydrophobicContact CG2-CZ 3.97Å; I119-L202 HydrophobicContact CG1-CD1 3.59Å
120E89.2Confident88Confident1 Ų131.8 Ų31.81%0.00518%0.18CC..Hα-helixtrans-58.2-48.6178-175.6-96.6-170.300111.3M55 L116 L117 F122 T123 A124 Y131 F135M55-E120 HydrophobicContact CE-CB 3.76Å; M55-E120 HydrophobicContact CE-CG 3.43Å; M55-E120 VanDerWaalsContact CE-CG 3.43Å; M55-E120 HydrophobicContact SD-CB 3.95Å; M55-E120 HydrophobicContact SD-CG 4.28Å; L116-E120 WeakPolarHBondContact O-CB 3.38Å; L116-E120 PolarHBondContact O-N 2.91Å; L117-E120 PolarHBondContact O-N 3.29Å; E120-F122 PolarHBondContact O-N 3.13Å; E120-T123 PolarHBondContact O-N 3.46Å; E120-T123 PolarHBondContact O-OG1 3.33Å; E120-A124 WeakPolarHBondContact O-CB 3.29Å; E120-A124 PolarHBondContact O-N 2.98Å; E120-Y131 HydrophobicContact CG-CD2 4.33Å; E120-Y131 HydrophobicContact CG-CE2 3.67Å; E120-Y131 VanDerWaalsContact OE1-CE2 3.29Å; E120-Y131 WeakPolarHBondContact OE1-CE2 3.48Å; E120-Y131 PolarHBondContact OE1-OH 3.45Å; E120-F135 HydrophobicContact CB-CD1 3.99Å; E120-F135 HydrophobicContact CB-CD2 4.34Å; E120-F135 HydrophobicContact CB-CE1 3.63Å; E120-F135 HydrophobicContact CB-CE2 4.03Å; E120-F135 HydrophobicContact CB-CG 4.33Å; E120-F135 HydrophobicContact CB-CZ 3.65Å; E120-F135 HydrophobicContact CG-CB 4.47Å; E120-F135 HydrophobicContact CG-CD1 3.8Å; E120-F135 HydrophobicContact CG-CD2 4.08Å; E120-F135 HydrophobicContact CG-CE1 3.99Å; E120-F135 HydrophobicContact CG-CE2 4.27Å; E120-F135 HydrophobicContact CG-CG 3.84Å; E120-F135 HydrophobicContact CG-CZ 4.22Å
121R85.3Confident87.7Confident1 Ų134.3 Ų34.30%0.00419%0.19CC..Hα-helixtrans-61.9-46.8177.9-60.1-57.5175.3-139.10.1111.7D52 L117 S118 I119 T123 A124 F125 Y203 A206D52-R121 VanDerWaalsContact CG-NH1 3.32Å; D52-R121 IonicContact OD1-CZ 3.27Å; D52-R121 IonicContact OD1-NH1 2.84Å; D52-R121 IonicContact OD1-NH2 2.8Å; D52-R121 PolarHBondContact OD1-NH2 3.04Å; D52-R121 IonicContact OD2-CZ 2.81Å; D52-R121 VanDerWaalsContact OD2-CZ 3.27Å; D52-R121 IonicContact OD2-NH1 3.66Å; D52-R121 PolarHBondContact OD2-NH1 2.85Å; D52-R121 IonicContact OD2-NH2 2.81Å; D52-R121 PolarHBondContact OD2-NH2 3.39Å; L117-R121 WeakPolarHBondContact O-CG 3.35Å; L117-R121 PolarHBondContact O-N 3.46Å; S118-R121 PolarHBondContact O-N 3.04Å; I119-R121 PolarHBondContact O-N 2.92Å; R121-T123 VanDerWaalsContact C-N 3.34Å; R121-T123 PolarHBondContact O-N 2.89Å; R121-A124 PolarHBondContact O-N 3.31Å; R121-F125 WeakPolarHBondContact O-CD2 3.5Å; R121-F125 PolarHBondContact O-N 3.05Å; R121-Y203 HydrophobicContact CG-CE1 4.2Å; R121-A206 HydrophobicContact CB-CB 4.39Å
122F86.7Confident87.3Confident56 Ų5642.5 Ų42.525%0.24622%0.218CC..Hα-helixtrans-59.2-46.2178.7176.7-105.7000111.4S118 I119 E120 A124 F125 C126 L202 L205 A206S118-F122 WeakPolarHBondContact O-CB 3.42Å; S118-F122 PolarHBondContact O-N 3.4Å; I119-F122 PolarHBondContact O-N 3.23Å; E120-F122 PolarHBondContact O-N 3.13Å; F122-A124 PolarHBondContact O-N 3.35Å; F122-F125 PolarHBondContact O-N 2.91Å; F122-C126 VanDerWaalsContact CE2-SG 3.52Å; F122-C126 WeakPolarHBondContact CZ-SG 3.33Å; F122-C126 WeakPolarHBondContact O-CB 3.47Å; F122-C126 PolarHBondContact O-N 3.36Å; F122-C126 PolarHBondContact O-SG 3Å; F122-L202 HydrophobicContact CB-CD2 4.3Å; F122-L202 HydrophobicContact CD1-CD2 4.1Å; F122-L202 HydrophobicContact CG-CD2 4.06Å; F122-L205 HydrophobicContact CD2-CB 3.86Å; F122-L205 HydrophobicContact CE2-CB 3.75Å; F122-L205 HydrophobicContact CE2-CD1 4.27Å; F122-A206 HydrophobicContact CB-CB 4.4Å
123T88Confident87Confident20 Ų2044.9 Ų44.912%0.12324%0.235CC..Hα-helixtrans-66.8-37.9179.358.80000112.8I119 E120 R121 F125 C126 S127 F135I119-T123 HydrophobicContact CG2-CG2 4.13Å; I119-T123 WeakPolarHBondContact O-CB 3.35Å; I119-T123 VanDerWaalsContact O-CG2 3.29Å; I119-T123 WeakPolarHBondContact O-CG2 3.36Å; I119-T123 PolarHBondContact O-N 2.83Å; I119-T123 PolarHBondContact O-OG1 3.45Å; I119-T123 VanDerWaalsContact O-OG1 3.05Å; E120-T123 PolarHBondContact O-N 3.46Å; E120-T123 PolarHBondContact O-OG1 3.33Å; R121-T123 VanDerWaalsContact C-N 3.34Å; R121-T123 PolarHBondContact O-N 2.89Å; T123-F125 VanDerWaalsContact C-N 3.32Å; T123-F125 PolarHBondContact O-N 3.01Å; T123-C126 PolarHBondContact O-N 3.05Å; T123-S127 PolarHBondContact O-N 3.49Å; T123-F135 HydrophobicContact CG2-CE2 4.21Å; T123-F135 WeakPolarHBondContact OG1-CD2 3.39Å; T123-F135 WeakPolarHBondContact OG1-CE2 3.35Å
124A84.5Confident86.8Confident18 Ų1848 Ų4815%0.14925%0.25CS..Hα-helixtrans-58.8-43.2173.800000111.7E120 R121 F122 Y131 L234E120-A124 WeakPolarHBondContact O-CB 3.29Å; E120-A124 PolarHBondContact O-N 2.98Å; R121-A124 PolarHBondContact O-N 3.31Å; F122-A124 PolarHBondContact O-N 3.35Å; A124-Y131 HydrophobicContact CB-CD2 3.85Å; A124-Y131 HydrophobicContact CB-CE2 4.21Å; A124-Y131 HydrophobicContact CB-CG 4.17Å; A124-L234 HydrophobicContact CB-CD1 4.15Å
125F82.1Confident86.7Confident7 Ų747.8 Ų47.83%0.03125%0.249CC..Hα-helixtrans-78.8-21.5176.8-65.8-58.2000114.2R121 F122 T123 A206 M209 H210 K213 T231 L234R121-F125 WeakPolarHBondContact O-CD2 3.5Å; R121-F125 PolarHBondContact O-N 3.05Å; F122-F125 PolarHBondContact O-N 2.91Å; T123-F125 VanDerWaalsContact C-N 3.32Å; T123-F125 PolarHBondContact O-N 3.01Å; F125-A206 HydrophobicContact CD2-CB 3.98Å; F125-A206 HydrophobicContact CE2-CB 4.48Å; F125-M209 HydrophobicContact CB-CB 4Å; F125-H210 HydrophobicContact CD1-CB 4.03Å; F125-H210 HydrophobicContact CD2-CB 4.48Å; F125-H210 HydrophobicContact CE1-CB 3.94Å; F125-H210 AromaticContact CE1-CD2 3.48Å; F125-H210 VanDerWaalsContact CE1-CD2 3.48Å; F125-H210 WeakPolarHBondContact CE1-CD2 3.46Å; F125-H210 HydrophobicContact CE2-CB 4.38Å; F125-H210 HydrophobicContact CG-CB 4.32Å; F125-H210 HydrophobicContact CZ-CB 4.1Å; F125-H210 AromaticContact CZ-CD2 3.87Å; F125-K213 WeakPolarHBondContact O-CE 3.3Å; F125-K213 PolarHBondContact O-NZ 3.25Å; F125-T231 HydrophobicContact CE1-CG2 3.83Å; F125-L234 HydrophobicContact CE1-CB 4.41Å; F125-L234 HydrophobicContact CE1-CD1 4.21Å; F125-L234 HydrophobicContact CE2-CB 4.19Å; F125-L234 HydrophobicContact CZ-CB 3.6Å; F125-L234 HydrophobicContact CZ-CD1 4.11Å; F125-L234 HydrophobicContact CZ-CG 4.43Å
126C84.3Confident86.7Confident52 Ų5248.4 Ų48.435%0.35126%0.256SS..Hα-helixtrans-74.2-53.8173.4-75.80000111.4F122 T123F122-C126 VanDerWaalsContact CE2-SG 3.52Å; F122-C126 WeakPolarHBondContact CZ-SG 3.33Å; F122-C126 WeakPolarHBondContact O-CB 3.47Å; F122-C126 PolarHBondContact O-N 3.36Å; F122-C126 PolarHBondContact O-SG 3Å; T123-C126 PolarHBondContact O-N 3.05Å
127S82.8Confident86.5Confident34 Ų3450.8 Ų50.824%0.23827%0.268CS..  trans-162.2127.2-177173.70000112.4T123 S129 Y130 Y131T123-S127 PolarHBondContact O-N 3.49Å; S127-S129 PolarHBondContact O-N 2.87Å; S127-S129 PolarHBondContact OG-N 3.4Å; S127-Y130 PolarHBondContact O-N 3.28Å; S127-Y131 WeakPolarHBondContact O-CB 3.33Å; S127-Y131 PolarHBondContact O-N 2.88Å
128A79.7Confident86.6Confident57 Ų5760.1 Ų60.147%0.47130%0.303SS..Hα-helixtrans-61.7-30.617700000113R132A128-R132 WeakPolarHBondContact O-CG 3.36Å; A128-R132 PolarHBondContact O-N 3.4Å; A128-R132 VanDerWaalsContact O-N 3.14Å
129S82.6Confident86.8Confident84 Ų8462.8 Ų62.859%0.58732%0.318SS*.Hα-helixtrans-67.6-53178.8-173.10000111S127 Y131 R132 T133S127-S129 PolarHBondContact O-N 2.87Å; S127-S129 PolarHBondContact OG-N 3.4Å; S129-Y131 VanDerWaalsContact C-N 3.32Å; S129-Y131 PolarHBondContact O-N 2.83Å; S129-R132 PolarHBondContact O-N 3.4Å; S129-T133 PolarHBondContact O-N 3.34Å; S129-T133 PolarHBondContact O-OG1 3.25Å
130Y85.2Confident86.9Confident164 Ų16460 Ų6064%0.64330%0.303SS*.Hα-helixtrans-62.2-40.2177.9-73.6-70.3000112.1S127 R132 T133 I134S127-Y130 PolarHBondContact O-N 3.28Å; Y130-R132 PolarHBondContact O-N 2.94Å; Y130-T133 PolarHBondContact O-N 3.29Å; Y130-I134 WeakPolarHBondContact O-CB 3.4Å; Y130-I134 WeakPolarHBondContact O-CG1 3.29Å; Y130-I134 PolarHBondContact O-N 3.06Å
131Y86.5Confident87.2Confident54 Ų5464.5 Ų64.521%0.21232%0.323CS..Hα-helixtrans-57-49175.9169.8-104.6000112.1E120 A124 S127 S129 T133 I134 F135E120-Y131 HydrophobicContact CG-CD2 4.33Å; E120-Y131 HydrophobicContact CG-CE2 3.67Å; E120-Y131 VanDerWaalsContact OE1-CE2 3.29Å; E120-Y131 WeakPolarHBondContact OE1-CE2 3.48Å; E120-Y131 PolarHBondContact OE1-OH 3.45Å; A124-Y131 HydrophobicContact CB-CD2 3.85Å; A124-Y131 HydrophobicContact CB-CE2 4.21Å; A124-Y131 HydrophobicContact CB-CG 4.17Å; S127-Y131 WeakPolarHBondContact O-CB 3.33Å; S127-Y131 PolarHBondContact O-N 2.88Å; S129-Y131 VanDerWaalsContact C-N 3.32Å; S129-Y131 PolarHBondContact O-N 2.83Å; Y131-T133 VanDerWaalsContact C-N 3.3Å; Y131-T133 PolarHBondContact O-N 3.23Å; Y131-I134 PolarHBondContact O-N 3.25Å; Y131-F135 HydrophobicContact CD2-CB 3.98Å; Y131-F135 AromaticContact CD2-CD2 3.97Å; Y131-F135 HydrophobicContact CD2-CD2 3.97Å; Y131-F135 HydrophobicContact CD2-CG 4.29Å; Y131-F135 HydrophobicContact CE2-CB 3.74Å; Y131-F135 HydrophobicContact CE2-CD2 4.32Å; Y131-F135 HydrophobicContact CE2-CG 4.21Å; Y131-F135 WeakPolarHBondContact O-CA 3.48Å; Y131-F135 WeakPolarHBondContact O-CB 3.42Å; Y131-F135 PolarHBondContact O-N 3.27Å
132R84.1Confident87.7Confident186 Ų18668.3 Ų68.370%0.70234%0.342SS*.Hα-helixtrans-63-35.4179.8-74.2179.1-176.6-166.83.7112.9A128 S129 Y130A128-R132 WeakPolarHBondContact O-CG 3.36Å; A128-R132 PolarHBondContact O-N 3.4Å; A128-R132 VanDerWaalsContact O-N 3.14Å; S129-R132 PolarHBondContact O-N 3.4Å; Y130-R132 PolarHBondContact O-N 2.94Å
133T86.8Confident88.2Confident95 Ų9570.8 Ų70.858%0.58335%0.35SS*.Hα-helixtrans-72.2-46.6178.3-54.40000111.9S129 Y130 Y131 N139S129-T133 PolarHBondContact O-N 3.34Å; S129-T133 PolarHBondContact O-OG1 3.25Å; Y130-T133 PolarHBondContact O-N 3.29Å; Y131-T133 VanDerWaalsContact C-N 3.3Å; Y131-T133 PolarHBondContact O-N 3.23Å; T133-N139 PolarHBondContact O-ND2 3.22Å
134I89.3Confident88.6Confident65 Ų6570.5 Ų70.533%0.33335%0.348SS..Hα-helixtrans-77.1-48.1-175-63.1170.7000110.7Y130 Y131 S136 N139Y130-I134 WeakPolarHBondContact O-CB 3.4Å; Y130-I134 WeakPolarHBondContact O-CG1 3.29Å; Y130-I134 PolarHBondContact O-N 3.06Å; Y131-I134 PolarHBondContact O-N 3.25Å; I134-S136 PolarHBondContact O-N 2.75Å; I134-N139 WeakPolarHBondContact O-CB 3.43Å; I134-N139 PolarHBondContact O-ND2 3.16Å
135F89.4Confident89.2Confident9 Ų974.6 Ų74.64%0.03937%0.366CS..THydrogen-bonded Turntrans-101.245-173.9-68.8-80.7000112.6A51 M55 L116 I119 E120 T123 Y131A51-F135 HydrophobicContact CB-CB 4.49Å; A51-F135 WeakPolarHBondContact CB-O 3.35Å; M55-F135 HydrophobicContact CE-CD1 4.2Å; M55-F135 HydrophobicContact SD-CD1 4.24Å; M55-F135 HydrophobicContact SD-CE1 4.04Å; L116-F135 HydrophobicContact CD1-CE1 3.91Å; L116-F135 HydrophobicContact CD1-CZ 4.27Å; L116-F135 HydrophobicContact CG-CE1 4.37Å; I119-F135 HydrophobicContact CB-CZ 4.49Å; I119-F135 HydrophobicContact CG2-CE2 4.27Å; I119-F135 HydrophobicContact CG2-CZ 3.97Å; E120-F135 HydrophobicContact CB-CD1 3.99Å; E120-F135 HydrophobicContact CB-CD2 4.34Å; E120-F135 HydrophobicContact CB-CE1 3.63Å; E120-F135 HydrophobicContact CB-CE2 4.03Å; E120-F135 HydrophobicContact CB-CG 4.33Å; E120-F135 HydrophobicContact CB-CZ 3.65Å; E120-F135 HydrophobicContact CG-CB 4.47Å; E120-F135 HydrophobicContact CG-CD1 3.8Å; E120-F135 HydrophobicContact CG-CD2 4.08Å; E120-F135 HydrophobicContact CG-CE1 3.99Å; E120-F135 HydrophobicContact CG-CE2 4.27Å; E120-F135 HydrophobicContact CG-CG 3.84Å; E120-F135 HydrophobicContact CG-CZ 4.22Å; T123-F135 HydrophobicContact CG2-CE2 4.21Å; T123-F135 WeakPolarHBondContact OG1-CD2 3.39Å; T123-F135 WeakPolarHBondContact OG1-CE2 3.35Å; Y131-F135 HydrophobicContact CD2-CB 3.98Å; Y131-F135 AromaticContact CD2-CD2 3.97Å; Y131-F135 HydrophobicContact CD2-CD2 3.97Å; Y131-F135 HydrophobicContact CD2-CG 4.29Å; Y131-F135 HydrophobicContact CE2-CB 3.74Å; Y131-F135 HydrophobicContact CE2-CD2 4.32Å; Y131-F135 HydrophobicContact CE2-CG 4.21Å; Y131-F135 WeakPolarHBondContact O-CA 3.48Å; Y131-F135 WeakPolarHBondContact O-CB 3.42Å; Y131-F135 PolarHBondContact O-N 3.27Å
136S89.9Confident89.9Confident40 Ų4077.3 Ų77.328%0.2838%0.381SS..  trans-64.6155.2161.677.90000109.9I134 R138 N139 T140I134-S136 PolarHBondContact O-N 2.75Å; S136-R138 PolarHBondContact O-N 2.81Å; S136-N139 PolarHBondContact O-N 3.18Å; S136-N139 WeakPolarHBondContact OG-CB 3.27Å; S136-N139 PolarHBondContact OG-N 3.18Å; S136-N139 PolarHBondContact OG-ND2 3.21Å; S136-T140 WeakPolarHBondContact O-CB 3.46Å; S136-T140 PolarHBondContact O-N 3.25Å; S136-T140 PolarHBondContact O-OG1 3.06Å
137I89.6Confident90.6Very high63 Ų6375.4 Ų75.432%0.32337%0.368SS..Hα-helixtrans-56.3-42-179.5-62.6153.6000111.1Q49 T140 K141Q49-I137 HydrophobicContact CB-CD1 3.92Å; Q49-I137 HydrophobicContact CB-CG1 4.5Å; Q49-I137 HydrophobicContact CB-CG2 4.31Å; Q49-I137 WeakPolarHBondContact O-CD1 3.48Å; Q49-I137 WeakPolarHBondContact O-CG1 3.28Å; I137-T140 PolarHBondContact O-N 3.42Å; I137-K141 WeakPolarHBondContact O-CG 3.4Å; I137-K141 PolarHBondContact O-N 3.24Å
138R91.6Very high91.3Very high197 Ų19776.2 Ų76.274%0.74337%0.368SS*.Hα-helixtrans-64.8-47.3179-173.9178.5180177.6-0.3111.2S136 T140 K141 I142S136-R138 PolarHBondContact O-N 2.81Å; R138-T140 VanDerWaalsContact C-N 3.33Å; R138-T140 PolarHBondContact O-N 3.49Å; R138-K141 PolarHBondContact O-N 2.95Å; R138-I142 HydrophobicContact CG-CD1 4.4Å; R138-I142 WeakPolarHBondContact O-CG1 3.22Å; R138-I142 PolarHBondContact O-N 3.22Å; R138-I142 VanDerWaalsContact O-N 3.13Å
139N93.9Very high92.2Very high56 Ų5676.3 Ų76.330%0.29936%0.362SS..Hα-helixtrans-66.1-39.2179.5-66.2-7.7000111.1T133 I134 S136 K141 I142 W143T133-N139 PolarHBondContact O-ND2 3.22Å; I134-N139 WeakPolarHBondContact O-CB 3.43Å; I134-N139 PolarHBondContact O-ND2 3.16Å; S136-N139 PolarHBondContact O-N 3.18Å; S136-N139 WeakPolarHBondContact OG-CB 3.27Å; S136-N139 PolarHBondContact OG-N 3.18Å; S136-N139 PolarHBondContact OG-ND2 3.21Å; N139-K141 VanDerWaalsContact C-N 3.34Å; N139-K141 PolarHBondContact O-N 3.44Å; N139-I142 CarbonylContact O-C 3.57Å; N139-I142 WeakPolarHBondContact O-CA 3.33Å; N139-I142 WeakPolarHBondContact O-CB 3.35Å; N139-I142 PolarHBondContact O-N 3.02Å; N139-I142 VanDerWaalsContact O-N 3.08Å; N139-W143 PolarHBondContact O-N 2.92Å
140T94Very high92.8Very high0 Ų077.7 Ų77.70%036%0.358CS..Hα-helixtrans-62.1-42.2177.7-54.30000111.5A51 C54 M55 S136 I137 R138 I142 W143 V144A51-T140 HydrophobicContact CB-CG2 4.16Å; A51-T140 WeakPolarHBondContact CB-OG1 3.03Å; A51-T140 WeakPolarHBondContact O-CG2 3.49Å; C54-T140 HydrophobicContact CB-CG2 4.13Å; M55-T140 HydrophobicContact CE-CG2 4.13Å; M55-T140 HydrophobicContact CG-CG2 3.46Å; M55-T140 VanDerWaalsContact CG-CG2 3.46Å; M55-T140 HydrophobicContact SD-CG2 4.09Å; S136-T140 WeakPolarHBondContact O-CB 3.46Å; S136-T140 PolarHBondContact O-N 3.25Å; S136-T140 PolarHBondContact O-OG1 3.06Å; I137-T140 PolarHBondContact O-N 3.42Å; R138-T140 VanDerWaalsContact C-N 3.33Å; R138-T140 PolarHBondContact O-N 3.49Å; T140-I142 VanDerWaalsContact C-N 3.31Å; T140-I142 PolarHBondContact O-N 3.42Å; T140-W143 PolarHBondContact O-N 2.88Å; T140-V144 WeakPolarHBondContact O-CG2 3.38Å; T140-V144 PolarHBondContact O-N 2.97Å
141K94.6Very high93.4Very high96 Ų9669.9 Ų69.942%0.41733%0.327SS..Hα-helixtrans-59.5-43.2172.1-73.9176.2-179.2-177.90111.7C54 I137 R138 N139 V144 I145C54-K141 VanDerWaalsContact SG-CG 3.56Å; I137-K141 WeakPolarHBondContact O-CG 3.4Å; I137-K141 PolarHBondContact O-N 3.24Å; R138-K141 PolarHBondContact O-N 2.95Å; N139-K141 VanDerWaalsContact C-N 3.34Å; N139-K141 PolarHBondContact O-N 3.44Å; K141-V144 PolarHBondContact O-N 3.23Å; K141-I145 WeakPolarHBondContact O-CB 3.47Å; K141-I145 WeakPolarHBondContact O-CD1 3.18Å; K141-I145 WeakPolarHBondContact O-CG1 3.38Å; K141-I145 PolarHBondContact O-N 2.96Å
142I96.6Very high93.9Very high81 Ų8169.2 Ų69.242%0.41533%0.333SS..Hα-helixtrans-61.3-46.5176.2-65.4165.5000110.2R138 N139 T140 V144 I145 L146R138-I142 HydrophobicContact CG-CD1 4.4Å; R138-I142 WeakPolarHBondContact O-CG1 3.22Å; R138-I142 PolarHBondContact O-N 3.22Å; R138-I142 VanDerWaalsContact O-N 3.13Å; N139-I142 CarbonylContact O-C 3.57Å; N139-I142 WeakPolarHBondContact O-CA 3.33Å; N139-I142 WeakPolarHBondContact O-CB 3.35Å; N139-I142 PolarHBondContact O-N 3.02Å; N139-I142 VanDerWaalsContact O-N 3.08Å; T140-I142 VanDerWaalsContact C-N 3.31Å; T140-I142 PolarHBondContact O-N 3.42Å; I142-V144 PolarHBondContact O-N 3.49Å; I142-I145 PolarHBondContact O-N 3.28Å; I142-L146 HydrophobicContact CG2-CD1 4Å; I142-L146 HydrophobicContact CG2-CG 4.3Å; I142-L146 WeakPolarHBondContact O-CB 3.15Å; I142-L146 VanDerWaalsContact O-CG 3.29Å; I142-L146 WeakPolarHBondContact O-CG 2.99Å; I142-L146 PolarHBondContact O-N 3.33Å
143W96.7Very high94.5Very high109 Ų10964.9 Ų64.941%0.41332%0.323SS..Hα-helixtrans-60.2-43.2177.2-71.7121.9000112.9L116 N139 T140 L146 C147L116-W143 HydrophobicContact CD1-CB 3.9Å; L116-W143 HydrophobicContact CD1-CD2 4.49Å; L116-W143 HydrophobicContact CD1-CG 4.11Å; L116-W143 HydrophobicContact CD2-CB 3.65Å; L116-W143 HydrophobicContact CG-CB 4.44Å; N139-W143 PolarHBondContact O-N 2.92Å; T140-W143 PolarHBondContact O-N 2.88Å; W143-L146 HydrophobicContact CE3-CD1 3.93Å; W143-L146 HydrophobicContact CZ3-CD1 4.16Å; W143-L146 WeakPolarHBondContact O-CB 3.36Å; W143-L146 PolarHBondContact O-N 3.39Å; W143-C147 PolarHBondContact O-N 2.9Å; W143-C147 PolarHBondContact O-SG 3.48Å
144V96.3Very high94.9Very high13 Ų1361.2 Ų61.28%0.07930%0.299CS..Hα-helixtrans-64.4-46.5176.1172.70000110.6M55 L116 T140 K141 I142 L146 C147 F148M55-V144 HydrophobicContact CG-CG2 4.2Å; L116-V144 HydrophobicContact CD2-CG2 4.15Å; T140-V144 WeakPolarHBondContact O-CG2 3.38Å; T140-V144 PolarHBondContact O-N 2.97Å; K141-V144 PolarHBondContact O-N 3.23Å; I142-V144 PolarHBondContact O-N 3.49Å; V144-L146 VanDerWaalsContact C-N 3.28Å; V144-L146 PolarHBondContact O-N 3.32Å; V144-C147 VanDerWaalsContact O-CB 3.29Å; V144-C147 WeakPolarHBondContact O-CB 3.49Å; V144-C147 PolarHBondContact O-N 3.45Å; V144-C147 VanDerWaalsContact O-N 3.11Å; V144-F148 HydrophobicContact CG1-CD2 4.08Å; V144-F148 HydrophobicContact CG1-CE2 3.91Å; V144-F148 VanDerWaalsContact O-CD2 3.32Å; V144-F148 WeakPolarHBondContact O-CD2 3.34Å; V144-F148 PolarHBondContact O-N 2.68Å; V144-F148 VanDerWaalsContact O-N 3.14Å
145I97.3Very high95.3Very high104 Ų10458.3 Ų58.353%0.53329%0.285SS..Hα-helixtrans-58.8-42.6175.4-69164.6000110.4K141 I142 C147 F148 T149K141-I145 WeakPolarHBondContact O-CB 3.47Å; K141-I145 WeakPolarHBondContact O-CD1 3.18Å; K141-I145 WeakPolarHBondContact O-CG1 3.38Å; K141-I145 PolarHBondContact O-N 2.96Å; I142-I145 PolarHBondContact O-N 3.28Å; I145-C147 VanDerWaalsContact C-N 3.31Å; I145-C147 PolarHBondContact O-N 3.34Å; I145-F148 CarbonylContact O-C 3.59Å; I145-F148 WeakPolarHBondContact O-CA 3.21Å; I145-F148 WeakPolarHBondContact O-CB 3.38Å; I145-F148 PolarHBondContact O-N 3.34Å; I145-F148 VanDerWaalsContact O-N 3.08Å; I145-T149 HydrophobicContact CG2-CG2 4.31Å; I145-T149 WeakPolarHBondContact O-CG2 3.41Å; I145-T149 PolarHBondContact O-N 3.44Å
146L97.3Very high95.6Very high64 Ų6462.3 Ų62.334%0.33531%0.31SS..Hα-helixtrans-58.9-42.7176-76.2172.5000111.4I142 W143 V144 F148 T149 F150I142-L146 HydrophobicContact CG2-CD1 4Å; I142-L146 HydrophobicContact CG2-CG 4.3Å; I142-L146 WeakPolarHBondContact O-CB 3.15Å; I142-L146 VanDerWaalsContact O-CG 3.29Å; I142-L146 WeakPolarHBondContact O-CG 2.99Å; I142-L146 PolarHBondContact O-N 3.33Å; W143-L146 HydrophobicContact CE3-CD1 3.93Å; W143-L146 HydrophobicContact CZ3-CD1 4.16Å; W143-L146 WeakPolarHBondContact O-CB 3.36Å; W143-L146 PolarHBondContact O-N 3.39Å; V144-L146 VanDerWaalsContact C-N 3.28Å; V144-L146 PolarHBondContact O-N 3.32Å; L146-F148 VanDerWaalsContact C-N 3.31Å; L146-F148 PolarHBondContact O-N 2.91Å; L146-T149 VanDerWaalsContact CA-OG1 3.31Å; L146-T149 WeakPolarHBondContact CA-OG1 3.35Å; L146-T149 PolarHBondContact O-N 3.27Å; L146-T149 VanDerWaalsContact O-N 3.14Å; L146-T149 PolarHBondContact O-OG1 3.42Å; L146-F150 WeakPolarHBondContact O-CD2 3.26Å; L146-F150 PolarHBondContact O-N 2.81Å
147C97.7Very high95.9Very high12 Ų1264.9 Ų64.98%0.08132%0.32CS..Hα-helixtrans-54.8-48.5173.4-62.80000111T109 M112 T113 W143 V144 I145 T149 F150 G151T109-C147 WeakPolarHBondContact CG2-O 2.85Å; M112-C147 HydrophobicContact CB-CB 3.92Å; T113-C147 HydrophobicContact CG2-CB 4.2Å; W143-C147 PolarHBondContact O-N 2.9Å; W143-C147 PolarHBondContact O-SG 3.48Å; V144-C147 VanDerWaalsContact O-CB 3.29Å; V144-C147 WeakPolarHBondContact O-CB 3.49Å; V144-C147 PolarHBondContact O-N 3.45Å; V144-C147 VanDerWaalsContact O-N 3.11Å; I145-C147 VanDerWaalsContact C-N 3.31Å; I145-C147 PolarHBondContact O-N 3.34Å; C147-T149 PolarHBondContact O-N 3.19Å; C147-F150 PolarHBondContact O-N 2.87Å; C147-G151 PolarHBondContact O-N 3.48Å
148F98.1Very high96.1Very high52 Ų5261.9 Ų61.923%0.22831%0.305CS..Hα-helixtrans-60.8-41.4175.7-79.4-80.7000113.2V61 S62 L65 I105 T109 V144 I145 L146 F150 G151 A152V61-F148 HydrophobicContact CB-CZ 4.05Å; V61-F148 HydrophobicContact CG1-CE1 4.06Å; V61-F148 HydrophobicContact CG1-CZ 3.72Å; S62-F148 WeakPolarHBondContact OG-CZ 3.32Å; L65-F148 HydrophobicContact CD1-CE1 3.91Å; I105-F148 HydrophobicContact CG2-CD1 4.44Å; T109-F148 HydrophobicContact CG2-CB 4.4Å; T109-F148 HydrophobicContact CG2-CD1 3.78Å; T109-F148 HydrophobicContact CG2-CE1 4.18Å; T109-F148 HydrophobicContact CG2-CG 4.11Å; V144-F148 HydrophobicContact CG1-CD2 4.08Å; V144-F148 HydrophobicContact CG1-CE2 3.91Å; V144-F148 VanDerWaalsContact O-CD2 3.32Å; V144-F148 WeakPolarHBondContact O-CD2 3.34Å; V144-F148 PolarHBondContact O-N 2.68Å; V144-F148 VanDerWaalsContact O-N 3.14Å; I145-F148 CarbonylContact O-C 3.59Å; I145-F148 WeakPolarHBondContact O-CA 3.21Å; I145-F148 WeakPolarHBondContact O-CB 3.38Å; I145-F148 PolarHBondContact O-N 3.34Å; I145-F148 VanDerWaalsContact O-N 3.08Å; L146-F148 VanDerWaalsContact C-N 3.31Å; L146-F148 PolarHBondContact O-N 2.91Å; F148-F150 VanDerWaalsContact C-N 3.34Å; F148-F150 PolarHBondContact O-N 3.05Å; F148-G151 PolarHBondContact O-N 2.96Å; F148-A152 PolarHBondContact O-N 2.92Å
149T97.8Very high96.4Very high59 Ų5955.6 Ų55.636%0.36228%0.282SS..Hα-helixtrans-63.7-39.7175.761.90000112I145 L146 C147 A152 L153I145-T149 HydrophobicContact CG2-CG2 4.31Å; I145-T149 WeakPolarHBondContact O-CG2 3.41Å; I145-T149 PolarHBondContact O-N 3.44Å; L146-T149 VanDerWaalsContact CA-OG1 3.31Å; L146-T149 WeakPolarHBondContact CA-OG1 3.35Å; L146-T149 PolarHBondContact O-N 3.27Å; L146-T149 VanDerWaalsContact O-N 3.14Å; L146-T149 PolarHBondContact O-OG1 3.42Å; C147-T149 PolarHBondContact O-N 3.19Å; T149-A152 PolarHBondContact O-N 2.82Å; T149-L153 WeakPolarHBondContact O-CB 2.99Å; T149-L153 VanDerWaalsContact O-CG 3.26Å; T149-L153 WeakPolarHBondContact O-CG 3.22Å; T149-L153 PolarHBondContact O-N 3Å
150F96.9Very high96.5Very high113 Ų11360.2 Ų60.250%0.49630%0.296SS..Hα-helixtrans-64.4-40.5174.3-80-65.8000112.3L146 C147 F148 A152 L153 E154L146-F150 WeakPolarHBondContact O-CD2 3.26Å; L146-F150 PolarHBondContact O-N 2.81Å; C147-F150 PolarHBondContact O-N 2.87Å; F148-F150 VanDerWaalsContact C-N 3.34Å; F148-F150 PolarHBondContact O-N 3.05Å; F150-A152 VanDerWaalsContact C-N 3.35Å; F150-L153 HydrophobicContact CD1-CD1 4.45Å; F150-L153 PolarHBondContact O-N 3.06Å; F150-E154 WeakPolarHBondContact O-CB 3.49Å; F150-E154 PolarHBondContact O-N 3.37Å
151G96.9Very high96.6Very high0 Ų061.2 Ų61.20%030%0.302CS..Hα-helixtrans-60.9-42.4172.800000112.7C147 F148 E154 A155C147-G151 PolarHBondContact O-N 3.48Å; F148-G151 PolarHBondContact O-N 2.96Å; G151-E154 PolarHBondContact O-N 3.49Å; G151-A155 PolarHBondContact O-N 3.4Å; G151-A155 VanDerWaalsContact O-N 3.1Å
152A97.7Very high96.6Very high40 Ų4056.6 Ų56.633%0.33128%0.282SS..Hα-helixtrans-66.1-42.5176.100000112.2F148 T149 F150 E154 A155 V156F148-A152 PolarHBondContact O-N 2.92Å; T149-A152 PolarHBondContact O-N 2.82Å; F150-A152 VanDerWaalsContact C-N 3.35Å; A152-E154 VanDerWaalsContact C-N 3.31Å; A152-E154 PolarHBondContact O-N 3.49Å; A152-A155 WeakPolarHBondContact O-CB 3.33Å; A152-A155 PolarHBondContact O-N 3.46Å; A152-V156 WeakPolarHBondContact O-CG2 3.45Å; A152-V156 PolarHBondContact O-N 3.17Å
153L97.1Very high96.6Very high95 Ų9557.5 Ų57.550%0.49728%0.283SS..Hα-helixtrans-61.4-40175.3-73.7171.4000111.6T149 F150 V156 L157T149-L153 WeakPolarHBondContact O-CB 2.99Å; T149-L153 VanDerWaalsContact O-CG 3.26Å; T149-L153 WeakPolarHBondContact O-CG 3.22Å; T149-L153 PolarHBondContact O-N 3Å; F150-L153 HydrophobicContact CD1-CD1 4.45Å; F150-L153 PolarHBondContact O-N 3.06Å; L153-V156 PolarHBondContact O-N 3.44Å; L153-L157 WeakPolarHBondContact O-CB 3.47Å; L153-L157 VanDerWaalsContact O-CG 3.32Å; L153-L157 WeakPolarHBondContact O-CG 2.91Å; L153-L157 PolarHBondContact O-N 3.17Å
154E95.4Very high96.5Very high17 Ų1756.4 Ų56.48%0.07929%0.288CS..Hα-helixtrans-61.3-44174.7-174.6-88.5125.700111.7T108 F150 G151 A152 L157 C158 R176T108-E154 HydrophobicContact CG2-CB 4.29Å; T108-E154 HydrophobicContact CG2-CG 4.46Å; T108-E154 PolarHBondContact OG1-OE2 2.88Å; F150-E154 WeakPolarHBondContact O-CB 3.49Å; F150-E154 PolarHBondContact O-N 3.37Å; G151-E154 PolarHBondContact O-N 3.49Å; A152-E154 VanDerWaalsContact C-N 3.31Å; A152-E154 PolarHBondContact O-N 3.49Å; E154-L157 PolarHBondContact O-N 3.39Å; E154-C158 PolarHBondContact O-N 3.3Å; E154-C158 PolarHBondContact OE1-SG 2.87Å; E154-R176 IonicContact OE1-CZ 3.86Å; E154-R176 VanDerWaalsContact OE1-CZ 3.29Å; E154-R176 IonicContact OE1-NH1 2.87Å; E154-R176 PolarHBondContact OE1-NH1 3.44Å; E154-R176 IonicContact OE1-NH2 3.7Å; E154-R176 PolarHBondContact OE1-NH2 3.32Å; E154-R176 IonicContact OE2-NH1 3.84Å; E154-R176 IonicContact OE2-NH2 3.56Å
155A95.7Very high96.3Very high5 Ų556.7 Ų56.74%0.04129%0.289CS..Hα-helixtrans-61.5-44.517400000112P101 I105 G151 A152 L157 C158 Y159P101-A155 HydrophobicContact CB-CB 4.33Å; I105-A155 HydrophobicContact CD1-CB 4.39Å; I105-A155 HydrophobicContact CG1-CB 4.04Å; G151-A155 PolarHBondContact O-N 3.4Å; G151-A155 VanDerWaalsContact O-N 3.1Å; A152-A155 WeakPolarHBondContact O-CB 3.33Å; A152-A155 PolarHBondContact O-N 3.46Å; A155-L157 VanDerWaalsContact C-N 3.33Å; A155-L157 PolarHBondContact O-N 2.9Å; A155-C158 WeakPolarHBondContact O-CB 3.12Å; A155-C158 PolarHBondContact O-N 3.36Å; A155-C158 VanDerWaalsContact O-N 3.17Å; A155-Y159 VanDerWaalsContact O-CD2 3.23Å; A155-Y159 WeakPolarHBondContact O-CD2 3.09Å; A155-Y159 PolarHBondContact O-N 2.87Å
156V96.7Very high96Very high93 Ų9357.1 Ų57.156%0.56428%0.284SS*.Hα-helixtrans-60.6-41.7176.2172.10000111.5A152 L153 Y159 Y160A152-V156 WeakPolarHBondContact O-CG2 3.45Å; A152-V156 PolarHBondContact O-N 3.17Å; L153-V156 PolarHBondContact O-N 3.44Å; V156-Y159 WeakPolarHBondContact O-CB 3.46Å; V156-Y159 PolarHBondContact O-N 3.22Å; V156-Y160 PolarHBondContact O-N 3.04Å
157L95.7Very high95.8Very high93 Ų9360.1 Ų60.149%0.48730%0.3SS..Hα-helixtrans-62.9-41.2174.6-73171.6000111.6L153 E154 A155 Y159 Y160 V161 Y184L153-L157 WeakPolarHBondContact O-CB 3.47Å; L153-L157 VanDerWaalsContact O-CG 3.32Å; L153-L157 WeakPolarHBondContact O-CG 2.91Å; L153-L157 PolarHBondContact O-N 3.17Å; E154-L157 PolarHBondContact O-N 3.39Å; A155-L157 VanDerWaalsContact C-N 3.33Å; A155-L157 PolarHBondContact O-N 2.9Å; L157-Y159 VanDerWaalsContact C-N 3.33Å; L157-Y159 PolarHBondContact O-N 3.35Å; L157-Y160 PolarHBondContact O-N 2.91Å; L157-V161 VanDerWaalsContact O-CG2 3.32Å; L157-V161 WeakPolarHBondContact O-CG2 3.37Å; L157-V161 PolarHBondContact O-N 3.1Å; L157-Y184 HydrophobicContact CB-CE2 4.37Å
158C95.2Very high95.4Very high0 Ų065.3 Ų65.30%032%0.323CS..Hα-helixtrans-59.9-41.3172.7-800000112M104 E154 A155 V161 A162M104-C158 HydrophobicContact SD-CB 3.92Å; E154-C158 PolarHBondContact O-N 3.3Å; E154-C158 PolarHBondContact OE1-SG 2.87Å; A155-C158 WeakPolarHBondContact O-CB 3.12Å; A155-C158 PolarHBondContact O-N 3.36Å; A155-C158 VanDerWaalsContact O-N 3.17Å; C158-V161 PolarHBondContact O-N 2.8Å; C158-A162 VanDerWaalsContact O-CB 3.27Å; C158-A162 WeakPolarHBondContact O-CB 3.29Å; C158-A162 PolarHBondContact O-N 3.45Å
159Y96.2Very high95.1Very high65 Ų6569.1 Ų69.126%0.25534%0.34SS..Hα-helixtrans-61.3-44.9173.9-85.6-77.7000112.2L91 L94 L95 P101 A155 V156 L157 A162 F163L91-Y159 HydrophobicContact CD1-CD1 4.3Å; L94-Y159 HydrophobicContact CB-CD1 4.01Å; L94-Y159 HydrophobicContact CB-CE1 3.48Å; L94-Y159 VanDerWaalsContact CB-CE1 3.48Å; L94-Y159 HydrophobicContact CD1-CD1 4.16Å; L94-Y159 HydrophobicContact CD1-CE1 4.39Å; L94-Y159 HydrophobicContact CD1-CG 4.35Å; L94-Y159 PolarHBondContact O-OH 2.84Å; L95-Y159 HydrophobicContact CD2-CD1 4.35Å; L95-Y159 HydrophobicContact CD2-CE1 3.76Å; L95-Y159 HydrophobicContact CG-CE1 4.16Å; P101-Y159 HydrophobicContact CB-CE2 4.11Å; P101-Y159 HydrophobicContact CG-CE2 4.41Å; A155-Y159 VanDerWaalsContact O-CD2 3.23Å; A155-Y159 WeakPolarHBondContact O-CD2 3.09Å; A155-Y159 PolarHBondContact O-N 2.87Å; V156-Y159 WeakPolarHBondContact O-CB 3.46Å; V156-Y159 PolarHBondContact O-N 3.22Å; L157-Y159 VanDerWaalsContact C-N 3.33Å; L157-Y159 PolarHBondContact O-N 3.35Å; Y159-A162 PolarHBondContact O-N 3.36Å; Y159-F163 WeakPolarHBondContact O-CB 3.36Å; Y159-F163 PolarHBondContact O-N 2.65Å
160Y96.5Very high94.7Very high154 Ų15466.8 Ų66.860%0.60433%0.325SS*.Hα-helixtrans-61.6-47177.7178.3-99.7000111.6V156 L157 A162 F163 V164V156-Y160 PolarHBondContact O-N 3.04Å; L157-Y160 PolarHBondContact O-N 2.91Å; Y160-A162 PolarHBondContact O-N 2.66Å; Y160-F163 WeakPolarHBondContact O-CB 3.41Å; Y160-F163 PolarHBondContact O-N 3.47Å; Y160-V164 HydrophobicContact CD1-CG2 4.45Å; Y160-V164 HydrophobicContact CE1-CG2 4.04Å; Y160-V164 WeakPolarHBondContact O-CG2 3.38Å; Y160-V164 PolarHBondContact O-N 3.33Å
161V95.7Very high94.3Very high20 Ų2061.4 Ų61.412%0.12130%0.301CS..Hα-helixtrans-60.8-47.1177.1173.50000110.6L157 C158 F163 V164 I165 N180 T181 Y184L157-V161 VanDerWaalsContact O-CG2 3.32Å; L157-V161 WeakPolarHBondContact O-CG2 3.37Å; L157-V161 PolarHBondContact O-N 3.1Å; C158-V161 PolarHBondContact O-N 2.8Å; V161-F163 VanDerWaalsContact C-N 3.27Å; V161-F163 PolarHBondContact O-N 2.94Å; V161-V164 PolarHBondContact O-N 3.22Å; V161-V164 VanDerWaalsContact O-N 3.15Å; V161-I165 WeakPolarHBondContact O-CG1 3.48Å; V161-I165 PolarHBondContact O-N 2.94Å; V161-I165 VanDerWaalsContact O-N 3.17Å; V161-N180 HydrophobicContact CG1-CB 4.38Å; V161-T181 HydrophobicContact CG1-CG2 3.93Å; V161-Y184 HydrophobicContact CG2-CD2 4.02Å; V161-Y184 HydrophobicContact CG2-CE2 4.39Å; V161-Y184 HydrophobicContact CG2-CG 4.21Å
162A95.2Very high93.9Very high0 Ų061.4 Ų61.40%030%0.301CS..Hα-helixtrans-62.4-32.7178.100000113P90 L94 C158 Y159 Y160 I165 R166P90-A162 HydrophobicContact CB-CB 3.99Å; L94-A162 HydrophobicContact CD1-CB 3.53Å; L94-A162 HydrophobicContact CG-CB 4.41Å; C158-A162 VanDerWaalsContact O-CB 3.27Å; C158-A162 WeakPolarHBondContact O-CB 3.29Å; C158-A162 PolarHBondContact O-N 3.45Å; Y159-A162 PolarHBondContact O-N 3.36Å; Y160-A162 PolarHBondContact O-N 2.66Å; A162-I165 CarbonylContact O-C 3.53Å; A162-I165 PolarHBondContact O-N 2.91Å; A162-R166 PolarHBondContact O-N 2.65Å; A162-R166 VanDerWaalsContact O-N 3.16Å
163F95.8Very high93.4Very high99 Ų9960 Ų6043%0.43429%0.289SS..Hα-helixtrans-66.9-42.5173.2175.9-95000112.1L91 Y159 Y160 V161 I165 R166L91-F163 HydrophobicContact CD1-CB 4.2Å; L91-F163 HydrophobicContact CD2-CD2 3.78Å; Y159-F163 WeakPolarHBondContact O-CB 3.36Å; Y159-F163 PolarHBondContact O-N 2.65Å; Y160-F163 WeakPolarHBondContact O-CB 3.41Å; Y160-F163 PolarHBondContact O-N 3.47Å; V161-F163 VanDerWaalsContact C-N 3.27Å; V161-F163 PolarHBondContact O-N 2.94Å; F163-I165 PolarHBondContact O-N 2.92Å; F163-R166 WeakPolarHBondContact O-CB 3.22Å; F163-R166 WeakPolarHBondContact O-CG 3.48Å; F163-R166 PolarHBondContact O-N 3.39Å
164V94.9Very high93.2Very high86 Ų8655.7 Ų55.752%0.52127%0.267SS..Hα-helixtrans-61.9-34.4177.3172.10000111.4Y160 V161Y160-V164 HydrophobicContact CD1-CG2 4.45Å; Y160-V164 HydrophobicContact CE1-CG2 4.04Å; Y160-V164 WeakPolarHBondContact O-CG2 3.38Å; Y160-V164 PolarHBondContact O-N 3.33Å; V161-V164 PolarHBondContact O-N 3.22Å; V161-V164 VanDerWaalsContact O-N 3.15Å
165I92.9Very high92.9Very high20 Ų2056.3 Ų56.310%0.10327%0.269CS..THydrogen-bonded Turntrans-102.623.2179.565.7160.5000114.3P90 V161 A162 F163 D167 H168 T181P90-I165 HydrophobicContact CB-CD1 4.26Å; P90-I165 HydrophobicContact CB-CG1 4.12Å; P90-I165 HydrophobicContact CG-CD1 4Å; P90-I165 HydrophobicContact CG-CG1 4.03Å; V161-I165 WeakPolarHBondContact O-CG1 3.48Å; V161-I165 PolarHBondContact O-N 2.94Å; V161-I165 VanDerWaalsContact O-N 3.17Å; A162-I165 CarbonylContact O-C 3.53Å; A162-I165 PolarHBondContact O-N 2.91Å; F163-I165 PolarHBondContact O-N 2.92Å; I165-D167 PolarHBondContact O-N 3.08Å; I165-D167 VanDerWaalsContact O-N 3.08Å; I165-H168 WeakPolarHBondContact O-CB 3.19Å; I165-H168 PolarHBondContact O-N 3.44Å; I165-H168 VanDerWaalsContact O-N 3.1Å; I165-T181 HydrophobicContact CG2-CG2 3.72Å
166R91.8Very high92.6Very high113 Ų11357.8 Ų57.843%0.42627%0.273SS..THydrogen-bonded Turntrans-58.4-25.3-172.767.1-173.7-178.9-143.1-0.3115S89 L91 A162 F163 H168S89-R166 WeakPolarHBondContact CB-O 3.32Å; L91-R166 HydrophobicContact CB-CB 4.42Å; A162-R166 PolarHBondContact O-N 2.65Å; A162-R166 VanDerWaalsContact O-N 3.16Å; F163-R166 WeakPolarHBondContact O-CB 3.22Å; F163-R166 WeakPolarHBondContact O-CG 3.48Å; F163-R166 PolarHBondContact O-N 3.39Å; R166-H168 VanDerWaalsContact C-N 3.29Å; R166-H168 PolarHBondContact O-N 3.19Å
167D91.5Very high92.2Very high126 Ų12656.1 Ų56.167%0.67427%0.266SS*.THydrogen-bonded Turntrans-79-15.7-177.1-58.2-44.2000112.5I165I165-D167 PolarHBondContact O-N 3.08Å; I165-D167 VanDerWaalsContact O-N 3.08Å
168H90Very high91.8Very high121 Ų12154.1 Ų54.156%0.5625%0.254SS*.SBendtrans-69.2148.6174.4-67.5138.3000111.9P90 I165 R166P90-H168 WeakPolarHBondContact CD-O 3.21Å; P90-H168 HydrophobicContact CG-CB 4.46Å; I165-H168 WeakPolarHBondContact O-CB 3.19Å; I165-H168 PolarHBondContact O-N 3.44Å; I165-H168 VanDerWaalsContact O-N 3.1Å; R166-H168 VanDerWaalsContact C-N 3.29Å; R166-H168 PolarHBondContact O-N 3.19Å
169K90.8Very high91.7Very high133 Ų13354.4 Ų54.458%0.57826%0.255SS*.  trans-102.9127.2174.7-60.2-56.8-179.3-1720109.4T87T87-K169 HydrophobicContact CG2-CB 4.12Å
170I90.6Very high91.5Very high10 Ų1051.5 Ų51.55%0.05124%0.244CC..BIsolated β-bridgetrans-126169.3-178.365.7164000111.3T87 V88 P90 C93 Q178T87-I170 WeakPolarHBondContact CA-O 3.33Å; V88-I170 HydrophobicContact CG2-CD1 4.42Å; V88-I170 HydrophobicContact CG2-CG1 3.86Å; V88-I170 PolarHBondContact N-O 3.19Å; V88-I170 VanDerWaalsContact O-CG1 3.32Å; V88-I170 WeakPolarHBondContact O-CG1 3.35Å; V88-I170 PolarHBondContact O-N 3.4Å; P90-I170 HydrophobicContact CB-CD1 4.34Å; P90-I170 HydrophobicContact CG-CD1 4.22Å; P90-I170 HydrophobicContact CG-CG1 4.38Å; P90-I170 HydrophobicContact CG-CG2 3.97Å; C93-I170 HydrophobicContact CB-CD1 3.95Å; I170-Q178 HydrophobicContact CB-CB 4.05Å; I170-Q178 HydrophobicContact CG2-CB 3.98Å; I170-Q178 WeakPolarHBondContact CG2-O 3.39Å
171S88.6Confident91.3Very high0 Ų046.1 Ų46.10%023%0.228CC..  trans-66.7142.1175.6-177.70000110.3V12 A173 C174V12-S171 VanDerWaalsContact CG1-N 3.33Å; S171-A173 PolarHBondContact O-N 3.08Å; S171-A173 VanDerWaalsContact O-N 3.14Å; S171-A173 PolarHBondContact OG-N 3.2Å; S171-C174 PolarHBondContact O-N 2.99Å
172P88.4Confident91Very high0 Ų050 Ų500%025%0.253CS..THydrogen-bonded Turntrans-66.7-11.3172.928.9-35.7000112.6W14 L80 F86 V88 R97 C174W14-P172 HydrophobicContact CH2-CB 4.49Å; W14-P172 HydrophobicContact CH2-CG 3.13Å; W14-P172 VanDerWaalsContact CZ2-CD 3.46Å; W14-P172 HydrophobicContact CZ2-CG 3.24Å; W14-P172 HydrophobicContact CZ3-CG 3.88Å; L80-P172 HydrophobicContact CD1-CB 4.33Å; L80-P172 WeakPolarHBondContact CD1-O 3.41Å; L80-P172 HydrophobicContact CD2-CB 3.87Å; L80-P172 HydrophobicContact CD2-CG 3.93Å; F86-P172 HydrophobicContact CD1-CG 4.29Å; F86-P172 HydrophobicContact CD2-CB 4.15Å; F86-P172 HydrophobicContact CD2-CG 4.35Å; F86-P172 HydrophobicContact CE1-CB 4.05Å; F86-P172 HydrophobicContact CE1-CG 3.99Å; F86-P172 HydrophobicContact CE2-CB 3.5Å; F86-P172 HydrophobicContact CE2-CG 4.09Å; F86-P172 HydrophobicContact CG-CG 4.46Å; F86-P172 HydrophobicContact CZ-CB 3.42Å; F86-P172 VanDerWaalsContact CZ-CB 3.42Å; F86-P172 HydrophobicContact CZ-CG 3.89Å; F86-P172 WeakPolarHBondContact O-CD 3.35Å; V88-P172 HydrophobicContact CG1-CB 4.15Å; V88-P172 HydrophobicContact CG2-CB 4.45Å; R97-P172 PolarHBondContact NH1-O 2.86Å; R97-P172 PolarHBondContact NH2-O 3.34Å; P172-C174 PolarHBondContact O-N 3.49Å
173A87.8Confident90.9Very high10 Ų1054.3 Ų54.38%0.08328%0.279CS..THydrogen-bonded Turntrans-68.1-11170.100000113.7L80 S171 Y175L80-A173 HydrophobicContact CD1-CB 4.26Å; S171-A173 PolarHBondContact O-N 3.08Å; S171-A173 VanDerWaalsContact O-N 3.14Å; S171-A173 PolarHBondContact OG-N 3.2Å; A173-Y175 HydrophobicContact CB-CD2 4.04Å; A173-Y175 HydrophobicContact CB-CE2 3.43Å; A173-Y175 VanDerWaalsContact CB-CE2 3.43Å; A173-Y175 PolarHBondContact O-N 2.83Å
174C91.1Very high90.7Very high4 Ų451.5 Ų51.53%0.02727%0.266CS..  trans55.551171.1-770000114.5C93 R97 L100 S171 P172 Y179C93-C174 HydrophobicContact CB-CB 4.45Å; C93-C174 WeakPolarHBondContact CB-SG 3.16Å; C93-C174 VanDerWaalsContact SG-CA 3.58Å; C93-C174 WeakPolarHBondContact SG-CB 3.34Å; C93-C174 CovalentContact SG-SG 2Å; C93-C174 PolarHBondContact SG-SG 3.05Å; R97-C174 VanDerWaalsContact CZ-SG 3.57Å; R97-C174 PolarHBondContact NH1-SG 3.31Å; L100-C174 HydrophobicContact CD1-CB 3.73Å; S171-C174 PolarHBondContact O-N 2.99Å; P172-C174 PolarHBondContact O-N 3.49Å; C174-Y179 WeakPolarHBondContact O-CE1 3.18Å
175Y89.3Confident90.5Very high31 Ų3150.8 Ų50.812%0.12226%0.255CS..  trans-67.2138.4174.7-62.9-73.4000110.8S15 A173 S177 Q178 Y179S15-Y175 WeakPolarHBondContact CB-OH 3.15Å; S15-Y175 PolarHBondContact OG-OH 3.15Å; A173-Y175 HydrophobicContact CB-CD2 4.04Å; A173-Y175 HydrophobicContact CB-CE2 3.43Å; A173-Y175 VanDerWaalsContact CB-CE2 3.43Å; A173-Y175 PolarHBondContact O-N 2.83Å; Y175-S177 PolarHBondContact O-N 3.05Å; Y175-S177 VanDerWaalsContact O-N 3.17Å; Y175-Q178 WeakPolarHBondContact O-CA 3.47Å; Y175-Q178 WeakPolarHBondContact O-CB 3.29Å; Y175-Q178 PolarHBondContact O-N 2.78Å; Y175-Y179 WeakPolarHBondContact O-CD1 3.32Å; Y175-Y179 PolarHBondContact O-N 3.32Å
176R89.5Confident90.3Very high35 Ų3558 Ų5813%0.13228%0.281CS..Hα-helixtrans-58.4-28.9179.3-174.2162.5-179.3146.74.4114.5E154 Q178 Y179 N180 Y185 F188E154-R176 IonicContact OE1-CZ 3.86Å; E154-R176 VanDerWaalsContact OE1-CZ 3.29Å; E154-R176 IonicContact OE1-NH1 2.87Å; E154-R176 PolarHBondContact OE1-NH1 3.44Å; E154-R176 IonicContact OE1-NH2 3.7Å; E154-R176 PolarHBondContact OE1-NH2 3.32Å; E154-R176 IonicContact OE2-NH1 3.84Å; E154-R176 IonicContact OE2-NH2 3.56Å; R176-Q178 PolarHBondContact O-N 3.14Å; R176-Y179 VanDerWaalsContact CA-CZ 3.43Å; R176-Y179 HydrophobicContact CB-CE1 3.93Å; R176-Y179 HydrophobicContact CB-CE2 4.46Å; R176-Y179 WeakPolarHBondContact CB-OH 3.47Å; R176-Y179 WeakPolarHBondContact CD-OH 3.42Å; R176-Y179 HydrophobicContact CG-CE1 4.41Å; R176-Y179 HydrophobicContact CG-CE2 4.08Å; R176-Y179 WeakPolarHBondContact CG-OH 3.29Å; R176-N180 WeakPolarHBondContact O-CB 3.38Å; R176-Y185 HydrophobicContact CG-CD2 4.22Å; R176-Y185 HydrophobicContact CG-CE2 4.36Å; R176-F188 VanDerWaalsContact CZ-CE2 3.45Å; R176-F188 VanDerWaalsContact CZ-CZ 3.42Å
177S87.9Confident90.3Very high58 Ų5858.2 Ų58.241%0.40629%0.288SS..Hα-helixtrans-73.2-13.4173.859.30000114Y175Y175-S177 PolarHBondContact O-N 3.05Å; Y175-S177 VanDerWaalsContact O-N 3.17Å
178Q89.2Confident90.2Very high52 Ų5253.6 Ų53.624%0.24326%0.262CS..Hα-helixtrans-103.6-41.6-176.8-65.6-178.3-12.800112.5I170 Y175 R176 N180I170-Q178 HydrophobicContact CB-CB 4.05Å; I170-Q178 HydrophobicContact CG2-CB 3.98Å; I170-Q178 WeakPolarHBondContact CG2-O 3.39Å; Y175-Q178 WeakPolarHBondContact O-CA 3.47Å; Y175-Q178 WeakPolarHBondContact O-CB 3.29Å; Y175-Q178 PolarHBondContact O-N 2.78Å; R176-Q178 PolarHBondContact O-N 3.14Å; Q178-N180 VanDerWaalsContact C-N 3.26Å; Q178-N180 PolarHBondContact O-N 3.11Å
179Y92.3Very high90.1Very high6 Ų650.4 Ų50.42%0.02425%0.248CC..Hα-helixtrans-80.6-5.2178.465.7-111.7000114L94 M104 C174 Y175 R176L94-Y179 HydrophobicContact CD1-CD2 4.29Å; L94-Y179 HydrophobicContact CD2-CD1 4.36Å; L94-Y179 HydrophobicContact CD2-CD2 4.03Å; L94-Y179 HydrophobicContact CD2-CE1 4.31Å; L94-Y179 HydrophobicContact CD2-CE2 4.01Å; L94-Y179 HydrophobicContact CD2-CG 4.23Å; L94-Y179 HydrophobicContact CG-CD2 4.41Å; M104-Y179 HydrophobicContact CE-CE1 4.4Å; M104-Y179 HydrophobicContact CE-CE2 3.79Å; M104-Y179 VanDerWaalsContact CE-CZ 3.5Å; M104-Y179 WeakPolarHBondContact CE-OH 3.47Å; M104-Y179 HydrophobicContact SD-CE2 4.41Å; C174-Y179 WeakPolarHBondContact O-CE1 3.18Å; Y175-Y179 WeakPolarHBondContact O-CD1 3.32Å; Y175-Y179 PolarHBondContact O-N 3.32Å; R176-Y179 VanDerWaalsContact CA-CZ 3.43Å; R176-Y179 HydrophobicContact CB-CE1 3.93Å; R176-Y179 HydrophobicContact CB-CE2 4.46Å; R176-Y179 WeakPolarHBondContact CB-OH 3.47Å; R176-Y179 WeakPolarHBondContact CD-OH 3.42Å; R176-Y179 HydrophobicContact CG-CE1 4.41Å; R176-Y179 HydrophobicContact CG-CE2 4.08Å; R176-Y179 WeakPolarHBondContact CG-OH 3.29Å
180N91.8Very high90Very high3 Ų348.6 Ų48.62%0.01624%0.244CC..SBendtrans-115.1156.9173.8-75.7-33.8000111V161 R176 Q178 Y184V161-N180 HydrophobicContact CG1-CB 4.38Å; R176-N180 WeakPolarHBondContact O-CB 3.38Å; Q178-N180 VanDerWaalsContact C-N 3.26Å; Q178-N180 PolarHBondContact O-N 3.11Å; N180-Y184 HydrophobicContact CB-CD1 3.93Å
181T92.2Very high90Very high42 Ų4251.8 Ų51.826%0.25826%0.264SS..  trans-63.7148.5170.760.20000110.7V161 I165 T183 Y184 Y185V161-T181 HydrophobicContact CG1-CG2 3.93Å; I165-T181 HydrophobicContact CG2-CG2 3.72Å; T181-T183 PolarHBondContact O-N 3.06Å; T181-Y184 PolarHBondContact O-N 3.1Å; T181-Y184 VanDerWaalsContact O-N 3.13Å; T181-Y184 VanDerWaalsContact OG1-CB 3.28Å; T181-Y184 WeakPolarHBondContact OG1-CB 3.44Å; T181-Y184 PolarHBondContact OG1-N 3.46Å; T181-Y185 PolarHBondContact O-N 3.35Å
182P90.2Very high89.9Confident100 Ų10053 Ų5365%0.64927%0.272SS*.Hα-helixtrans-55.8-36.3177.3-2734.8000113.1R186P182-R186 WeakPolarHBondContact O-CB 3.47Å; P182-R186 PolarHBondContact O-N 2.97Å
183T91.5Very high89.8Confident91 Ų9155.2 Ų55.256%0.55829%0.285SS*.Hα-helixtrans-63.7-49.9176.5-51.50000111.4T181 R186 M187T181-T183 PolarHBondContact O-N 3.06Å; T183-R186 PolarHBondContact O-N 3.02Å; T183-M187 HydrophobicContact CG2-CE 3.99Å; T183-M187 HydrophobicContact CG2-SD 4.45Å; T183-M187 WeakPolarHBondContact O-CG 3.21Å; T183-M187 PolarHBondContact O-N 3.48Å
184Y92.3Very high89.9Confident41 Ų4157.8 Ų57.816%0.16130%0.303CS..Hα-helixtrans-64.2-42.6178.4-176.4-90.5000111.5L157 V161 N180 T181 R186 M187 F188L157-Y184 HydrophobicContact CB-CE2 4.37Å; V161-Y184 HydrophobicContact CG2-CD2 4.02Å; V161-Y184 HydrophobicContact CG2-CE2 4.39Å; V161-Y184 HydrophobicContact CG2-CG 4.21Å; N180-Y184 HydrophobicContact CB-CD1 3.93Å; T181-Y184 PolarHBondContact O-N 3.1Å; T181-Y184 VanDerWaalsContact O-N 3.13Å; T181-Y184 VanDerWaalsContact OG1-CB 3.28Å; T181-Y184 WeakPolarHBondContact OG1-CB 3.44Å; T181-Y184 PolarHBondContact OG1-N 3.46Å; Y184-R186 VanDerWaalsContact C-N 3.32Å; Y184-R186 PolarHBondContact O-N 3.46Å; Y184-M187 PolarHBondContact O-N 3.48Å; Y184-F188 WeakPolarHBondContact O-CB 3.47Å; Y184-F188 PolarHBondContact O-N 2.87Å
185Y90.5Very high89.8Confident71 Ų7159.1 Ų59.128%0.27831%0.309SS..Hα-helixtrans-59.8-42.4176.4-179.3-112.6000111.9R176 T181 F188 M189R176-Y185 HydrophobicContact CG-CD2 4.22Å; R176-Y185 HydrophobicContact CG-CE2 4.36Å; T181-Y185 PolarHBondContact O-N 3.35Å; Y185-F188 PolarHBondContact O-N 3.31Å; Y185-M189 HydrophobicContact CD1-CG 4.46Å; Y185-M189 HydrophobicContact CD2-CG 4.41Å; Y185-M189 HydrophobicContact CE1-CG 4.06Å; Y185-M189 HydrophobicContact CE2-CG 3.99Å; Y185-M189 HydrophobicContact CE2-SD 4.06Å; Y185-M189 VanDerWaalsContact O-CG 3.3Å; Y185-M189 WeakPolarHBondContact O-CG 3.28Å; Y185-M189 PolarHBondContact O-N 3.18Å
186R89.8Confident89.6Confident172 Ų17258.4 Ų58.465%0.64931%0.31SS*.Hα-helixtrans-64.4-44.1175.4-171.3-177.5-63.71780.4112P182 T183 Y184 F188 M189 N190P182-R186 WeakPolarHBondContact O-CB 3.47Å; P182-R186 PolarHBondContact O-N 2.97Å; T183-R186 PolarHBondContact O-N 3.02Å; Y184-R186 VanDerWaalsContact C-N 3.32Å; Y184-R186 PolarHBondContact O-N 3.46Å; R186-F188 VanDerWaalsContact C-N 3.35Å; R186-M189 PolarHBondContact O-N 3.39Å; R186-N190 WeakPolarHBondContact O-CB 3.29Å; R186-N190 PolarHBondContact O-N 2.99Å; R186-N190 PolarHBondContact O-OD1 3.27Å
187M91.4Very high89.5Confident116 Ų11660.6 Ų60.657%0.57132%0.323SS*.Hα-helixtrans-59.4-46.5175.4-73.3177173.300111.2T183 Y184 N190 T191T183-M187 HydrophobicContact CG2-CE 3.99Å; T183-M187 HydrophobicContact CG2-SD 4.45Å; T183-M187 WeakPolarHBondContact O-CG 3.21Å; T183-M187 PolarHBondContact O-N 3.48Å; Y184-M187 PolarHBondContact O-N 3.48Å; M187-N190 PolarHBondContact O-N 3.12Å; M187-T191 WeakPolarHBondContact O-CB 3.34Å; M187-T191 PolarHBondContact O-N 2.73Å; M187-T191 PolarHBondContact O-OG1 3.35Å
188F89.5Confident89.7Confident29 Ų2961.2 Ų61.213%0.12733%0.325CS..Hα-helixtrans-57.7-51.8176.1171.7-102.3000111.7R176 Y184 Y185 R186 N190 T191 T192R176-F188 VanDerWaalsContact CZ-CE2 3.45Å; R176-F188 VanDerWaalsContact CZ-CZ 3.42Å; Y184-F188 WeakPolarHBondContact O-CB 3.47Å; Y184-F188 PolarHBondContact O-N 2.87Å; Y185-F188 PolarHBondContact O-N 3.31Å; R186-F188 VanDerWaalsContact C-N 3.35Å; F188-N190 VanDerWaalsContact C-N 3.33Å; F188-N190 PolarHBondContact O-N 3.48Å; F188-T191 PolarHBondContact O-N 2.86Å; F188-T192 PolarHBondContact O-N 2.81Å; F188-T192 PolarHBondContact O-OG1 2.86Å; F188-T192 VanDerWaalsContact O-OG1 3.08Å
189M87.2Confident89.7Confident54 Ų5458.9 Ų58.927%0.26631%0.314SS..Hα-helixtrans-58-45.7178.5-70.4-60.4-61.800111.6Y185 R186 T191 T192 V193Y185-M189 HydrophobicContact CD1-CG 4.46Å; Y185-M189 HydrophobicContact CD2-CG 4.41Å; Y185-M189 HydrophobicContact CE1-CG 4.06Å; Y185-M189 HydrophobicContact CE2-CG 3.99Å; Y185-M189 HydrophobicContact CE2-SD 4.06Å; Y185-M189 VanDerWaalsContact O-CG 3.3Å; Y185-M189 WeakPolarHBondContact O-CG 3.28Å; Y185-M189 PolarHBondContact O-N 3.18Å; R186-M189 PolarHBondContact O-N 3.39Å; M189-T191 PolarHBondContact O-N 3.45Å; M189-T192 PolarHBondContact O-N 3.32Å; M189-V193 WeakPolarHBondContact O-CB 3.31Å; M189-V193 VanDerWaalsContact O-CG2 3.28Å; M189-V193 WeakPolarHBondContact O-CG2 3.46Å; M189-V193 PolarHBondContact O-N 3.27Å
190N88.8Confident89.4Confident95 Ų9560.1 Ų60.151%0.50832%0.321SS..Hα-helixtrans-62.3-42.6178-73.1-3.8000111.9R186 M187 F188 V193 S194R186-N190 WeakPolarHBondContact O-CB 3.29Å; R186-N190 PolarHBondContact O-N 2.99Å; R186-N190 PolarHBondContact O-OD1 3.27Å; M187-N190 PolarHBondContact O-N 3.12Å; F188-N190 VanDerWaalsContact C-N 3.33Å; F188-N190 PolarHBondContact O-N 3.48Å; N190-V193 PolarHBondContact O-N 2.96Å; N190-S194 VanDerWaalsContact O-CB 3.26Å; N190-S194 WeakPolarHBondContact O-CB 3.45Å; N190-S194 PolarHBondContact O-N 2.96Å; N190-S194 PolarHBondContact O-OG 2.65Å
191T90Very high89.2Confident77 Ų7763.4 Ų63.447%0.47234%0.341SS..Hα-helixtrans-64.6-46.4177.5-61.90000111.1M187 F188 M189 V193 S194 L195M187-T191 WeakPolarHBondContact O-CB 3.34Å; M187-T191 PolarHBondContact O-N 2.73Å; M187-T191 PolarHBondContact O-OG1 3.35Å; F188-T191 PolarHBondContact O-N 2.86Å; M189-T191 PolarHBondContact O-N 3.45Å; T191-V193 PolarHBondContact O-N 3.31Å; T191-S194 PolarHBondContact O-N 2.7Å; T191-L195 HydrophobicContact CG2-CD1 3.95Å; T191-L195 HydrophobicContact CG2-CG 4.37Å; T191-L195 WeakPolarHBondContact O-CB 3.37Å; T191-L195 VanDerWaalsContact O-CG 3.25Å; T191-L195 WeakPolarHBondContact O-CG 3.32Å; T191-L195 PolarHBondContact O-N 3.46Å
192T87.6Confident89.1Confident26 Ų2662.8 Ų62.816%0.1634%0.335CS..Hα-helixtrans-60.5-44.8177.5-58.60000111.7F188 M189 L195 A196F188-T192 PolarHBondContact O-N 2.81Å; F188-T192 PolarHBondContact O-OG1 2.86Å; F188-T192 VanDerWaalsContact O-OG1 3.08Å; M189-T192 PolarHBondContact O-N 3.32Å; T192-L195 PolarHBondContact O-N 3.28Å; T192-A196 PolarHBondContact O-N 3.11Å; T192-A196 VanDerWaalsContact O-N 3.08Å
193V86.2Confident88.8Confident47 Ų4758.4 Ų58.429%0.28531%0.306SS..Hα-helixtrans-64.7-43.3176.8171.20000111M189 N190 T191 L195 A196 I197 F249M189-V193 WeakPolarHBondContact O-CB 3.31Å; M189-V193 VanDerWaalsContact O-CG2 3.28Å; M189-V193 WeakPolarHBondContact O-CG2 3.46Å; M189-V193 PolarHBondContact O-N 3.27Å; N190-V193 PolarHBondContact O-N 2.96Å; T191-V193 PolarHBondContact O-N 3.31Å; V193-L195 PolarHBondContact O-N 2.89Å; V193-A196 PolarHBondContact O-N 3.37Å; V193-I197 HydrophobicContact CG1-CD1 3.81Å; V193-I197 HydrophobicContact CG1-CG1 4.44Å; V193-I197 WeakPolarHBondContact O-CG1 3.3Å; V193-I197 PolarHBondContact O-N 3.38Å; V193-F249 HydrophobicContact CG1-CE2 4.42Å
194S89Confident88.5Confident64 Ų6458.1 Ų58.145%0.44830%0.3SS..Hα-helixtrans-62.9-44.2178.7-58.80000111.7N190 T191 A196 I197 V198N190-S194 VanDerWaalsContact O-CB 3.26Å; N190-S194 WeakPolarHBondContact O-CB 3.45Å; N190-S194 PolarHBondContact O-N 2.96Å; N190-S194 PolarHBondContact O-OG 2.65Å; T191-S194 PolarHBondContact O-N 2.7Å; S194-A196 VanDerWaalsContact C-N 3.31Å; S194-A196 PolarHBondContact O-N 3.14Å; S194-I197 PolarHBondContact O-N 2.91Å; S194-V198 VanDerWaalsContact O-CG2 3.29Å; S194-V198 WeakPolarHBondContact O-CG2 3.27Å; S194-V198 PolarHBondContact O-N 2.83Å
195L90.2Very high88.4Confident31 Ų3159.6 Ų59.616%0.16231%0.31CS..Hα-helixtrans-59.2-43.5175.3-72.6167000111.3M112 L115 T191 T192 V193 V198 T199M112-L195 HydrophobicContact CE-CD1 3.41Å; M112-L195 VanDerWaalsContact CE-CD1 3.41Å; M112-L195 HydrophobicContact CE-CD2 4.13Å; M112-L195 HydrophobicContact CE-CG 4.43Å; M112-L195 HydrophobicContact SD-CD1 4.14Å; M112-L195 HydrophobicContact SD-CD2 4.13Å; L115-L195 HydrophobicContact CD2-CD2 3.7Å; T191-L195 HydrophobicContact CG2-CD1 3.95Å; T191-L195 HydrophobicContact CG2-CG 4.37Å; T191-L195 WeakPolarHBondContact O-CB 3.37Å; T191-L195 VanDerWaalsContact O-CG 3.25Å; T191-L195 WeakPolarHBondContact O-CG 3.32Å; T191-L195 PolarHBondContact O-N 3.46Å; T192-L195 PolarHBondContact O-N 3.28Å; V193-L195 PolarHBondContact O-N 2.89Å; L195-V198 PolarHBondContact O-N 2.8Å; L195-T199 WeakPolarHBondContact O-CB 3.29Å; L195-T199 PolarHBondContact O-N 3.44Å; L195-T199 PolarHBondContact O-OG1 3.08Å
196A85.1Confident88.1Confident17 Ų1756.2 Ų56.214%0.1430%0.297CS..Hα-helixtrans-62.8-43.7176.900000112T192 V193 S194 T199 M200 F249T192-A196 PolarHBondContact O-N 3.11Å; T192-A196 VanDerWaalsContact O-N 3.08Å; V193-A196 PolarHBondContact O-N 3.37Å; S194-A196 VanDerWaalsContact C-N 3.31Å; S194-A196 PolarHBondContact O-N 3.14Å; A196-T199 PolarHBondContact O-N 3.44Å; A196-M200 WeakPolarHBondContact O-CG 3.25Å; A196-M200 PolarHBondContact O-N 3.13Å; A196-F249 HydrophobicContact CB-CD2 4.24Å
197I87.1Confident87.8Confident80 Ų8052.7 Ų52.741%0.4129%0.285SS..Hα-helixtrans-62-48.4176.7-68167000110.7V193 S194 T199 M200 V201 F249V193-I197 HydrophobicContact CG1-CD1 3.81Å; V193-I197 HydrophobicContact CG1-CG1 4.44Å; V193-I197 WeakPolarHBondContact O-CG1 3.3Å; V193-I197 PolarHBondContact O-N 3.38Å; S194-I197 PolarHBondContact O-N 2.91Å; I197-T199 VanDerWaalsContact C-N 3.29Å; I197-T199 PolarHBondContact O-N 2.98Å; I197-M200 WeakPolarHBondContact O-CB 3.4Å; I197-M200 PolarHBondContact O-N 3.32Å; I197-V201 HydrophobicContact CG2-CG2 4.39Å; I197-V201 WeakPolarHBondContact O-CG2 3.12Å; I197-V201 PolarHBondContact O-N 3.25Å; I197-F249 HydrophobicContact CG1-CE2 3.98Å; I197-F249 HydrophobicContact CG1-CZ 4.43Å
198V90.9Very high87.5Confident71 Ų7151 Ų5143%0.4328%0.277SS..Hα-helixtrans-59.2-43.9178.2172.40000110.5L115 S194 L195 M200 V201 L202L115-V198 HydrophobicContact CD1-CB 4.46Å; L115-V198 HydrophobicContact CD1-CG1 3.81Å; S194-V198 VanDerWaalsContact O-CG2 3.29Å; S194-V198 WeakPolarHBondContact O-CG2 3.27Å; S194-V198 PolarHBondContact O-N 2.83Å; L195-V198 PolarHBondContact O-N 2.8Å; V198-M200 VanDerWaalsContact C-N 3.35Å; V198-M200 PolarHBondContact O-N 3.15Å; V198-V201 PolarHBondContact O-N 3.4Å; V198-L202 HydrophobicContact CG1-CD1 4.01Å; V198-L202 HydrophobicContact CG1-CG 4.42Å; V198-L202 WeakPolarHBondContact O-CB 3.03Å; V198-L202 WeakPolarHBondContact O-CG 3.43Å; V198-L202 PolarHBondContact O-N 2.87Å
199T89.2Confident87.2Confident3 Ų352.5 Ų52.52%0.01829%0.285CS..Hα-helixtrans-59.9-45.5177-52.60000110.9L195 A196 I197 L202 Y203 L245L195-T199 WeakPolarHBondContact O-CB 3.29Å; L195-T199 PolarHBondContact O-N 3.44Å; L195-T199 PolarHBondContact O-OG1 3.08Å; A196-T199 PolarHBondContact O-N 3.44Å; I197-T199 VanDerWaalsContact C-N 3.29Å; I197-T199 PolarHBondContact O-N 2.98Å; T199-L202 PolarHBondContact O-N 3.3Å; T199-Y203 HydrophobicContact CG2-CD2 3.94Å; T199-Y203 HydrophobicContact CG2-CE2 3.67Å; T199-Y203 WeakPolarHBondContact O-CD2 3.32Å; T199-Y203 PolarHBondContact O-N 2.91Å; T199-L245 HydrophobicContact CG2-CD1 3.69Å; T199-L245 HydrophobicContact CG2-CD2 3.9Å; T199-L245 HydrophobicContact CG2-CG 4.34Å
200M86Confident86.9Confident33 Ų3351.7 Ų51.716%0.16328%0.281CS..Hα-helixtrans-60.9-46.5176.2-79.4-70.6-85.400112.4A196 I197 V198 L202 Y203 I204 F242 L245 L246A196-M200 WeakPolarHBondContact O-CG 3.25Å; A196-M200 PolarHBondContact O-N 3.13Å; I197-M200 WeakPolarHBondContact O-CB 3.4Å; I197-M200 PolarHBondContact O-N 3.32Å; V198-M200 VanDerWaalsContact C-N 3.35Å; V198-M200 PolarHBondContact O-N 3.15Å; M200-L202 VanDerWaalsContact C-N 3.33Å; M200-L202 PolarHBondContact O-N 3.14Å; M200-Y203 PolarHBondContact O-N 3.33Å; M200-I204 WeakPolarHBondContact O-CG1 3.39Å; M200-I204 PolarHBondContact O-N 2.87Å; M200-F242 HydrophobicContact CE-CD2 4.23Å; M200-F242 HydrophobicContact CE-CE2 3.71Å; M200-F242 HydrophobicContact CE-CZ 4.46Å; M200-F242 HydrophobicContact SD-CD2 4.11Å; M200-F242 HydrophobicContact SD-CE2 4.18Å; M200-L245 HydrophobicContact CG-CB 4.08Å; M200-L245 HydrophobicContact CG-CD1 4.01Å; M200-L245 HydrophobicContact CG-CD2 4.33Å; M200-L245 HydrophobicContact CG-CG 4.38Å; M200-L245 HydrophobicContact SD-CB 3.4Å; M200-L245 WeakPolarHBondContact SD-CB 3.45Å; M200-L245 HydrophobicContact SD-CD1 3.63Å; M200-L245 HydrophobicContact SD-CG 4.06Å; M200-L246 HydrophobicContact CE-CD2 3.96Å
201V89.3Confident86.4Confident72 Ų7252.9 Ų52.944%0.43628%0.278SS..Hα-helixtrans-60.5-44.9177.7171.60000110.4I197 V198 Y203 I204 L205I197-V201 HydrophobicContact CG2-CG2 4.39Å; I197-V201 WeakPolarHBondContact O-CG2 3.12Å; I197-V201 PolarHBondContact O-N 3.25Å; V198-V201 PolarHBondContact O-N 3.4Å; V201-Y203 VanDerWaalsContact C-N 3.31Å; V201-Y203 PolarHBondContact O-N 3.23Å; V201-I204 PolarHBondContact O-N 3.05Å; V201-L205 HydrophobicContact CG1-CD1 3.91Å; V201-L205 HydrophobicContact CG1-CG 4.26Å; V201-L205 WeakPolarHBondContact O-CB 3.3Å; V201-L205 VanDerWaalsContact O-CG 3.27Å; V201-L205 WeakPolarHBondContact O-CG 3.25Å; V201-L205 PolarHBondContact O-N 2.93Å
202L89.6Confident86.1Confident28 Ų2853.7 Ų53.715%0.14728%0.279CS..Hα-helixtrans-61.2-38.4177.1-73.4172.9000112.4L115 S118 I119 F122 V198 T199 M200 L205 A206L115-L202 HydrophobicContact CD1-CD1 3.86Å; S118-L202 WeakPolarHBondContact OG-CD1 3.34Å; I119-L202 HydrophobicContact CG1-CD1 3.59Å; F122-L202 HydrophobicContact CB-CD2 4.3Å; F122-L202 HydrophobicContact CD1-CD2 4.1Å; F122-L202 HydrophobicContact CG-CD2 4.06Å; V198-L202 HydrophobicContact CG1-CD1 4.01Å; V198-L202 HydrophobicContact CG1-CG 4.42Å; V198-L202 WeakPolarHBondContact O-CB 3.03Å; V198-L202 WeakPolarHBondContact O-CG 3.43Å; V198-L202 PolarHBondContact O-N 2.87Å; T199-L202 PolarHBondContact O-N 3.3Å; M200-L202 VanDerWaalsContact C-N 3.33Å; M200-L202 PolarHBondContact O-N 3.14Å; L202-L205 PolarHBondContact O-N 3.5Å; L202-A206 VanDerWaalsContact O-CB 3.23Å; L202-A206 WeakPolarHBondContact O-CB 3.4Å; L202-A206 PolarHBondContact O-N 2.93Å
203Y84.2Confident85.6Confident9 Ų956.8 Ų56.84%0.03529%0.29CS..Hα-helixtrans-67.2-42.1174.2-84.9-64000113.2S118 R121 T199 M200 V201 L205 A206 Y207 C241 L245S118-Y203 PolarHBondContact N-OH 2.98Å; R121-Y203 HydrophobicContact CG-CE1 4.2Å; T199-Y203 HydrophobicContact CG2-CD2 3.94Å; T199-Y203 HydrophobicContact CG2-CE2 3.67Å; T199-Y203 WeakPolarHBondContact O-CD2 3.32Å; T199-Y203 PolarHBondContact O-N 2.91Å; M200-Y203 PolarHBondContact O-N 3.33Å; V201-Y203 VanDerWaalsContact C-N 3.31Å; V201-Y203 PolarHBondContact O-N 3.23Å; Y203-L205 VanDerWaalsContact C-N 3.32Å; Y203-L205 PolarHBondContact O-N 3.33Å; Y203-A206 PolarHBondContact O-N 3.45Å; Y203-Y207 WeakPolarHBondContact O-CB 3.09Å; Y203-Y207 PolarHBondContact O-N 3.13Å; Y203-C241 HydrophobicContact CD1-CB 4.38Å; Y203-C241 HydrophobicContact CD2-CB 4.33Å; Y203-C241 HydrophobicContact CE1-CB 3.61Å; Y203-C241 HydrophobicContact CE2-CB 3.51Å; Y203-C241 WeakPolarHBondContact OH-CB 3.44Å; Y203-C241 PolarHBondContact OH-SG 3.47Å; Y203-L245 HydrophobicContact CD2-CD1 3.34Å; Y203-L245 HydrophobicContact CE2-CD1 3.66Å; Y203-L245 HydrophobicContact CG-CD1 4.44Å
204I85.4Confident84.9Confident84 Ų8456.6 Ų56.643%0.43129%0.294SS..Hα-helixtrans-61.3-45.5175.7-67.8166.8000109.7M200 V201 Y207 I208M200-I204 WeakPolarHBondContact O-CG1 3.39Å; M200-I204 PolarHBondContact O-N 2.87Å; V201-I204 PolarHBondContact O-N 3.05Å; I204-Y207 WeakPolarHBondContact O-CB 3.23Å; I204-Y207 PolarHBondContact O-N 3.33Å; I204-I208 HydrophobicContact CG2-CD1 3.79Å; I204-I208 HydrophobicContact CG2-CG1 4.47Å; I204-I208 VanDerWaalsContact O-CG1 3.28Å; I204-I208 WeakPolarHBondContact O-CG1 3.4Å; I204-I208 PolarHBondContact O-N 2.78Å
205L88.8Confident84Confident72 Ų7259.4 Ų59.438%0.37730%0.304SS..Hα-helixtrans-63.1-43.9176.4-68.8175.4000111.8F122 V201 L202 Y203 Y207 I208 M209F122-L205 HydrophobicContact CD2-CB 3.86Å; F122-L205 HydrophobicContact CE2-CB 3.75Å; F122-L205 HydrophobicContact CE2-CD1 4.27Å; V201-L205 HydrophobicContact CG1-CD1 3.91Å; V201-L205 HydrophobicContact CG1-CG 4.26Å; V201-L205 WeakPolarHBondContact O-CB 3.3Å; V201-L205 VanDerWaalsContact O-CG 3.27Å; V201-L205 WeakPolarHBondContact O-CG 3.25Å; V201-L205 PolarHBondContact O-N 2.93Å; L202-L205 PolarHBondContact O-N 3.5Å; Y203-L205 VanDerWaalsContact C-N 3.32Å; Y203-L205 PolarHBondContact O-N 3.33Å; L205-Y207 VanDerWaalsContact C-N 3.3Å; L205-Y207 PolarHBondContact O-N 3.43Å; L205-I208 PolarHBondContact O-N 3.35Å; L205-M209 WeakPolarHBondContact O-CB 3.31Å; L205-M209 WeakPolarHBondContact O-CG 3.46Å; L205-M209 PolarHBondContact O-N 3.49Å
206A85.1Confident83Confident1 Ų168.3 Ų68.31%0.00834%0.335CS..Hα-helixtrans-58.8-42.2175.300000111.5R121 F122 F125 L202 Y203 H210R121-A206 HydrophobicContact CB-CB 4.39Å; F122-A206 HydrophobicContact CB-CB 4.4Å; F125-A206 HydrophobicContact CD2-CB 3.98Å; F125-A206 HydrophobicContact CE2-CB 4.48Å; L202-A206 VanDerWaalsContact O-CB 3.23Å; L202-A206 WeakPolarHBondContact O-CB 3.4Å; L202-A206 PolarHBondContact O-N 2.93Å; Y203-A206 PolarHBondContact O-N 3.45Å; A206-H210 WeakPolarHBondContact O-CB 3.34Å; A206-H210 PolarHBondContact O-N 3.44Å
207Y82.7Confident81.9Confident98 Ų9870.7 Ų70.738%0.38435%0.351SS..Hα-helixtrans-64.6-46.6176.2179.5-93.7000112.5Y203 I204 L205 H210 R211 Y235Y203-Y207 WeakPolarHBondContact O-CB 3.09Å; Y203-Y207 PolarHBondContact O-N 3.13Å; I204-Y207 WeakPolarHBondContact O-CB 3.23Å; I204-Y207 PolarHBondContact O-N 3.33Å; L205-Y207 VanDerWaalsContact C-N 3.3Å; L205-Y207 PolarHBondContact O-N 3.43Å; Y207-H210 WeakPolarHBondContact O-CB 3.48Å; Y207-H210 PolarHBondContact O-N 3.3Å; Y207-R211 HydrophobicContact CD1-CG 4.34Å; Y207-R211 HydrophobicContact CE1-CG 3.9Å; Y207-R211 WeakPolarHBondContact O-CG 3.49Å; Y207-R211 PolarHBondContact O-N 3.25Å; Y207-R211 PolarHBondContact OH-NE 3.16Å; Y207-R211 VanDerWaalsContact OH-NE 3.11Å; Y207-R211 PolarHBondContact OH-NH2 3.42Å; Y207-Y235 HydrophobicContact CE2-CE2 4.23Å
208I85.8Confident80.4Confident81 Ų8175.8 Ų75.842%0.41537%0.373SS..Hα-helixtrans-60.7-48177.1-67.9166.1000110I204 L205 H210 R211 L212I204-I208 HydrophobicContact CG2-CD1 3.79Å; I204-I208 HydrophobicContact CG2-CG1 4.47Å; I204-I208 VanDerWaalsContact O-CG1 3.28Å; I204-I208 WeakPolarHBondContact O-CG1 3.4Å; I204-I208 PolarHBondContact O-N 2.78Å; L205-I208 PolarHBondContact O-N 3.35Å; I208-H210 VanDerWaalsContact C-N 3.29Å; I208-H210 PolarHBondContact O-N 2.88Å; I208-R211 PolarHBondContact O-N 3.08Å; I208-R211 VanDerWaalsContact O-N 3.15Å; I208-L212 HydrophobicContact CG2-CD1 3.97Å; I208-L212 HydrophobicContact CG2-CG 4.37Å; I208-L212 WeakPolarHBondContact O-CG 3.24Å; I208-L212 PolarHBondContact O-N 3.49Å
209M84.1Confident78.7Confident60 Ų6077.5 Ų77.530%0.29638%0.383SS..Hα-helixtrans-60.6-38.7178.5-72.4-64-70.200112.2F125 L205 K213F125-M209 HydrophobicContact CB-CB 4Å; L205-M209 WeakPolarHBondContact O-CB 3.31Å; L205-M209 WeakPolarHBondContact O-CG 3.46Å; L205-M209 PolarHBondContact O-N 3.49Å; M209-K213 WeakPolarHBondContact O-CG 3.44Å; M209-K213 PolarHBondContact O-N 3.09Å; M209-K213 VanDerWaalsContact O-N 3.09Å
210H79.3Confident77Confident36 Ų3684.5 Ų84.517%0.16742%0.418CS..Hα-helixtrans-61.7-48173.5171.4-94.5000111.8F125 A206 Y207 I208 L212 K213 A214F125-H210 HydrophobicContact CD1-CB 4.03Å; F125-H210 HydrophobicContact CD2-CB 4.48Å; F125-H210 HydrophobicContact CE1-CB 3.94Å; F125-H210 AromaticContact CE1-CD2 3.48Å; F125-H210 VanDerWaalsContact CE1-CD2 3.48Å; F125-H210 WeakPolarHBondContact CE1-CD2 3.46Å; F125-H210 HydrophobicContact CE2-CB 4.38Å; F125-H210 HydrophobicContact CG-CB 4.32Å; F125-H210 HydrophobicContact CZ-CB 4.1Å; F125-H210 AromaticContact CZ-CD2 3.87Å; A206-H210 WeakPolarHBondContact O-CB 3.34Å; A206-H210 PolarHBondContact O-N 3.44Å; Y207-H210 WeakPolarHBondContact O-CB 3.48Å; Y207-H210 PolarHBondContact O-N 3.3Å; I208-H210 VanDerWaalsContact C-N 3.29Å; I208-H210 PolarHBondContact O-N 2.88Å; H210-L212 PolarHBondContact O-N 3.24Å; H210-K213 PolarHBondContact O-N 2.95Å; H210-A214 PolarHBondContact O-N 3.42Å
211R80.1Confident75.5Confident120 Ų12088 Ų8845%0.45344%0.437SS..Hα-helixtrans-58.4-47.8177.3-72.8-66.3-169179.34111.9Y207 I208 K213 A214 D215Y207-R211 HydrophobicContact CD1-CG 4.34Å; Y207-R211 HydrophobicContact CE1-CG 3.9Å; Y207-R211 WeakPolarHBondContact O-CG 3.49Å; Y207-R211 PolarHBondContact O-N 3.25Å; Y207-R211 PolarHBondContact OH-NE 3.16Å; Y207-R211 VanDerWaalsContact OH-NE 3.11Å; Y207-R211 PolarHBondContact OH-NH2 3.42Å; I208-R211 PolarHBondContact O-N 3.08Å; I208-R211 VanDerWaalsContact O-N 3.15Å; R211-K213 PolarHBondContact O-N 3.5Å; R211-A214 PolarHBondContact O-N 2.87Å; R211-A214 VanDerWaalsContact O-N 3.17Å; R211-D215 PolarHBondContact O-N 2.64Å; R211-D215 VanDerWaalsContact O-N 3.07Å
212L82.3Confident73.8Confident94 Ų9491.7 Ų91.749%0.49245%0.453SS..Hα-helixtrans-60.8-31.1177.9-67.5173.7000113.3I208 H210 R216I208-L212 HydrophobicContact CG2-CD1 3.97Å; I208-L212 HydrophobicContact CG2-CG 4.37Å; I208-L212 WeakPolarHBondContact O-CG 3.24Å; I208-L212 PolarHBondContact O-N 3.49Å; H210-L212 PolarHBondContact O-N 3.24Å; L212-R216 WeakPolarHBondContact O-CG 3.25Å
213K77.3Confident72.3Confident92 Ų9296.6 Ų96.640%0.448%0.48SS..Hα-helixtrans-78.7-39.1175.6-79.8-173.5168.1-174.70112.7F125 M209 H210 R211 D215 R216 S217F125-K213 WeakPolarHBondContact O-CE 3.3Å; F125-K213 PolarHBondContact O-NZ 3.25Å; M209-K213 WeakPolarHBondContact O-CG 3.44Å; M209-K213 PolarHBondContact O-N 3.09Å; M209-K213 VanDerWaalsContact O-N 3.09Å; H210-K213 PolarHBondContact O-N 2.95Å; R211-K213 PolarHBondContact O-N 3.5Å; K213-D215 VanDerWaalsContact C-N 3.3Å; K213-D215 PolarHBondContact O-N 3.09Å; K213-R216 PolarHBondContact O-N 3.47Å; K213-S217 PolarHBondContact O-N 2.65Å
214A71.7Confident71Confident43 Ų4399.6 Ų99.636%0.35549%0.494SS..Hα-helixtrans-62.1-39.2177.500000111.6H210 R211 R216 S217H210-A214 PolarHBondContact O-N 3.42Å; R211-A214 PolarHBondContact O-N 2.87Å; R211-A214 VanDerWaalsContact O-N 3.17Å; A214-R216 PolarHBondContact O-N 2.94Å; A214-S217 PolarHBondContact O-N 2.8Å; A214-S217 PolarHBondContact O-OG 3.44Å; A214-S217 VanDerWaalsContact O-OG 3.04Å
215D71Confident69.6Low123 Ų123100 Ų10066%0.65850%0.497SS*.THydrogen-bonded Turntrans-70.3-19.9179.4-62.5-18000113R211 K213R211-D215 PolarHBondContact O-N 2.64Å; R211-D215 VanDerWaalsContact O-N 3.07Å; K213-D215 VanDerWaalsContact C-N 3.3Å; K213-D215 PolarHBondContact O-N 3.09Å
216R68.8Low68.3Low218 Ų218105 Ų10582%0.82351%0.511SS*.THydrogen-bonded Turntrans-90.3-14.3179.1-72.7-178.2-179.9-174.10.9113.8L212 K213 A214 E218L212-R216 WeakPolarHBondContact O-CG 3.25Å; K213-R216 PolarHBondContact O-N 3.47Å; A214-R216 PolarHBondContact O-N 2.94Å; R216-E218 VanDerWaalsContact C-N 3.33Å; R216-E218 PolarHBondContact O-N 2.89Å; R216-E218 VanDerWaalsContact O-N 3.1Å
217S60.7Low67.1Low67 Ų67108.7 Ų108.747%0.46953%0.53SS..  trans-87.563.9-173.664.50000112.3K213 A214K213-S217 PolarHBondContact O-N 2.65Å; A214-S217 PolarHBondContact O-N 2.8Å; A214-S217 PolarHBondContact O-OG 3.44Å; A214-S217 VanDerWaalsContact O-OG 3.04Å
218E55.9Low66Low186 Ų186106.4 Ų106.487%0.86953%0.531SS*.  trans-82.8-14.7171.8-76.8-171.8155.300113.1R216R216-E218 VanDerWaalsContact C-N 3.33Å; R216-E218 PolarHBondContact O-N 2.89Å; R216-E218 VanDerWaalsContact O-N 3.1Å
219V55.3Low64.9Low108 Ų108112.1 Ų112.166%0.65555%0.548SS*.SBendtrans-114.390.7-176-1700000111.1N221 Q224V219-N221 PolarHBondContact O-N 3.46Å; V219-N221 VanDerWaalsContact O-N 3.12Å; V219-Q224 VanDerWaalsContact O-CD 3.29Å; V219-Q224 PolarHBondContact O-NE2 3.49Å; V219-Q224 VanDerWaalsContact O-NE2 3.11Å; V219-Q224 PolarHBondContact O-OE1 3.24Å
220M53.4Low63.9Low150 Ų150113.3 Ų113.374%0.73955%0.552SS**  trans-59.5104.6177.2-93.4168.160.400112.1L225M220-L225 HydrophobicContact CE-CD1 4Å
221N54Low63.2Low106 Ų106113.5 Ų113.557%0.56756%0.556SS**  trans-97.4149.7159.3-89.6-26.7000110.2V219 N223 Q224 L225V219-N221 PolarHBondContact O-N 3.46Å; V219-N221 VanDerWaalsContact O-N 3.12Å; N221-N223 PolarHBondContact O-N 2.95Å; N221-N223 VanDerWaalsContact O-N 3.13Å; N221-Q224 HydrophobicContact CB-CG 4.34Å; N221-Q224 WeakPolarHBondContact O-CA 3.35Å; N221-Q224 VanDerWaalsContact O-CB 3.24Å; N221-Q224 WeakPolarHBondContact O-CB 3.29Å; N221-Q224 PolarHBondContact O-N 3.48Å; N221-L225 PolarHBondContact O-N 3.42Å
222L55Low62.5Low149 Ų149110.7 Ų110.778%0.7856%0.555SS**Hα-helixtrans-56-32.2-179.5-75.6168000113.8Q224 L225 R226L222-Q224 VanDerWaalsContact C-N 3.29Å; L222-Q224 PolarHBondContact O-N 2.88Å; L222-L225 HydrophobicContact CD2-CD1 4.28Å; L222-L225 WeakPolarHBondContact O-CB 3.41Å; L222-L225 PolarHBondContact O-N 2.9Å; L222-R226 PolarHBondContact O-N 3.14Å
223N57.6Low61.6Low131 Ų131107.2 Ų107.270%0.70154%0.538SS*.Hα-helixtrans-63.4-36.1172.5-73.6-15.8000112N221 L225 R226 D227N221-N223 PolarHBondContact O-N 2.95Å; N221-N223 VanDerWaalsContact O-N 3.13Å; N223-L225 VanDerWaalsContact C-N 3.34Å; N223-L225 PolarHBondContact O-N 2.87Å; N223-R226 PolarHBondContact O-N 2.86Å; N223-D227 PolarHBondContact O-N 3.38Å
224Q56.5Low61.2Low72 Ų72103.9 Ų103.934%0.33652%0.524SS..Hα-helixtrans-70.3-28.8176.3-62.5175-4.600112.5V219 N221 L222 R226 D227 A228V219-Q224 VanDerWaalsContact O-CD 3.29Å; V219-Q224 PolarHBondContact O-NE2 3.49Å; V219-Q224 VanDerWaalsContact O-NE2 3.11Å; V219-Q224 PolarHBondContact O-OE1 3.24Å; N221-Q224 HydrophobicContact CB-CG 4.34Å; N221-Q224 WeakPolarHBondContact O-CA 3.35Å; N221-Q224 VanDerWaalsContact O-CB 3.24Å; N221-Q224 WeakPolarHBondContact O-CB 3.29Å; N221-Q224 PolarHBondContact O-N 3.48Å; L222-Q224 VanDerWaalsContact C-N 3.29Å; L222-Q224 PolarHBondContact O-N 2.88Å; Q224-R226 VanDerWaalsContact C-N 3.32Å; Q224-D227 CarbonylContact O-C 3.54Å; Q224-D227 PolarHBondContact O-N 3.08Å; Q224-A228 WeakPolarHBondContact O-CA 3.44Å; Q224-A228 WeakPolarHBondContact O-CB 3.24Å; Q224-A228 PolarHBondContact O-N 3.24Å
225L56.4Low61Low93 Ų93106.2 Ų106.249%0.48752%0.524SS..Hα-helixtrans-64.8-38.6174-103.5148.5000111.5M220 N221 L222 N223 A228 R229M220-L225 HydrophobicContact CE-CD1 4Å; N221-L225 PolarHBondContact O-N 3.42Å; L222-L225 HydrophobicContact CD2-CD1 4.28Å; L222-L225 WeakPolarHBondContact O-CB 3.41Å; L222-L225 PolarHBondContact O-N 2.9Å; N223-L225 VanDerWaalsContact C-N 3.34Å; N223-L225 PolarHBondContact O-N 2.87Å; L225-A228 PolarHBondContact O-N 3.49Å; L225-R229 PolarHBondContact O-N 3.48Å; L225-R229 VanDerWaalsContact O-N 3.15Å
226R60.7Low61Low178 Ų178101.1 Ų101.167%0.67250%0.499SS*.Hα-helixtrans-68.7-43.6174-171.8175.3160.3158.8-4110.9L222 N223 Q224 A228 R229 E230L222-R226 PolarHBondContact O-N 3.14Å; N223-R226 PolarHBondContact O-N 2.86Å; Q224-R226 VanDerWaalsContact C-N 3.32Å; R226-A228 VanDerWaalsContact C-N 3.32Å; R226-A228 PolarHBondContact O-N 3.39Å; R226-R229 PolarHBondContact O-N 2.9Å; R226-E230 PolarHBondContact O-N 3.3Å; R226-E230 VanDerWaalsContact O-N 3.13Å
227D60.2Low61Low77 Ų7790.8 Ų90.841%0.41246%0.459SS..Hα-helixtrans-65.1-33.8174.4-67.5-14.8000112N223 Q224 R229 E230 T231N223-D227 PolarHBondContact O-N 3.38Å; Q224-D227 CarbonylContact O-C 3.54Å; Q224-D227 PolarHBondContact O-N 3.08Å; D227-R229 VanDerWaalsContact C-N 3.32Å; D227-R229 PolarHBondContact O-N 3.06Å; D227-E230 PolarHBondContact O-N 2.99Å; D227-T231 WeakPolarHBondContact O-CB 3.23Å; D227-T231 VanDerWaalsContact O-CG2 3.31Å; D227-T231 WeakPolarHBondContact O-CG2 3.48Å; D227-T231 PolarHBondContact O-N 2.99Å; D227-T231 PolarHBondContact O-OG1 3.45Å
228A60.6Low61.5Low50 Ų5088.3 Ų88.341%0.41344%0.442SS..Hα-helixtrans-64.3-38.9176.200000111Q224 L225 R226 T231 S232Q224-A228 WeakPolarHBondContact O-CA 3.44Å; Q224-A228 WeakPolarHBondContact O-CB 3.24Å; Q224-A228 PolarHBondContact O-N 3.24Å; L225-A228 PolarHBondContact O-N 3.49Å; R226-A228 VanDerWaalsContact C-N 3.32Å; R226-A228 PolarHBondContact O-N 3.39Å; A228-T231 VanDerWaalsContact C-OG1 3.29Å; A228-T231 WeakPolarHBondContact CA-OG1 3.28Å; A228-T231 PolarHBondContact O-N 2.69Å; A228-T231 PolarHBondContact O-OG1 3.16Å; A228-S232 PolarHBondContact O-N 3.22Å
229R61.5Low62.3Low202 Ų20282.7 Ų82.776%0.76242%0.417SS*.Hα-helixtrans-68.1-43.8175.6-158176.9-174.6-177.22.8111.2L225 R226 D227 S232 V233L225-R229 PolarHBondContact O-N 3.48Å; L225-R229 VanDerWaalsContact O-N 3.15Å; R226-R229 PolarHBondContact O-N 2.9Å; D227-R229 VanDerWaalsContact C-N 3.32Å; D227-R229 PolarHBondContact O-N 3.06Å; R229-S232 PolarHBondContact O-N 3.33Å; R229-S232 PolarHBondContact O-OG 2.99Å; R229-V233 WeakPolarHBondContact O-CG2 3.41Å; R229-V233 PolarHBondContact O-N 2.91Å
230E63.3Low63.2Low84 Ų8477.5 Ų77.539%0.39339%0.386SS..Hα-helixtrans-62.3-41.5175.1-70.8-176.9-171.800111.5R226 D227 S232 V233 L234R226-E230 PolarHBondContact O-N 3.3Å; R226-E230 VanDerWaalsContact O-N 3.13Å; D227-E230 PolarHBondContact O-N 2.99Å; E230-S232 PolarHBondContact O-N 3.03Å; E230-V233 WeakPolarHBondContact O-CB 3.31Å; E230-V233 PolarHBondContact O-N 2.89Å; E230-L234 VanDerWaalsContact O-CG 3.3Å; E230-L234 WeakPolarHBondContact O-CG 3.16Å; E230-L234 PolarHBondContact O-N 3.2Å
231T65.4Low64Low41 Ų4170.7 Ų70.725%0.25235%0.353SS..Hα-helixtrans-67.4-31.9176.448.80000113.8F125 D227 A228 V233 L234 Y235F125-T231 HydrophobicContact CE1-CG2 3.83Å; D227-T231 WeakPolarHBondContact O-CB 3.23Å; D227-T231 VanDerWaalsContact O-CG2 3.31Å; D227-T231 WeakPolarHBondContact O-CG2 3.48Å; D227-T231 PolarHBondContact O-N 2.99Å; D227-T231 PolarHBondContact O-OG1 3.45Å; A228-T231 VanDerWaalsContact C-OG1 3.29Å; A228-T231 WeakPolarHBondContact CA-OG1 3.28Å; A228-T231 PolarHBondContact O-N 2.69Å; A228-T231 PolarHBondContact O-OG1 3.16Å; T231-V233 VanDerWaalsContact C-N 3.31Å; T231-V233 PolarHBondContact O-N 3.5Å; T231-L234 HydrophobicContact CG2-CD1 4.28Å; T231-L234 WeakPolarHBondContact O-CB 3.45Å; T231-L234 PolarHBondContact O-N 3.35Å; T231-Y235 WeakPolarHBondContact O-CB 3.28Å; T231-Y235 PolarHBondContact O-N 2.93Å
232S64.6Low65Low61 Ų6169.6 Ų69.643%0.42734%0.343SS..Hα-helixtrans-62.4-38.5171.979.50000112.3A228 R229 E230 Y235 S236A228-S232 PolarHBondContact O-N 3.22Å; R229-S232 PolarHBondContact O-N 3.33Å; R229-S232 PolarHBondContact O-OG 2.99Å; E230-S232 PolarHBondContact O-N 3.03Å; S232-Y235 PolarHBondContact O-N 2.68Å; S232-S236 WeakPolarHBondContact O-CB 3.46Å; S232-S236 PolarHBondContact O-N 3.45Å
233V64.6Low66.1Low21 Ų2164.9 Ų64.913%0.12732%0.321CS..Hα-helixtrans-67-43.2174.5-176.40000110R229 E230 T231 Y235 S236 L237 P288R229-V233 WeakPolarHBondContact O-CG2 3.41Å; R229-V233 PolarHBondContact O-N 2.91Å; E230-V233 WeakPolarHBondContact O-CB 3.31Å; E230-V233 PolarHBondContact O-N 2.89Å; T231-V233 VanDerWaalsContact C-N 3.31Å; T231-V233 PolarHBondContact O-N 3.5Å; V233-Y235 VanDerWaalsContact C-N 3.3Å; V233-Y235 PolarHBondContact O-N 2.99Å; V233-S236 PolarHBondContact O-N 3.2Å; V233-S236 PolarHBondContact O-OG 3.45Å; V233-S236 VanDerWaalsContact O-OG 3.07Å; V233-L237 HydrophobicContact CG1-CD1 3.61Å; V233-L237 HydrophobicContact CG1-CG 4.39Å; V233-L237 WeakPolarHBondContact O-CB 3.26Å; V233-L237 WeakPolarHBondContact O-CD1 3.41Å; V233-L237 WeakPolarHBondContact O-CG 3.26Å; V233-L237 PolarHBondContact O-N 3.5Å; V233-P288 HydrophobicContact CB-CG 4.34Å; V233-P288 HydrophobicContact CG1-CG 4.35Å; V233-P288 HydrophobicContact CG2-CG 3.41Å; V233-P288 VanDerWaalsContact CG2-CG 3.41Å
234L67.5Low66.8Low21 Ų2158.8 Ų58.811%0.1129%0.288CS..Hα-helixtrans-60.6-39.1176.5-66.2167.8000112.3A124 F125 E230 T231 S238A124-L234 HydrophobicContact CB-CD1 4.15Å; F125-L234 HydrophobicContact CE1-CB 4.41Å; F125-L234 HydrophobicContact CE1-CD1 4.21Å; F125-L234 HydrophobicContact CE2-CB 4.19Å; F125-L234 HydrophobicContact CZ-CB 3.6Å; F125-L234 HydrophobicContact CZ-CD1 4.11Å; F125-L234 HydrophobicContact CZ-CG 4.43Å; E230-L234 VanDerWaalsContact O-CG 3.3Å; E230-L234 WeakPolarHBondContact O-CG 3.16Å; E230-L234 PolarHBondContact O-N 3.2Å; T231-L234 HydrophobicContact CG2-CD1 4.28Å; T231-L234 WeakPolarHBondContact O-CB 3.45Å; T231-L234 PolarHBondContact O-N 3.35Å; L234-S238 WeakPolarHBondContact O-CB 3.42Å; L234-S238 PolarHBondContact O-N 3.45Å
235Y69Low67.7Low92 Ų9255.6 Ų55.636%0.36127%0.274SS..Hα-helixtrans-67.4-46.6176.9174.3-104.3000112Y207 T231 S232 V233 L237 S238 I239Y207-Y235 HydrophobicContact CE2-CE2 4.23Å; T231-Y235 WeakPolarHBondContact O-CB 3.28Å; T231-Y235 PolarHBondContact O-N 2.93Å; S232-Y235 PolarHBondContact O-N 2.68Å; V233-Y235 VanDerWaalsContact C-N 3.3Å; V233-Y235 PolarHBondContact O-N 2.99Å; Y235-L237 PolarHBondContact O-N 3.04Å; Y235-S238 PolarHBondContact O-N 2.77Å; Y235-S238 VanDerWaalsContact O-N 3.12Å; Y235-S238 PolarHBondContact O-OG 3.47Å; Y235-I239 HydrophobicContact CD1-CD1 4.15Å; Y235-I239 HydrophobicContact CE1-CD1 3.49Å; Y235-I239 VanDerWaalsContact CE1-CD1 3.49Å; Y235-I239 HydrophobicContact CE1-CG1 4.4Å; Y235-I239 HydrophobicContact CE2-CD1 4.28Å; Y235-I239 HydrophobicContact CE2-CG1 4.45Å; Y235-I239 PolarHBondContact O-N 3.08Å; Y235-I239 VanDerWaalsContact O-N 3.13Å
236S69.6Low68.6Low17 Ų1755 Ų5512%0.11927%0.271CS..Hα-helixtrans-61.4-40.3-178.789.10000110.2S232 V233 I239 V240 I286S232-S236 WeakPolarHBondContact O-CB 3.46Å; S232-S236 PolarHBondContact O-N 3.45Å; V233-S236 PolarHBondContact O-N 3.2Å; V233-S236 PolarHBondContact O-OG 3.45Å; V233-S236 VanDerWaalsContact O-OG 3.07Å; S236-I239 PolarHBondContact O-N 2.83Å; S236-V240 WeakPolarHBondContact O-CG2 3.41Å; S236-V240 PolarHBondContact O-N 2.95Å; S236-I286 VanDerWaalsContact OG-CG2 3.26Å; S236-I286 WeakPolarHBondContact OG-CG2 3.44Å; S236-I286 PolarHBondContact OG-O 3.24Å
237L69.6Low69.2Low0 Ų048.3 Ų48.30%025%0.248CC..Hα-helixtrans-72.1-31.2175.2-61.5168.1000113.3D52 V233 Y235 I239 V240 C241 Y283 H287D52-L237 WeakPolarHBondContact OD2-CD1 3.44Å; V233-L237 HydrophobicContact CG1-CD1 3.61Å; V233-L237 HydrophobicContact CG1-CG 4.39Å; V233-L237 WeakPolarHBondContact O-CB 3.26Å; V233-L237 WeakPolarHBondContact O-CD1 3.41Å; V233-L237 WeakPolarHBondContact O-CG 3.26Å; V233-L237 PolarHBondContact O-N 3.5Å; Y235-L237 PolarHBondContact O-N 3.04Å; L237-I239 VanDerWaalsContact C-N 3.35Å; L237-V240 PolarHBondContact O-N 3.27Å; L237-C241 PolarHBondContact O-N 3.39Å; L237-C241 PolarHBondContact O-SG 2.88Å; L237-Y283 HydrophobicContact CD2-CD1 3.31Å; L237-Y283 HydrophobicContact CD2-CE1 3.45Å; L237-Y283 VanDerWaalsContact CD2-CE1 3.45Å; L237-H287 HydrophobicContact CD2-CB 4.25Å
238S69.8Low69.7Low15 Ų1545.3 Ų45.311%0.10523%0.231CC..Hα-helixtrans-67.6-35.5175.973.50000112.2L234 Y235 C241 F242L234-S238 WeakPolarHBondContact O-CB 3.42Å; L234-S238 PolarHBondContact O-N 3.45Å; Y235-S238 PolarHBondContact O-N 2.77Å; Y235-S238 VanDerWaalsContact O-N 3.12Å; Y235-S238 PolarHBondContact O-OG 3.47Å; S238-C241 PolarHBondContact O-N 2.69Å; S238-F242 VanDerWaalsContact O-CB 3.29Å; S238-F242 WeakPolarHBondContact O-CB 3.26Å; S238-F242 PolarHBondContact O-N 3.2Å
239I73.8Confident70.1Confident68 Ų6845.6 Ų45.635%0.34922%0.223SC..Hα-helixtrans-62-47.8171.3-64.1173.7000110.4Y235 S236 L237 C241 F242 V243Y235-I239 HydrophobicContact CD1-CD1 4.15Å; Y235-I239 HydrophobicContact CE1-CD1 3.49Å; Y235-I239 VanDerWaalsContact CE1-CD1 3.49Å; Y235-I239 HydrophobicContact CE1-CG1 4.4Å; Y235-I239 HydrophobicContact CE2-CD1 4.28Å; Y235-I239 HydrophobicContact CE2-CG1 4.45Å; Y235-I239 PolarHBondContact O-N 3.08Å; Y235-I239 VanDerWaalsContact O-N 3.13Å; S236-I239 PolarHBondContact O-N 2.83Å; L237-I239 VanDerWaalsContact C-N 3.35Å; I239-C241 VanDerWaalsContact C-N 3.31Å; I239-C241 PolarHBondContact O-N 2.86Å; I239-F242 PolarHBondContact O-N 2.87Å; I239-V243 HydrophobicContact CG2-CG2 4.26Å; I239-V243 WeakPolarHBondContact O-CG2 3.35Å; I239-V243 PolarHBondContact O-N 2.81Å
240V74Confident70.3Confident0 Ų039.3 Ų39.30%021%0.21CC..Hα-helixtrans-55.3-49.4179177.30000110.9S236 L237 V243 T244 L282 Y283 I286S236-V240 WeakPolarHBondContact O-CG2 3.41Å; S236-V240 PolarHBondContact O-N 2.95Å; L237-V240 PolarHBondContact O-N 3.27Å; V240-V243 PolarHBondContact O-N 3.2Å; V240-T244 WeakPolarHBondContact O-CB 3.38Å; V240-T244 PolarHBondContact O-N 2.87Å; V240-T244 PolarHBondContact O-OG1 3.08Å; V240-L282 HydrophobicContact CB-CB 4.07Å; V240-L282 HydrophobicContact CB-CD1 4.44Å; V240-L282 HydrophobicContact CG1-CB 3.47Å; V240-L282 VanDerWaalsContact CG1-CB 3.47Å; V240-L282 HydrophobicContact CG1-CD1 4.04Å; V240-L282 HydrophobicContact CG1-CG 4.42Å; V240-L282 HydrophobicContact CG2-CB 3.6Å; V240-L282 HydrophobicContact CG2-CD1 4.44Å; V240-Y283 HydrophobicContact CB-CE1 4.46Å; V240-Y283 HydrophobicContact CG1-CD1 4.24Å; V240-Y283 HydrophobicContact CG1-CD2 4.26Å; V240-Y283 HydrophobicContact CG1-CE1 4.1Å; V240-Y283 HydrophobicContact CG1-CE2 4.13Å; V240-Y283 HydrophobicContact CG1-CG 4.31Å; V240-I286 HydrophobicContact CG2-CB 4.2Å; V240-I286 HydrophobicContact CG2-CD1 3.86Å; V240-I286 HydrophobicContact CG2-CG1 4.5Å; V240-I286 HydrophobicContact CG2-CG2 4.29Å
241C70.8Confident70.4Confident6 Ų635.4 Ų35.44%0.04119%0.192CC..Hα-helixtrans-66.9-38.6-179.7-65.80000112.7Y203 L237 S238 I239 T244 L245 Y283Y203-C241 HydrophobicContact CD1-CB 4.38Å; Y203-C241 HydrophobicContact CD2-CB 4.33Å; Y203-C241 HydrophobicContact CE1-CB 3.61Å; Y203-C241 HydrophobicContact CE2-CB 3.51Å; Y203-C241 WeakPolarHBondContact OH-CB 3.44Å; Y203-C241 PolarHBondContact OH-SG 3.47Å; L237-C241 PolarHBondContact O-N 3.39Å; L237-C241 PolarHBondContact O-SG 2.88Å; S238-C241 PolarHBondContact O-N 2.69Å; I239-C241 VanDerWaalsContact C-N 3.31Å; I239-C241 PolarHBondContact O-N 2.86Å; C241-T244 PolarHBondContact O-N 2.79Å; C241-L245 WeakPolarHBondContact O-CB 3.14Å; C241-L245 WeakPolarHBondContact O-CG 3.12Å; C241-L245 PolarHBondContact O-N 3.12Å; C241-Y283 PolarHBondContact SG-OH 3.3Å
242F74.6Confident70.3Confident84 Ų8435.6 Ų35.637%0.36819%0.191SC..Hα-helixtrans-62.8-45.9176.7-176.3-103.6000111.4M200 S238 I239 T244 L245 L246M200-F242 HydrophobicContact CE-CD2 4.23Å; M200-F242 HydrophobicContact CE-CE2 3.71Å; M200-F242 HydrophobicContact CE-CZ 4.46Å; M200-F242 HydrophobicContact SD-CD2 4.11Å; M200-F242 HydrophobicContact SD-CE2 4.18Å; S238-F242 VanDerWaalsContact O-CB 3.29Å; S238-F242 WeakPolarHBondContact O-CB 3.26Å; S238-F242 PolarHBondContact O-N 3.2Å; I239-F242 PolarHBondContact O-N 2.87Å; F242-T244 VanDerWaalsContact C-N 3.32Å; F242-T244 PolarHBondContact O-N 2.6Å; F242-L245 PolarHBondContact O-N 3.3Å; F242-L246 HydrophobicContact CD1-CD1 3.89Å; F242-L246 HydrophobicContact CD1-CG 4.4Å; F242-L246 HydrophobicContact CE1-CD1 3.42Å; F242-L246 VanDerWaalsContact CE1-CD1 3.42Å; F242-L246 HydrophobicContact CE1-CG 4.08Å; F242-L246 HydrophobicContact CZ-CD1 3.93Å; F242-L246 HydrophobicContact CZ-CD2 4.35Å; F242-L246 HydrophobicContact CZ-CG 4.23Å; F242-L246 WeakPolarHBondContact O-CG 3.37Å; F242-L246 PolarHBondContact O-N 3.22Å
243V78Confident70.2Confident50 Ų5037.4 Ų37.430%0.30320%0.196SC..Hα-helixtrans-60.6-44.3174.7172.80000110.6I239 V240 L245 L246 L247 V278 L282I239-V243 HydrophobicContact CG2-CG2 4.26Å; I239-V243 WeakPolarHBondContact O-CG2 3.35Å; I239-V243 PolarHBondContact O-N 2.81Å; V240-V243 PolarHBondContact O-N 3.2Å; V243-L245 VanDerWaalsContact C-N 3.33Å; V243-L245 PolarHBondContact O-N 3.11Å; V243-L246 PolarHBondContact O-N 3.39Å; V243-L247 HydrophobicContact CG1-CD1 4.15Å; V243-L247 WeakPolarHBondContact O-CG 3.21Å; V243-L247 PolarHBondContact O-N 2.85Å; V243-V278 HydrophobicContact CG1-CG1 4.39Å; V243-L282 HydrophobicContact CB-CD1 4.31Å; V243-L282 HydrophobicContact CG1-CD1 4.11Å
244T73.4Confident70.2Confident3 Ų337.7 Ų37.72%0.01820%0.2CC..Hα-helixtrans-61.8-41178.7-56.40000111.7M114 V240 C241 F242 L247 K248 Y275 A279M114-T244 HydrophobicContact CE-CG2 3.43Å; M114-T244 VanDerWaalsContact CE-CG2 3.43Å; V240-T244 WeakPolarHBondContact O-CB 3.38Å; V240-T244 PolarHBondContact O-N 2.87Å; V240-T244 PolarHBondContact O-OG1 3.08Å; C241-T244 PolarHBondContact O-N 2.79Å; F242-T244 VanDerWaalsContact C-N 3.32Å; F242-T244 PolarHBondContact O-N 2.6Å; T244-L247 PolarHBondContact O-N 3.27Å; T244-K248 WeakPolarHBondContact O-CB 3.49Å; T244-K248 PolarHBondContact O-N 2.78Å; T244-Y275 HydrophobicContact CG2-CD2 4.03Å; T244-Y275 HydrophobicContact CG2-CG 4.33Å; T244-A279 HydrophobicContact CG2-CB 3.69Å; T244-A279 WeakPolarHBondContact OG1-CB 3.37Å
245L73.4Confident70Confident5 Ų541.6 Ų41.63%0.02621%0.214CC..Hα-helixtrans-68-40.8176.2-77.4162.3000112.3T199 M200 Y203 C241 F242 V243 L247 K248 F249T199-L245 HydrophobicContact CG2-CD1 3.69Å; T199-L245 HydrophobicContact CG2-CD2 3.9Å; T199-L245 HydrophobicContact CG2-CG 4.34Å; M200-L245 HydrophobicContact CG-CB 4.08Å; M200-L245 HydrophobicContact CG-CD1 4.01Å; M200-L245 HydrophobicContact CG-CD2 4.33Å; M200-L245 HydrophobicContact CG-CG 4.38Å; M200-L245 HydrophobicContact SD-CB 3.4Å; M200-L245 WeakPolarHBondContact SD-CB 3.45Å; M200-L245 HydrophobicContact SD-CD1 3.63Å; M200-L245 HydrophobicContact SD-CG 4.06Å; Y203-L245 HydrophobicContact CD2-CD1 3.34Å; Y203-L245 HydrophobicContact CE2-CD1 3.66Å; Y203-L245 HydrophobicContact CG-CD1 4.44Å; C241-L245 WeakPolarHBondContact O-CB 3.14Å; C241-L245 WeakPolarHBondContact O-CG 3.12Å; C241-L245 PolarHBondContact O-N 3.12Å; F242-L245 PolarHBondContact O-N 3.3Å; V243-L245 VanDerWaalsContact C-N 3.33Å; V243-L245 PolarHBondContact O-N 3.11Å; L245-L247 VanDerWaalsContact C-N 3.29Å; L245-L247 PolarHBondContact O-N 3.48Å; L245-K248 PolarHBondContact O-N 3.1Å; L245-F249 WeakPolarHBondContact O-CB 3.41Å; L245-F249 PolarHBondContact O-N 2.9Å
246L75.4Confident69.9Low81 Ų8142.4 Ų42.442%0.42423%0.229SC..Hα-helixtrans-60.6-41.9174.4-73179.4000111.2M200 F242 V243 K248 F249 S250M200-L246 HydrophobicContact CE-CD2 3.96Å; F242-L246 HydrophobicContact CD1-CD1 3.89Å; F242-L246 HydrophobicContact CD1-CG 4.4Å; F242-L246 HydrophobicContact CE1-CD1 3.42Å; F242-L246 VanDerWaalsContact CE1-CD1 3.42Å; F242-L246 HydrophobicContact CE1-CG 4.08Å; F242-L246 HydrophobicContact CZ-CD1 3.93Å; F242-L246 HydrophobicContact CZ-CD2 4.35Å; F242-L246 HydrophobicContact CZ-CG 4.23Å; F242-L246 WeakPolarHBondContact O-CG 3.37Å; F242-L246 PolarHBondContact O-N 3.22Å; V243-L246 PolarHBondContact O-N 3.39Å; L246-K248 VanDerWaalsContact C-N 3.34Å; L246-K248 PolarHBondContact O-N 3.45Å; L246-F249 PolarHBondContact O-N 2.92Å; L246-S250 WeakPolarHBondContact O-CB 3.39Å; L246-S250 PolarHBondContact O-N 3.38Å
247L74Confident69.6Low36 Ų3648.4 Ų48.419%0.18826%0.259CS..Hα-helixtrans-65.2-34.3176.2-71172.7000112.8V243 T244 L245 P251 V271 V278V243-L247 HydrophobicContact CG1-CD1 4.15Å; V243-L247 WeakPolarHBondContact O-CG 3.21Å; V243-L247 PolarHBondContact O-N 2.85Å; T244-L247 PolarHBondContact O-N 3.27Å; L245-L247 VanDerWaalsContact C-N 3.29Å; L245-L247 PolarHBondContact O-N 3.48Å; L247-P251 WeakPolarHBondContact O-CD 3.2Å; L247-P251 VanDerWaalsContact O-CG 3.22Å; L247-P251 WeakPolarHBondContact O-CG 3.3Å; L247-V271 HydrophobicContact CD2-CG1 4.14Å; L247-V278 HydrophobicContact CD1-CB 4Å; L247-V278 HydrophobicContact CD1-CG1 3.85Å; L247-V278 HydrophobicContact CD1-CG2 4.27Å
248K71.4Confident69.2Low15 Ų1549.1 Ų49.17%0.06527%0.265CS..Hα-helixtrans-82.1-29177.4-171162.2-174.8142.80113.8N107 M114 T244 L245 L246 N252 Y275N107-K248 PolarHBondContact OD1-NZ 3.18Å; N107-K248 VanDerWaalsContact OD1-NZ 3.1Å; M114-K248 HydrophobicContact CE-CD 4.45Å; M114-K248 HydrophobicContact SD-CD 4.28Å; T244-K248 WeakPolarHBondContact O-CB 3.49Å; T244-K248 PolarHBondContact O-N 2.78Å; L245-K248 PolarHBondContact O-N 3.1Å; L246-K248 VanDerWaalsContact C-N 3.34Å; L246-K248 PolarHBondContact O-N 3.45Å; K248-N252 PolarHBondContact O-ND2 3.28Å; K248-Y275 HydrophobicContact CB-CD1 4.08Å; K248-Y275 HydrophobicContact CB-CE1 4.39Å; K248-Y275 HydrophobicContact CD-CD1 4.4Å; K248-Y275 HydrophobicContact CD-CE1 3.94Å; K248-Y275 HydrophobicContact CG-CD1 4.34Å; K248-Y275 HydrophobicContact CG-CE1 4.14Å; K248-Y275 PolarHBondContact NZ-OH 2.9Å; K248-Y275 VanDerWaalsContact NZ-OH 3.11Å
249F68.3Low68.9Low55 Ų5558.8 Ų58.824%0.24130%0.299CS..Hα-helixtrans-91-41.7-175.1-167.1-94.6000113.2V193 A196 I197 L245 L246 P251 N252 L253V193-F249 HydrophobicContact CG1-CE2 4.42Å; A196-F249 HydrophobicContact CB-CD2 4.24Å; I197-F249 HydrophobicContact CG1-CE2 3.98Å; I197-F249 HydrophobicContact CG1-CZ 4.43Å; L245-F249 WeakPolarHBondContact O-CB 3.41Å; L245-F249 PolarHBondContact O-N 2.9Å; L246-F249 PolarHBondContact O-N 2.92Å; F249-P251 VanDerWaalsContact C-CD 3.46Å; F249-P251 VanDerWaalsContact C-N 3.28Å; F249-N252 PolarHBondContact O-N 3.27Å; F249-N252 VanDerWaalsContact O-N 3.1Å; F249-L253 HydrophobicContact CD1-CB 4.48Å; F249-L253 HydrophobicContact CE1-CB 4.18Å; F249-L253 HydrophobicContact CE1-CD1 4.19Å; F249-L253 HydrophobicContact CE1-CD2 4.2Å; F249-L253 HydrophobicContact CE1-CG 4.44Å; F249-L253 HydrophobicContact CZ-CD1 4.36Å; F249-L253 PolarHBondContact O-N 3.03Å
250S66.5Low68.4Low71 Ų7160.9 Ų60.950%0.49732%0.32SS..Hα-helixtrans-45-48.3175.3176.60000112.6L246 A254L246-S250 WeakPolarHBondContact O-CB 3.39Å; L246-S250 PolarHBondContact O-N 3.38Å; S250-A254 WeakPolarHBondContact O-CB 3.31Å; S250-A254 PolarHBondContact O-N 3.45Å
251P63.9Low68.2Low2 Ų266.6 Ų66.61%0.01335%0.348CS..Hα-helixtrans-74.2-34.2179.826.4-34.7000114.7L247 F249 L253 A254 Y255 I268 D272L247-P251 WeakPolarHBondContact O-CD 3.2Å; L247-P251 VanDerWaalsContact O-CG 3.22Å; L247-P251 WeakPolarHBondContact O-CG 3.3Å; F249-P251 VanDerWaalsContact C-CD 3.46Å; F249-P251 VanDerWaalsContact C-N 3.28Å; P251-L253 VanDerWaalsContact C-N 3.33Å; P251-L253 PolarHBondContact O-N 3.35Å; P251-A254 PolarHBondContact O-N 3.47Å; P251-Y255 VanDerWaalsContact O-CB 3.3Å; P251-Y255 WeakPolarHBondContact O-CB 3.45Å; P251-Y255 PolarHBondContact O-N 3.39Å; P251-I268 HydrophobicContact CB-CB 4.34Å; P251-I268 HydrophobicContact CB-CG2 3.41Å; P251-I268 VanDerWaalsContact CB-CG2 3.41Å; P251-I268 WeakPolarHBondContact CB-O 3.23Å; P251-I268 WeakPolarHBondContact O-CG2 3.37Å; P251-D272 HydrophobicContact CB-CB 3.68Å; P251-D272 HydrophobicContact CG-CB 3.42Å; P251-D272 VanDerWaalsContact CG-CB 3.42Å; P251-D272 WeakPolarHBondContact CG-OD1 3.49Å
252N63.9Low68Low44 Ų4470.9 Ų70.924%0.23538%0.375CS..Hα-helixtrans-63.9-41.1176.4-84.6-58.8000111.4K248 F249K248-N252 PolarHBondContact O-ND2 3.28Å; F249-N252 PolarHBondContact O-N 3.27Å; F249-N252 VanDerWaalsContact O-N 3.1Å
253L63.3Low67.8Low99 Ų9968.2 Ų68.252%0.51837%0.372SS..Hα-helixtrans-68.9-43.8174.5-160.172.8000111.1F249 P251 Y255 V256 L257F249-L253 HydrophobicContact CD1-CB 4.48Å; F249-L253 HydrophobicContact CE1-CB 4.18Å; F249-L253 HydrophobicContact CE1-CD1 4.19Å; F249-L253 HydrophobicContact CE1-CD2 4.2Å; F249-L253 HydrophobicContact CE1-CG 4.44Å; F249-L253 HydrophobicContact CZ-CD1 4.36Å; F249-L253 PolarHBondContact O-N 3.03Å; P251-L253 VanDerWaalsContact C-N 3.33Å; P251-L253 PolarHBondContact O-N 3.35Å; L253-Y255 VanDerWaalsContact C-N 3.34Å; L253-Y255 PolarHBondContact O-N 2.94Å; L253-V256 PolarHBondContact O-N 3.13Å; L253-L257 PolarHBondContact O-N 3.24Å
254A63.1Low67.7Low27 Ų2768.6 Ų68.622%0.22337%0.374CS..Hα-helixtrans-66.6-33.2-179.800000112.7S250 P251 V256 L257 A258 I268S250-A254 WeakPolarHBondContact O-CB 3.31Å; S250-A254 PolarHBondContact O-N 3.45Å; P251-A254 PolarHBondContact O-N 3.47Å; A254-V256 VanDerWaalsContact C-N 3.27Å; A254-V256 PolarHBondContact O-N 2.91Å; A254-L257 CarbonylContact O-C 3.58Å; A254-L257 PolarHBondContact O-N 3.34Å; A254-L257 VanDerWaalsContact O-N 3.08Å; A254-A258 WeakPolarHBondContact O-CB 3.34Å; A254-A258 PolarHBondContact O-N 2.96Å; A254-I268 HydrophobicContact CB-CD1 3.47Å; A254-I268 VanDerWaalsContact CB-CD1 3.47Å; A254-I268 HydrophobicContact CB-CG1 3.84Å
255Y64.8Low67.8Low103 Ų10369.7 Ų69.740%0.40438%0.381SS..Hα-helixtrans-63.1-34.4178.3-173.1-98000112.2P251 L253 L257 V265P251-Y255 VanDerWaalsContact O-CB 3.3Å; P251-Y255 WeakPolarHBondContact O-CB 3.45Å; P251-Y255 PolarHBondContact O-N 3.39Å; L253-Y255 VanDerWaalsContact C-N 3.34Å; L253-Y255 PolarHBondContact O-N 2.94Å; Y255-L257 VanDerWaalsContact C-N 3.31Å; Y255-V265 HydrophobicContact CD2-CG1 4.31Å; Y255-V265 HydrophobicContact CE2-CG1 3.96Å
256V65.5Low67.9Low110 Ų11070.5 Ų70.567%0.66739%0.387SS*.Hα-helixtrans-66.8-36.3174.9178.60000110.9L253 A254L253-V256 PolarHBondContact O-N 3.13Å; A254-V256 VanDerWaalsContact C-N 3.27Å; A254-V256 PolarHBondContact O-N 2.91Å
257L63.7Low68Low142 Ų14269.1 Ų69.174%0.74339%0.387SS*.Hα-helixtrans-84-32.5-178.3-63172.3000113.4L253 A254 Y255 R259L253-L257 PolarHBondContact O-N 3.24Å; A254-L257 CarbonylContact O-C 3.58Å; A254-L257 PolarHBondContact O-N 3.34Å; A254-L257 VanDerWaalsContact O-N 3.08Å; Y255-L257 VanDerWaalsContact C-N 3.31Å; L257-R259 PolarHBondContact O-N 3.39Å
258A62.6Low68.3Low16 Ų1668.2 Ų68.213%0.13238%0.382CS..  trans-95.516.6-165.300000115.2A254 S260 M261 V264 I268A254-A258 WeakPolarHBondContact O-CB 3.34Å; A254-A258 PolarHBondContact O-N 2.96Å; A258-S260 PolarHBondContact O-N 3.41Å; A258-M261 PolarHBondContact O-N 2.85Å; A258-V264 HydrophobicContact CB-CB 4.25Å; A258-V264 HydrophobicContact CB-CG1 3.59Å; A258-I268 HydrophobicContact CB-CD1 3.62Å
259R62.6Low68.7Low217 Ų21770.6 Ų70.682%0.81939%0.391SS*.THydrogen-bonded Turntrans-48.5-24.8-177.9-93.1-175.3-180178.71.2114.4L257L257-R259 PolarHBondContact O-N 3.39Å
260S63.7Low69.4Low112 Ų11269.4 Ų69.478%0.78339%0.388SS*.THydrogen-bonded Turntrans-88-13.4-171.6-46.80000115.9A258A258-S260 PolarHBondContact O-N 3.41Å
261M68.6Low70.2Confident120 Ų12068.8 Ų68.859%0.59138%0.381SS*.  trans-129.5111.8-173.3-70.7-168.3-107.700113.4A258 G263 V264 V265A258-M261 PolarHBondContact O-N 2.85Å; M261-G263 VanDerWaalsContact C-N 3.33Å; M261-G263 PolarHBondContact O-N 2.95Å; M261-V264 HydrophobicContact CB-CB 4.07Å; M261-V264 HydrophobicContact CB-CG2 3.67Å; M261-V264 PolarHBondContact O-N 2.97Å; M261-V264 VanDerWaalsContact O-N 3.13Å; M261-V264 HydrophobicContact SD-CG2 4.22Å; M261-V265 PolarHBondContact O-N 3.24Å; M261-V265 VanDerWaalsContact O-N 3.16Å
262P67.8Low71.1Confident96 Ų9670.5 Ų70.562%0.62339%0.39SS*.Hα-helixtrans-65.6-32.3-174.424.9-33.7000113.5V264 V265 S266P262-V264 VanDerWaalsContact C-N 3.33Å; P262-V265 PolarHBondContact O-N 3.04Å; P262-S266 PolarHBondContact O-N 3.3Å; P262-S266 VanDerWaalsContact O-N 3.09Å
263G70.6Confident72.2Confident29 Ų2969 Ų6930%0.29938%0.382SS..Hα-helixtrans-63.9-38.5175.200000112.5M261 S266 A267M261-G263 VanDerWaalsContact C-N 3.33Å; M261-G263 PolarHBondContact O-N 2.95Å; G263-S266 PolarHBondContact O-N 3.4Å; G263-A267 PolarHBondContact O-N 2.96Å; G263-A267 VanDerWaalsContact O-N 3.08Å
264V75.8Confident73.4Confident58 Ų5867.7 Ų67.735%0.35238%0.375SS..Hα-helixtrans-68.9-42.6178-177.10000110.2A258 M261 P262 S266 A267 I268A258-V264 HydrophobicContact CB-CB 4.25Å; A258-V264 HydrophobicContact CB-CG1 3.59Å; M261-V264 HydrophobicContact CB-CB 4.07Å; M261-V264 HydrophobicContact CB-CG2 3.67Å; M261-V264 PolarHBondContact O-N 2.97Å; M261-V264 VanDerWaalsContact O-N 3.13Å; M261-V264 HydrophobicContact SD-CG2 4.22Å; P262-V264 VanDerWaalsContact C-N 3.33Å; V264-S266 VanDerWaalsContact C-N 3.3Å; V264-S266 PolarHBondContact O-N 2.84Å; V264-A267 PolarHBondContact O-N 3.43Å; V264-I268 HydrophobicContact CG1-CD1 3.72Å; V264-I268 HydrophobicContact CG1-CG1 4.23Å; V264-I268 WeakPolarHBondContact O-CB 3.45Å; V264-I268 WeakPolarHBondContact O-CG1 3.2Å; V264-I268 PolarHBondContact O-N 3.17Å
265V74Confident74.5Confident25 Ų2566.8 Ų66.815%0.15237%0.366CS..Hα-helixtrans-59.8-40175.61770000111.8Y255 M261 P262 R269Y255-V265 HydrophobicContact CD2-CG1 4.31Å; Y255-V265 HydrophobicContact CE2-CG1 3.96Å; M261-V265 PolarHBondContact O-N 3.24Å; M261-V265 VanDerWaalsContact O-N 3.16Å; P262-V265 PolarHBondContact O-N 3.04Å; V265-R269 WeakPolarHBondContact O-CG 3.42Å; V265-R269 PolarHBondContact O-N 2.87Å; V265-R269 VanDerWaalsContact O-N 3.08Å
266S75.6Confident75.6Confident22 Ų2262 Ų6215%0.15435%0.347CS..Hα-helixtrans-61.8-50.8174.3176.80000111.7T21 P262 G263 V264 I268 R269 T270T21-S266 WeakPolarHBondContact CG2-OG 3.48Å; T21-S266 PolarHBondContact OG1-OG 2.94Å; P262-S266 PolarHBondContact O-N 3.3Å; P262-S266 VanDerWaalsContact O-N 3.09Å; G263-S266 PolarHBondContact O-N 3.4Å; V264-S266 VanDerWaalsContact C-N 3.3Å; V264-S266 PolarHBondContact O-N 2.84Å; S266-I268 VanDerWaalsContact C-N 3.33Å; S266-I268 PolarHBondContact O-N 3.44Å; S266-R269 PolarHBondContact O-N 3.28Å; S266-T270 PolarHBondContact O-N 3.2Å; S266-T270 PolarHBondContact O-OG1 3.42Å
267A78.5Confident76.8Confident52 Ų5257.6 Ų57.643%0.4332%0.321SS..Hα-helixtrans-61-43.2-179.400000111.6G263 V264 R269 T270 V271G263-A267 PolarHBondContact O-N 2.96Å; G263-A267 VanDerWaalsContact O-N 3.08Å; V264-A267 PolarHBondContact O-N 3.43Å; A267-R269 VanDerWaalsContact C-N 3.32Å; A267-R269 PolarHBondContact O-N 3.17Å; A267-T270 PolarHBondContact O-N 3.3Å; A267-V271 WeakPolarHBondContact O-CG2 3.37Å; A267-V271 PolarHBondContact O-N 3.27Å
268I80.5Confident78Confident17 Ų1752.5 Ų52.59%0.08730%0.296CS..Hα-helixtrans-53.4-49.5173.9-76.4170.6000110.6P251 A254 A258 V264 S266 T270 V271 D272P251-I268 HydrophobicContact CB-CB 4.34Å; P251-I268 HydrophobicContact CB-CG2 3.41Å; P251-I268 VanDerWaalsContact CB-CG2 3.41Å; P251-I268 WeakPolarHBondContact CB-O 3.23Å; P251-I268 WeakPolarHBondContact O-CG2 3.37Å; A254-I268 HydrophobicContact CB-CD1 3.47Å; A254-I268 VanDerWaalsContact CB-CD1 3.47Å; A254-I268 HydrophobicContact CB-CG1 3.84Å; A258-I268 HydrophobicContact CB-CD1 3.62Å; V264-I268 HydrophobicContact CG1-CD1 3.72Å; V264-I268 HydrophobicContact CG1-CG1 4.23Å; V264-I268 WeakPolarHBondContact O-CB 3.45Å; V264-I268 WeakPolarHBondContact O-CG1 3.2Å; V264-I268 PolarHBondContact O-N 3.17Å; S266-I268 VanDerWaalsContact C-N 3.33Å; S266-I268 PolarHBondContact O-N 3.44Å; I268-T270 PolarHBondContact O-N 3.14Å; I268-V271 PolarHBondContact O-N 3.05Å; I268-D272 WeakPolarHBondContact O-CB 3.03Å; I268-D272 PolarHBondContact O-N 3.2Å
269R79.4Confident79.1Confident66 Ų6651.8 Ų51.825%0.24929%0.29CS..Hα-helixtrans-64.9-40.4179-74.1176.7-180-179-4112.6E17 V265 S266 A267 V271 D272 N273E17-R269 IonicContact OE1-CZ 3.63Å; E17-R269 IonicContact OE1-NH1 3.45Å; E17-R269 PolarHBondContact OE1-NH1 3.28Å; E17-R269 IonicContact OE1-NH2 2.8Å; V265-R269 WeakPolarHBondContact O-CG 3.42Å; V265-R269 PolarHBondContact O-N 2.87Å; V265-R269 VanDerWaalsContact O-N 3.08Å; S266-R269 PolarHBondContact O-N 3.28Å; A267-R269 VanDerWaalsContact C-N 3.32Å; A267-R269 PolarHBondContact O-N 3.17Å; R269-V271 VanDerWaalsContact C-N 3.34Å; R269-D272 PolarHBondContact O-N 2.97Å; R269-N273 PolarHBondContact O-N 3.29Å; R269-N273 VanDerWaalsContact O-N 3.14Å; R269-N273 PolarHBondContact O-ND2 2.96Å
270T83.1Confident80.3Confident30 Ų3041.4 Ų41.418%0.18425%0.251CS..Hα-helixtrans-61.3-45.8176.5-60.30000110.9I24 I28 S266 A267 I268 N273 L274I24-T270 HydrophobicContact CG2-CG2 3.59Å; I28-T270 HydrophobicContact CD1-CG2 3.85Å; S266-T270 PolarHBondContact O-N 3.2Å; S266-T270 PolarHBondContact O-OG1 3.42Å; A267-T270 PolarHBondContact O-N 3.3Å; I268-T270 PolarHBondContact O-N 3.14Å; T270-N273 PolarHBondContact O-N 2.83Å; T270-L274 PolarHBondContact O-N 3.37Å
271V83.5Confident81.4Confident57 Ų5739.3 Ų39.335%0.34523%0.23SC..Hα-helixtrans-63.9-41176.9173.70000111.3L247 A267 I268 R269 N273 L274L247-V271 HydrophobicContact CD2-CG1 4.14Å; A267-V271 WeakPolarHBondContact O-CG2 3.37Å; A267-V271 PolarHBondContact O-N 3.27Å; I268-V271 PolarHBondContact O-N 3.05Å; R269-V271 VanDerWaalsContact C-N 3.34Å; V271-N273 PolarHBondContact O-N 2Å; V271-L274 WeakPolarHBondContact O-CB 3.01Å; V271-L274 PolarHBondContact O-N 2.92Å; V271-L274 VanDerWaalsContact O-N 3.13Å
272D82.1Confident82.3Confident39 Ų3935.4 Ų35.421%0.20921%0.212CC..Hα-helixtrans-61.9-24.9177-166.743.1000113.5P251 I268 R269 Y275P251-D272 HydrophobicContact CB-CB 3.68Å; P251-D272 HydrophobicContact CG-CB 3.42Å; P251-D272 VanDerWaalsContact CG-CB 3.42Å; P251-D272 WeakPolarHBondContact CG-OD1 3.49Å; I268-D272 WeakPolarHBondContact O-CB 3.03Å; I268-D272 PolarHBondContact O-N 3.2Å; R269-D272 PolarHBondContact O-N 2.97Å; D272-Y275 WeakPolarHBondContact O-CD1 2.9Å; D272-Y275 WeakPolarHBondContact O-CE1 3.39Å
273N87.6Confident83.1Confident12 Ų1231 Ų316%0.06418%0.182CC..Hα-helixtrans-100.9-10.4178.1-68.9-83.1000112.2L25 I28 L70 R269 T270 V271 Y275 L276L25-N273 HydrophobicContact CD2-CB 3.67Å; L25-N273 WeakPolarHBondContact CD2-ND2 3.32Å; I28-N273 HydrophobicContact CG2-CB 4.38Å; I28-N273 WeakPolarHBondContact CG2-O 3.48Å; L70-N273 HydrophobicContact CD2-CB 4.13Å; L70-N273 WeakPolarHBondContact CD2-OD1 3.14Å; R269-N273 PolarHBondContact O-N 3.29Å; R269-N273 VanDerWaalsContact O-N 3.14Å; R269-N273 PolarHBondContact O-ND2 2.96Å; T270-N273 PolarHBondContact O-N 2.83Å; V271-N273 PolarHBondContact O-N 2Å; N273-Y275 PolarHBondContact O-N 3.46Å; N273-L276 HydrophobicContact CB-CD1 4.09Å; N273-L276 VanDerWaalsContact O-CB 3.31Å; N273-L276 WeakPolarHBondContact O-CB 3.31Å; N273-L276 VanDerWaalsContact O-CG 3.25Å; N273-L276 WeakPolarHBondContact O-CG 3.23Å; N273-L276 PolarHBondContact O-N 3.04Å; N273-L276 VanDerWaalsContact O-N 3.16Å
274L88Confident83.7Confident71 Ų7130.1 Ų30.137%0.37217%0.172SC..Hα-helixtrans-65.3-26.4178.1-16368000111.9I28 T270 V271 L276 V277 V278I28-L274 HydrophobicContact CD1-CD1 4.24Å; I28-L274 HydrophobicContact CG1-CD1 4.48Å; T270-L274 PolarHBondContact O-N 3.37Å; V271-L274 WeakPolarHBondContact O-CB 3.01Å; V271-L274 PolarHBondContact O-N 2.92Å; V271-L274 VanDerWaalsContact O-N 3.13Å; L274-L276 PolarHBondContact O-N 3.44Å; L274-V277 PolarHBondContact O-N 3.13Å; L274-V277 VanDerWaalsContact O-N 3.11Å; L274-V278 HydrophobicContact CD2-CG2 4.39Å; L274-V278 HydrophobicContact CG-CG2 3.95Å; L274-V278 WeakPolarHBondContact O-CG2 3.38Å; L274-V278 PolarHBondContact O-N 3.2Å
275Y86.4Confident84Confident8 Ų832.3 Ų32.33%0.03118%0.18CC..Hα-helixtrans-60.6-29.6176.587.2-107.7000112.4L110 M114 T244 K248 D272 N273 V277 V278 A279L110-Y275 HydrophobicContact CD1-CE2 3.82Å; L110-Y275 HydrophobicContact CD2-CE2 3.72Å; L110-Y275 WeakPolarHBondContact CD2-OH 3.24Å; L110-Y275 HydrophobicContact CG-CE2 4.39Å; M114-Y275 HydrophobicContact CE-CD2 4.03Å; M114-Y275 HydrophobicContact CE-CE2 3.95Å; T244-Y275 HydrophobicContact CG2-CD2 4.03Å; T244-Y275 HydrophobicContact CG2-CG 4.33Å; K248-Y275 HydrophobicContact CB-CD1 4.08Å; K248-Y275 HydrophobicContact CB-CE1 4.39Å; K248-Y275 HydrophobicContact CD-CD1 4.4Å; K248-Y275 HydrophobicContact CD-CE1 3.94Å; K248-Y275 HydrophobicContact CG-CD1 4.34Å; K248-Y275 HydrophobicContact CG-CE1 4.14Å; K248-Y275 PolarHBondContact NZ-OH 2.9Å; K248-Y275 VanDerWaalsContact NZ-OH 3.11Å; D272-Y275 WeakPolarHBondContact O-CD1 2.9Å; D272-Y275 WeakPolarHBondContact O-CE1 3.39Å; N273-Y275 PolarHBondContact O-N 3.46Å; Y275-V277 PolarHBondContact O-N 3.33Å; Y275-V278 PolarHBondContact O-N 2.9Å; Y275-A279 VanDerWaalsContact O-CB 3.23Å; Y275-A279 WeakPolarHBondContact O-CB 3.39Å; Y275-A279 PolarHBondContact O-N 3.13Å
276L88Confident84.1Confident2 Ų233.6 Ų33.61%0.0119%0.186CC..Hα-helixtrans-59.7-26.8177.9-55171.2000111.6A32 D63 A66 L70 L110 N273 L274 P280A32-L276 HydrophobicContact CB-CB 3.89Å; A32-L276 WeakPolarHBondContact CB-O 3.46Å; D63-L276 WeakPolarHBondContact OD1-CD2 3.44Å; D63-L276 VanDerWaalsContact OD2-O 3.05Å; A66-L276 HydrophobicContact CB-CD2 4.35Å; L70-L276 HydrophobicContact CD2-CD1 3.84Å; L110-L276 HydrophobicContact CD1-CD2 4.4Å; N273-L276 HydrophobicContact CB-CD1 4.09Å; N273-L276 VanDerWaalsContact O-CB 3.31Å; N273-L276 WeakPolarHBondContact O-CB 3.31Å; N273-L276 VanDerWaalsContact O-CG 3.25Å; N273-L276 WeakPolarHBondContact O-CG 3.23Å; N273-L276 PolarHBondContact O-N 3.04Å; N273-L276 VanDerWaalsContact O-N 3.16Å; L274-L276 PolarHBondContact O-N 3.44Å; L276-P280 VanDerWaalsContact O-CD 3.28Å; L276-P280 WeakPolarHBondContact O-CD 3.4Å; L276-P280 WeakPolarHBondContact O-CG 3.44Å
277V91.3Very high84Confident18 Ų1832.7 Ų32.711%0.10918%0.179CC..Hα-helixtrans-99-43.5177.6-177.70000110.5I28 A31 A32 L274 Y275 P280 L281I28-V277 HydrophobicContact CG2-CG2 3.81Å; I28-V277 WeakPolarHBondContact O-CG2 3.29Å; A31-V277 HydrophobicContact CB-CG1 4.5Å; A31-V277 HydrophobicContact CB-CG2 4.09Å; A32-V277 HydrophobicContact CB-CG2 3.79Å; L274-V277 PolarHBondContact O-N 3.13Å; L274-V277 VanDerWaalsContact O-N 3.11Å; Y275-V277 PolarHBondContact O-N 3.33Å; V277-P280 WeakPolarHBondContact O-CD 3.37Å; V277-P280 WeakPolarHBondContact O-CG 3.31Å; V277-L281 HydrophobicContact CG1-CD1 3.68Å; V277-L281 HydrophobicContact CG1-CG 4.21Å; V277-L281 VanDerWaalsContact O-CB 3.31Å; V277-L281 WeakPolarHBondContact O-CB 3.34Å; V277-L281 VanDerWaalsContact O-CG 3.25Å; V277-L281 WeakPolarHBondContact O-CG 3.46Å; V277-L281 PolarHBondContact O-N 3.47Å; V277-L281 VanDerWaalsContact O-N 3.12Å
278V87.8Confident83.4Confident36 Ų3633.2 Ų33.222%0.21818%0.178CC..Hα-helixtrans-66.6-42.1-173.4171.80000111.4V243 L247 L274 Y275 L281 L282V243-V278 HydrophobicContact CG1-CG1 4.39Å; L247-V278 HydrophobicContact CD1-CB 4Å; L247-V278 HydrophobicContact CD1-CG1 3.85Å; L247-V278 HydrophobicContact CD1-CG2 4.27Å; L274-V278 HydrophobicContact CD2-CG2 4.39Å; L274-V278 HydrophobicContact CG-CG2 3.95Å; L274-V278 WeakPolarHBondContact O-CG2 3.38Å; L274-V278 PolarHBondContact O-N 3.2Å; Y275-V278 PolarHBondContact O-N 2.9Å; V278-L281 PolarHBondContact O-N 3.02Å; V278-L282 HydrophobicContact CG1-CD1 3.57Å; V278-L282 HydrophobicContact CG1-CG 4.03Å; V278-L282 VanDerWaalsContact O-CB 3.25Å; V278-L282 WeakPolarHBondContact O-CB 3.32Å; V278-L282 WeakPolarHBondContact O-CG 3.38Å; V278-L282 PolarHBondContact O-N 2.98Å
279A87.1Confident82.8Confident0 Ų033.5 Ų33.50%018%0.182CC..Hα-helixtrans-60.9-55.5-179.200000112.8F59 T244 Y275 L281 L282 Y283F59-A279 HydrophobicContact CE1-CB 4.02Å; F59-A279 HydrophobicContact CZ-CB 3.71Å; T244-A279 HydrophobicContact CG2-CB 3.69Å; T244-A279 WeakPolarHBondContact OG1-CB 3.37Å; Y275-A279 VanDerWaalsContact O-CB 3.23Å; Y275-A279 WeakPolarHBondContact O-CB 3.39Å; Y275-A279 PolarHBondContact O-N 3.13Å; A279-L281 PolarHBondContact O-N 3.27Å; A279-L282 PolarHBondContact O-N 3.29Å; A279-Y283 WeakPolarHBondContact O-CD2 3.28Å; A279-Y283 PolarHBondContact O-N 3.1Å
280P87.2Confident82.1Confident0 Ų030.4 Ų30.40%017%0.17CC..Hα-helixtrans-66.2-35.3178.828.7-37.4000112.6V35 D36 L39 L276 V277 L282 Y283 T284V35-P280 HydrophobicContact CB-CG 4.48Å; V35-P280 HydrophobicContact CG1-CB 3.83Å; V35-P280 HydrophobicContact CG1-CG 3.95Å; D36-P280 WeakPolarHBondContact OD1-CB 3.39Å; D36-P280 VanDerWaalsContact OD1-CG 3.26Å; D36-P280 WeakPolarHBondContact OD1-CG 3.4Å; L39-P280 HydrophobicContact CD2-CB 3.78Å; L276-P280 VanDerWaalsContact O-CD 3.28Å; L276-P280 WeakPolarHBondContact O-CD 3.4Å; L276-P280 WeakPolarHBondContact O-CG 3.44Å; V277-P280 WeakPolarHBondContact O-CD 3.37Å; V277-P280 WeakPolarHBondContact O-CG 3.31Å; P280-L282 PolarHBondContact O-N 2.68Å; P280-Y283 WeakPolarHBondContact O-CB 3.46Å; P280-Y283 PolarHBondContact O-N 3.28Å; P280-T284 WeakPolarHBondContact O-CG2 3.39Å; P280-T284 PolarHBondContact O-N 2.88Å
281L87.6Confident81.4Confident68 Ų6832.3 Ų32.336%0.35618%0.179SC..Hα-helixtrans-59.2-48.6172.2-80.1179.3000111.4V35 V277 V278 A279 Y283 T284 I285V35-L281 HydrophobicContact CB-CD2 4.39Å; V35-L281 HydrophobicContact CG1-CB 4.49Å; V35-L281 HydrophobicContact CG1-CD2 3.69Å; V35-L281 HydrophobicContact CG1-CG 3.84Å; V35-L281 HydrophobicContact CG2-CD2 3.67Å; V35-L281 HydrophobicContact CG2-CG 3.97Å; V277-L281 HydrophobicContact CG1-CD1 3.68Å; V277-L281 HydrophobicContact CG1-CG 4.21Å; V277-L281 VanDerWaalsContact O-CB 3.31Å; V277-L281 WeakPolarHBondContact O-CB 3.34Å; V277-L281 VanDerWaalsContact O-CG 3.25Å; V277-L281 WeakPolarHBondContact O-CG 3.46Å; V277-L281 PolarHBondContact O-N 3.47Å; V277-L281 VanDerWaalsContact O-N 3.12Å; V278-L281 PolarHBondContact O-N 3.02Å; A279-L281 PolarHBondContact O-N 3.27Å; L281-Y283 VanDerWaalsContact C-N 3.3Å; L281-Y283 PolarHBondContact O-N 3.41Å; L281-T284 PolarHBondContact O-N 2.97Å; L281-T284 VanDerWaalsContact O-N 3.09Å; L281-T284 PolarHBondContact O-OG1 3.44Å; L281-I285 WeakPolarHBondContact O-CG1 3.1Å; L281-I285 PolarHBondContact O-N 3.44Å
282L86.2Confident80.4Confident38 Ų3831.6 Ų31.620%0.19918%0.183CC..Hα-helixtrans-61.3-40.2177.5-75.3176.3000111.2V240 V243 V278 A279 P280 T284 I285 I286V240-L282 HydrophobicContact CB-CB 4.07Å; V240-L282 HydrophobicContact CB-CD1 4.44Å; V240-L282 HydrophobicContact CG1-CB 3.47Å; V240-L282 VanDerWaalsContact CG1-CB 3.47Å; V240-L282 HydrophobicContact CG1-CD1 4.04Å; V240-L282 HydrophobicContact CG1-CG 4.42Å; V240-L282 HydrophobicContact CG2-CB 3.6Å; V240-L282 HydrophobicContact CG2-CD1 4.44Å; V243-L282 HydrophobicContact CB-CD1 4.31Å; V243-L282 HydrophobicContact CG1-CD1 4.11Å; V278-L282 HydrophobicContact CG1-CD1 3.57Å; V278-L282 HydrophobicContact CG1-CG 4.03Å; V278-L282 VanDerWaalsContact O-CB 3.25Å; V278-L282 WeakPolarHBondContact O-CB 3.32Å; V278-L282 WeakPolarHBondContact O-CG 3.38Å; V278-L282 PolarHBondContact O-N 2.98Å; A279-L282 PolarHBondContact O-N 3.29Å; P280-L282 PolarHBondContact O-N 2.68Å; L282-T284 VanDerWaalsContact C-N 3.33Å; L282-T284 PolarHBondContact O-N 2.9Å; L282-I285 PolarHBondContact O-N 3.03Å; L282-I286 HydrophobicContact CD2-CD1 3.78Å; L282-I286 WeakPolarHBondContact O-CB 3.27Å; L282-I286 WeakPolarHBondContact O-CG1 3.16Å; L282-I286 PolarHBondContact O-N 2.89Å
283Y84.4Confident79.1Confident2 Ų232.2 Ų32.21%0.00819%0.186CC..Hα-helixtrans-59.2-41.8172.5-75.6-58.5000112.5I56 F59 L117 L237 V240 C241 A279 P280 L281 H287I56-Y283 HydrophobicContact CD1-CD1 4.24Å; I56-Y283 HydrophobicContact CD1-CE1 4.38Å; I56-Y283 HydrophobicContact CG1-CD1 4.48Å; I56-Y283 HydrophobicContact CG1-CE1 4.33Å; I56-Y283 HydrophobicContact CG2-CG 4.47Å; F59-Y283 HydrophobicContact CD1-CE2 4.04Å; F59-Y283 HydrophobicContact CE1-CD2 4.34Å; F59-Y283 AromaticContact CE1-CE2 3.89Å; F59-Y283 HydrophobicContact CE1-CE2 3.89Å; F59-Y283 HydrophobicContact CZ-CE2 4.27Å; L117-Y283 WeakPolarHBondContact CD1-OH 3.32Å; L237-Y283 HydrophobicContact CD2-CD1 3.31Å; L237-Y283 HydrophobicContact CD2-CE1 3.45Å; L237-Y283 VanDerWaalsContact CD2-CE1 3.45Å; V240-Y283 HydrophobicContact CB-CE1 4.46Å; V240-Y283 HydrophobicContact CG1-CD1 4.24Å; V240-Y283 HydrophobicContact CG1-CD2 4.26Å; V240-Y283 HydrophobicContact CG1-CE1 4.1Å; V240-Y283 HydrophobicContact CG1-CE2 4.13Å; V240-Y283 HydrophobicContact CG1-CG 4.31Å; C241-Y283 PolarHBondContact SG-OH 3.3Å; A279-Y283 WeakPolarHBondContact O-CD2 3.28Å; A279-Y283 PolarHBondContact O-N 3.1Å; P280-Y283 WeakPolarHBondContact O-CB 3.46Å; P280-Y283 PolarHBondContact O-N 3.28Å; L281-Y283 VanDerWaalsContact C-N 3.3Å; L281-Y283 PolarHBondContact O-N 3.41Å; Y283-H287 WeakPolarHBondContact O-CB 3.49Å; Y283-H287 PolarHBondContact O-N 3.45Å; Y283-H287 VanDerWaalsContact O-N 3.15Å
284T83.2Confident77.5Confident12 Ų1233.6 Ų33.67%0.07420%0.196CC..Hα-helixtrans-66.4-40.7178.3610000113.2Y38 L39 P280 L281 L282Y38-T284 HydrophobicContact CD1-CG2 4.2Å; Y38-T284 HydrophobicContact CE1-CG2 4.41Å; L39-T284 HydrophobicContact CB-CG2 4.07Å; L39-T284 HydrophobicContact CD1-CG2 3.83Å; L39-T284 HydrophobicContact CG-CG2 4.4Å; P280-T284 WeakPolarHBondContact O-CG2 3.39Å; P280-T284 PolarHBondContact O-N 2.88Å; L281-T284 PolarHBondContact O-N 2.97Å; L281-T284 VanDerWaalsContact O-N 3.09Å; L281-T284 PolarHBondContact O-OG1 3.44Å; L282-T284 VanDerWaalsContact C-N 3.33Å; L282-T284 PolarHBondContact O-N 2.9Å
285I82.4Confident75.7Confident103 Ų10336.2 Ų36.253%0.52821%0.21SC..Hα-helixtrans-77-45.2-176-64.8165.7000111L281 L282L281-I285 WeakPolarHBondContact O-CG1 3.1Å; L281-I285 PolarHBondContact O-N 3.44Å; L282-I285 PolarHBondContact O-N 3.03Å
286I77.4Confident73.9Confident53 Ų5344.3 Ų44.327%0.27224%0.24SC..Hα-helixtrans-92.5-26.7-165.2-64.4-173.1000112.2S236 V240 L282 P288S236-I286 VanDerWaalsContact OG-CG2 3.26Å; S236-I286 WeakPolarHBondContact OG-CG2 3.44Å; S236-I286 PolarHBondContact OG-O 3.24Å; V240-I286 HydrophobicContact CG2-CB 4.2Å; V240-I286 HydrophobicContact CG2-CD1 3.86Å; V240-I286 HydrophobicContact CG2-CG1 4.5Å; V240-I286 HydrophobicContact CG2-CG2 4.29Å; L282-I286 HydrophobicContact CD2-CD1 3.78Å; L282-I286 WeakPolarHBondContact O-CB 3.27Å; L282-I286 WeakPolarHBondContact O-CG1 3.16Å; L282-I286 PolarHBondContact O-N 2.89Å; I286-P288 WeakPolarHBondContact O-CD 3.4Å
287H72.7Confident72.1Confident3 Ų346.1 Ų46.11%0.01425%0.253CS..  trans-74.8110.9179.7-165.9-57.4000109.5L237 Y283 S289 L290 N291L237-H287 HydrophobicContact CD2-CB 4.25Å; Y283-H287 WeakPolarHBondContact O-CB 3.49Å; Y283-H287 PolarHBondContact O-N 3.45Å; Y283-H287 VanDerWaalsContact O-N 3.15Å; H287-S289 VanDerWaalsContact CE1-CB 3.44Å; H287-S289 WeakPolarHBondContact CE1-CB 3.24Å; H287-S289 PolarHBondContact CE1-OG 2.94Å; H287-S289 VanDerWaalsContact CE1-OG 3.31Å; H287-S289 WeakPolarHBondContact ND1-CB 3.16Å; H287-S289 PolarHBondContact ND1-N 2.91Å; H287-S289 PolarHBondContact O-N 3.03Å; H287-S289 VanDerWaalsContact O-N 3.14Å; H287-L290 HydrophobicContact CB-CB 4.18Å; H287-L290 HydrophobicContact CB-CD1 3.85Å; H287-L290 HydrophobicContact CB-CG 4.06Å; H287-L290 PolarHBondContact O-N 3.36Å; H287-N291 PolarHBondContact O-N 3.44Å
288P66.1Low70Confident63 Ų6351 Ų5141%0.40928%0.283SS..Hα-helixtrans-64.1-31.2-169.622.7-30.8000112.5V233 I286 L290 G292V233-P288 HydrophobicContact CB-CG 4.34Å; V233-P288 HydrophobicContact CG1-CG 4.35Å; V233-P288 HydrophobicContact CG2-CG 3.41Å; V233-P288 VanDerWaalsContact CG2-CG 3.41Å; I286-P288 WeakPolarHBondContact O-CD 3.4Å; P288-L290 VanDerWaalsContact C-N 3.33Å; P288-L290 PolarHBondContact O-N 3.25Å; P288-G292 PolarHBondContact O-N 3.23Å
289S67.3Low67.9Low23 Ų2353.7 Ų53.716%0.16130%0.303CS..Hα-helixtrans-61.3-42.1172.6-47.30000111.7K46 H287K46-S289 WeakPolarHBondContact CE-O 3.49Å; K46-S289 PolarHBondContact NZ-O 3.41Å; H287-S289 VanDerWaalsContact CE1-CB 3.44Å; H287-S289 WeakPolarHBondContact CE1-CB 3.24Å; H287-S289 PolarHBondContact CE1-OG 2.94Å; H287-S289 VanDerWaalsContact CE1-OG 3.31Å; H287-S289 WeakPolarHBondContact ND1-CB 3.16Å; H287-S289 PolarHBondContact ND1-N 2.91Å; H287-S289 PolarHBondContact O-N 3.03Å; H287-S289 VanDerWaalsContact O-N 3.14Å
290L65.3Low65.8Low1 Ų157 Ų571%0.00533%0.325CS..Hα-helixtrans-76.3-42.1-177.8-63.3175.4000111.1L39 L42 I43 K46 H287 P288 G292 N293L39-L290 HydrophobicContact CD1-CD1 3.43Å; L39-L290 VanDerWaalsContact CD1-CD1 3.43Å; L42-L290 HydrophobicContact CB-CD2 4.02Å; I43-L290 HydrophobicContact CG1-CD2 4.19Å; K46-L290 HydrophobicContact CD-CD2 4.16Å; H287-L290 HydrophobicContact CB-CB 4.18Å; H287-L290 HydrophobicContact CB-CD1 3.85Å; H287-L290 HydrophobicContact CB-CG 4.06Å; H287-L290 PolarHBondContact O-N 3.36Å; P288-L290 VanDerWaalsContact C-N 3.33Å; P288-L290 PolarHBondContact O-N 3.25Å; L290-G292 PolarHBondContact O-N 3.39Å; L290-N293 PolarHBondContact O-N 2.9Å
291N68.2Low63.9Low69 Ų6963.4 Ų63.437%0.36937%0.368SS..Hα-helixtrans-62.1-39.9-179.3-167.719.4000112.9H287 N293 V294H287-N291 PolarHBondContact O-N 3.44Å; N291-N293 PolarHBondContact O-N 2.91Å; N291-V294 WeakPolarHBondContact O-CB 3.48Å; N291-V294 PolarHBondContact O-N 3.48Å
292G61.7Low61.5Low43 Ų4367 Ų6744%0.44339%0.387SS..Hα-helixtrans-61.1-17.2179.200000115P288 L290P288-G292 PolarHBondContact O-N 3.23Å; L290-G292 PolarHBondContact O-N 3.39Å
293N54.7Low59.2Low51 Ų5175 Ų7527%0.27341%0.414SS..Hα-helixtrans-92.1-18.1171.9-83.3-10.6000113.2L290 N291 D295 R296 S297L290-N293 PolarHBondContact O-N 2.9Å; N291-N293 PolarHBondContact O-N 2.91Å; N293-D295 VanDerWaalsContact C-N 3.33Å; N293-R296 CarbonylContact O-C 3.6Å; N293-R296 PolarHBondContact O-N 2.84Å; N293-S297 WeakPolarHBondContact O-CA 3.34Å; N293-S297 WeakPolarHBondContact O-CB 3.34Å; N293-S297 PolarHBondContact O-N 3.15Å
294V54.8Low57Low42 Ų4285 Ų8526%0.25546%0.458SS..Hα-helixtrans-62.7-45.5176.2-179.70000109.2N291 R296 S297 T298N291-V294 WeakPolarHBondContact O-CB 3.48Å; N291-V294 PolarHBondContact O-N 3.48Å; V294-R296 VanDerWaalsContact C-N 3.29Å; V294-R296 PolarHBondContact O-N 3.01Å; V294-S297 PolarHBondContact O-N 2.95Å; V294-T298 PolarHBondContact O-N 2.64Å; V294-T298 VanDerWaalsContact O-N 3.12Å; V294-T298 PolarHBondContact O-OG1 3.02Å
295D51.1Low54.8Low125 Ų12592.3 Ų92.367%0.66849%0.489SS*.Hα-helixtrans-62.1-32.6175.9-76.7-18.7000113.6N293N293-D295 VanDerWaalsContact C-N 3.33Å
296R48.4Very low52.6Low179 Ų17993.9 Ų93.968%0.67550%0.503SS*.Hα-helixtrans-84-34.3175.1-79.7-176.3178.5174.61.7112.3N293 V294 C299 C300N293-R296 CarbonylContact O-C 3.6Å; N293-R296 PolarHBondContact O-N 2.84Å; V294-R296 VanDerWaalsContact C-N 3.29Å; V294-R296 PolarHBondContact O-N 3.01Å; R296-C299 CarbonylContact O-C 3.41Å; R296-C299 WeakPolarHBondContact O-CA 3.33Å; R296-C299 WeakPolarHBondContact O-CB 3.43Å; R296-C299 PolarHBondContact O-N 3.49Å; R296-C300 WeakPolarHBondContact O-CA 3.39Å; R296-C300 WeakPolarHBondContact O-CB 3.42Å; R296-C300 PolarHBondContact O-N 3.01Å; R296-C300 PolarHBondContact O-SG 3.17Å
297S49.8Very low50.8Low39 Ų3997.3 Ų97.327%0.27353%0.527SS..Hα-helixtrans-67.6-40-176.2176.50000112N293 V294 C299 C300N293-S297 WeakPolarHBondContact O-CA 3.34Å; N293-S297 WeakPolarHBondContact O-CB 3.34Å; N293-S297 PolarHBondContact O-N 3.15Å; V294-S297 PolarHBondContact O-N 2.95Å; S297-C299 PolarHBondContact O-N 3.1Å; S297-C300 PolarHBondContact O-N 3.34Å
298T46.9Very low49.2Very low120 Ų120102.2 Ų102.274%0.73656%0.561SS**THydrogen-bonded Turntrans-65-21.6171.437.10000112.3V294V294-T298 PolarHBondContact O-N 2.64Å; V294-T298 VanDerWaalsContact O-N 3.12Å; V294-T298 PolarHBondContact O-OG1 3.02Å
299C44.6Very low48.1Very low94 Ų94104.6 Ų104.664%0.63557%0.574SS**THydrogen-bonded Turntrans-94.7-21.1174.8-145.60000113.3R296 S297 C301 L302R296-C299 CarbonylContact O-C 3.41Å; R296-C299 WeakPolarHBondContact O-CA 3.33Å; R296-C299 WeakPolarHBondContact O-CB 3.43Å; R296-C299 PolarHBondContact O-N 3.49Å; S297-C299 PolarHBondContact O-N 3.1Å; C299-C301 VanDerWaalsContact C-N 3.33Å; C299-C301 PolarHBondContact O-N 3.08Å; C299-L302 PolarHBondContact O-N 3.16Å; C299-L302 VanDerWaalsContact O-N 3.13Å
300C41.1Very low46.9Very low70 Ų70109 Ų10947%0.47360%0.6SS.*THydrogen-bonded Turntrans-84.614.5-167.6-89.50000116R296 S297 L302R296-C300 WeakPolarHBondContact O-CA 3.39Å; R296-C300 WeakPolarHBondContact O-CB 3.42Å; R296-C300 PolarHBondContact O-N 3.01Å; R296-C300 PolarHBondContact O-SG 3.17Å; S297-C300 PolarHBondContact O-N 3.34Å; C300-L302 PolarHBondContact O-N 3.29Å
301C47.6Very low45.8Very low133 Ų133119.4 Ų119.490%0.89964%0.641SS**THydrogen-bonded Turntrans-59.3-17149.7-75.40000111C299C299-C301 VanDerWaalsContact C-N 3.33Å; C299-C301 PolarHBondContact O-N 3.08Å
302L38.1Very low44.1Very low144 Ų144122.4 Ų122.475%0.75466%0.662SS**SBendtrans-113.2127.8164.6-78.9108.2000112.2C299 C300C299-L302 PolarHBondContact O-N 3.16Å; C299-L302 VanDerWaalsContact O-N 3.13Å; C300-L302 PolarHBondContact O-N 3.29Å
303R37.7Very low43Very low205 Ų205127.7 Ų127.777%0.77472%0.717SS**  trans99.983.1156-134.2171-164.6176.84.6117.3K305R303-K305 PolarHBondContact O-N 3.5Å
304K38.1Very low42.4Very low213 Ų213131.6 Ų131.693%0.92674%0.739SS**  trans-48.6124.3147.1-77.5175.5175.2175.60109.2
305K36.6Very low41.8Very low165 Ų165136.3 Ų136.372%0.71777%0.765SS**  trans-133.9107.9161.3-118-176.8178.9-173.60109.3R303R303-K305 PolarHBondContact O-N 3.5Å
306T36.1Very low41.3Very low137 Ų137136.9 Ų136.984%0.8477%0.77SS**  trans-59.7123.4162330000108.8
307V39.5Very low40.8Very low125 Ų125134.4 Ų134.476%0.75878%0.775SS**  trans-114.6106.3170.5177.50000107
308S40.3Very low40.3Very low105 Ų105140.4 Ų140.473%0.73481%0.807SS**  trans-75.5113.6174-350000108.7V310S308-V310 PolarHBondContact O-N 3.35Å
309T41.6Very low39.8Very low113 Ų113141.7 Ų141.769%0.69381%0.812SS**  trans-74.9104.7171.942.20000109.5
310V43.6Very low39.5Very low116 Ų116145.1 Ų145.170%0.70382%0.824SS**  trans-93.4112.7163.3178.90000106.7S308 T312S308-V310 PolarHBondContact O-N 3.35Å; V310-T312 HydrophobicContact CG1-CG2 4.14Å; V310-T312 PolarHBondContact O-N 3.05Å
311Y40.7Very low39.4Very low219 Ų219150.9 Ų150.986%0.85985%0.851SS**  trans-78.6112.6167.9-75.7-92.2000108.2
312T33.1Very low38.7Very low132 Ų132152.4 Ų152.481%0.8185%0.847SS**  trans-114.4124165.344.10000108.3V310V310-T312 HydrophobicContact CG1-CG2 4.14Å; V310-T312 PolarHBondContact O-N 3.05Å
313G38.8Very low38.7Very low155 Ų155153.2 Ų153.2100%1.59886%0.856SS**  trans134.60173.700000111.7

Retrieved 313 of 313 residues in 99.1 ms (Link to these results)

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