A0A060Y6W5_ONCMY Loading...

Sugar phosphate transporter domain-containing protein

Putative transporter.

AlphaFold DB , UniProt , Accession A0A060Y6W5, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 349 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
1M40.5Very low36.1Very low234 Ų234146.7 Ų146.7100%1.15386%0.861SS**  0135.60-152167-168.700106.2
2A32.9Very low36.6Very low97 Ų97140.4 Ų140.480%0.80285%0.85SS**  trans72.183.5-172.500000116.4
3L30.3Very low37.2Very low183 Ų183146.5 Ų146.596%0.95886%0.858SS**SBendtrans-168.644.2143-97.4-179.5000109.7
4A37.6Very low38.3Very low107 Ų107141.2 Ų141.288%0.88485%0.851SS**SBendtrans-140.436.1179.700000111.8
5G35.4Very low39.7Very low74 Ų74138.6 Ų138.676%0.76383%0.826SS**SBendtrans-145.517.5-165.200000117.9
6S32.2Very low42.2Very low94 Ų94135.6 Ų135.666%0.65781%0.809SS**SBendtrans-139.6-18.3175.861.90000117
7D33.2Very low44.6Very low154 Ų154138.3 Ų138.382%0.82481%0.808SS**THydrogen-bonded Turntrans-101.87.9-170-65.94.9000114.2
8S38.8Very low46.7Very low109 Ų109137.2 Ų137.276%0.76280%0.798SS**THydrogen-bonded Turntrans-106.53.3-178.758.70000115.1
9M36.4Very low48.7Very low178 Ų178134.6 Ų134.688%0.87778%0.78SS**SBendtrans-110.6-1-174.4-82.3-163.2148.700116.8
10E36.9Very low50.4Low192 Ų192134.2 Ų134.290%0.89777%0.768SS**SBendtrans-114-6.4-178.1-72.8-157.4141.700117.7
11E42.5Very low52.1Low192 Ų192130 Ų13090%0.89775%0.75SS**SBendtrans-90.74.5177.6-76.9-167.7148.500115
12G42.8Very low54.4Low71 Ų71123.7 Ų123.773%0.73272%0.72SS**  trans-98.99.8-162.800000118.3
13K44Very low57Low219 Ų219123.7 Ų123.795%0.95270%0.702SS**SBendtrans-107.171.7-178.1-79.2-177177173.50111.9
14G52.3Low59.8Low73 Ų73117.6 Ų117.675%0.75367%0.669SS**SBendtrans163.2-13.4167.600000117.9T16G14-T16 PolarHBondContact O-N 3.17Å
15E60.2Low62.2Low102 Ų102114 Ų11448%0.47764%0.643SS.*  trans-77119.6-177.7-67-161.4147.400112.4K23E15-K23 IonicContact OE1-NZ 2.75Å; E15-K23 PolarHBondContact OE1-NZ 3.13Å; E15-K23 IonicContact OE2-NZ 2.89Å
16T80Confident64.8Low90 Ų90112.5 Ų112.555%0.55263%0.628SS**  trans-60.7140.6170.915.90000110.2G14 L18 L19 K20G14-T16 PolarHBondContact O-N 3.17Å; T16-L18 PolarHBondContact O-N 3.14Å; T16-L19 WeakPolarHBondContact O-CB 3.28Å; T16-L19 PolarHBondContact O-N 3.37Å; T16-L19 WeakPolarHBondContact OG1-CD1 3.35Å; T16-K20 PolarHBondContact O-N 3.46Å
17F81.9Confident67.6Low182 Ų182108.8 Ų108.880%0.79860%0.601SS**Hα-helixtrans-48.2-36.6177.1175.7-97.4000112.9K20 A21F17-K20 PolarHBondContact O-N 2.87Å; F17-A21 WeakPolarHBondContact O-CB 3.47Å; F17-A21 PolarHBondContact O-N 2.86Å
18L83.1Confident70.3Confident119 Ų119103 Ų10362%0.62357%0.571SS**Hα-helixtrans-61.5-45.3175.9-174.166.9000112.8T16 K20 A21 I22T16-L18 PolarHBondContact O-N 3.14Å; L18-K20 VanDerWaalsContact C-N 3.31Å; L18-K20 PolarHBondContact O-N 3.31Å; L18-A21 PolarHBondContact O-N 3.06Å; L18-I22 HydrophobicContact CD1-CD1 4.29Å; L18-I22 HydrophobicContact CD2-CD1 4.49Å; L18-I22 HydrophobicContact CG-CD1 3.88Å; L18-I22 WeakPolarHBondContact O-CB 3.36Å; L18-I22 VanDerWaalsContact O-CG1 3.26Å; L18-I22 WeakPolarHBondContact O-CG1 3.43Å; L18-I22 PolarHBondContact O-N 3.48Å
19L84.3Confident72.8Confident87 Ų87102.5 Ų102.546%0.45556%0.563SS.*Hα-helixtrans-62.5-40.4177.6-74.6173.1000111.2T16 I22 K23T16-L19 WeakPolarHBondContact O-CB 3.28Å; T16-L19 PolarHBondContact O-N 3.37Å; T16-L19 WeakPolarHBondContact OG1-CD1 3.35Å; L19-I22 PolarHBondContact O-N 3.43Å; L19-K23 WeakPolarHBondContact O-CB 3.37Å; L19-K23 WeakPolarHBondContact O-CG 3.4Å; L19-K23 PolarHBondContact O-N 2.59Å
20K83.4Confident75.5Confident127 Ų12797.5 Ų97.555%0.55254%0.54SS*.Hα-helixtrans-64.3-43175.9-167.4171.8-175.4172.90111.9T16 F17 L18 K23 I24T16-K20 PolarHBondContact O-N 3.46Å; F17-K20 PolarHBondContact O-N 2.87Å; L18-K20 VanDerWaalsContact C-N 3.31Å; L18-K20 PolarHBondContact O-N 3.31Å; K20-K23 PolarHBondContact O-N 3.37Å; K20-I24 HydrophobicContact CG-CD1 4.22Å; K20-I24 VanDerWaalsContact O-CG1 3.32Å; K20-I24 WeakPolarHBondContact O-CG1 3.39Å; K20-I24 PolarHBondContact O-N 2.89Å
21A85.2Confident78.1Confident46 Ų4689.2 Ų89.238%0.3850%0.5SS..Hα-helixtrans-64.3-42.217600000112.3F17 L18 I24 G25F17-A21 WeakPolarHBondContact O-CB 3.47Å; F17-A21 PolarHBondContact O-N 2.86Å; L18-A21 PolarHBondContact O-N 3.06Å; A21-I24 PolarHBondContact O-N 3.02Å; A21-G25 PolarHBondContact O-N 3.24Å
22I89.6Confident80.5Confident102 Ų10283.4 Ų83.452%0.52347%0.47SS..Hα-helixtrans-63.1-44.4175.8-70167.7000110.6L18 L19 G25 G26L18-I22 HydrophobicContact CD1-CD1 4.29Å; L18-I22 HydrophobicContact CD2-CD1 4.49Å; L18-I22 HydrophobicContact CG-CD1 3.88Å; L18-I22 WeakPolarHBondContact O-CB 3.36Å; L18-I22 VanDerWaalsContact O-CG1 3.26Å; L18-I22 WeakPolarHBondContact O-CG1 3.43Å; L18-I22 PolarHBondContact O-N 3.48Å; L19-I22 PolarHBondContact O-N 3.43Å; I22-G25 PolarHBondContact O-N 3.04Å; I22-G26 PolarHBondContact O-N 2.92Å
23K87.5Confident82.9Confident97 Ų9785.8 Ų85.842%0.42246%0.461SS..Hα-helixtrans-58.9-48.7175.8-77.3179.5176.9-174.50111.6E15 L19 K20 G26 V27E15-K23 IonicContact OE1-NZ 2.75Å; E15-K23 PolarHBondContact OE1-NZ 3.13Å; E15-K23 IonicContact OE2-NZ 2.89Å; L19-K23 WeakPolarHBondContact O-CB 3.37Å; L19-K23 WeakPolarHBondContact O-CG 3.4Å; L19-K23 PolarHBondContact O-N 2.59Å; K20-K23 PolarHBondContact O-N 3.37Å; K23-G26 PolarHBondContact O-N 3.07Å; K23-V27 WeakPolarHBondContact O-CG2 3.48Å; K23-V27 PolarHBondContact O-N 3.32Å
24I87.9Confident85.1Confident54 Ų5476 Ų7628%0.27742%0.418SS..Hα-helixtrans-60.8-47.8177.6-69.8166.3000110.8K20 A21 G26 V27 V28 T272K20-I24 HydrophobicContact CG-CD1 4.22Å; K20-I24 VanDerWaalsContact O-CG1 3.32Å; K20-I24 WeakPolarHBondContact O-CG1 3.39Å; K20-I24 PolarHBondContact O-N 2.89Å; A21-I24 PolarHBondContact O-N 3.02Å; I24-G26 VanDerWaalsContact C-N 3.33Å; I24-G26 PolarHBondContact O-N 3.16Å; I24-V27 PolarHBondContact O-N 3.15Å; I24-V28 HydrophobicContact CG2-CG2 4.4Å; I24-V28 VanDerWaalsContact O-CG2 3.26Å; I24-V28 WeakPolarHBondContact O-CG2 3.38Å; I24-V28 PolarHBondContact O-N 3.3Å; I24-T272 HydrophobicContact CG1-CG2 4.45Å; I24-T272 HydrophobicContact CG2-CG2 3.58Å
25G88Confident86.8Confident32 Ų3273.1 Ų73.133%0.3339%0.387SS..Hα-helixtrans-58.4-44.6177.200000112.2A21 I22 V27 V28 V29A21-G25 PolarHBondContact O-N 3.24Å; I22-G25 PolarHBondContact O-N 3.04Å; G25-V27 PolarHBondContact O-N 3.04Å; G25-V28 PolarHBondContact O-N 3.36Å; G25-V29 WeakPolarHBondContact O-CB 3.04Å; G25-V29 VanDerWaalsContact O-CG2 3.31Å; G25-V29 WeakPolarHBondContact O-CG2 3.26Å; G25-V29 PolarHBondContact O-N 3.44Å
26G91.3Very high88Confident43 Ų4369.4 Ų69.444%0.44337%0.37SS..Hα-helixtrans-59.8-44.3176.600000112.9I22 K23 I24 V29 L30I22-G26 PolarHBondContact O-N 2.92Å; K23-G26 PolarHBondContact O-N 3.07Å; I24-G26 VanDerWaalsContact C-N 3.33Å; I24-G26 PolarHBondContact O-N 3.16Å; G26-V29 PolarHBondContact O-N 2.73Å; G26-L30 VanDerWaalsContact O-CB 3.29Å; G26-L30 WeakPolarHBondContact O-CB 3.45Å; G26-L30 PolarHBondContact O-N 3.06Å
27V90.1Very high88.4Confident16 Ų1667 Ų6710%0.09736%0.355CS..Hα-helixtrans-66.4-39.5177.6177.20000111.6K23 I24 G25 L30 Y31 L267 Q268 F271K23-V27 WeakPolarHBondContact O-CG2 3.48Å; K23-V27 PolarHBondContact O-N 3.32Å; I24-V27 PolarHBondContact O-N 3.15Å; G25-V27 PolarHBondContact O-N 3.04Å; V27-L30 PolarHBondContact O-N 3.4Å; V27-Y31 PolarHBondContact O-N 3.14Å; V27-L267 HydrophobicContact CG1-CB 4.27Å; V27-L267 HydrophobicContact CG1-CD2 4.09Å; V27-L267 HydrophobicContact CG1-CG 3.96Å; V27-L267 HydrophobicContact CG2-CD2 4.05Å; V27-L267 HydrophobicContact CG2-CG 4.25Å; V27-Q268 VanDerWaalsContact CG1-CA 3.42Å; V27-Q268 HydrophobicContact CG1-CB 3.82Å; V27-Q268 HydrophobicContact CG1-CG 4.32Å; V27-F271 HydrophobicContact CG2-CD2 4.16Å; V27-F271 HydrophobicContact CG2-CG 4.39Å
28V90.3Very high88.5Confident32 Ų3260.3 Ų60.319%0.19433%0.327CS..Hα-helixtrans-63.7-47.6175.7173.40000110.9I24 G25 L30 Y31 W32 Q268 S280I24-V28 HydrophobicContact CG2-CG2 4.4Å; I24-V28 VanDerWaalsContact O-CG2 3.26Å; I24-V28 WeakPolarHBondContact O-CG2 3.38Å; I24-V28 PolarHBondContact O-N 3.3Å; G25-V28 PolarHBondContact O-N 3.36Å; V28-L30 VanDerWaalsContact C-N 3.32Å; V28-L30 PolarHBondContact O-N 3.33Å; V28-Y31 PolarHBondContact O-N 3.01Å; V28-W32 PolarHBondContact O-N 3.29Å; V28-Q268 HydrophobicContact CG2-CG 4.44Å; V28-S280 WeakPolarHBondContact CG1-OG 3.48Å
29V91.8Very high88.3Confident98 Ų9856.2 Ų56.259%0.59431%0.307SS*.Hα-helixtrans-62.7-41.2178.6170.10000110.9G25 G26 Y31 W32 F33G25-V29 WeakPolarHBondContact O-CB 3.04Å; G25-V29 VanDerWaalsContact O-CG2 3.31Å; G25-V29 WeakPolarHBondContact O-CG2 3.26Å; G25-V29 PolarHBondContact O-N 3.44Å; G26-V29 PolarHBondContact O-N 2.73Å; V29-Y31 PolarHBondContact O-N 2.86Å; V29-W32 PolarHBondContact O-N 2.93Å; V29-F33 WeakPolarHBondContact O-CB 3.38Å; V29-F33 PolarHBondContact O-N 3.23Å
30L92.4Very high88.2Confident73 Ų7354.4 Ų54.438%0.38230%0.295SS..Hα-helixtrans-61.5-44.4176.2-177.365.9000111.7G26 V27 V28 W32 F33 I34 V264G26-L30 VanDerWaalsContact O-CB 3.29Å; G26-L30 WeakPolarHBondContact O-CB 3.45Å; G26-L30 PolarHBondContact O-N 3.06Å; V27-L30 PolarHBondContact O-N 3.4Å; V28-L30 VanDerWaalsContact C-N 3.32Å; V28-L30 PolarHBondContact O-N 3.33Å; L30-W32 PolarHBondContact O-N 2.98Å; L30-F33 PolarHBondContact O-N 3.44Å; L30-I34 HydrophobicContact CD1-CD1 4.09Å; L30-I34 HydrophobicContact CD1-CG1 4.34Å; L30-I34 HydrophobicContact CG-CD1 4.19Å; L30-I34 WeakPolarHBondContact O-CG1 3.4Å; L30-I34 PolarHBondContact O-N 3.12Å; L30-V264 HydrophobicContact CD2-CG1 3.71Å; L30-V264 HydrophobicContact CG-CG1 3.94Å
31Y91.9Very high88.1Confident18 Ų1849.4 Ų49.47%0.07128%0.275CS..Hα-helixtrans-59.1-45.4173.8165.2-105.7000111.9V27 V28 V29 S35 I261 V264 H277 K284V27-Y31 PolarHBondContact O-N 3.14Å; V28-Y31 PolarHBondContact O-N 3.01Å; V29-Y31 PolarHBondContact O-N 2.86Å; Y31-S35 WeakPolarHBondContact O-CB 3.29Å; Y31-S35 PolarHBondContact O-N 3.25Å; Y31-I261 HydrophobicContact CD2-CD1 3.91Å; Y31-I261 HydrophobicContact CE2-CD1 3.79Å; Y31-V264 HydrophobicContact CD2-CG2 4.22Å; Y31-H277 AromaticContact CE2-NE2 3.76Å; Y31-H277 AromaticContact CZ-NE2 3.8Å; Y31-K284 HydrophobicContact CE1-CD 3.92Å
32W92.9Very high87.8Confident70 Ų7049.2 Ų49.227%0.26527%0.267SS..Hα-helixtrans-62.1-47.9178.2-79.744.5000111.3V28 V29 L30 S35 I36 S280 A283 K284 A287V28-W32 PolarHBondContact O-N 3.29Å; V29-W32 PolarHBondContact O-N 2.93Å; L30-W32 PolarHBondContact O-N 2.98Å; W32-S35 PolarHBondContact O-N 3.34Å; W32-I36 HydrophobicContact CB-CD1 4.4Å; W32-I36 HydrophobicContact CE3-CD1 4.42Å; W32-I36 VanDerWaalsContact O-CB 3.26Å; W32-I36 WeakPolarHBondContact O-CB 3.31Å; W32-I36 WeakPolarHBondContact O-CG1 3.44Å; W32-I36 PolarHBondContact O-N 3.45Å; W32-S280 PolarHBondContact NE1-O 3.12Å; W32-S280 PolarHBondContact NE1-OG 3.07Å; W32-A283 HydrophobicContact CH2-CB 3.78Å; W32-A283 WeakPolarHBondContact CH2-O 3.2Å; W32-A283 VanDerWaalsContact CZ2-C 3.46Å; W32-A283 HydrophobicContact CZ2-CB 3.54Å; W32-K284 HydrophobicContact CB-CG 4.49Å; W32-K284 HydrophobicContact CD2-CB 3.81Å; W32-K284 HydrophobicContact CD2-CG 4.05Å; W32-K284 HydrophobicContact CE3-CB 4.37Å; W32-K284 HydrophobicContact CG-CB 4.12Å; W32-K284 HydrophobicContact CG-CG 4.03Å; W32-K284 HydrophobicContact CZ2-CB 4.06Å; W32-A287 HydrophobicContact CE3-CB 4.13Å; W32-A287 HydrophobicContact CH2-CB 4.25Å; W32-A287 HydrophobicContact CZ3-CB 3.48Å; W32-A287 VanDerWaalsContact CZ3-CB 3.48Å
33F92.4Very high87.1Confident122 Ų12246 Ų4654%0.53525%0.252SS..Hα-helixtrans-58.3-53.2179.6177-100.8000111.5V29 L30 S35 T37 F257V29-F33 WeakPolarHBondContact O-CB 3.38Å; V29-F33 PolarHBondContact O-N 3.23Å; L30-F33 PolarHBondContact O-N 3.44Å; F33-S35 PolarHBondContact O-N 3.19Å; F33-T37 WeakPolarHBondContact O-CB 3.25Å; F33-T37 PolarHBondContact O-N 2.83Å; F33-T37 PolarHBondContact O-OG1 3.17Å; F33-F257 HydrophobicContact CE1-CE1 4.39Å; F33-F257 HydrophobicContact CE1-CZ 4.49Å
34I90.8Very high86.6Confident12 Ų1247 Ų476%0.06225%0.253CS..Hα-helixtrans-61.2-45.8-180-70.2-177.7000111L30 M38 F257 A260 I261 V264L30-I34 HydrophobicContact CD1-CD1 4.09Å; L30-I34 HydrophobicContact CD1-CG1 4.34Å; L30-I34 HydrophobicContact CG-CD1 4.19Å; L30-I34 WeakPolarHBondContact O-CG1 3.4Å; L30-I34 PolarHBondContact O-N 3.12Å; I34-M38 VanDerWaalsContact O-CB 3.29Å; I34-M38 WeakPolarHBondContact O-CB 3.48Å; I34-M38 PolarHBondContact O-N 2.89Å; I34-F257 HydrophobicContact CB-CD1 4.31Å; I34-F257 HydrophobicContact CG1-CD1 4.07Å; I34-F257 HydrophobicContact CG1-CE1 4.12Å; I34-F257 HydrophobicContact CG2-CD1 3.95Å; I34-A260 HydrophobicContact CD1-CB 4Å; I34-A260 HydrophobicContact CG2-CB 4.37Å; I34-I261 HydrophobicContact CG2-CB 4.17Å; I34-I261 HydrophobicContact CG2-CD1 4.16Å; I34-V264 HydrophobicContact CB-CG2 4.31Å; I34-V264 HydrophobicContact CD1-CB 4.37Å; I34-V264 HydrophobicContact CD1-CG1 3.57Å; I34-V264 HydrophobicContact CD1-CG2 3.96Å; I34-V264 HydrophobicContact CG2-CG2 4.29Å
35S87.2Confident85.9Confident14 Ų1444.6 Ų44.610%0.09824%0.241CC..Hα-helixtrans-69.8-41.7-176.1-177.60000113Y31 W32 F33 V39 K284Y31-S35 WeakPolarHBondContact O-CB 3.29Å; Y31-S35 PolarHBondContact O-N 3.25Å; W32-S35 PolarHBondContact O-N 3.34Å; F33-S35 PolarHBondContact O-N 3.19Å; S35-V39 WeakPolarHBondContact O-CG2 3.42Å; S35-V39 PolarHBondContact O-N 2.99Å; S35-K284 WeakPolarHBondContact OG-CD 3.44Å; S35-K284 VanDerWaalsContact OG-CE 3.29Å; S35-K284 WeakPolarHBondContact OG-CE 3.35Å; S35-K284 PolarHBondContact OG-NZ 2.94Å
36I86.7Confident85Confident24 Ų2445.4 Ų45.412%0.12324%0.238CC..Hα-helixtrans-67.4-48177.3-67.8169.5000109.4W32 M38 V39 F40 K284 Q288 I291W32-I36 HydrophobicContact CB-CD1 4.4Å; W32-I36 HydrophobicContact CE3-CD1 4.42Å; W32-I36 VanDerWaalsContact O-CB 3.26Å; W32-I36 WeakPolarHBondContact O-CB 3.31Å; W32-I36 WeakPolarHBondContact O-CG1 3.44Å; W32-I36 PolarHBondContact O-N 3.45Å; I36-M38 VanDerWaalsContact C-N 3.29Å; I36-M38 PolarHBondContact O-N 3.37Å; I36-V39 PolarHBondContact O-N 3.26Å; I36-V39 VanDerWaalsContact O-N 3.08Å; I36-F40 HydrophobicContact CG2-CD2 3.67Å; I36-F40 HydrophobicContact CG2-CE2 3.75Å; I36-F40 WeakPolarHBondContact O-CD2 3.32Å; I36-F40 PolarHBondContact O-N 3.34Å; I36-K284 HydrophobicContact CD1-CG 4.16Å; I36-K284 HydrophobicContact CG1-CD 4.47Å; I36-K284 HydrophobicContact CG1-CG 3.97Å; I36-Q288 HydrophobicContact CG1-CB 4.4Å; I36-I291 HydrophobicContact CD1-CD1 4.35Å
37T87.6Confident83.8Confident39 Ų3948.8 Ų48.824%0.23925%0.245CC..Hα-helixtrans-56.1-44.3176.7-630000111.3F33 V39 F40 L41 F257F33-T37 WeakPolarHBondContact O-CB 3.25Å; F33-T37 PolarHBondContact O-N 2.83Å; F33-T37 PolarHBondContact O-OG1 3.17Å; T37-V39 VanDerWaalsContact C-N 3.32Å; T37-V39 PolarHBondContact O-N 3.28Å; T37-F40 PolarHBondContact O-N 2.98Å; T37-L41 WeakPolarHBondContact O-CB 3.34Å; T37-L41 PolarHBondContact O-N 2.94Å; T37-F257 HydrophobicContact CG2-CD2 4.22Å; T37-F257 HydrophobicContact CG2-CE2 3.8Å; T37-F257 HydrophobicContact CG2-CZ 3.99Å
38M84.1Confident82.5Confident41 Ų4149.4 Ų49.420%0.20225%0.25CS..Hα-helixtrans-59.1-41.3177-174.5-176.9-175.800112.5I34 I36 N42 F257 I261I34-M38 VanDerWaalsContact O-CB 3.29Å; I34-M38 WeakPolarHBondContact O-CB 3.48Å; I34-M38 PolarHBondContact O-N 2.89Å; I36-M38 VanDerWaalsContact C-N 3.29Å; I36-M38 PolarHBondContact O-N 3.37Å; M38-N42 WeakPolarHBondContact O-CB 3.29Å; M38-N42 VanDerWaalsContact O-CG 3.23Å; M38-N42 PolarHBondContact O-N 3.26Å; M38-N42 PolarHBondContact O-ND2 3.46Å; M38-F257 HydrophobicContact CB-CB 4.45Å; M38-I261 HydrophobicContact SD-CB 4.43Å; M38-I261 HydrophobicContact SD-CG2 4.2Å
39V80Confident80.7Confident34 Ų3457.3 Ų57.321%0.20628%0.282CS..Hα-helixtrans-66.7-46.5178.6172.20000111.4S35 I36 T37 N42 N43S35-V39 WeakPolarHBondContact O-CG2 3.42Å; S35-V39 PolarHBondContact O-N 2.99Å; I36-V39 PolarHBondContact O-N 3.26Å; I36-V39 VanDerWaalsContact O-N 3.08Å; T37-V39 VanDerWaalsContact C-N 3.32Å; T37-V39 PolarHBondContact O-N 3.28Å; V39-N42 PolarHBondContact O-N 3.25Å; V39-N43 WeakPolarHBondContact O-CB 3.48Å; V39-N43 PolarHBondContact O-N 3.2Å
40F81.1Confident78.9Confident48 Ų4857.6 Ų57.621%0.21128%0.28CS..Hα-helixtrans-69.5-36.5179.6-82-84000112.6I36 T37 N43 Y44 Q288 I291 A292 Y295I36-F40 HydrophobicContact CG2-CD2 3.67Å; I36-F40 HydrophobicContact CG2-CE2 3.75Å; I36-F40 WeakPolarHBondContact O-CD2 3.32Å; I36-F40 PolarHBondContact O-N 3.34Å; T37-F40 PolarHBondContact O-N 2.98Å; F40-N43 PolarHBondContact O-N 2.84Å; F40-Y44 WeakPolarHBondContact O-CB 3.23Å; F40-Y44 PolarHBondContact O-N 3.49Å; F40-Q288 HydrophobicContact CE2-CG 4.4Å; F40-I291 HydrophobicContact CE2-CB 4.48Å; F40-I291 HydrophobicContact CE2-CG2 3.89Å; F40-I291 HydrophobicContact CZ-CB 4.28Å; F40-I291 HydrophobicContact CZ-CG2 3.63Å; F40-A292 HydrophobicContact CZ-CB 4.07Å; F40-Y295 HydrophobicContact CE1-CD1 4.31Å; F40-Y295 HydrophobicContact CE1-CG 4.44Å
41L81.6Confident77.6Confident22 Ų2254.4 Ų54.412%0.11526%0.263CS..Hα-helixtrans-64.6-45.4175.3-170.8157.4000110.4T37 N43 Y44 L45 L253 F257T37-L41 WeakPolarHBondContact O-CB 3.34Å; T37-L41 PolarHBondContact O-N 2.94Å; L41-N43 VanDerWaalsContact C-N 3.33Å; L41-N43 PolarHBondContact O-N 3.46Å; L41-Y44 PolarHBondContact O-N 2.94Å; L41-L45 HydrophobicContact CD2-CD1 3.5Å; L41-L45 VanDerWaalsContact CD2-CD1 3.5Å; L41-L45 HydrophobicContact CD2-CG 4.07Å; L41-L45 WeakPolarHBondContact O-CG 3.19Å; L41-L45 PolarHBondContact O-N 3Å; L41-L253 HydrophobicContact CD1-CB 4.32Å; L41-L253 HydrophobicContact CD1-CD2 3.95Å; L41-L253 HydrophobicContact CD1-CG 3.97Å; L41-F257 HydrophobicContact CD1-CD2 4.34Å
42N78.1Confident76.5Confident42 Ų4256.8 Ų56.823%0.22528%0.277CS..Hα-helixtrans-61.6-42.6173.5-75-11.4000111.4M38 V39 Y44 L45 L46 Q61M38-N42 WeakPolarHBondContact O-CB 3.29Å; M38-N42 VanDerWaalsContact O-CG 3.23Å; M38-N42 PolarHBondContact O-N 3.26Å; M38-N42 PolarHBondContact O-ND2 3.46Å; V39-N42 PolarHBondContact O-N 3.25Å; N42-Y44 VanDerWaalsContact C-N 3.35Å; N42-Y44 PolarHBondContact O-N 2.99Å; N42-L45 PolarHBondContact O-N 3.38Å; N42-L46 WeakPolarHBondContact O-CB 3.46Å; N42-L46 WeakPolarHBondContact O-CG 3.17Å; N42-L46 PolarHBondContact O-N 3.21Å; N42-Q61 PolarHBondContact OD1-NE2 3.27Å
43N74.9Confident75.8Confident36 Ų3653.5 Ų53.519%0.19327%0.265CS..Hα-helixtrans-61.3-43.6175.8-169.265.4000111.7V39 F40 L41 L46 D47 V121V39-N43 WeakPolarHBondContact O-CB 3.48Å; V39-N43 PolarHBondContact O-N 3.2Å; F40-N43 PolarHBondContact O-N 2.84Å; L41-N43 VanDerWaalsContact C-N 3.33Å; L41-N43 PolarHBondContact O-N 3.46Å; N43-L46 PolarHBondContact O-N 2.98Å; N43-D47 WeakPolarHBondContact O-CB 3.42Å; N43-D47 PolarHBondContact O-N 2.83Å; N43-V121 VanDerWaalsContact OD1-CG2 3.25Å; N43-V121 WeakPolarHBondContact OD1-CG2 3.33Å
44Y77.8Confident75.2Confident118 Ų11848.7 Ų48.746%0.46325%0.246SC..Hα-helixtrans-63.3-42.8177.5177-93.8000112.5F40 L41 N42 L46 D47 S48 M250F40-Y44 WeakPolarHBondContact O-CB 3.23Å; F40-Y44 PolarHBondContact O-N 3.49Å; L41-Y44 PolarHBondContact O-N 2.94Å; N42-Y44 VanDerWaalsContact C-N 3.35Å; N42-Y44 PolarHBondContact O-N 2.99Å; Y44-L46 VanDerWaalsContact C-N 3.31Å; Y44-L46 PolarHBondContact O-N 3.37Å; Y44-D47 PolarHBondContact O-N 3Å; Y44-S48 PolarHBondContact O-N 3.47Å; Y44-M250 HydrophobicContact CD1-SD 4.23Å; Y44-M250 HydrophobicContact CE1-CE 3.85Å; Y44-M250 HydrophobicContact CE1-SD 3.55Å; Y44-M250 VanDerWaalsContact CE1-SD 3.55Å
45L74.1Confident74.9Confident3 Ų348.3 Ų48.32%0.01624%0.244CC..Hα-helixtrans-62.3-39.7175.8-73.3175.2000111.5L41 N42 S48 V57 F247 M250 M251L41-L45 HydrophobicContact CD2-CD1 3.5Å; L41-L45 VanDerWaalsContact CD2-CD1 3.5Å; L41-L45 HydrophobicContact CD2-CG 4.07Å; L41-L45 WeakPolarHBondContact O-CG 3.19Å; L41-L45 PolarHBondContact O-N 3Å; N42-L45 PolarHBondContact O-N 3.38Å; L45-S48 PolarHBondContact O-OG 2.97Å; L45-V57 HydrophobicContact CD1-CG1 4.04Å; L45-F247 HydrophobicContact CD2-CE2 4.42Å; L45-M250 HydrophobicContact CD2-CB 4.05Å; L45-M251 HydrophobicContact CD1-SD 3.98Å; L45-M251 HydrophobicContact CD2-CG 4.46Å; L45-M251 HydrophobicContact CD2-SD 4.21Å
46L68.6Low74.9Confident49 Ų4949 Ų4926%0.25725%0.246SC..Hα-helixtrans-78.6-28.8-180-66.9171.4000113.8N42 N43 Y44 S48 P54N42-L46 WeakPolarHBondContact O-CB 3.46Å; N42-L46 WeakPolarHBondContact O-CG 3.17Å; N42-L46 PolarHBondContact O-N 3.21Å; N43-L46 PolarHBondContact O-N 2.98Å; Y44-L46 VanDerWaalsContact C-N 3.31Å; Y44-L46 PolarHBondContact O-N 3.37Å; L46-S48 VanDerWaalsContact C-N 3.32Å; L46-P54 HydrophobicContact CD2-CB 3.69Å
47D65.8Low74.8Confident114 Ų11448.2 Ų48.261%0.6124%0.242SC*.Hα-helixtrans-83.5-10.1-180-164.941000112.6N43 Y44 K49N43-D47 WeakPolarHBondContact O-CB 3.42Å; N43-D47 PolarHBondContact O-N 2.83Å; Y44-D47 PolarHBondContact O-N 3Å; D47-K49 VanDerWaalsContact C-N 3.35Å; D47-K49 PolarHBondContact O-N 3.25Å
48S62.4Low74.7Confident28 Ų2847 Ų4720%0.19623%0.234CC..SBendtrans-63.599.516569.90000108.4Y44 L45 L46 D50 L51Y44-S48 PolarHBondContact O-N 3.47Å; L45-S48 PolarHBondContact O-OG 2.97Å; L46-S48 VanDerWaalsContact C-N 3.32Å; S48-D50 PolarHBondContact O-N 3.34Å; S48-L51 PolarHBondContact O-N 3.23Å
49K52.4Low75Confident199 Ų19946.7 Ų46.787%0.86523%0.232SC*.THydrogen-bonded Turntrans-51.4-11.4-174.2-70.1-176.9176.7176.80115.4D47D47-K49 VanDerWaalsContact C-N 3.35Å; D47-K49 PolarHBondContact O-N 3.25Å
50D54.8Low75.5Confident103 Ų10347 Ų4755%0.55123%0.23SC*.THydrogen-bonded Turntrans-92-22.2-179.1-60.9-40000113S48 F239S48-D50 PolarHBondContact O-N 3.34Å; D50-F239 VanDerWaalsContact C-CD2 3.5Å; D50-F239 HydrophobicContact CB-CD2 3.67Å; D50-F239 HydrophobicContact CB-CE2 3.42Å; D50-F239 VanDerWaalsContact CB-CE2 3.42Å; D50-F239 WeakPolarHBondContact O-CD2 3.35Å
51L64.4Low75.9Confident6 Ų645.5 Ų45.53%0.03122%0.223CC..  trans-10775.6-176.4-162.396.6000112.7S48 A53 V57 L236 F239 F247S48-L51 PolarHBondContact O-N 3.23Å; L51-A53 HydrophobicContact CG-CB 4.27Å; L51-A53 PolarHBondContact O-N 2.68Å; L51-V57 HydrophobicContact CD2-CG2 3.43Å; L51-V57 VanDerWaalsContact CD2-CG2 3.43Å; L51-L236 HydrophobicContact CD1-CD2 4.07Å; L51-F239 HydrophobicContact CB-CD2 4.26Å; L51-F239 HydrophobicContact CB-CE2 3.69Å; L51-F239 HydrophobicContact CB-CZ 3.98Å; L51-F239 HydrophobicContact CD1-CD1 3.7Å; L51-F239 HydrophobicContact CD1-CD2 4Å; L51-F239 HydrophobicContact CD1-CE1 3.56Å; L51-F239 HydrophobicContact CD1-CE2 3.82Å; L51-F239 HydrophobicContact CD1-CG 3.92Å; L51-F239 HydrophobicContact CD1-CZ 3.61Å; L51-F239 HydrophobicContact CG-CE2 4.4Å; L51-F239 HydrophobicContact CG-CZ 4.41Å; L51-F247 HydrophobicContact CD1-CE2 3.9Å; L51-F247 HydrophobicContact CD1-CZ 3.65Å; L51-F247 HydrophobicContact CD2-CE2 4.01Å; L51-F247 HydrophobicContact CD2-CZ 4.08Å
52D69.9Low76.3Confident68 Ų6844.6 Ų44.636%0.36422%0.219SC..  trans-78.453.6170.9-160.111.8000111.3K117D52-K117 IonicContact OD1-NZ 3.19Å; D52-K117 PolarHBondContact OD1-NZ 3.11Å; D52-K117 IonicContact OD2-NZ 3.41Å; D52-K117 PolarHBondContact OD2-NZ 3.12Å
53A78.1Confident77Confident1 Ų146.8 Ų46.81%0.00823%0.23CC..  trans-137.458.7-176.600000114L51 L55 F56 V57 E232 L236L51-A53 HydrophobicContact CG-CB 4.27Å; L51-A53 PolarHBondContact O-N 2.68Å; A53-L55 VanDerWaalsContact C-N 3.31Å; A53-L55 PolarHBondContact O-N 3.46Å; A53-F56 HydrophobicContact CB-CB 3.95Å; A53-F56 PolarHBondContact O-N 3.19Å; A53-V57 WeakPolarHBondContact O-CG2 3.26Å; A53-V57 PolarHBondContact O-N 2.85Å; A53-V57 VanDerWaalsContact O-N 3.14Å; A53-E232 WeakPolarHBondContact CA-OE2 3.32Å; A53-E232 HydrophobicContact CB-CB 4.02Å; A53-E232 HydrophobicContact CB-CG 4.12Å; A53-L236 HydrophobicContact CB-CD2 3.94Å; A53-L236 HydrophobicContact CB-CG 4.17Å
54P79.1Confident77.7Confident21 Ų2146 Ų4614%0.13623%0.227CC..Hα-helixtrans-60.1-33.1-179.320.7-32.1000115L46 T58 N113 E232L46-P54 HydrophobicContact CD2-CB 3.69Å; P54-T58 PolarHBondContact O-N 3.21Å; P54-T58 PolarHBondContact O-OG1 3.4Å; P54-T58 VanDerWaalsContact O-OG1 3.07Å; P54-N113 HydrophobicContact CB-CB 3.52Å; P54-N113 VanDerWaalsContact CB-CG 3.4Å; P54-N113 WeakPolarHBondContact CB-ND2 3.36Å; P54-N113 HydrophobicContact CG-CB 3.96Å; P54-E232 WeakPolarHBondContact CD-OE1 3.33Å
55L84.4Confident78.2Confident4 Ų440.8 Ų40.82%0.02121%0.207CC..Hα-helixtrans-72.5-39.1-179.9-56.5174.5000110.2A53 T58 F59 T110 F223 L226 I227 F230 E232A53-L55 VanDerWaalsContact C-N 3.31Å; A53-L55 PolarHBondContact O-N 3.46Å; L55-T58 PolarHBondContact O-N 3.47Å; L55-F59 WeakPolarHBondContact O-CB 3.42Å; L55-F59 PolarHBondContact O-N 2.89Å; L55-T110 HydrophobicContact CD2-CG2 4.24Å; L55-T110 WeakPolarHBondContact CD2-OG1 3.33Å; L55-F223 HydrophobicContact CB-CD1 4.33Å; L55-F223 HydrophobicContact CD2-CD1 4.45Å; L55-F223 HydrophobicContact CD2-CE1 4.02Å; L55-L226 HydrophobicContact CD1-CB 4.28Å; L55-L226 HydrophobicContact CD1-CD2 4.46Å; L55-I227 HydrophobicContact CB-CG1 4.06Å; L55-F230 HydrophobicContact CD1-CB 4.17Å; L55-F230 HydrophobicContact CD1-CD2 3.61Å; L55-F230 HydrophobicContact CD1-CE2 4.13Å; L55-F230 HydrophobicContact CD1-CG 3.87Å; L55-E232 WeakPolarHBondContact CB-OE1 3.31Å; L55-E232 WeakPolarHBondContact CB-OE2 3.37Å; L55-E232 WeakPolarHBondContact CG-OE1 3.27Å; L55-E232 PolarHBondContact N-OE1 3.21Å; L55-E232 PolarHBondContact N-OE2 2.84Å
56F86.6Confident78.9Confident30 Ų3042.1 Ų42.113%0.13222%0.215CC..Hα-helixtrans-60.5-44172.4178.7-101.4000112.5A53 T58 F59 Y60 I227 E232 L236 W248 M251A53-F56 HydrophobicContact CB-CB 3.95Å; A53-F56 PolarHBondContact O-N 3.19Å; F56-T58 VanDerWaalsContact C-N 3.3Å; F56-T58 PolarHBondContact O-N 2.87Å; F56-F59 HydrophobicContact CD2-CD1 4.35Å; F56-F59 HydrophobicContact CE2-CD1 4.5Å; F56-F59 WeakPolarHBondContact O-CB 3.32Å; F56-F59 PolarHBondContact O-N 2.84Å; F56-Y60 PolarHBondContact O-N 3.41Å; F56-I227 HydrophobicContact CB-CD1 4.44Å; F56-E232 WeakPolarHBondContact CB-OE2 3.39Å; F56-E232 PolarHBondContact N-OE2 3.28Å; F56-L236 HydrophobicContact CB-CD1 3.94Å; F56-L236 HydrophobicContact CB-CD2 4.41Å; F56-L236 HydrophobicContact CD1-CD1 4.02Å; F56-L236 HydrophobicContact CD1-CD2 3.52Å; F56-L236 HydrophobicContact CD1-CG 4.42Å; F56-L236 HydrophobicContact CD2-CD1 3.45Å; F56-L236 VanDerWaalsContact CD2-CD1 3.45Å; F56-L236 HydrophobicContact CD2-CD2 4.48Å; F56-L236 HydrophobicContact CE1-CD1 4.41Å; F56-L236 HydrophobicContact CE1-CD2 3.82Å; F56-L236 HydrophobicContact CE2-CD1 3.9Å; F56-L236 HydrophobicContact CG-CD1 3.51Å; F56-L236 HydrophobicContact CG-CD2 3.88Å; F56-L236 HydrophobicContact CG-CG 4.31Å; F56-L236 HydrophobicContact CZ-CD1 4.35Å; F56-L236 HydrophobicContact CZ-CD2 4.42Å; F56-W248 HydrophobicContact CE1-CH2 4.49Å; F56-W248 HydrophobicContact CZ-CH2 4.06Å; F56-W248 HydrophobicContact CZ-CZ3 4.49Å; F56-M251 HydrophobicContact CD1-CE 4.23Å; F56-M251 HydrophobicContact CE1-CE 4.06Å
57V84.9Confident79.9Confident6 Ų641.9 Ų41.94%0.03623%0.225CC..Hα-helixtrans-56-48.7175.8174.60000110.5L45 L51 A53 Y60 Q61 M251L45-V57 HydrophobicContact CD1-CG1 4.04Å; L51-V57 HydrophobicContact CD2-CG2 3.43Å; L51-V57 VanDerWaalsContact CD2-CG2 3.43Å; A53-V57 WeakPolarHBondContact O-CG2 3.26Å; A53-V57 PolarHBondContact O-N 2.85Å; A53-V57 VanDerWaalsContact O-N 3.14Å; V57-Y60 PolarHBondContact O-N 3.35Å; V57-Q61 VanDerWaalsContact O-CG 3.3Å; V57-Q61 WeakPolarHBondContact O-CG 3.41Å; V57-Q61 PolarHBondContact O-N 2.96Å; V57-M251 HydrophobicContact CB-CE 4.23Å; V57-M251 HydrophobicContact CB-SD 4.31Å; V57-M251 HydrophobicContact CG1-CE 4.31Å; V57-M251 HydrophobicContact CG1-SD 3.98Å; V57-M251 HydrophobicContact CG2-CE 4.11Å; V57-M251 HydrophobicContact CG2-SD 3.9Å
58T86.3Confident80.9Confident13 Ų1339.2 Ų39.28%0.0821%0.21CC..Hα-helixtrans-68.5-39.8-179.1-49.10000111.8P54 L55 F56 Y60 Q61 C62 I109 F223P54-T58 PolarHBondContact O-N 3.21Å; P54-T58 PolarHBondContact O-OG1 3.4Å; P54-T58 VanDerWaalsContact O-OG1 3.07Å; L55-T58 PolarHBondContact O-N 3.47Å; F56-T58 VanDerWaalsContact C-N 3.3Å; F56-T58 PolarHBondContact O-N 2.87Å; T58-Y60 VanDerWaalsContact C-N 3.34Å; T58-Y60 PolarHBondContact O-N 2.97Å; T58-Q61 PolarHBondContact O-N 3.48Å; T58-C62 WeakPolarHBondContact O-CB 3.46Å; T58-C62 PolarHBondContact O-N 3.32Å; T58-C62 PolarHBondContact O-SG 3.34Å; T58-C62 VanDerWaalsContact O-SG 3.33Å; T58-I109 HydrophobicContact CG2-CD1 4.29Å; T58-I109 HydrophobicContact CG2-CG1 4.14Å; T58-I109 HydrophobicContact CG2-CG2 3.9Å; T58-I109 VanDerWaalsContact OG1-CG2 3.28Å; T58-I109 WeakPolarHBondContact OG1-CG2 3.47Å; T58-F223 HydrophobicContact CG2-CE2 3.88Å; T58-F223 HydrophobicContact CG2-CZ 3.7Å
59F90.8Very high82Confident36 Ų3637.9 Ų37.916%0.15820%0.201CC..Hα-helixtrans-55.6-48.5174.2165.9-100.6000111.6L55 F56 C62 L63 C220 F223 L224 I227L55-F59 WeakPolarHBondContact O-CB 3.42Å; L55-F59 PolarHBondContact O-N 2.89Å; F56-F59 HydrophobicContact CD2-CD1 4.35Å; F56-F59 HydrophobicContact CE2-CD1 4.5Å; F56-F59 WeakPolarHBondContact O-CB 3.32Å; F56-F59 PolarHBondContact O-N 2.84Å; F59-C62 WeakPolarHBondContact O-CB 3.4Å; F59-C62 PolarHBondContact O-N 3.28Å; F59-L63 PolarHBondContact O-N 3.14Å; F59-C220 HydrophobicContact CD2-CB 4.45Å; F59-C220 HydrophobicContact CE2-CB 4.11Å; F59-C220 WeakPolarHBondContact CE2-O 3.22Å; F59-F223 HydrophobicContact CB-CB 3.96Å; F59-F223 HydrophobicContact CB-CD2 4.26Å; F59-F223 HydrophobicContact CB-CG 4.2Å; F59-F223 HydrophobicContact CD2-CB 3.86Å; F59-F223 HydrophobicContact CG-CB 4.32Å; F59-L224 HydrophobicContact CE2-CD2 3.86Å; F59-L224 HydrophobicContact CE2-CG 4.12Å; F59-L224 HydrophobicContact CZ-CD2 3.86Å; F59-I227 HydrophobicContact CB-CD1 3.78Å; F59-I227 HydrophobicContact CD1-CD1 4.24Å; F59-I227 HydrophobicContact CD2-CD1 4.49Å; F59-I227 HydrophobicContact CG-CD1 3.92Å
60Y89.6Confident83.4Confident41 Ų4135.4 Ų35.416%0.16119%0.187CC..Hα-helixtrans-64.7-41.3177.4-176.4-94.3000111.9F56 V57 T58 C62 L63 V64 W248 M251 T252F56-Y60 PolarHBondContact O-N 3.41Å; V57-Y60 PolarHBondContact O-N 3.35Å; T58-Y60 VanDerWaalsContact C-N 3.34Å; T58-Y60 PolarHBondContact O-N 2.97Å; Y60-C62 VanDerWaalsContact C-N 3.32Å; Y60-C62 PolarHBondContact O-N 2.99Å; Y60-L63 WeakPolarHBondContact O-CB 3.42Å; Y60-L63 PolarHBondContact O-N 3.13Å; Y60-L63 VanDerWaalsContact O-N 3.15Å; Y60-V64 HydrophobicContact CD1-CG2 3.94Å; Y60-V64 HydrophobicContact CE1-CG2 3.51Å; Y60-V64 WeakPolarHBondContact O-CG2 3.46Å; Y60-V64 PolarHBondContact O-N 3.48Å; Y60-W248 HydrophobicContact CD2-CE3 4.39Å; Y60-W248 AromaticContact CD2-CZ3 3.76Å; Y60-W248 HydrophobicContact CD2-CZ3 3.76Å; Y60-W248 HydrophobicContact CE1-CE3 4.48Å; Y60-W248 AromaticContact CE2-CE3 3.79Å; Y60-W248 HydrophobicContact CE2-CE3 3.79Å; Y60-W248 AromaticContact CE2-CZ3 3.51Å; Y60-W248 HydrophobicContact CE2-CZ3 3.51Å; Y60-W248 HydrophobicContact CG-CZ3 4.47Å; Y60-W248 AromaticContact CZ-CE3 3.84Å; Y60-M251 HydrophobicContact CD1-CB 3.71Å; Y60-M251 HydrophobicContact CD1-CE 3.87Å; Y60-M251 HydrophobicContact CE1-CB 3.65Å; Y60-M251 HydrophobicContact CG-CE 3.93Å; Y60-T252 PolarHBondContact OH-OG1 3.34Å
61Q89.7Confident84.8Confident15 Ų1532.3 Ų32.37%0.0718%0.179CC..Hα-helixtrans-61-39.8174.7-70.2179.1-1.200112.1N42 V57 T58 V64 T65N42-Q61 PolarHBondContact OD1-NE2 3.27Å; V57-Q61 VanDerWaalsContact O-CG 3.3Å; V57-Q61 WeakPolarHBondContact O-CG 3.41Å; V57-Q61 PolarHBondContact O-N 2.96Å; T58-Q61 PolarHBondContact O-N 3.48Å; Q61-V64 PolarHBondContact O-N 3.03Å; Q61-T65 WeakPolarHBondContact O-CB 3.44Å; Q61-T65 PolarHBondContact O-N 3.49Å; Q61-T65 PolarHBondContact O-OG1 3.42Å
62C89.7Confident85.6Confident4 Ų434 Ų343%0.02719%0.187CC..Hα-helixtrans-63.2-42.4172.6-71.60000111.6T58 F59 Y60 T65 V66 N216T58-C62 WeakPolarHBondContact O-CB 3.46Å; T58-C62 PolarHBondContact O-N 3.32Å; T58-C62 PolarHBondContact O-SG 3.34Å; T58-C62 VanDerWaalsContact O-SG 3.33Å; F59-C62 WeakPolarHBondContact O-CB 3.4Å; F59-C62 PolarHBondContact O-N 3.28Å; Y60-C62 VanDerWaalsContact C-N 3.32Å; Y60-C62 PolarHBondContact O-N 2.99Å; C62-T65 WeakPolarHBondContact O-CB 3.4Å; C62-T65 PolarHBondContact O-N 2.96Å; C62-V66 WeakPolarHBondContact O-CG2 3.43Å; C62-V66 PolarHBondContact O-N 2.89Å; C62-N216 WeakPolarHBondContact CA-OD1 3.47Å; C62-N216 HydrophobicContact CB-CB 4.36Å; C62-N216 WeakPolarHBondContact CB-OD1 3.4Å; C62-N216 PolarHBondContact SG-OD1 3.3Å
63L92.1Very high86Confident87 Ų8733 Ų3346%0.45518%0.18SC..Hα-helixtrans-60.2-47.9176.6-169.193.9000111.5F59 Y60 T65 V66 G67F59-L63 PolarHBondContact O-N 3.14Å; Y60-L63 WeakPolarHBondContact O-CB 3.42Å; Y60-L63 PolarHBondContact O-N 3.13Å; Y60-L63 VanDerWaalsContact O-N 3.15Å; L63-T65 VanDerWaalsContact C-N 3.29Å; L63-T65 PolarHBondContact O-N 3.11Å; L63-V66 PolarHBondContact O-N 2.89Å; L63-G67 PolarHBondContact O-N 2.88Å
64V91.1Very high86Confident21 Ų2137.2 Ų37.213%0.12720%0.202CC..Hα-helixtrans-59.4-42.5175.5172.40000110.4Y60 Q61 V66 G67 L68 T252 V256Y60-V64 HydrophobicContact CD1-CG2 3.94Å; Y60-V64 HydrophobicContact CE1-CG2 3.51Å; Y60-V64 WeakPolarHBondContact O-CG2 3.46Å; Y60-V64 PolarHBondContact O-N 3.48Å; Q61-V64 PolarHBondContact O-N 3.03Å; V64-V66 PolarHBondContact O-N 3.32Å; V64-G67 PolarHBondContact O-N 3.43Å; V64-L68 HydrophobicContact CG1-CD1 3.9Å; V64-L68 HydrophobicContact CG1-CG 4.28Å; V64-L68 WeakPolarHBondContact O-CB 3.37Å; V64-L68 VanDerWaalsContact O-CG 3.3Å; V64-L68 WeakPolarHBondContact O-CG 3.48Å; V64-L68 PolarHBondContact O-N 3.39Å; V64-T252 HydrophobicContact CG1-CG2 4.46Å; V64-V256 HydrophobicContact CG1-CG2 4.45Å
65T88.4Confident86Confident7 Ų739.8 Ų39.84%0.04322%0.215CC..Hα-helixtrans-60.9-43.9177.3-57.50000111.6Q61 C62 L63 L68 C69 F259Q61-T65 WeakPolarHBondContact O-CB 3.44Å; Q61-T65 PolarHBondContact O-N 3.49Å; Q61-T65 PolarHBondContact O-OG1 3.42Å; C62-T65 WeakPolarHBondContact O-CB 3.4Å; C62-T65 PolarHBondContact O-N 2.96Å; L63-T65 VanDerWaalsContact C-N 3.29Å; L63-T65 PolarHBondContact O-N 3.11Å; T65-L68 PolarHBondContact O-N 2.88Å; T65-C69 PolarHBondContact O-N 3.47Å; T65-C69 PolarHBondContact O-SG 3.42Å; T65-F259 HydrophobicContact CG2-CB 4.26Å; T65-F259 HydrophobicContact CG2-CD2 3.86Å
66V88.3Confident85.5Confident31 Ų3140.6 Ų40.619%0.18822%0.221CC..Hα-helixtrans-63-44.3175173.80000111C62 L63 V64 L68 C69 Y70 F213 N216 I217C62-V66 WeakPolarHBondContact O-CG2 3.43Å; C62-V66 PolarHBondContact O-N 2.89Å; L63-V66 PolarHBondContact O-N 2.89Å; V64-V66 PolarHBondContact O-N 3.32Å; V66-L68 PolarHBondContact O-N 3.3Å; V66-C69 PolarHBondContact O-N 2.76Å; V66-Y70 PolarHBondContact O-N 2.95Å; V66-F213 HydrophobicContact CG1-CD2 4.5Å; V66-F213 HydrophobicContact CG1-CE2 3.97Å; V66-N216 HydrophobicContact CG2-CB 3.7Å; V66-I217 HydrophobicContact CG1-CD1 4.47Å; V66-I217 HydrophobicContact CG1-CG1 4.01Å; V66-I217 HydrophobicContact CG2-CG1 3.8Å
67G88.8Confident84.7Confident45 Ų4546.5 Ų46.546%0.46425%0.249SC..Hα-helixtrans-60-43.3176.400000112.7L63 V64 Y70 G71L63-G67 PolarHBondContact O-N 2.88Å; V64-G67 PolarHBondContact O-N 3.43Å; G67-Y70 PolarHBondContact O-N 3.25Å; G67-G71 PolarHBondContact O-N 3.38Å
68L87.9Confident84.1Confident57 Ų5751.9 Ų51.930%0.29828%0.277SS..Hα-helixtrans-65.4-43.7176-71.7171.4000112V64 T65 V66 Y70 G71 M72 V256 F259V64-L68 HydrophobicContact CG1-CD1 3.9Å; V64-L68 HydrophobicContact CG1-CG 4.28Å; V64-L68 WeakPolarHBondContact O-CB 3.37Å; V64-L68 VanDerWaalsContact O-CG 3.3Å; V64-L68 WeakPolarHBondContact O-CG 3.48Å; V64-L68 PolarHBondContact O-N 3.39Å; T65-L68 PolarHBondContact O-N 2.88Å; V66-L68 PolarHBondContact O-N 3.3Å; L68-Y70 VanDerWaalsContact C-N 3.3Å; L68-Y70 PolarHBondContact O-N 2.83Å; L68-G71 PolarHBondContact O-N 2.97Å; L68-M72 WeakPolarHBondContact O-CB 3.19Å; L68-M72 WeakPolarHBondContact O-CG 3.34Å; L68-M72 PolarHBondContact O-N 3.46Å; L68-V256 HydrophobicContact CD1-CG2 4.06Å; L68-F259 HydrophobicContact CB-CD1 4.43Å; L68-F259 HydrophobicContact CB-CD2 4.33Å; L68-F259 HydrophobicContact CB-CG 4.25Å; L68-F259 HydrophobicContact CD1-CB 3.78Å; L68-F259 HydrophobicContact CD1-CD1 4.18Å; L68-F259 HydrophobicContact CD1-CG 4Å
69C84.3Confident83.2Confident0 Ų054 Ų540%029%0.291CS..Hα-helixtrans-57.9-43.5174-74.50000111.8T65 V66 H73 F85 F213 F259T65-C69 PolarHBondContact O-N 3.47Å; T65-C69 PolarHBondContact O-SG 3.42Å; V66-C69 PolarHBondContact O-N 2.76Å; C69-H73 WeakPolarHBondContact O-CB 3.32Å; C69-H73 PolarHBondContact O-N 2.87Å; C69-F85 HydrophobicContact CB-CE1 4.42Å; C69-F85 HydrophobicContact CB-CZ 4.17Å; C69-F85 WeakPolarHBondContact O-CE1 3.18Å; C69-F213 HydrophobicContact CB-CD2 3.56Å; C69-F213 HydrophobicContact CB-CE2 4.2Å; C69-F259 VanDerWaalsContact SG-CE2 3.53Å
70Y83Confident81.7Confident148 Ų14857.7 Ų57.758%0.5832%0.319SS*.Hα-helixtrans-68.1-42.3177.6-171.4-96.8000111.8V66 G67 L68 M72 H73 L74V66-Y70 PolarHBondContact O-N 2.95Å; G67-Y70 PolarHBondContact O-N 3.25Å; L68-Y70 VanDerWaalsContact C-N 3.3Å; L68-Y70 PolarHBondContact O-N 2.83Å; Y70-M72 PolarHBondContact O-N 3.29Å; Y70-H73 WeakPolarHBondContact O-CB 3.29Å; Y70-H73 PolarHBondContact O-N 2.76Å; Y70-L74 PolarHBondContact O-N 3.33Å
71G84.1Confident80Confident37 Ų3759.5 Ų59.538%0.38135%0.349SS..Hα-helixtrans-60.3-43175.100000112.5G67 L68 L74 L75G67-G71 PolarHBondContact O-N 3.38Å; L68-G71 PolarHBondContact O-N 2.97Å; G71-L74 PolarHBondContact O-N 3.12Å; G71-L75 WeakPolarHBondContact O-CB 3.27Å; G71-L75 PolarHBondContact O-N 3.27Å
72M80.4Confident78.3Confident42 Ų4264.6 Ų64.621%0.20738%0.382CS..Hα-helixtrans-66.6-36.6174.6-74.3-171.66900112.6L68 Y70 L75 S76 I83 F85 F259L68-M72 WeakPolarHBondContact O-CB 3.19Å; L68-M72 WeakPolarHBondContact O-CG 3.34Å; L68-M72 PolarHBondContact O-N 3.46Å; Y70-M72 PolarHBondContact O-N 3.29Å; M72-L75 PolarHBondContact O-N 3.03Å; M72-S76 VanDerWaalsContact O-CB 3.31Å; M72-S76 WeakPolarHBondContact O-CB 3.38Å; M72-S76 PolarHBondContact O-N 2.86Å; M72-I83 HydrophobicContact CE-CG2 3.79Å; M72-F85 HydrophobicContact CB-CD1 4.35Å; M72-F85 HydrophobicContact CB-CD2 4Å; M72-F85 HydrophobicContact CB-CE2 4.27Å; M72-F85 HydrophobicContact CB-CG 4.03Å; M72-F85 HydrophobicContact CE-CD2 3.8Å; M72-F85 HydrophobicContact CE-CE2 4.23Å; M72-F85 HydrophobicContact SD-CD2 4.34Å; M72-F85 HydrophobicContact SD-CE2 4.26Å; M72-F259 HydrophobicContact SD-CE1 3.47Å; M72-F259 WeakPolarHBondContact SD-CE1 3.32Å; M72-F259 HydrophobicContact SD-CZ 3.3Å; M72-F259 WeakPolarHBondContact SD-CZ 3.16Å
73H78.6Confident76.7Confident46 Ų4666.5 Ų66.521%0.21339%0.391CS..Hα-helixtrans-61.8-45.1173176.755.2000111.7C69 Y70 S76 H77 F85 V88C69-H73 WeakPolarHBondContact O-CB 3.32Å; C69-H73 PolarHBondContact O-N 2.87Å; Y70-H73 WeakPolarHBondContact O-CB 3.29Å; Y70-H73 PolarHBondContact O-N 2.76Å; H73-S76 PolarHBondContact O-N 3.1Å; H73-H77 PolarHBondContact O-N 3.14Å; H73-F85 HydrophobicContact CB-CD1 4.06Å; H73-F85 HydrophobicContact CB-CE1 4.48Å; H73-V88 HydrophobicContact CB-CG2 4.38Å
74L78.6Confident75Confident90 Ų9070.3 Ų70.347%0.47141%0.412SS..Hα-helixtrans-63.9-42.5176-177.163000111.6Y70 G71 H77 L78Y70-L74 PolarHBondContact O-N 3.33Å; G71-L74 PolarHBondContact O-N 3.12Å; L74-H77 PolarHBondContact O-N 2.84Å; L74-L78 HydrophobicContact CG-CD1 4.12Å; L74-L78 WeakPolarHBondContact O-CG 3.2Å; L74-L78 PolarHBondContact O-N 3.39Å
75L78.3Confident73.6Confident75 Ų7569.9 Ų69.939%0.39341%0.408SS..Hα-helixtrans-67.7-35.3179.9-171.158.7000112.6G71 M72 H77 L78 C79 I83G71-L75 WeakPolarHBondContact O-CB 3.27Å; G71-L75 PolarHBondContact O-N 3.27Å; M72-L75 PolarHBondContact O-N 3.03Å; L75-H77 VanDerWaalsContact C-N 3.29Å; L75-H77 PolarHBondContact O-N 3.23Å; L75-L78 PolarHBondContact O-N 2.98Å; L75-C79 PolarHBondContact O-N 3.27Å; L75-I83 HydrophobicContact CD2-CD1 3.38Å; L75-I83 HydrophobicContact CG-CD1 3.88Å
76S73.5Confident72.3Confident22 Ų2271.1 Ų71.115%0.15442%0.416CS..Hα-helixtrans-59.9-39.2171.1168.10000111.6M72 H73 C79 P80 I83M72-S76 VanDerWaalsContact O-CB 3.31Å; M72-S76 WeakPolarHBondContact O-CB 3.38Å; M72-S76 PolarHBondContact O-N 2.86Å; H73-S76 PolarHBondContact O-N 3.1Å; S76-C79 CarbonylContact O-C 3.58Å; S76-P80 WeakPolarHBondContact O-CA 3.41Å; S76-I83 WeakPolarHBondContact CB-O 3.21Å; S76-I83 PolarHBondContact OG-O 3.45Å
77H70Confident70.8Confident154 Ų15473.2 Ų73.271%0.71343%0.433SS*.Hα-helixtrans-72.5-29.5176.1-164.6-73.4000113.3H73 L74 L75H73-H77 PolarHBondContact O-N 3.14Å; L74-H77 PolarHBondContact O-N 2.84Å; L75-H77 VanDerWaalsContact C-N 3.29Å; L75-H77 PolarHBondContact O-N 3.23Å
78L73Confident69.6Low119 Ų11972.2 Ų72.262%0.62342%0.417SS*.Hα-helixtrans-83.1-31.9178.2-68.3169.6000112.7L74 L75L74-L78 HydrophobicContact CG-CD1 4.12Å; L74-L78 WeakPolarHBondContact O-CG 3.2Å; L74-L78 PolarHBondContact O-N 3.39Å; L75-L78 PolarHBondContact O-N 2.98Å
79C66.4Low68.5Low58 Ų5877.2 Ų77.239%0.39244%0.437SS..  trans-132.972.1-176.9-69.40000111.5L75 S76 G81 V82L75-C79 PolarHBondContact O-N 3.27Å; S76-C79 CarbonylContact O-C 3.58Å; C79-G81 PolarHBondContact O-N 2.82Å; C79-V82 PolarHBondContact O-N 3.2Å
80P60.3Low67.9Low113 Ų11382.9 Ų82.973%0.73446%0.462SS*.THydrogen-bonded Turntrans-65-0.3-173.623.6-32.9000115.6S76S76-P80 WeakPolarHBondContact O-CA 3.41Å
81G53.5Low67.8Low78 Ų7879.1 Ų79.180%0.80445%0.452SS*.THydrogen-bonded Turntrans-107.3-6.5177.400000115.8C79C79-G81 PolarHBondContact O-N 2.82Å
82V54.5Low67.8Low123 Ų12383.4 Ų83.475%0.74547%0.465SS*.THydrogen-bonded Turntrans-114.7-30-172.7-173.80000112.7C79C79-V82 PolarHBondContact O-N 3.2Å
83I55.4Low68Low44 Ų4488.9 Ų88.923%0.22649%0.488CS..  trans-138.8108.3-176.9-63.2168000110.1M72 L75 S76 F85M72-I83 HydrophobicContact CE-CG2 3.79Å; L75-I83 HydrophobicContact CD2-CD1 3.38Å; L75-I83 HydrophobicContact CG-CD1 3.88Å; S76-I83 WeakPolarHBondContact CB-O 3.21Å; S76-I83 PolarHBondContact OG-O 3.45Å; I83-F85 HydrophobicContact CG2-CB 4.22Å; I83-F85 PolarHBondContact O-N 2.89Å
84D55.9Low68.3Low167 Ų16787.3 Ų87.389%0.89348%0.481SS*.  trans-81.995.8168.3-111.6-44.7000109.4
85F62.7Low68.7Low11 Ų1183.5 Ų83.55%0.04846%0.462CS..  trans-114.5130.1172.6-157.5-99.8000110.4C69 M72 H73 I83 V88 W209C69-F85 HydrophobicContact CB-CE1 4.42Å; C69-F85 HydrophobicContact CB-CZ 4.17Å; C69-F85 WeakPolarHBondContact O-CE1 3.18Å; M72-F85 HydrophobicContact CB-CD1 4.35Å; M72-F85 HydrophobicContact CB-CD2 4Å; M72-F85 HydrophobicContact CB-CE2 4.27Å; M72-F85 HydrophobicContact CB-CG 4.03Å; M72-F85 HydrophobicContact CE-CD2 3.8Å; M72-F85 HydrophobicContact CE-CE2 4.23Å; M72-F85 HydrophobicContact SD-CD2 4.34Å; M72-F85 HydrophobicContact SD-CE2 4.26Å; H73-F85 HydrophobicContact CB-CD1 4.06Å; H73-F85 HydrophobicContact CB-CE1 4.48Å; I83-F85 HydrophobicContact CG2-CB 4.22Å; I83-F85 PolarHBondContact O-N 2.89Å; F85-V88 HydrophobicContact CD1-CG2 4.07Å; F85-V88 HydrophobicContact CE1-CG2 3.59Å; F85-W209 HydrophobicContact CE2-CB 4.04Å; F85-W209 AromaticContact CE2-CD2 3.85Å; F85-W209 HydrophobicContact CE2-CD2 3.85Å; F85-W209 AromaticContact CE2-CE3 3.81Å; F85-W209 HydrophobicContact CE2-CE3 3.81Å; F85-W209 AromaticContact CE2-CG 3.97Å; F85-W209 HydrophobicContact CE2-CG 3.97Å; F85-W209 HydrophobicContact CZ-CB 4.05Å; F85-W209 HydrophobicContact CZ-CE3 4.31Å; F85-W209 HydrophobicContact CZ-CG 4.46Å
86P60.6Low69.2Low33 Ų3389.5 Ų89.521%0.21448%0.48CS..  trans-59.3145.1-176.726.2-36.8000111.6V88 N207 W209P86-V88 WeakPolarHBondContact O-CG2 3.17Å; P86-V88 PolarHBondContact O-N 3.37Å; P86-N207 VanDerWaalsContact CB-ND2 3.29Å; P86-N207 WeakPolarHBondContact CB-ND2 3.21Å; P86-N207 VanDerWaalsContact CG-ND2 3.34Å; P86-N207 WeakPolarHBondContact CG-ND2 3.4Å; P86-W209 HydrophobicContact CG-CB 3.99Å
87S57.8Low69.9Low76 Ų7693.6 Ų93.653%0.53150%0.496SS..  trans-60.9108174.5-1760000109.7K89S87-K89 VanDerWaalsContact C-N 3.34Å; S87-K89 PolarHBondContact O-N 3.31Å; S87-K89 VanDerWaalsContact O-N 3.07Å
88V62.3Low70.8Confident24 Ų2486.2 Ų86.215%0.14546%0.462CS..  trans-85.281.6-179.2-1710000108.6H73 F85 P86 F213H73-V88 HydrophobicContact CB-CG2 4.38Å; F85-V88 HydrophobicContact CD1-CG2 4.07Å; F85-V88 HydrophobicContact CE1-CG2 3.59Å; P86-V88 WeakPolarHBondContact O-CG2 3.17Å; P86-V88 PolarHBondContact O-N 3.37Å; V88-F213 HydrophobicContact CG1-CD1 3.2Å; V88-F213 HydrophobicContact CG1-CD2 4.01Å; V88-F213 HydrophobicContact CG1-CE1 3.03Å; V88-F213 HydrophobicContact CG1-CE2 3.86Å; V88-F213 HydrophobicContact CG1-CG 3.67Å; V88-F213 HydrophobicContact CG1-CZ 3.36Å
89K65.2Low71.7Confident162 Ų16283.6 Ų83.670%0.70445%0.448SS*.  trans-79.9128.5167.7-64.4-176.9-178.7178.70108S87 D91 Y214S87-K89 VanDerWaalsContact C-N 3.34Å; S87-K89 PolarHBondContact O-N 3.31Å; S87-K89 VanDerWaalsContact O-N 3.07Å; K89-D91 PolarHBondContact O-N 3.46Å; K89-Y214 PolarHBondContact O-OH 3.12Å
90F71.7Confident72.8Confident119 Ų11983.6 Ų83.652%0.52245%0.447SS..  trans-77.2109.8174.8-176.6-101.4000109.6L92 C95 I217F90-L92 HydrophobicContact CE1-CD2 3.58Å; F90-L92 HydrophobicContact CE1-CG 4.06Å; F90-L92 HydrophobicContact CZ-CD2 3.85Å; F90-C95 VanDerWaalsContact CE2-SG 3.57Å; F90-I217 HydrophobicContact CD2-CD1 4.14Å; F90-I217 HydrophobicContact CE2-CD1 4.16Å; F90-I217 HydrophobicContact CE2-CG2 4.16Å
91D81.4Confident74.2Confident69 Ų6978.3 Ų78.337%0.36941%0.413SS..  trans-118.7118.3177.1-169.7-19.8000110.1K89 K93 V94 C95 Y214K89-D91 PolarHBondContact O-N 3.46Å; D91-K93 PolarHBondContact O-N 3.29Å; D91-K93 WeakPolarHBondContact OD1-CB 3.11Å; D91-K93 PolarHBondContact OD1-N 3.28Å; D91-V94 HydrophobicContact CB-CB 4.34Å; D91-V94 HydrophobicContact CB-CG2 3.97Å; D91-V94 PolarHBondContact O-N 3.32Å; D91-V94 VanDerWaalsContact O-N 3.16Å; D91-C95 PolarHBondContact O-N 3.1Å; D91-Y214 PolarHBondContact N-OH 3.35Å; D91-Y214 WeakPolarHBondContact O-CE1 3.42Å
92L83.3Confident76Confident126 Ų12674.6 Ų74.666%0.6638%0.375SS*.Hα-helixtrans-61.1-27.7179-70.3171.4000112.8F90 C95 R96F90-L92 HydrophobicContact CE1-CD2 3.58Å; F90-L92 HydrophobicContact CE1-CG 4.06Å; F90-L92 HydrophobicContact CZ-CD2 3.85Å; L92-C95 WeakPolarHBondContact O-CB 3.41Å; L92-R96 PolarHBondContact O-N 3.23Å
93K85.7Confident77.8Confident158 Ų15873.3 Ų73.369%0.68736%0.363SS*.Hα-helixtrans-66.2-46.5175.9-65.3178-179.4175.20110.7D91 R96 E97D91-K93 PolarHBondContact O-N 3.29Å; D91-K93 WeakPolarHBondContact OD1-CB 3.11Å; D91-K93 PolarHBondContact OD1-N 3.28Å; K93-R96 WeakPolarHBondContact O-CB 3.4Å; K93-R96 PolarHBondContact O-N 2.84Å; K93-R96 VanDerWaalsContact O-N 3.15Å; K93-E97 PolarHBondContact O-N 3.35Å
94V84.6Confident79.5Confident13 Ų1372.2 Ų72.28%0.07936%0.358CS..Hα-helixtrans-66.3-40.2177.8-176.70000110.5D91 R96 E97 V98 V204 Y214D91-V94 HydrophobicContact CB-CB 4.34Å; D91-V94 HydrophobicContact CB-CG2 3.97Å; D91-V94 PolarHBondContact O-N 3.32Å; D91-V94 VanDerWaalsContact O-N 3.16Å; V94-R96 VanDerWaalsContact C-N 3.28Å; V94-R96 PolarHBondContact O-N 3.41Å; V94-E97 PolarHBondContact O-N 3.17Å; V94-V98 HydrophobicContact CG1-CG2 4.21Å; V94-V98 VanDerWaalsContact O-CG2 3.23Å; V94-V98 WeakPolarHBondContact O-CG2 3.28Å; V94-V98 PolarHBondContact O-N 3.41Å; V94-V204 HydrophobicContact CG1-CG1 3.71Å; V94-Y214 HydrophobicContact CB-CD1 4.26Å; V94-Y214 HydrophobicContact CB-CE1 3.79Å; V94-Y214 HydrophobicContact CB-CE2 4.14Å; V94-Y214 HydrophobicContact CG1-CD1 4.01Å; V94-Y214 HydrophobicContact CG1-CD2 3.63Å; V94-Y214 HydrophobicContact CG1-CE1 3.92Å; V94-Y214 HydrophobicContact CG1-CE2 3.59Å; V94-Y214 HydrophobicContact CG1-CG 3.87Å
95C85.6Confident81Confident10 Ų1065.8 Ų65.87%0.06832%0.322CS..Hα-helixtrans-52.7-46170.5-81.80000112F90 D91 L92 V98 L99 Y214 N218F90-C95 VanDerWaalsContact CE2-SG 3.57Å; D91-C95 PolarHBondContact O-N 3.1Å; L92-C95 WeakPolarHBondContact O-CB 3.41Å; C95-V98 PolarHBondContact O-N 2.96Å; C95-L99 PolarHBondContact O-N 2.92Å; C95-Y214 HydrophobicContact CB-CD1 4.36Å; C95-Y214 WeakPolarHBondContact SG-CD1 3.36Å; C95-N218 PolarHBondContact O-ND2 3.28Å
96R89.3Confident82.3Confident201 Ų20165.7 Ų65.776%0.75832%0.322SS*.Hα-helixtrans-67.6-37.1-179.5-173.4178.3177.3-177-0.6112.6L92 K93 V94 V98 L99L92-R96 PolarHBondContact O-N 3.23Å; K93-R96 WeakPolarHBondContact O-CB 3.4Å; K93-R96 PolarHBondContact O-N 2.84Å; K93-R96 VanDerWaalsContact O-N 3.15Å; V94-R96 VanDerWaalsContact C-N 3.28Å; V94-R96 PolarHBondContact O-N 3.41Å; R96-V98 VanDerWaalsContact C-N 3.34Å; R96-L99 VanDerWaalsContact O-CB 3.31Å; R96-L99 WeakPolarHBondContact O-CB 3.43Å; R96-L99 PolarHBondContact O-N 3.47Å
97E88.5Confident83.6Confident107 Ų10764.9 Ų64.950%0.532%0.32SS..Hα-helixtrans-70.4-31.7176.9-71.2-176.3172.600112.6K93 V94 P100 A203K93-E97 PolarHBondContact O-N 3.35Å; V94-E97 PolarHBondContact O-N 3.17Å; E97-P100 WeakPolarHBondContact O-CD 3.5Å; E97-A203 HydrophobicContact CB-CB 4.25Å; E97-A203 WeakPolarHBondContact OE2-CB 3.13Å
98V89.9Confident85Confident0 Ų062.4 Ų62.40%030%0.3CS..Hα-helixtrans-81.7-16.1175.7-178.60000112.2V94 C95 R96 P100 L101 S102 V200 V204 L211 N215V94-V98 HydrophobicContact CG1-CG2 4.21Å; V94-V98 VanDerWaalsContact O-CG2 3.23Å; V94-V98 WeakPolarHBondContact O-CG2 3.28Å; V94-V98 PolarHBondContact O-N 3.41Å; C95-V98 PolarHBondContact O-N 2.96Å; R96-V98 VanDerWaalsContact C-N 3.34Å; V98-P100 VanDerWaalsContact C-CD 3.48Å; V98-L101 HydrophobicContact CG1-CB 4.48Å; V98-L101 HydrophobicContact CG1-CD2 4.3Å; V98-L101 VanDerWaalsContact O-CB 3.28Å; V98-L101 WeakPolarHBondContact O-CB 3.36Å; V98-L101 PolarHBondContact O-N 2.91Å; V98-S102 PolarHBondContact O-N 2.92Å; V98-S102 VanDerWaalsContact O-N 3.12Å; V98-S102 PolarHBondContact O-OG 2.74Å; V98-V200 HydrophobicContact CB-CG1 4.25Å; V98-V200 HydrophobicContact CG2-CG1 3.61Å; V98-V204 HydrophobicContact CG2-CG1 4.14Å; V98-L211 HydrophobicContact CG1-CD1 4.3Å; V98-L211 HydrophobicContact CG2-CD1 4.08Å; V98-N215 HydrophobicContact CG1-CB 3.99Å
99L90.6Very high86Confident64 Ų6462.6 Ų62.634%0.33530%0.3SS..Hα-helixtrans-54.1-44.1-175.9-170.771.1000114.7C95 R96 L101 S102 I103 N218 L222C95-L99 PolarHBondContact O-N 2.92Å; R96-L99 VanDerWaalsContact O-CB 3.31Å; R96-L99 WeakPolarHBondContact O-CB 3.43Å; R96-L99 PolarHBondContact O-N 3.47Å; L99-L101 VanDerWaalsContact C-N 3.26Å; L99-L101 PolarHBondContact O-N 3.21Å; L99-S102 PolarHBondContact O-N 2.96Å; L99-S102 VanDerWaalsContact O-N 3.1Å; L99-I103 HydrophobicContact CG-CD1 4.16Å; L99-I103 WeakPolarHBondContact O-CG1 3.19Å; L99-I103 PolarHBondContact O-N 3.45Å; L99-N218 PolarHBondContact N-ND2 2.86Å; L99-L222 HydrophobicContact CD1-CD1 3.98Å
100P89.9Confident86.9Confident57 Ų5755.6 Ų55.637%0.3727%0.271SS..Hα-helixtrans-61-36.1177.6-22.134.5000112.7E97 V98 V104E97-P100 WeakPolarHBondContact O-CD 3.5Å; V98-P100 VanDerWaalsContact C-CD 3.48Å; P100-V104 WeakPolarHBondContact O-CG2 3.26Å; P100-V104 PolarHBondContact O-N 3.49Å
101L89.7Confident87.7Confident3 Ų352.7 Ų52.72%0.01626%0.258CS..Hα-helixtrans-63.1-45.8174.2175.364.3000110.4V98 L99 I103 V104 F105 N193 F196 T197 L211V98-L101 HydrophobicContact CG1-CB 4.48Å; V98-L101 HydrophobicContact CG1-CD2 4.3Å; V98-L101 VanDerWaalsContact O-CB 3.28Å; V98-L101 WeakPolarHBondContact O-CB 3.36Å; V98-L101 PolarHBondContact O-N 2.91Å; L99-L101 VanDerWaalsContact C-N 3.26Å; L99-L101 PolarHBondContact O-N 3.21Å; L101-I103 PolarHBondContact O-N 3.48Å; L101-V104 PolarHBondContact O-N 3.23Å; L101-F105 WeakPolarHBondContact O-CB 3.47Å; L101-F105 PolarHBondContact O-N 3.15Å; L101-N193 WeakPolarHBondContact CD1-O 2.82Å; L101-N193 WeakPolarHBondContact CD1-OD1 3.38Å; L101-F196 HydrophobicContact CB-CB 4.28Å; L101-F196 HydrophobicContact CD1-CB 3.89Å; L101-T197 WeakPolarHBondContact CD1-OG1 3.49Å; L101-L211 HydrophobicContact CD2-CD1 3.88Å; L101-L211 HydrophobicContact CD2-CD2 4.22Å; L101-L211 HydrophobicContact CD2-CG 4.1Å
102S90.8Very high87.8Confident0 Ų050.3 Ų50.30%025%0.245CC..Hα-helixtrans-64.5-38.2-179.4-51.40000113.2V98 L99 F105 I106 N215 N218V98-S102 PolarHBondContact O-N 2.92Å; V98-S102 VanDerWaalsContact O-N 3.12Å; V98-S102 PolarHBondContact O-OG 2.74Å; L99-S102 PolarHBondContact O-N 2.96Å; L99-S102 VanDerWaalsContact O-N 3.1Å; S102-F105 WeakPolarHBondContact O-CB 3.23Å; S102-F105 PolarHBondContact O-N 2.92Å; S102-I106 VanDerWaalsContact O-CG1 3.27Å; S102-I106 WeakPolarHBondContact O-CG1 3.16Å; S102-I106 PolarHBondContact O-N 3.27Å; S102-N215 WeakPolarHBondContact CA-OD1 3.45Å; S102-N215 WeakPolarHBondContact CB-OD1 3.34Å; S102-N215 PolarHBondContact N-OD1 2.96Å; S102-N215 PolarHBondContact OG-OD1 3.03Å; S102-N218 WeakPolarHBondContact OG-CB 2.9Å; S102-N218 PolarHBondContact OG-ND2 3.42Å
103I92.2Very high87.6Confident95 Ų9545.3 Ų45.349%0.48722%0.22SC..Hα-helixtrans-61.8-46.6174.8-67.7167000110.6L99 L101 I106 G107 L222L99-I103 HydrophobicContact CG-CD1 4.16Å; L99-I103 WeakPolarHBondContact O-CG1 3.19Å; L99-I103 PolarHBondContact O-N 3.45Å; L101-I103 PolarHBondContact O-N 3.48Å; I103-I106 PolarHBondContact O-N 3.33Å; I103-G107 PolarHBondContact O-N 3.25Å; I103-L222 HydrophobicContact CG1-CD1 3.97Å
104V91.4Very high87.3Confident21 Ų2139.9 Ų39.913%0.12720%0.198CC..Hα-helixtrans-67.9-37.7179174.60000111.7P100 L101 I106 G107 M108 C189 L192 N193 F196P100-V104 WeakPolarHBondContact O-CG2 3.26Å; P100-V104 PolarHBondContact O-N 3.49Å; L101-V104 PolarHBondContact O-N 3.23Å; V104-I106 VanDerWaalsContact C-N 3.33Å; V104-I106 PolarHBondContact O-N 3.13Å; V104-G107 PolarHBondContact O-N 3.15Å; V104-M108 WeakPolarHBondContact O-CB 3.37Å; V104-M108 PolarHBondContact O-N 2.87Å; V104-C189 HydrophobicContact CG1-CB 4.5Å; V104-C189 VanDerWaalsContact CG1-O 3.29Å; V104-C189 WeakPolarHBondContact CG1-O 3.38Å; V104-L192 HydrophobicContact CG1-CB 3.54Å; V104-L192 HydrophobicContact CG2-CB 4.46Å; V104-N193 HydrophobicContact CG1-CB 3.97Å; V104-F196 HydrophobicContact CB-CD2 4.36Å; V104-F196 HydrophobicContact CG2-CD2 3.77Å; V104-F196 HydrophobicContact CG2-CE2 3.76Å
105F88.8Confident87.1Confident32 Ų3239.3 Ų39.314%0.1419%0.194CC..Hα-helixtrans-58.2-44.6173.8173.3-103.8000111.6L101 S102 M108 I109 A219 F223L101-F105 WeakPolarHBondContact O-CB 3.47Å; L101-F105 PolarHBondContact O-N 3.15Å; S102-F105 WeakPolarHBondContact O-CB 3.23Å; S102-F105 PolarHBondContact O-N 2.92Å; F105-M108 HydrophobicContact CD2-CE 3.44Å; F105-M108 VanDerWaalsContact CD2-CE 3.44Å; F105-M108 HydrophobicContact CE2-CE 3.63Å; F105-M108 HydrophobicContact CG-CE 4.47Å; F105-M108 WeakPolarHBondContact O-CB 3.08Å; F105-M108 PolarHBondContact O-N 3.35Å; F105-I109 HydrophobicContact CE1-CG1 4.27Å; F105-I109 HydrophobicContact CE2-CD1 4.3Å; F105-I109 HydrophobicContact CE2-CG1 4.15Å; F105-I109 HydrophobicContact CZ-CD1 4.28Å; F105-I109 HydrophobicContact CZ-CG1 3.99Å; F105-I109 WeakPolarHBondContact O-CG1 3.3Å; F105-I109 PolarHBondContact O-N 3.42Å; F105-A219 HydrophobicContact CD1-CB 4.21Å; F105-A219 HydrophobicContact CE1-CB 4.24Å; F105-F223 HydrophobicContact CE1-CE2 4.34Å
106I88.4Confident86.5Confident9 Ų941.1 Ų41.15%0.04620%0.203CC..Hα-helixtrans-66.3-43.5177.2-68.8166.8000111.3S102 I103 V104 M108 I109 T110 L222 F223 L226S102-I106 VanDerWaalsContact O-CG1 3.27Å; S102-I106 WeakPolarHBondContact O-CG1 3.16Å; S102-I106 PolarHBondContact O-N 3.27Å; I103-I106 PolarHBondContact O-N 3.33Å; V104-I106 VanDerWaalsContact C-N 3.33Å; V104-I106 PolarHBondContact O-N 3.13Å; I106-M108 VanDerWaalsContact C-N 3.3Å; I106-M108 PolarHBondContact O-N 2.9Å; I106-I109 PolarHBondContact O-N 3.24Å; I106-T110 WeakPolarHBondContact O-CB 3.38Å; I106-T110 PolarHBondContact O-N 3.27Å; I106-T110 PolarHBondContact O-OG1 3.15Å; I106-L222 HydrophobicContact CD1-CB 3.15Å; I106-L222 HydrophobicContact CD1-CD1 3.64Å; I106-L222 HydrophobicContact CD1-CG 4.04Å; I106-F223 HydrophobicContact CB-CE1 4.35Å; I106-F223 HydrophobicContact CB-CZ 4.44Å; I106-F223 HydrophobicContact CG1-CD1 4.39Å; I106-F223 HydrophobicContact CG1-CD2 4.45Å; I106-F223 HydrophobicContact CG1-CE1 3.98Å; I106-F223 HydrophobicContact CG1-CE2 4.05Å; I106-F223 HydrophobicContact CG1-CZ 3.79Å; I106-F223 HydrophobicContact CG2-CD1 4.24Å; I106-F223 HydrophobicContact CG2-CE1 3.87Å; I106-F223 HydrophobicContact CG2-CZ 4.45Å; I106-L226 HydrophobicContact CG2-CD2 3.46Å; I106-L226 VanDerWaalsContact CG2-CD2 3.46Å
107G88.5Confident85.8Confident17 Ų1737 Ų3718%0.17519%0.191CC..Hα-helixtrans-58.1-44.3174.100000111.8I103 V104 I109 T110 F111I103-G107 PolarHBondContact O-N 3.25Å; V104-G107 PolarHBondContact O-N 3.15Å; G107-I109 PolarHBondContact O-N 3.38Å; G107-T110 PolarHBondContact O-N 3.42Å; G107-F111 WeakPolarHBondContact O-CB 3.3Å; G107-F111 WeakPolarHBondContact O-CD2 3.46Å; G107-F111 WeakPolarHBondContact O-CG 3.38Å; G107-F111 PolarHBondContact O-N 2.96Å
108M88.4Confident85.1Confident23 Ų2335.5 Ų35.511%0.11318%0.183CC..Hα-helixtrans-56.2-50.1174.8174.9-169.576.100111.7V104 F105 I106 N112 C189 V190 N193V104-M108 WeakPolarHBondContact O-CB 3.37Å; V104-M108 PolarHBondContact O-N 2.87Å; F105-M108 HydrophobicContact CD2-CE 3.44Å; F105-M108 VanDerWaalsContact CD2-CE 3.44Å; F105-M108 HydrophobicContact CE2-CE 3.63Å; F105-M108 HydrophobicContact CG-CE 4.47Å; F105-M108 WeakPolarHBondContact O-CB 3.08Å; F105-M108 PolarHBondContact O-N 3.35Å; I106-M108 VanDerWaalsContact C-N 3.3Å; I106-M108 PolarHBondContact O-N 2.9Å; M108-N112 WeakPolarHBondContact O-CB 3.47Å; M108-N112 PolarHBondContact O-N 3.44Å; M108-N112 PolarHBondContact O-ND2 3.42Å; M108-C189 HydrophobicContact CB-CB 3.81Å; M108-V190 HydrophobicContact CG-CB 4.44Å; M108-V190 HydrophobicContact CG-CG2 3.56Å; M108-V190 HydrophobicContact SD-CB 4.27Å; M108-V190 HydrophobicContact SD-CG2 3.68Å; M108-N193 HydrophobicContact SD-CB 4.3Å
109I83.4Confident84.3Confident29 Ų2935.9 Ų35.915%0.14919%0.186CC..Hα-helixtrans-64-47.4179.4-67-65.2000110.9T58 F105 I106 G107 F111 N112 N113 F223T58-I109 HydrophobicContact CG2-CD1 4.29Å; T58-I109 HydrophobicContact CG2-CG1 4.14Å; T58-I109 HydrophobicContact CG2-CG2 3.9Å; T58-I109 VanDerWaalsContact OG1-CG2 3.28Å; T58-I109 WeakPolarHBondContact OG1-CG2 3.47Å; F105-I109 HydrophobicContact CE1-CG1 4.27Å; F105-I109 HydrophobicContact CE2-CD1 4.3Å; F105-I109 HydrophobicContact CE2-CG1 4.15Å; F105-I109 HydrophobicContact CZ-CD1 4.28Å; F105-I109 HydrophobicContact CZ-CG1 3.99Å; F105-I109 WeakPolarHBondContact O-CG1 3.3Å; F105-I109 PolarHBondContact O-N 3.42Å; I106-I109 PolarHBondContact O-N 3.24Å; G107-I109 PolarHBondContact O-N 3.38Å; I109-F111 PolarHBondContact O-N 2.81Å; I109-N112 PolarHBondContact O-N 3.32Å; I109-N113 VanDerWaalsContact CG2-ND2 3.32Å; I109-N113 WeakPolarHBondContact CG2-ND2 3.36Å; I109-N113 WeakPolarHBondContact O-CB 3.45Å; I109-N113 PolarHBondContact O-N 3.47Å; I109-N113 PolarHBondContact O-ND2 2.83Å; I109-F223 HydrophobicContact CB-CZ 4.5Å; I109-F223 HydrophobicContact CG2-CZ 4.31Å
110T83.5Confident83.3Confident15 Ų1535.2 Ų35.29%0.09219%0.194CC..Hα-helixtrans-58.9-52.5-178.6-530000110.9L55 I106 G107 N112 N113 L114 F230L55-T110 HydrophobicContact CD2-CG2 4.24Å; L55-T110 WeakPolarHBondContact CD2-OG1 3.33Å; I106-T110 WeakPolarHBondContact O-CB 3.38Å; I106-T110 PolarHBondContact O-N 3.27Å; I106-T110 PolarHBondContact O-OG1 3.15Å; G107-T110 PolarHBondContact O-N 3.42Å; T110-N112 PolarHBondContact O-N 2.84Å; T110-N113 PolarHBondContact O-N 3.4Å; T110-L114 HydrophobicContact CG2-CD1 4.14Å; T110-L114 WeakPolarHBondContact O-CG 3.43Å; T110-L114 PolarHBondContact O-N 3.38Å; T110-F230 HydrophobicContact CG2-CZ 4.06Å
111F87.3Confident82.3Confident57 Ų5733.4 Ų33.425%0.2518%0.182CC..Hα-helixtrans-68.5-33.5179.2-63.5-48.8000112.8G107 I109 L114 C115 F182 L185 A186G107-F111 WeakPolarHBondContact O-CB 3.3Å; G107-F111 WeakPolarHBondContact O-CD2 3.46Å; G107-F111 WeakPolarHBondContact O-CG 3.38Å; G107-F111 PolarHBondContact O-N 2.96Å; I109-F111 PolarHBondContact O-N 2.81Å; F111-L114 HydrophobicContact CD1-CD1 4.48Å; F111-C115 VanDerWaalsContact O-CB 3.26Å; F111-C115 WeakPolarHBondContact O-CB 3.46Å; F111-C115 PolarHBondContact O-N 3.13Å; F111-F182 AromaticContact CD1-CD1 3.76Å; F111-F182 HydrophobicContact CD1-CD1 3.76Å; F111-F182 HydrophobicContact CD1-CE1 4.21Å; F111-F182 HydrophobicContact CE1-CD1 4.29Å; F111-F182 HydrophobicContact CE1-CE1 4.37Å; F111-L185 HydrophobicContact CB-CB 4.49Å; F111-L185 HydrophobicContact CD1-CB 4.44Å; F111-L185 HydrophobicContact CD1-CD1 4.34Å; F111-L185 HydrophobicContact CD2-CB 4.05Å; F111-L185 HydrophobicContact CE1-CD1 4.03Å; F111-L185 HydrophobicContact CE2-CB 4.38Å; F111-L185 HydrophobicContact CG-CB 4.1Å; F111-L185 HydrophobicContact CZ-CD1 4.16Å; F111-A186 HydrophobicContact CB-CB 3.67Å
112N84.8Confident81.2Confident19 Ų1933.9 Ų33.910%0.10219%0.186CC..Hα-helixtrans-61.5-46173.5-85.5-34.9000111.4M108 I109 T110 C115 L116 Y124 A186M108-N112 WeakPolarHBondContact O-CB 3.47Å; M108-N112 PolarHBondContact O-N 3.44Å; M108-N112 PolarHBondContact O-ND2 3.42Å; I109-N112 PolarHBondContact O-N 3.32Å; T110-N112 PolarHBondContact O-N 2.84Å; N112-C115 WeakPolarHBondContact O-CB 3.5Å; N112-C115 PolarHBondContact O-N 3.03Å; N112-L116 PolarHBondContact O-N 3.47Å; N112-Y124 HydrophobicContact CB-CE2 4.4Å; N112-Y124 WeakPolarHBondContact OD1-CE2 3.5Å; N112-Y124 PolarHBondContact OD1-OH 3.03Å; N112-A186 HydrophobicContact CB-CB 4.49Å; N112-A186 VanDerWaalsContact OD1-CB 3.3Å; N112-A186 WeakPolarHBondContact OD1-CB 3.49Å
113N78.1Confident80.4Confident22 Ų2234 Ų3412%0.11819%0.187CC..Hα-helixtrans-68.2-41.9-179.4-72-40.1000111.7P54 I109 T110 C115 L116 K117P54-N113 HydrophobicContact CB-CB 3.52Å; P54-N113 VanDerWaalsContact CB-CG 3.4Å; P54-N113 WeakPolarHBondContact CB-ND2 3.36Å; P54-N113 HydrophobicContact CG-CB 3.96Å; I109-N113 VanDerWaalsContact CG2-ND2 3.32Å; I109-N113 WeakPolarHBondContact CG2-ND2 3.36Å; I109-N113 WeakPolarHBondContact O-CB 3.45Å; I109-N113 PolarHBondContact O-N 3.47Å; I109-N113 PolarHBondContact O-ND2 2.83Å; T110-N113 PolarHBondContact O-N 3.4Å; N113-C115 VanDerWaalsContact C-N 3.28Å; N113-C115 PolarHBondContact O-N 3.35Å; N113-L116 PolarHBondContact O-N 3Å; N113-K117 PolarHBondContact O-N 2.81Å
114L79.5Confident79.6Confident43 Ų4330.6 Ų30.623%0.22517%0.168CC..Hα-helixtrans-62.3-35.6173.2-69172.7000112.3T110 F111 H118 F182T110-L114 HydrophobicContact CG2-CD1 4.14Å; T110-L114 WeakPolarHBondContact O-CG 3.43Å; T110-L114 PolarHBondContact O-N 3.38Å; F111-L114 HydrophobicContact CD1-CD1 4.48Å; L114-H118 PolarHBondContact O-CD2 3.19Å; L114-H118 PolarHBondContact O-N 2.68Å; L114-F182 HydrophobicContact CB-CB 4.31Å; L114-F182 HydrophobicContact CB-CD1 4.32Å; L114-F182 HydrophobicContact CB-CD2 3.76Å; L114-F182 HydrophobicContact CB-CE2 4.08Å; L114-F182 HydrophobicContact CB-CG 3.89Å; L114-F182 HydrophobicContact CD1-CD1 4.24Å; L114-F182 HydrophobicContact CD1-CE1 3.94Å; L114-F182 HydrophobicContact CD1-CE2 4.35Å; L114-F182 HydrophobicContact CD1-CZ 4Å
115C80.8Confident78.6Confident1 Ų130.1 Ų30.11%0.00717%0.165CC..Hα-helixtrans-63.7-50.1173.4179.40000111.4F111 N112 N113 K117 H118 V119 G179 F182 G183F111-C115 VanDerWaalsContact O-CB 3.26Å; F111-C115 WeakPolarHBondContact O-CB 3.46Å; F111-C115 PolarHBondContact O-N 3.13Å; N112-C115 WeakPolarHBondContact O-CB 3.5Å; N112-C115 PolarHBondContact O-N 3.03Å; N113-C115 VanDerWaalsContact C-N 3.28Å; N113-C115 PolarHBondContact O-N 3.35Å; C115-K117 VanDerWaalsContact C-N 3.26Å; C115-K117 PolarHBondContact O-N 3.35Å; C115-H118 CarbonylContact O-C 3.43Å; C115-H118 PolarHBondContact O-N 3.01Å; C115-V119 PolarHBondContact O-N 3.45Å; C115-G179 PolarHBondContact SG-O 3.26Å; C115-F182 HydrophobicContact CB-CB 4.13Å; C115-G183 WeakPolarHBondContact SG-CA 3.27Å
116L73.1Confident78Confident48 Ų4828.6 Ų28.625%0.25116%0.159SC..Hα-helixtrans-64.5-28.7179.6-74.5170000113.2N112 N113 H118 V119 V121 Y124N112-L116 PolarHBondContact O-N 3.47Å; N113-L116 PolarHBondContact O-N 3Å; L116-H118 VanDerWaalsContact C-N 3.26Å; L116-H118 PolarHBondContact O-N 3.43Å; L116-V119 CarbonylContact C-O 3.57Å; L116-V119 WeakPolarHBondContact CA-O 3.29Å; L116-V119 VanDerWaalsContact O-O 3.06Å; L116-V121 HydrophobicContact CD2-CG2 4.26Å; L116-Y124 HydrophobicContact CD2-CD1 4.15Å; L116-Y124 HydrophobicContact CD2-CD2 3.91Å; L116-Y124 HydrophobicContact CD2-CG 3.62Å; L116-Y124 HydrophobicContact CG-CD2 3.98Å; L116-Y124 HydrophobicContact CG-CE2 4.42Å; L116-Y124 HydrophobicContact CG-CG 4.2Å
117K73.6Confident77.6Confident116 Ų11628.4 Ų28.450%0.50416%0.159SC..Hα-helixtrans-65.2-30.2172.7-174.2170.6-173.3162.40112.9D52 N113 C115D52-K117 IonicContact OD1-NZ 3.19Å; D52-K117 PolarHBondContact OD1-NZ 3.11Å; D52-K117 IonicContact OD2-NZ 3.41Å; D52-K117 PolarHBondContact OD2-NZ 3.12Å; N113-K117 PolarHBondContact O-N 2.81Å; C115-K117 VanDerWaalsContact C-N 3.26Å; C115-K117 PolarHBondContact O-N 3.35Å
118H74.9Confident77.1Confident74 Ų7433 Ų3334%0.34317%0.171SC..Hα-helixtrans-107.4-14.9-175-68.6-54.4000113.8L114 C115 L116 S176L114-H118 PolarHBondContact O-CD2 3.19Å; L114-H118 PolarHBondContact O-N 2.68Å; C115-H118 CarbonylContact O-C 3.43Å; C115-H118 PolarHBondContact O-N 3.01Å; L116-H118 VanDerWaalsContact C-N 3.26Å; L116-H118 PolarHBondContact O-N 3.43Å; H118-S176 WeakPolarHBondContact O-CB 3.49Å
119V73.4Confident76.8Confident9 Ų932.4 Ų32.46%0.05517%0.169CC..SBendtrans-142.8146.7178.9-146.30000112.2C115 L116 F123 G179C115-V119 PolarHBondContact O-N 3.45Å; L116-V119 CarbonylContact C-O 3.57Å; L116-V119 WeakPolarHBondContact CA-O 3.29Å; L116-V119 VanDerWaalsContact O-O 3.06Å; V119-F123 HydrophobicContact CB-CD1 3.92Å; V119-F123 HydrophobicContact CG1-CB 3.62Å; V119-F123 HydrophobicContact CG1-CD1 3.37Å; V119-F123 HydrophobicContact CG1-CE1 4.25Å; V119-F123 HydrophobicContact CG1-CG 3.7Å; V119-F123 HydrophobicContact CG2-CD1 4.09Å; V119-F123 HydrophobicContact CG2-CE1 4.42Å; V119-G179 VanDerWaalsContact CG2-CA 3.42Å
120G69.3Low76.9Confident49 Ų4931.6 Ų31.651%0.50517%0.165SC..  trans-64.7156.4178.500000114.6A122 F123 Y124G120-A122 PolarHBondContact O-N 3.5Å; G120-A122 VanDerWaalsContact O-N 3.09Å; G120-F123 PolarHBondContact O-N 3.01Å; G120-F123 VanDerWaalsContact O-N 3.09Å; G120-Y124 PolarHBondContact O-N 3.44Å
121V68.3Low77.1Confident20 Ų2031.8 Ų31.812%0.12117%0.167CC..Hα-helixtrans-52.5-33.8-179.2-177.10000113.4N43 L116 Y124 T125N43-V121 VanDerWaalsContact OD1-CG2 3.25Å; N43-V121 WeakPolarHBondContact OD1-CG2 3.33Å; L116-V121 HydrophobicContact CD2-CG2 4.26Å; V121-Y124 WeakPolarHBondContact O-CB 3.34Å; V121-Y124 PolarHBondContact O-N 3.32Å; V121-T125 PolarHBondContact O-N 2.92Å; V121-T125 VanDerWaalsContact O-N 3.13Å; V121-T125 PolarHBondContact O-OG1 3.1Å
122A67.1Low77Confident12 Ų1230.2 Ų30.210%0.09916%0.162CC..Hα-helixtrans-67.4-44.9-178.900000111.5G120 T125 W304G120-A122 PolarHBondContact O-N 3.5Å; G120-A122 VanDerWaalsContact O-N 3.09Å; A122-T125 PolarHBondContact O-N 3.33Å; A122-W304 HydrophobicContact CB-CH2 3.96Å; A122-W304 HydrophobicContact CB-CZ2 3.53Å
123F72.7Confident77.2Confident4 Ų430.5 Ų30.52%0.01816%0.164CC..Hα-helixtrans-72.3-34.9173.9-177.9-97.9000112.2V119 G120 T125 V126 G127 F162 V166 E169 L175 V180V119-F123 HydrophobicContact CB-CD1 3.92Å; V119-F123 HydrophobicContact CG1-CB 3.62Å; V119-F123 HydrophobicContact CG1-CD1 3.37Å; V119-F123 HydrophobicContact CG1-CE1 4.25Å; V119-F123 HydrophobicContact CG1-CG 3.7Å; V119-F123 HydrophobicContact CG2-CD1 4.09Å; V119-F123 HydrophobicContact CG2-CE1 4.42Å; G120-F123 PolarHBondContact O-N 3.01Å; G120-F123 VanDerWaalsContact O-N 3.09Å; F123-T125 PolarHBondContact O-N 3.22Å; F123-V126 WeakPolarHBondContact O-CA 3.08Å; F123-V126 WeakPolarHBondContact O-CB 3.46Å; F123-V126 PolarHBondContact O-N 3Å; F123-G127 PolarHBondContact O-N 3.48Å; F123-F162 HydrophobicContact CZ-CE2 4.18Å; F123-F162 HydrophobicContact CZ-CZ 4.38Å; F123-V166 HydrophobicContact CE2-CB 4.41Å; F123-V166 HydrophobicContact CE2-CG2 3.68Å; F123-V166 HydrophobicContact CZ-CG2 3.73Å; F123-E169 HydrophobicContact CB-CG 4.34Å; F123-E169 HydrophobicContact CD2-CB 4.35Å; F123-E169 HydrophobicContact CD2-CG 3.75Å; F123-E169 HydrophobicContact CG-CG 4.38Å; F123-L175 HydrophobicContact CE2-CD1 4.36Å; F123-L175 HydrophobicContact CZ-CD1 4.43Å; F123-V180 HydrophobicContact CE1-CG2 3.84Å; F123-V180 HydrophobicContact CZ-CG2 3.76Å
124Y75.6Confident77.8Confident22 Ų2231.5 Ų31.59%0.08617%0.168CC..Hα-helixtrans-53-38.6172167.5-97.1000112.1N112 L116 G120 V121 G127 R128N112-Y124 HydrophobicContact CB-CE2 4.4Å; N112-Y124 WeakPolarHBondContact OD1-CE2 3.5Å; N112-Y124 PolarHBondContact OD1-OH 3.03Å; L116-Y124 HydrophobicContact CD2-CD1 4.15Å; L116-Y124 HydrophobicContact CD2-CD2 3.91Å; L116-Y124 HydrophobicContact CD2-CG 3.62Å; L116-Y124 HydrophobicContact CG-CD2 3.98Å; L116-Y124 HydrophobicContact CG-CE2 4.42Å; L116-Y124 HydrophobicContact CG-CG 4.2Å; G120-Y124 PolarHBondContact O-N 3.44Å; V121-Y124 WeakPolarHBondContact O-CB 3.34Å; V121-Y124 PolarHBondContact O-N 3.32Å; Y124-G127 PolarHBondContact O-N 3.39Å; Y124-R128 VanDerWaalsContact O-CB 3.31Å; Y124-R128 WeakPolarHBondContact O-CB 3.34Å; Y124-R128 PolarHBondContact O-N 3.19Å; Y124-R128 PolarHBondContact OH-NH1 3.37Å
125T71.3Confident78.1Confident12 Ų1231.1 Ų31.17%0.07417%0.166CC..Hα-helixtrans-66.5-38.2178.2-55.10000112.2V121 A122 F123 R128 S129 T289V121-T125 PolarHBondContact O-N 2.92Å; V121-T125 VanDerWaalsContact O-N 3.13Å; V121-T125 PolarHBondContact O-OG1 3.1Å; A122-T125 PolarHBondContact O-N 3.33Å; F123-T125 PolarHBondContact O-N 3.22Å; T125-R128 PolarHBondContact O-N 2.73Å; T125-S129 PolarHBondContact O-N 3.39Å; T125-T289 WeakPolarHBondContact CG2-OG1 3.27Å
126V75.5Confident78.3Confident0 Ų031.8 Ų31.80%017%0.17CC..Hα-helixtrans-64.7-47173.8174.90000110.2F123 R128 S129 F162 V311F123-V126 WeakPolarHBondContact O-CA 3.08Å; F123-V126 WeakPolarHBondContact O-CB 3.46Å; F123-V126 PolarHBondContact O-N 3Å; V126-R128 PolarHBondContact O-N 2.84Å; V126-S129 PolarHBondContact O-N 2.78Å; V126-S129 PolarHBondContact O-OG 3.5Å; V126-F162 HydrophobicContact CG1-CB 4.43Å; V126-F162 HydrophobicContact CG1-CD2 3.71Å; V126-F162 HydrophobicContact CG1-CE2 4.43Å; V126-F162 HydrophobicContact CG1-CG 4.46Å; V126-V311 HydrophobicContact CG1-CG2 4.38Å
127G79.5Confident79Confident5 Ų534 Ų345%0.05218%0.182CC..Hα-helixtrans-55.9-48.2172.800000112.4F123 Y124 S129 L130 S187F123-G127 PolarHBondContact O-N 3.48Å; Y124-G127 PolarHBondContact O-N 3.39Å; G127-S129 PolarHBondContact O-N 2.89Å; G127-S129 VanDerWaalsContact O-N 3.13Å; G127-L130 WeakPolarHBondContact O-CB 3.35Å; G127-L130 PolarHBondContact O-N 2.96Å; G127-S187 PolarHBondContact O-OG 2.71Å
128R78.2Confident79.7Confident113 Ų11330 Ų3043%0.42617%0.166SC..Hα-helixtrans-57.9-31.5-177.3-171.3175.2-177151.7-2113.5Y124 T125 V126 L130 S131Y124-R128 VanDerWaalsContact O-CB 3.31Å; Y124-R128 WeakPolarHBondContact O-CB 3.34Å; Y124-R128 PolarHBondContact O-N 3.19Å; Y124-R128 PolarHBondContact OH-NH1 3.37Å; T125-R128 PolarHBondContact O-N 2.73Å; V126-R128 PolarHBondContact O-N 2.84Å; R128-L130 PolarHBondContact O-N 3.44Å; R128-S131 VanDerWaalsContact O-CB 3.24Å; R128-S131 WeakPolarHBondContact O-CB 3.26Å; R128-S131 PolarHBondContact O-N 3.27Å; R128-S131 VanDerWaalsContact O-N 3.16Å; R128-S131 PolarHBondContact O-OG 3.33Å
129S82Confident80.1Confident11 Ų1127.1 Ų27.18%0.07715%0.154CC..Hα-helixtrans-64.4-23.5175.573.80000114.4T125 V126 G127 S131 T132 V311T125-S129 PolarHBondContact O-N 3.39Å; V126-S129 PolarHBondContact O-N 2.78Å; V126-S129 PolarHBondContact O-OG 3.5Å; G127-S129 PolarHBondContact O-N 2.89Å; G127-S129 VanDerWaalsContact O-N 3.13Å; S129-S131 PolarHBondContact O-N 3Å; S129-S131 VanDerWaalsContact O-N 3.17Å; S129-T132 VanDerWaalsContact O-CB 3.3Å; S129-T132 WeakPolarHBondContact O-CB 3.44Å; S129-T132 PolarHBondContact O-N 2.84Å; S129-T132 PolarHBondContact O-OG1 2.85Å; S129-V311 WeakPolarHBondContact OG-CG1 3.35Å
130L87.3Confident80.6Confident11 Ų1133.2 Ų33.26%0.05818%0.177CC..Hα-helixtrans-64.2-20.9177-164.165.3000111.2G127 R128 T132 V133 F134 L159 V184G127-L130 WeakPolarHBondContact O-CB 3.35Å; G127-L130 PolarHBondContact O-N 2.96Å; R128-L130 PolarHBondContact O-N 3.44Å; L130-T132 PolarHBondContact O-N 3.3Å; L130-V133 HydrophobicContact CD1-CB 4.19Å; L130-V133 HydrophobicContact CD1-CG2 4.18Å; L130-V133 WeakPolarHBondContact O-CB 3.5Å; L130-V133 PolarHBondContact O-N 3.49Å; L130-F134 HydrophobicContact CD2-CD2 4.39Å; L130-F134 HydrophobicContact CD2-CE2 3.61Å; L130-F134 HydrophobicContact CD2-CZ 4.22Å; L130-F134 HydrophobicContact CG-CD2 4.01Å; L130-F134 HydrophobicContact CG-CE2 3.72Å; L130-F134 WeakPolarHBondContact O-CD2 3.29Å; L130-F134 PolarHBondContact O-N 3.01Å; L130-L159 HydrophobicContact CD1-CD2 3.55Å; L130-V184 HydrophobicContact CD2-CB 4.41Å; L130-V184 HydrophobicContact CD2-CG1 4.16Å; L130-V184 HydrophobicContact CD2-CG2 3.9Å
131S86.6Confident81.4Confident20 Ų2035.4 Ų35.414%0.1418%0.18CC..Hα-helixtrans-57.3-30170.868.60000112.3R128 S129 N135 S187 S191R128-S131 VanDerWaalsContact O-CB 3.24Å; R128-S131 WeakPolarHBondContact O-CB 3.26Å; R128-S131 PolarHBondContact O-N 3.27Å; R128-S131 VanDerWaalsContact O-N 3.16Å; R128-S131 PolarHBondContact O-OG 3.33Å; S129-S131 PolarHBondContact O-N 3Å; S129-S131 VanDerWaalsContact O-N 3.17Å; S131-N135 WeakPolarHBondContact O-CB 3.35Å; S131-N135 PolarHBondContact O-N 2.57Å; S131-S187 WeakPolarHBondContact CB-O 3.5Å; S131-S191 VanDerWaalsContact CA-OG 3.28Å; S131-S191 WeakPolarHBondContact CA-OG 3.29Å; S131-S191 PolarHBondContact O-OG 3.5Å
132T86.1Confident82.1Confident23 Ų2337.2 Ų37.214%0.14119%0.189CC..Hα-helixtrans-64.2-45174.1-56.50000111S129 L130 N135 V136 I158 Y318S129-T132 VanDerWaalsContact O-CB 3.3Å; S129-T132 WeakPolarHBondContact O-CB 3.44Å; S129-T132 PolarHBondContact O-N 2.84Å; S129-T132 PolarHBondContact O-OG1 2.85Å; L130-T132 PolarHBondContact O-N 3.3Å; T132-N135 WeakPolarHBondContact O-CB 3.29Å; T132-N135 PolarHBondContact O-N 3.49Å; T132-V136 PolarHBondContact O-N 2.85Å; T132-V136 VanDerWaalsContact O-N 3.1Å; T132-I158 HydrophobicContact CG2-CD1 3.84Å; T132-Y318 HydrophobicContact CG2-CD1 3.26Å; T132-Y318 HydrophobicContact CG2-CD2 4.23Å; T132-Y318 HydrophobicContact CG2-CE1 3.64Å; T132-Y318 HydrophobicContact CG2-CG 3.58Å
133V89.1Confident82.7Confident25 Ų2539.3 Ų39.315%0.15220%0.197CC..Hα-helixtrans-65.4-46.8178.9-177.70000110.4L130 N135 V136 L137 C155 I158 L159L130-V133 HydrophobicContact CD1-CB 4.19Å; L130-V133 HydrophobicContact CD1-CG2 4.18Å; L130-V133 WeakPolarHBondContact O-CB 3.5Å; L130-V133 PolarHBondContact O-N 3.49Å; V133-N135 VanDerWaalsContact C-N 3.27Å; V133-N135 PolarHBondContact O-N 3.27Å; V133-V136 PolarHBondContact O-N 3.49Å; V133-L137 PolarHBondContact O-N 3.23Å; V133-C155 HydrophobicContact CG1-CB 4.29Å; V133-C155 HydrophobicContact CG2-CB 4.03Å; V133-I158 HydrophobicContact CG2-CB 4.05Å; V133-I158 HydrophobicContact CG2-CD1 4.46Å; V133-I158 HydrophobicContact CG2-CG2 3.85Å; V133-L159 HydrophobicContact CG1-CD1 4.36Å; V133-L159 HydrophobicContact CG1-CD2 4.34Å; V133-L159 HydrophobicContact CG1-CG 4.38Å; V133-L159 HydrophobicContact CG2-CD2 4.48Å; V133-L159 HydrophobicContact CG2-CG 4.29Å
134F89.2Confident83Confident44 Ų4447.7 Ų47.719%0.19323%0.234CC..Hα-helixtrans-62.7-34.6174.9-77-55.6000112.7L130 V136 L137 L138 V184 A188 S191L130-F134 HydrophobicContact CD2-CD2 4.39Å; L130-F134 HydrophobicContact CD2-CE2 3.61Å; L130-F134 HydrophobicContact CD2-CZ 4.22Å; L130-F134 HydrophobicContact CG-CD2 4.01Å; L130-F134 HydrophobicContact CG-CE2 3.72Å; L130-F134 WeakPolarHBondContact O-CD2 3.29Å; L130-F134 PolarHBondContact O-N 3.01Å; F134-V136 VanDerWaalsContact C-N 3.35Å; F134-L137 HydrophobicContact CD1-CD2 4.34Å; F134-L137 PolarHBondContact O-N 3.42Å; F134-L138 HydrophobicContact CB-CD1 4.36Å; F134-L138 WeakPolarHBondContact O-CB 3.39Å; F134-L138 WeakPolarHBondContact O-CG 3.43Å; F134-L138 PolarHBondContact O-N 2.89Å; F134-V184 HydrophobicContact CE2-CG1 3.81Å; F134-V184 WeakPolarHBondContact CE2-O 3.35Å; F134-V184 HydrophobicContact CZ-CG1 3.62Å; F134-A188 HydrophobicContact CD1-CB 4.27Å; F134-A188 HydrophobicContact CD2-CB 3.97Å; F134-A188 HydrophobicContact CE1-CB 4.41Å; F134-A188 HydrophobicContact CE2-CB 4.1Å; F134-A188 HydrophobicContact CG-CB 4.06Å; F134-A188 HydrophobicContact CZ-CB 4.33Å; F134-S191 VanDerWaalsContact CB-OG 3.29Å; F134-S191 WeakPolarHBondContact CB-OG 3.4Å
135N86.3Confident83Confident34 Ų3451.6 Ų51.618%0.18225%0.253CS..Hα-helixtrans-65.3-40.5177.3-168.3-1.8000111.1S131 T132 V133 S139 S191S131-N135 WeakPolarHBondContact O-CB 3.35Å; S131-N135 PolarHBondContact O-N 2.57Å; T132-N135 WeakPolarHBondContact O-CB 3.29Å; T132-N135 PolarHBondContact O-N 3.49Å; V133-N135 VanDerWaalsContact C-N 3.27Å; V133-N135 PolarHBondContact O-N 3.27Å; N135-S139 WeakPolarHBondContact O-CB 3.46Å; N135-S139 PolarHBondContact O-N 2.83Å; N135-S139 PolarHBondContact O-OG 3.16Å; N135-S139 PolarHBondContact OD1-OG 3.25Å; N135-S139 VanDerWaalsContact OD1-OG 3.1Å; N135-S191 PolarHBondContact N-OG 2.92Å
136V86Confident83.2Confident15 Ų1556.5 Ų56.59%0.09128%0.283CS..Hα-helixtrans-61.2-51172.4171.70000111.3T132 V133 F134 L138 S139 Y140 T147 Y318T132-V136 PolarHBondContact O-N 2.85Å; T132-V136 VanDerWaalsContact O-N 3.1Å; V133-V136 PolarHBondContact O-N 3.49Å; F134-V136 VanDerWaalsContact C-N 3.35Å; V136-L138 PolarHBondContact O-N 3.28Å; V136-S139 PolarHBondContact O-N 3.1Å; V136-Y140 PolarHBondContact O-N 3.29Å; V136-T147 HydrophobicContact CG1-CG2 3.84Å; V136-Y318 HydrophobicContact CG2-CD2 4.14Å; V136-Y318 HydrophobicContact CG2-CE2 3.14Å; V136-Y318 VanDerWaalsContact CG2-CZ 3.43Å; V136-Y318 WeakPolarHBondContact CG2-OH 3.47Å
137L88Confident83.3Confident96 Ų9657.9 Ų57.950%0.50329%0.292SS..Hα-helixtrans-58.5-51.1-179.2-174.680.1000111.4V133 F134 Y140 V141V133-L137 PolarHBondContact O-N 3.23Å; F134-L137 HydrophobicContact CD1-CD2 4.34Å; F134-L137 PolarHBondContact O-N 3.42Å; L137-Y140 WeakPolarHBondContact O-CB 3.21Å; L137-Y140 PolarHBondContact O-N 2.83Å; L137-V141 WeakPolarHBondContact O-CG2 3.21Å; L137-V141 PolarHBondContact O-N 3.38Å
138L86.3Confident83.6Confident31 Ų3159.6 Ų59.616%0.16230%0.303CS..Hα-helixtrans-74.2-30.9-176.5-66.2168.9000112.3F134 V136 Y140 V141 I142 L192 I195F134-L138 HydrophobicContact CB-CD1 4.36Å; F134-L138 WeakPolarHBondContact O-CB 3.39Å; F134-L138 WeakPolarHBondContact O-CG 3.43Å; F134-L138 PolarHBondContact O-N 2.89Å; V136-L138 PolarHBondContact O-N 3.28Å; L138-Y140 VanDerWaalsContact C-N 3.29Å; L138-V141 PolarHBondContact O-N 2.86Å; L138-I142 HydrophobicContact CB-CD1 4.23Å; L138-I142 HydrophobicContact CD2-CD1 4.3Å; L138-I142 VanDerWaalsContact O-CB 3.23Å; L138-I142 WeakPolarHBondContact O-CB 3.05Å; L138-I142 WeakPolarHBondContact O-CG1 3.23Å; L138-I142 PolarHBondContact O-N 3.27Å; L138-L192 HydrophobicContact CD1-CD2 3.73Å; L138-L192 HydrophobicContact CD1-CG 3.68Å; L138-L192 HydrophobicContact CD2-CD2 4.17Å; L138-L192 HydrophobicContact CG-CD2 4.42Å; L138-I195 HydrophobicContact CB-CD1 3.37Å
139S83.3Confident84Confident13 Ų1361.2 Ų61.29%0.09131%0.313CS..Hα-helixtrans-66-35.4171-66.30000111.2N135 V136 L143 K144 Q145N135-S139 WeakPolarHBondContact O-CB 3.46Å; N135-S139 PolarHBondContact O-N 2.83Å; N135-S139 PolarHBondContact O-OG 3.16Å; N135-S139 PolarHBondContact OD1-OG 3.25Å; N135-S139 VanDerWaalsContact OD1-OG 3.1Å; V136-S139 PolarHBondContact O-N 3.1Å; S139-L143 CarbonylContact O-C 3.57Å; S139-L143 WeakPolarHBondContact O-CA 3.5Å; S139-L143 WeakPolarHBondContact O-CB 3.38Å; S139-L143 PolarHBondContact O-N 2.95Å; S139-L143 VanDerWaalsContact O-N 3.1Å; S139-K144 PolarHBondContact O-N 2.89Å; S139-Q145 PolarHBondContact O-N 3.39Å
140Y84.1Confident84.3Confident137 Ų13768.3 Ų68.354%0.53734%0.339SS..Hα-helixtrans-67.4-46.3172.2-179.3-102.2000111.8V136 L137 L138 K144V136-Y140 PolarHBondContact O-N 3.29Å; L137-Y140 WeakPolarHBondContact O-CB 3.21Å; L137-Y140 PolarHBondContact O-N 2.83Å; L138-Y140 VanDerWaalsContact C-N 3.29Å; Y140-K144 WeakPolarHBondContact O-CA 3.44Å; Y140-K144 PolarHBondContact O-N 3.49Å; Y140-K144 VanDerWaalsContact O-N 3.17Å
141V86.1Confident84.3Confident95 Ų9567.8 Ų67.858%0.57634%0.337SS*.Hα-helixtrans-72.3-47.5-176.9173.70000112.8L137 L138L137-V141 WeakPolarHBondContact O-CG2 3.21Å; L137-V141 PolarHBondContact O-N 3.38Å; L138-V141 PolarHBondContact O-N 2.86Å
142I83.3Confident84.4Confident59 Ų5971.1 Ų71.130%0.30335%0.352SS..Hα-helixtrans-86.7-45.2-172.1-55.8176.5000111.2L138 L192 I195L138-I142 HydrophobicContact CB-CD1 4.23Å; L138-I142 HydrophobicContact CD2-CD1 4.3Å; L138-I142 VanDerWaalsContact O-CB 3.23Å; L138-I142 WeakPolarHBondContact O-CB 3.05Å; L138-I142 WeakPolarHBondContact O-CG1 3.23Å; L138-I142 PolarHBondContact O-N 3.27Å; I142-L192 HydrophobicContact CD1-CD2 3.56Å; I142-I195 HydrophobicContact CD1-CG2 4.5Å; I142-I195 HydrophobicContact CG2-CG2 4.36Å
143L79.3Confident84.7Confident55 Ų5574.6 Ų74.629%0.28837%0.369SS..Hα-helixtrans-93.2-7.4-175.8-89.759.3000112.7S139 Q145 I195S139-L143 CarbonylContact O-C 3.57Å; S139-L143 WeakPolarHBondContact O-CA 3.5Å; S139-L143 WeakPolarHBondContact O-CB 3.38Å; S139-L143 PolarHBondContact O-N 2.95Å; S139-L143 VanDerWaalsContact O-N 3.1Å; L143-Q145 HydrophobicContact CB-CB 4.46Å; L143-Q145 HydrophobicContact CB-CG 4.03Å; L143-Q145 PolarHBondContact O-N 3.43Å; L143-Q145 VanDerWaalsContact O-N 3.12Å; L143-I195 HydrophobicContact CD1-CG2 3.42Å; L143-I195 VanDerWaalsContact CD1-CG2 3.42Å
144K80.1Confident84.7Confident181 Ų18173.7 Ų73.779%0.78736%0.364SS*.  trans52.928.1-174.3-63-174.7177-177.20113S139 Y140S139-K144 PolarHBondContact O-N 2.89Å; Y140-K144 WeakPolarHBondContact O-CA 3.44Å; Y140-K144 PolarHBondContact O-N 3.49Å; Y140-K144 VanDerWaalsContact O-N 3.17Å
145Q75.8Confident84.8Confident103 Ų10372.1 Ų72.148%0.48136%0.358SS..  trans-86.5122178-75.9-179.4-4.900109.8S139 L143S139-Q145 PolarHBondContact O-N 3.39Å; L143-Q145 HydrophobicContact CB-CB 4.46Å; L143-Q145 HydrophobicContact CB-CG 4.03Å; L143-Q145 PolarHBondContact O-N 3.43Å; L143-Q145 VanDerWaalsContact O-N 3.12Å
146T75.8Confident85Confident116 Ų11672.4 Ų72.471%0.71237%0.37SS*.  trans-69.5145.517453.70000110.3
147T77.8Confident85.3Confident28 Ų2874.8 Ų74.817%0.17238%0.381CS..  trans-116.2138.7179.8-63.50000109.2V136 A151 I152V136-T147 HydrophobicContact CG1-CG2 3.84Å; T147-A151 HydrophobicContact CG2-CB 3.34Å; T147-I152 HydrophobicContact CG2-CG1 4.49Å
148S85.4Confident85.5Confident42 Ų4270.2 Ų70.229%0.29436%0.357SS..  trans-65.1152.7178.8-176.30000112.2Y150 A151 I152 E325S148-Y150 PolarHBondContact O-N 3.22Å; S148-A151 WeakPolarHBondContact O-CB 3.38Å; S148-A151 PolarHBondContact O-N 3.13Å; S148-I152 PolarHBondContact O-N 3.44Å; S148-I152 VanDerWaalsContact O-N 3.16Å; S148-E325 WeakPolarHBondContact CB-OE1 3.4Å
149F86.9Confident85.7Confident147 Ų14772.7 Ų72.765%0.64537%0.37SS*.Hα-helixtrans-52.7-39.6172.9-176.3-102000112.6A151 I152 L153F149-A151 VanDerWaalsContact C-N 3.31Å; F149-A151 PolarHBondContact O-N 2.93Å; F149-I152 WeakPolarHBondContact O-CB 3.35Å; F149-I152 PolarHBondContact O-N 3.4Å; F149-L153 PolarHBondContact O-N 3.28Å
150Y88.1Confident86.1Confident159 Ų15973.7 Ų73.762%0.62438%0.382SS*.Hα-helixtrans-62.6-36.8177.8-63-73.3000112.9S148 L153 C154S148-Y150 PolarHBondContact O-N 3.22Å; Y150-L153 PolarHBondContact O-N 2.83Å; Y150-C154 PolarHBondContact O-N 3.39Å; Y150-C154 VanDerWaalsContact O-N 3.11Å; Y150-C154 PolarHBondContact O-SG 2.84Å
151A85.9Confident86.4Confident0 Ų067.1 Ų67.10%036%0.357CS..Hα-helixtrans-72.8-32.7177.100000112T147 S148 F149 C154 C155 Y318 V321T147-A151 HydrophobicContact CG2-CB 3.34Å; S148-A151 WeakPolarHBondContact O-CB 3.38Å; S148-A151 PolarHBondContact O-N 3.13Å; F149-A151 VanDerWaalsContact C-N 3.31Å; F149-A151 PolarHBondContact O-N 2.93Å; A151-C154 PolarHBondContact O-N 3.3Å; A151-C155 PolarHBondContact O-N 2.65Å; A151-C155 VanDerWaalsContact O-N 3.13Å; A151-C155 PolarHBondContact O-SG 2.94Å; A151-Y318 HydrophobicContact CB-CD2 3.9Å; A151-Y318 HydrophobicContact CB-CE2 3.88Å; A151-V321 HydrophobicContact CB-CG1 4.08Å
152I89.4Confident86.5Confident91 Ų9163.9 Ų63.947%0.46734%0.335SS..Hα-helixtrans-65.8-42.4171.5-63.2172.7000110.6T147 S148 F149 C154 C155 G156T147-I152 HydrophobicContact CG2-CG1 4.49Å; S148-I152 PolarHBondContact O-N 3.44Å; S148-I152 VanDerWaalsContact O-N 3.16Å; F149-I152 WeakPolarHBondContact O-CB 3.35Å; F149-I152 PolarHBondContact O-N 3.4Å; I152-C154 VanDerWaalsContact C-N 3.31Å; I152-C154 PolarHBondContact O-N 3.21Å; I152-C155 WeakPolarHBondContact O-CA 3.3Å; I152-C155 VanDerWaalsContact O-CB 3.32Å; I152-C155 WeakPolarHBondContact O-CB 3.29Å; I152-C155 PolarHBondContact O-N 2.97Å; I152-G156 PolarHBondContact O-N 3.21Å
153L91.9Very high86.8Confident95 Ų9570.6 Ų70.650%0.49736%0.357SS..Hα-helixtrans-60.5-41.1176.1-172.4140.4000111.8F149 Y150 C155 G156 I157F149-L153 PolarHBondContact O-N 3.28Å; Y150-L153 PolarHBondContact O-N 2.83Å; L153-C155 VanDerWaalsContact C-N 3.31Å; L153-C155 PolarHBondContact O-N 3.01Å; L153-G156 PolarHBondContact O-N 3.28Å; L153-G156 VanDerWaalsContact O-N 3.13Å; L153-I157 HydrophobicContact CD2-CD1 3.96Å; L153-I157 PolarHBondContact O-N 3.41Å; L153-I157 VanDerWaalsContact O-N 3.11Å
154C90.6Very high87.3Confident6 Ų670 Ų704%0.04135%0.353CS..Hα-helixtrans-61-39.1173.2-62.40000112.1Y150 A151 I152 G156 I157 I158Y150-C154 PolarHBondContact O-N 3.39Å; Y150-C154 VanDerWaalsContact O-N 3.11Å; Y150-C154 PolarHBondContact O-SG 2.84Å; A151-C154 PolarHBondContact O-N 3.3Å; I152-C154 VanDerWaalsContact C-N 3.31Å; I152-C154 PolarHBondContact O-N 3.21Å; C154-G156 VanDerWaalsContact C-N 3.31Å; C154-G156 PolarHBondContact O-N 3.32Å; C154-I157 PolarHBondContact O-N 2.79Å; C154-I158 WeakPolarHBondContact O-CG1 3.48Å; C154-I158 PolarHBondContact O-N 3.07Å; C154-I158 VanDerWaalsContact O-N 3.07Å
155C89.4Confident87.5Confident11 Ų1161.3 Ų61.37%0.07432%0.316CS..Hα-helixtrans-62.8-38.6174.3-64.50000111.8V133 A151 I152 L153 I157 I158 L159V133-C155 HydrophobicContact CG1-CB 4.29Å; V133-C155 HydrophobicContact CG2-CB 4.03Å; A151-C155 PolarHBondContact O-N 2.65Å; A151-C155 VanDerWaalsContact O-N 3.13Å; A151-C155 PolarHBondContact O-SG 2.94Å; I152-C155 WeakPolarHBondContact O-CA 3.3Å; I152-C155 VanDerWaalsContact O-CB 3.32Å; I152-C155 WeakPolarHBondContact O-CB 3.29Å; I152-C155 PolarHBondContact O-N 2.97Å; L153-C155 VanDerWaalsContact C-N 3.31Å; L153-C155 PolarHBondContact O-N 3.01Å; C155-I157 VanDerWaalsContact C-N 3.35Å; C155-I157 PolarHBondContact O-N 2.6Å; C155-I158 PolarHBondContact O-N 3.48Å; C155-L159 WeakPolarHBondContact O-CG 3.27Å; C155-L159 PolarHBondContact O-N 2.92Å
156G91.6Very high88Confident41 Ų4157.5 Ų57.542%0.42330%0.3SS..Hα-helixtrans-59.2-43.1173.600000112.8I152 L153 C154 L159 G160I152-G156 PolarHBondContact O-N 3.21Å; L153-G156 PolarHBondContact O-N 3.28Å; L153-G156 VanDerWaalsContact O-N 3.13Å; C154-G156 VanDerWaalsContact C-N 3.31Å; C154-G156 PolarHBondContact O-N 3.32Å; G156-L159 PolarHBondContact O-N 3.49Å; G156-G160 PolarHBondContact O-N 3.01Å
157I92.8Very high88.4Confident65 Ų6555.8 Ų55.833%0.33329%0.286SS..Hα-helixtrans-62.5-43.8175.7-62.9170.5000111L153 C154 C155 G160 G161 M310L153-I157 HydrophobicContact CD2-CD1 3.96Å; L153-I157 PolarHBondContact O-N 3.41Å; L153-I157 VanDerWaalsContact O-N 3.11Å; C154-I157 PolarHBondContact O-N 2.79Å; C155-I157 VanDerWaalsContact C-N 3.35Å; C155-I157 PolarHBondContact O-N 2.6Å; I157-G160 PolarHBondContact O-N 3.2Å; I157-G161 PolarHBondContact O-N 3.15Å; I157-M310 HydrophobicContact CG2-CB 4.26Å; I157-M310 HydrophobicContact CG2-CE 4.47Å; I157-M310 WeakPolarHBondContact CG2-O 3.38Å
158I90.9Very high88.7Confident0 Ų055.8 Ų55.80%028%0.284CS..Hα-helixtrans-62.6-44.2177.9-64.3166.6000110.7T132 V133 C154 C155 G161 F162T132-I158 HydrophobicContact CG2-CD1 3.84Å; V133-I158 HydrophobicContact CG2-CB 4.05Å; V133-I158 HydrophobicContact CG2-CD1 4.46Å; V133-I158 HydrophobicContact CG2-CG2 3.85Å; C154-I158 WeakPolarHBondContact O-CG1 3.48Å; C154-I158 PolarHBondContact O-N 3.07Å; C154-I158 VanDerWaalsContact O-N 3.07Å; C155-I158 PolarHBondContact O-N 3.48Å; I158-G161 PolarHBondContact O-N 3.22Å; I158-F162 WeakPolarHBondContact O-CB 3.46Å; I158-F162 PolarHBondContact O-N 3.15Å
159L91.9Very high88.5Confident82 Ų8254.1 Ų54.143%0.42927%0.272SS..Hα-helixtrans-62.9-43.2177.2-72.9171.6000112.1L130 V133 C155 G156 F162 W163L130-L159 HydrophobicContact CD1-CD2 3.55Å; V133-L159 HydrophobicContact CG1-CD1 4.36Å; V133-L159 HydrophobicContact CG1-CD2 4.34Å; V133-L159 HydrophobicContact CG1-CG 4.38Å; V133-L159 HydrophobicContact CG2-CD2 4.48Å; V133-L159 HydrophobicContact CG2-CG 4.29Å; C155-L159 WeakPolarHBondContact O-CG 3.27Å; C155-L159 PolarHBondContact O-N 2.92Å; G156-L159 PolarHBondContact O-N 3.49Å; L159-F162 PolarHBondContact O-N 2.81Å; L159-W163 WeakPolarHBondContact O-CB 3.28Å; L159-W163 PolarHBondContact O-N 3.13Å
160G91.2Very high88Confident34 Ų3448.8 Ų48.835%0.35126%0.258SS..Hα-helixtrans-62.7-43.3175.300000112.3G156 I157 W163 L164G156-G160 PolarHBondContact O-N 3.01Å; I157-G160 PolarHBondContact O-N 3.2Å; G160-W163 PolarHBondContact O-N 2.86Å; G160-L164 WeakPolarHBondContact O-CB 3.4Å; G160-L164 PolarHBondContact O-N 3.25Å
161G89.9Confident87.4Confident0 Ų046.5 Ų46.50%026%0.26CS..Hα-helixtrans-63.9-42.5174.900000112.5I157 I158 L164 G165 S307I157-G161 PolarHBondContact O-N 3.15Å; I158-G161 PolarHBondContact O-N 3.22Å; G161-L164 PolarHBondContact O-N 3.41Å; G161-G165 PolarHBondContact O-N 3.39Å; G161-S307 WeakPolarHBondContact O-CB 3.36Å; G161-S307 PolarHBondContact O-OG 3.23Å
162F89.3Confident86.7Confident26 Ų2649.9 Ų49.911%0.11429%0.288CS..Hα-helixtrans-60.8-46.7175.1177.5-98.3000111.7F123 V126 I158 L159 L164 G165 V166 V180 V184F123-F162 HydrophobicContact CZ-CE2 4.18Å; F123-F162 HydrophobicContact CZ-CZ 4.38Å; V126-F162 HydrophobicContact CG1-CB 4.43Å; V126-F162 HydrophobicContact CG1-CD2 3.71Å; V126-F162 HydrophobicContact CG1-CE2 4.43Å; V126-F162 HydrophobicContact CG1-CG 4.46Å; I158-F162 WeakPolarHBondContact O-CB 3.46Å; I158-F162 PolarHBondContact O-N 3.15Å; L159-F162 PolarHBondContact O-N 2.81Å; F162-L164 PolarHBondContact O-N 2.84Å; F162-G165 PolarHBondContact O-N 2.74Å; F162-G165 VanDerWaalsContact O-N 3.11Å; F162-V166 HydrophobicContact CD1-CG2 4.14Å; F162-V166 HydrophobicContact CE1-CG2 3.68Å; F162-V166 HydrophobicContact CE2-CG2 4.14Å; F162-V166 HydrophobicContact CZ-CG2 3.67Å; F162-V166 WeakPolarHBondContact O-CG2 3.48Å; F162-V166 PolarHBondContact O-N 2.95Å; F162-V180 HydrophobicContact CZ-CG1 4.28Å; F162-V184 HydrophobicContact CZ-CG2 4.41Å
163W89.6Confident85.8Confident201 Ų20149 Ų4976%0.76130%0.301SS*.Hα-helixtrans-59.2-46.6177.6-169.4-76.9000111.9L159 G160 G165 V166 D167L159-W163 WeakPolarHBondContact O-CB 3.28Å; L159-W163 PolarHBondContact O-N 3.13Å; G160-W163 PolarHBondContact O-N 2.86Å; W163-G165 VanDerWaalsContact C-N 3.27Å; W163-G165 PolarHBondContact O-N 3Å; W163-V166 PolarHBondContact O-N 3.06Å; W163-D167 PolarHBondContact O-N 3.37Å
164L88.4Confident84.8Confident41 Ų4147.2 Ų47.222%0.21530%0.297CS..Hα-helixtrans-61.3-37.2175.5-175.964.3000111.7G160 G161 F162 Q168 T306 M310G160-L164 WeakPolarHBondContact O-CB 3.4Å; G160-L164 PolarHBondContact O-N 3.25Å; G161-L164 PolarHBondContact O-N 3.41Å; F162-L164 PolarHBondContact O-N 2.84Å; L164-Q168 VanDerWaalsContact O-CG 3.25Å; L164-Q168 WeakPolarHBondContact O-CG 3.18Å; L164-Q168 PolarHBondContact O-N 3.01Å; L164-Q168 VanDerWaalsContact O-N 3.08Å; L164-T306 HydrophobicContact CD2-CG2 4.3Å; L164-M310 HydrophobicContact CD2-SD 4.43Å
165G85.4Confident84.1Confident0 Ų048.5 Ų48.50%030%0.303CS..Hα-helixtrans-67.1-41.8177.300000112.9G161 F162 W163 Q168 E169 S307G161-G165 PolarHBondContact O-N 3.39Å; F162-G165 PolarHBondContact O-N 2.74Å; F162-G165 VanDerWaalsContact O-N 3.11Å; W163-G165 VanDerWaalsContact C-N 3.27Å; W163-G165 PolarHBondContact O-N 3Å; G165-Q168 PolarHBondContact O-N 3.46Å; G165-E169 WeakPolarHBondContact O-CG 3.38Å; G165-E169 PolarHBondContact O-N 2.83Å; G165-E169 VanDerWaalsContact O-N 3.08Å; G165-S307 WeakPolarHBondContact CA-OG 3.49Å; G165-S307 PolarHBondContact N-OG 3.43Å
166V84.8Confident83.7Confident23 Ų2349.4 Ų49.414%0.13931%0.31CS..Hα-helixtrans-61.8-46.8174.1171.30000110.8F123 F162 W163 Q168 E169 G170 L175F123-V166 HydrophobicContact CE2-CB 4.41Å; F123-V166 HydrophobicContact CE2-CG2 3.68Å; F123-V166 HydrophobicContact CZ-CG2 3.73Å; F162-V166 HydrophobicContact CD1-CG2 4.14Å; F162-V166 HydrophobicContact CE1-CG2 3.68Å; F162-V166 HydrophobicContact CE2-CG2 4.14Å; F162-V166 HydrophobicContact CZ-CG2 3.67Å; F162-V166 WeakPolarHBondContact O-CG2 3.48Å; F162-V166 PolarHBondContact O-N 2.95Å; W163-V166 PolarHBondContact O-N 3.06Å; V166-Q168 PolarHBondContact O-N 3.43Å; V166-E169 PolarHBondContact O-N 3.4Å; V166-G170 PolarHBondContact O-N 3.38Å; V166-L175 HydrophobicContact CG1-CD1 3.98Å; V166-L175 HydrophobicContact CG1-CD2 4.48Å
167D86.2Confident83.3Confident80 Ų8056.4 Ų56.443%0.42832%0.324SS..Hα-helixtrans-58-47.2178.4179.377.7000111.6W163 G170 V171W163-D167 PolarHBondContact O-N 3.37Å; D167-G170 WeakPolarHBondContact O-CA 3.13Å; D167-G170 PolarHBondContact O-N 3.18Å; D167-G170 VanDerWaalsContact O-N 3.15Å; D167-V171 WeakPolarHBondContact O-CG2 3.33Å; D167-V171 PolarHBondContact O-N 3.33Å
168Q83.6Confident82.9Confident27 Ų2756.9 Ų56.913%0.12633%0.329CS..Hα-helixtrans-68-37.8-178.8-67.7-60.7-62.200113.8L164 G165 V166 G170 A172 S301 L303 W304L164-Q168 VanDerWaalsContact O-CG 3.25Å; L164-Q168 WeakPolarHBondContact O-CG 3.18Å; L164-Q168 PolarHBondContact O-N 3.01Å; L164-Q168 VanDerWaalsContact O-N 3.08Å; G165-Q168 PolarHBondContact O-N 3.46Å; V166-Q168 PolarHBondContact O-N 3.43Å; Q168-G170 VanDerWaalsContact C-N 3.32Å; Q168-A172 WeakPolarHBondContact O-CB 3.28Å; Q168-A172 PolarHBondContact O-N 2.96Å; Q168-A172 VanDerWaalsContact O-N 3.08Å; Q168-S301 PolarHBondContact OE1-OG 3.42Å; Q168-L303 VanDerWaalsContact CD-CB 3.47Å; Q168-L303 HydrophobicContact CG-CB 3.75Å; Q168-W304 HydrophobicContact CB-CB 4.42Å
169E79.8Confident82.4Confident8 Ų856.9 Ų56.94%0.03733%0.329CS..Hα-helixtrans-70.5-30.8172.3-69.5-72157.900111.7F123 G165 V166 A172 G173 S174 L175 K300 W304F123-E169 HydrophobicContact CB-CG 4.34Å; F123-E169 HydrophobicContact CD2-CB 4.35Å; F123-E169 HydrophobicContact CD2-CG 3.75Å; F123-E169 HydrophobicContact CG-CG 4.38Å; G165-E169 WeakPolarHBondContact O-CG 3.38Å; G165-E169 PolarHBondContact O-N 2.83Å; G165-E169 VanDerWaalsContact O-N 3.08Å; V166-E169 PolarHBondContact O-N 3.4Å; E169-A172 PolarHBondContact O-N 3.2Å; E169-G173 PolarHBondContact O-N 2.91Å; E169-S174 PolarHBondContact O-N 3.23Å; E169-S174 PolarHBondContact O-OG 2.88Å; E169-S174 PolarHBondContact OE2-OG 3.4Å; E169-L175 HydrophobicContact CB-CB 4.49Å; E169-L175 HydrophobicContact CB-CD1 3.88Å; E169-L175 PolarHBondContact O-N 3.11Å; E169-K300 IonicContact OE1-NZ 3.82Å; E169-K300 PolarHBondContact OE1-NZ 2.81Å; E169-K300 IonicContact OE2-NZ 2.57Å; E169-W304 PolarHBondContact OE1-NE1 3.45Å
170G77.5Confident82.2Confident35 Ų3553.7 Ų53.736%0.36131%0.314SS..Hα-helixtrans-63.6-47.1172.500000112.2V166 D167 Q168 A172 G173V166-G170 PolarHBondContact O-N 3.38Å; D167-G170 WeakPolarHBondContact O-CA 3.13Å; D167-G170 PolarHBondContact O-N 3.18Å; D167-G170 VanDerWaalsContact O-N 3.15Å; Q168-G170 VanDerWaalsContact C-N 3.32Å; G170-A172 VanDerWaalsContact C-N 3.29Å; G170-A172 PolarHBondContact O-N 3.35Å; G170-G173 PolarHBondContact O-N 2.61Å; G170-G173 VanDerWaalsContact O-N 3.11Å
171V75.3Confident82.1Confident111 Ų11158 Ų5867%0.67332%0.323SS*.Hα-helixtrans-64-34.3175.9173.80000111.8D167 G173D167-V171 WeakPolarHBondContact O-CG2 3.33Å; D167-V171 PolarHBondContact O-N 3.33Å; V171-G173 PolarHBondContact O-N 3.14Å
172A72.1Confident82Confident71 Ų7160 Ų6059%0.58733%0.331SS*.THydrogen-bonded Turntrans-73.3-8.5176.100000114Q168 E169 G170 S174Q168-A172 WeakPolarHBondContact O-CB 3.28Å; Q168-A172 PolarHBondContact O-N 2.96Å; Q168-A172 VanDerWaalsContact O-N 3.08Å; E169-A172 PolarHBondContact O-N 3.2Å; G170-A172 VanDerWaalsContact C-N 3.29Å; G170-A172 PolarHBondContact O-N 3.35Å; A172-S174 PolarHBondContact O-N 2.82Å
173G69.5Low81.9Confident71 Ų7159 Ų5973%0.73233%0.329SS*.THydrogen-bonded Turntrans73.86.3-179.900000114.8E169 G170 V171E169-G173 PolarHBondContact O-N 2.91Å; G170-G173 PolarHBondContact O-N 2.61Å; G170-G173 VanDerWaalsContact O-N 3.11Å; V171-G173 PolarHBondContact O-N 3.14Å
174S70.4Confident81.9Confident59 Ų5951.6 Ų51.641%0.41331%0.306SS..  trans-91.7-2.5179.945.10000113.6E169 A172E169-S174 PolarHBondContact O-N 3.23Å; E169-S174 PolarHBondContact O-OG 2.88Å; E169-S174 PolarHBondContact OE2-OG 3.4Å; A172-S174 PolarHBondContact O-N 2.82Å
175L75.6Confident82.1Confident32 Ų3252.3 Ų52.317%0.16831%0.309CS..  trans-78123.3-174.9-166.2101.4000112.6F123 V166 E169 W177 V180F123-L175 HydrophobicContact CE2-CD1 4.36Å; F123-L175 HydrophobicContact CZ-CD1 4.43Å; V166-L175 HydrophobicContact CG1-CD1 3.98Å; V166-L175 HydrophobicContact CG1-CD2 4.48Å; E169-L175 HydrophobicContact CB-CB 4.49Å; E169-L175 HydrophobicContact CB-CD1 3.88Å; E169-L175 PolarHBondContact O-N 3.11Å; L175-W177 HydrophobicContact CD2-CD2 4.02Å; L175-W177 HydrophobicContact CD2-CE3 4.43Å; L175-W177 HydrophobicContact CD2-CG 4.47Å; L175-W177 HydrophobicContact CD2-CH2 4.38Å; L175-W177 HydrophobicContact CD2-CZ2 3.96Å; L175-V180 HydrophobicContact CD1-CG2 3.97Å; L175-V180 HydrophobicContact CD2-CG2 4.43Å; L175-V180 HydrophobicContact CG-CG2 4.15Å
176S82.1Confident82.3Confident31 Ų3152.3 Ų52.322%0.21731%0.309CS..  trans-105.6115.5166.31770000110.7H118 T178 G179 V180H118-S176 WeakPolarHBondContact O-CB 3.49Å; S176-T178 PolarHBondContact O-N 2.91Å; S176-G179 WeakPolarHBondContact O-CA 3.37Å; S176-G179 PolarHBondContact O-N 3.32Å; S176-G179 PolarHBondContact OG-N 3.38Å; S176-V180 WeakPolarHBondContact O-CG2 3.36Å; S176-V180 PolarHBondContact O-N 3.3Å
177W83.8Confident82.5Confident188 Ų18851.4 Ų51.471%0.71230%0.304SS*.Hα-helixtrans-59.2-34.9176.7-73.3107000113L175 G179 V180 F181L175-W177 HydrophobicContact CD2-CD2 4.02Å; L175-W177 HydrophobicContact CD2-CE3 4.43Å; L175-W177 HydrophobicContact CD2-CG 4.47Å; L175-W177 HydrophobicContact CD2-CH2 4.38Å; L175-W177 HydrophobicContact CD2-CZ2 3.96Å; W177-G179 VanDerWaalsContact C-N 3.32Å; W177-V180 PolarHBondContact O-N 2.94Å; W177-F181 PolarHBondContact O-N 3.16Å
178T83.1Confident82.8Confident74 Ų7448.5 Ų48.545%0.45429%0.292SS..Hα-helixtrans-62-42.7173.1-53.50000111.1S176 F181 F182S176-T178 PolarHBondContact O-N 2.91Å; T178-F181 PolarHBondContact O-N 3.45Å; T178-F182 HydrophobicContact CG2-CD2 3.84Å; T178-F182 HydrophobicContact CG2-CE2 3.46Å; T178-F182 VanDerWaalsContact CG2-CE2 3.46Å; T178-F182 HydrophobicContact CG2-CZ 4.4Å; T178-F182 WeakPolarHBondContact O-CD2 3.41Å; T178-F182 PolarHBondContact O-N 3.35Å
179G81.9Confident83.1Confident0 Ų048.1 Ų48.10%029%0.292CS..Hα-helixtrans-66.8-40175.900000113.2C115 V119 S176 W177 F181 F182 G183C115-G179 PolarHBondContact SG-O 3.26Å; V119-G179 VanDerWaalsContact CG2-CA 3.42Å; S176-G179 WeakPolarHBondContact O-CA 3.37Å; S176-G179 PolarHBondContact O-N 3.32Å; S176-G179 PolarHBondContact OG-N 3.38Å; W177-G179 VanDerWaalsContact C-N 3.32Å; G179-F181 PolarHBondContact O-N 3Å; G179-F182 PolarHBondContact O-N 2.95Å; G179-G183 PolarHBondContact O-N 3.27Å
180V86.6Confident83.5Confident16 Ų1649.2 Ų49.210%0.09730%0.299CS..Hα-helixtrans-58.7-48.2172.5179.50000110.6F123 F162 L175 S176 W177 F182 G183 V184F123-V180 HydrophobicContact CE1-CG2 3.84Å; F123-V180 HydrophobicContact CZ-CG2 3.76Å; F162-V180 HydrophobicContact CZ-CG1 4.28Å; L175-V180 HydrophobicContact CD1-CG2 3.97Å; L175-V180 HydrophobicContact CD2-CG2 4.43Å; L175-V180 HydrophobicContact CG-CG2 4.15Å; S176-V180 WeakPolarHBondContact O-CG2 3.36Å; S176-V180 PolarHBondContact O-N 3.3Å; W177-V180 PolarHBondContact O-N 2.94Å; V180-F182 PolarHBondContact O-N 3.23Å; V180-G183 PolarHBondContact O-N 3.04Å; V180-V184 HydrophobicContact CG1-CG2 4.48Å; V180-V184 WeakPolarHBondContact O-CG2 3.28Å; V180-V184 PolarHBondContact O-N 3.16Å
181F89.4Confident84Confident125 Ų12547.6 Ų47.655%0.54828%0.282SS..Hα-helixtrans-58.9-49.1179.1177.7-102.8000112.2W177 T178 G179 G183 V184 L185W177-F181 PolarHBondContact O-N 3.16Å; T178-F181 PolarHBondContact O-N 3.45Å; G179-F181 PolarHBondContact O-N 3Å; F181-G183 VanDerWaalsContact C-N 3.31Å; F181-G183 PolarHBondContact O-N 3.18Å; F181-V184 PolarHBondContact O-N 2.81Å; F181-L185 HydrophobicContact CD1-CD1 4.06Å; F181-L185 HydrophobicContact CE1-CD1 3.42Å; F181-L185 VanDerWaalsContact CE1-CD1 3.42Å; F181-L185 HydrophobicContact CE1-CG 4.29Å; F181-L185 HydrophobicContact CE2-CD1 4.4Å; F181-L185 HydrophobicContact CZ-CD1 3.63Å; F181-L185 HydrophobicContact CZ-CG 4.23Å; F181-L185 PolarHBondContact O-N 3.03Å
182F87.4Confident84.7Confident40 Ų4044.3 Ų44.318%0.17526%0.26CS..Hα-helixtrans-64.2-35.4175.5-70.9-49.5000112.6F111 L114 C115 T178 G179 V180 L185 A186F111-F182 AromaticContact CD1-CD1 3.76Å; F111-F182 HydrophobicContact CD1-CD1 3.76Å; F111-F182 HydrophobicContact CD1-CE1 4.21Å; F111-F182 HydrophobicContact CE1-CD1 4.29Å; F111-F182 HydrophobicContact CE1-CE1 4.37Å; L114-F182 HydrophobicContact CB-CB 4.31Å; L114-F182 HydrophobicContact CB-CD1 4.32Å; L114-F182 HydrophobicContact CB-CD2 3.76Å; L114-F182 HydrophobicContact CB-CE2 4.08Å; L114-F182 HydrophobicContact CB-CG 3.89Å; L114-F182 HydrophobicContact CD1-CD1 4.24Å; L114-F182 HydrophobicContact CD1-CE1 3.94Å; L114-F182 HydrophobicContact CD1-CE2 4.35Å; L114-F182 HydrophobicContact CD1-CZ 4Å; C115-F182 HydrophobicContact CB-CB 4.13Å; T178-F182 HydrophobicContact CG2-CD2 3.84Å; T178-F182 HydrophobicContact CG2-CE2 3.46Å; T178-F182 VanDerWaalsContact CG2-CE2 3.46Å; T178-F182 HydrophobicContact CG2-CZ 4.4Å; T178-F182 WeakPolarHBondContact O-CD2 3.41Å; T178-F182 PolarHBondContact O-N 3.35Å; G179-F182 PolarHBondContact O-N 2.95Å; V180-F182 PolarHBondContact O-N 3.23Å; F182-L185 PolarHBondContact O-N 3.1Å; F182-A186 WeakPolarHBondContact O-CB 3.34Å; F182-A186 PolarHBondContact O-N 3.37Å
183G87.6Confident85.5Confident7 Ų742.3 Ų42.37%0.07224%0.24CC..Hα-helixtrans-63.7-39.517500000113.4C115 G179 V180 F181 S187C115-G183 WeakPolarHBondContact SG-CA 3.27Å; G179-G183 PolarHBondContact O-N 3.27Å; V180-G183 PolarHBondContact O-N 3.04Å; F181-G183 VanDerWaalsContact C-N 3.31Å; F181-G183 PolarHBondContact O-N 3.18Å; G183-S187 WeakPolarHBondContact O-CB 3.32Å; G183-S187 PolarHBondContact O-N 3.39Å; G183-S187 PolarHBondContact O-OG 2.89Å
184V90.4Very high86.2Confident44 Ų4440.6 Ų40.627%0.26722%0.219SC..Hα-helixtrans-66-47.3174.7174.30000110.5L130 F134 F162 V180 F181 S187 A188L130-V184 HydrophobicContact CD2-CB 4.41Å; L130-V184 HydrophobicContact CD2-CG1 4.16Å; L130-V184 HydrophobicContact CD2-CG2 3.9Å; F134-V184 HydrophobicContact CE2-CG1 3.81Å; F134-V184 WeakPolarHBondContact CE2-O 3.35Å; F134-V184 HydrophobicContact CZ-CG1 3.62Å; F162-V184 HydrophobicContact CZ-CG2 4.41Å; V180-V184 HydrophobicContact CG1-CG2 4.48Å; V180-V184 WeakPolarHBondContact O-CG2 3.28Å; V180-V184 PolarHBondContact O-N 3.16Å; F181-V184 PolarHBondContact O-N 2.81Å; V184-S187 WeakPolarHBondContact O-CB 3.35Å; V184-S187 PolarHBondContact O-N 3.33Å; V184-A188 PolarHBondContact O-N 3.49Å
185L91.2Very high86.9Confident56 Ų5637.9 Ų37.929%0.29320%0.2SC..Hα-helixtrans-61.8-44.4176.2-73.6-178.3000112.3F111 F181 F182 S187 A188 C189F111-L185 HydrophobicContact CB-CB 4.49Å; F111-L185 HydrophobicContact CD1-CB 4.44Å; F111-L185 HydrophobicContact CD1-CD1 4.34Å; F111-L185 HydrophobicContact CD2-CB 4.05Å; F111-L185 HydrophobicContact CE1-CD1 4.03Å; F111-L185 HydrophobicContact CE2-CB 4.38Å; F111-L185 HydrophobicContact CG-CB 4.1Å; F111-L185 HydrophobicContact CZ-CD1 4.16Å; F181-L185 HydrophobicContact CD1-CD1 4.06Å; F181-L185 HydrophobicContact CE1-CD1 3.42Å; F181-L185 VanDerWaalsContact CE1-CD1 3.42Å; F181-L185 HydrophobicContact CE1-CG 4.29Å; F181-L185 HydrophobicContact CE2-CD1 4.4Å; F181-L185 HydrophobicContact CZ-CD1 3.63Å; F181-L185 HydrophobicContact CZ-CG 4.23Å; F181-L185 PolarHBondContact O-N 3.03Å; F182-L185 PolarHBondContact O-N 3.1Å; L185-S187 VanDerWaalsContact C-N 3.28Å; L185-S187 PolarHBondContact O-N 3.37Å; L185-A188 PolarHBondContact O-N 3.23Å; L185-C189 PolarHBondContact O-N 2.86Å
186A89.3Confident87.5Confident0 Ų038.2 Ų38.20%020%0.2CC..Hα-helixtrans-58.7-44.2176.600000110.7F111 N112 F182 A188 C189 V190F111-A186 HydrophobicContact CB-CB 3.67Å; N112-A186 HydrophobicContact CB-CB 4.49Å; N112-A186 VanDerWaalsContact OD1-CB 3.3Å; N112-A186 WeakPolarHBondContact OD1-CB 3.49Å; F182-A186 WeakPolarHBondContact O-CB 3.34Å; F182-A186 PolarHBondContact O-N 3.37Å; A186-A188 PolarHBondContact O-N 2.75Å; A186-C189 PolarHBondContact O-N 3.38Å; A186-V190 VanDerWaalsContact O-CG2 3.29Å; A186-V190 WeakPolarHBondContact O-CG2 3.18Å; A186-V190 PolarHBondContact O-N 3.49Å
187S90.2Very high87.6Confident4 Ų438.7 Ų38.73%0.02820%0.201CC..Hα-helixtrans-61.6-40.9176.9-62.40000112.5G127 S131 G183 V184 L185 V190 S191G127-S187 PolarHBondContact O-OG 2.71Å; S131-S187 WeakPolarHBondContact CB-O 3.5Å; G183-S187 WeakPolarHBondContact O-CB 3.32Å; G183-S187 PolarHBondContact O-N 3.39Å; G183-S187 PolarHBondContact O-OG 2.89Å; V184-S187 WeakPolarHBondContact O-CB 3.35Å; V184-S187 PolarHBondContact O-N 3.33Å; L185-S187 VanDerWaalsContact C-N 3.28Å; L185-S187 PolarHBondContact O-N 3.37Å; S187-V190 PolarHBondContact O-N 2.88Å; S187-S191 PolarHBondContact O-N 2.92Å; S187-S191 VanDerWaalsContact O-N 3.14Å; S187-S191 PolarHBondContact O-OG 3.41Å
188A91.8Very high87.6Confident20 Ų2035.8 Ų35.817%0.16519%0.194CC..Hα-helixtrans-64.2-42.9173.900000112F134 V184 L185 A186 S191 L192F134-A188 HydrophobicContact CD1-CB 4.27Å; F134-A188 HydrophobicContact CD2-CB 3.97Å; F134-A188 HydrophobicContact CE1-CB 4.41Å; F134-A188 HydrophobicContact CE2-CB 4.1Å; F134-A188 HydrophobicContact CG-CB 4.06Å; F134-A188 HydrophobicContact CZ-CB 4.33Å; V184-A188 PolarHBondContact O-N 3.49Å; L185-A188 PolarHBondContact O-N 3.23Å; A186-A188 PolarHBondContact O-N 2.75Å; A188-S191 WeakPolarHBondContact O-CB 3.3Å; A188-S191 PolarHBondContact O-N 3.42Å; A188-L192 WeakPolarHBondContact O-CG 3.42Å; A188-L192 PolarHBondContact O-N 3.35Å
189C90.9Very high87.6Confident19 Ų1940.2 Ų40.213%0.12820%0.202CC..Hα-helixtrans-64.2-38.5175.1-71.60000112.5V104 M108 L185 A186 S191 L192 N193V104-C189 HydrophobicContact CG1-CB 4.5Å; V104-C189 VanDerWaalsContact CG1-O 3.29Å; V104-C189 WeakPolarHBondContact CG1-O 3.38Å; M108-C189 HydrophobicContact CB-CB 3.81Å; L185-C189 PolarHBondContact O-N 2.86Å; A186-C189 PolarHBondContact O-N 3.38Å; C189-S191 VanDerWaalsContact C-N 3.3Å; C189-S191 PolarHBondContact O-N 3.1Å; C189-L192 PolarHBondContact O-N 3.41Å; C189-N193 VanDerWaalsContact O-CB 3.26Å; C189-N193 WeakPolarHBondContact O-CB 3.43Å; C189-N193 PolarHBondContact O-N 3.41Å
190V87.5Confident87.8Confident30 Ų3040.8 Ų40.818%0.18221%0.206CC..Hα-helixtrans-57.4-45.8172.6171.90000110.3M108 A186 S187 N193 A194M108-V190 HydrophobicContact CG-CB 4.44Å; M108-V190 HydrophobicContact CG-CG2 3.56Å; M108-V190 HydrophobicContact SD-CB 4.27Å; M108-V190 HydrophobicContact SD-CG2 3.68Å; A186-V190 VanDerWaalsContact O-CG2 3.29Å; A186-V190 WeakPolarHBondContact O-CG2 3.18Å; A186-V190 PolarHBondContact O-N 3.49Å; S187-V190 PolarHBondContact O-N 2.88Å; V190-N193 WeakPolarHBondContact O-CB 3.07Å; V190-N193 PolarHBondContact O-N 2.81Å; V190-A194 PolarHBondContact O-N 3.27Å
191S88.1Confident87.7Confident2 Ų243.2 Ų43.21%0.01422%0.217CC..Hα-helixtrans-65.5-44.7178.9-51.20000112.2S131 F134 N135 S187 A188 C189 N193 A194 I195S131-S191 VanDerWaalsContact CA-OG 3.28Å; S131-S191 WeakPolarHBondContact CA-OG 3.29Å; S131-S191 PolarHBondContact O-OG 3.5Å; F134-S191 VanDerWaalsContact CB-OG 3.29Å; F134-S191 WeakPolarHBondContact CB-OG 3.4Å; N135-S191 PolarHBondContact N-OG 2.92Å; S187-S191 PolarHBondContact O-N 2.92Å; S187-S191 VanDerWaalsContact O-N 3.14Å; S187-S191 PolarHBondContact O-OG 3.41Å; A188-S191 WeakPolarHBondContact O-CB 3.3Å; A188-S191 PolarHBondContact O-N 3.42Å; C189-S191 VanDerWaalsContact C-N 3.3Å; C189-S191 PolarHBondContact O-N 3.1Å; S191-N193 VanDerWaalsContact C-N 3.3Å; S191-N193 PolarHBondContact O-N 3.41Å; S191-A194 PolarHBondContact O-N 3.43Å; S191-I195 WeakPolarHBondContact O-CG1 3.36Å; S191-I195 PolarHBondContact O-N 2.88Å
192L89.3Confident87.5Confident41 Ų4142 Ų4222%0.21522%0.221CC..Hα-helixtrans-59.9-41.4173.7-74.8172.7000111.4V104 L138 I142 A188 C189 A194 I195 F196V104-L192 HydrophobicContact CG1-CB 3.54Å; V104-L192 HydrophobicContact CG2-CB 4.46Å; L138-L192 HydrophobicContact CD1-CD2 3.73Å; L138-L192 HydrophobicContact CD1-CG 3.68Å; L138-L192 HydrophobicContact CD2-CD2 4.17Å; L138-L192 HydrophobicContact CG-CD2 4.42Å; I142-L192 HydrophobicContact CD1-CD2 3.56Å; A188-L192 WeakPolarHBondContact O-CG 3.42Å; A188-L192 PolarHBondContact O-N 3.35Å; C189-L192 PolarHBondContact O-N 3.41Å; L192-A194 VanDerWaalsContact C-N 3.33Å; L192-A194 PolarHBondContact O-N 3.36Å; L192-I195 PolarHBondContact O-N 3.02Å; L192-F196 HydrophobicContact CB-CD2 4.45Å; L192-F196 HydrophobicContact CB-CE2 4.5Å; L192-F196 HydrophobicContact CD2-CE2 4.38Å; L192-F196 WeakPolarHBondContact O-CD2 3.42Å; L192-F196 PolarHBondContact O-N 2.94Å
193N89.2Confident87.2Confident29 Ų2941.4 Ų41.416%0.15522%0.224CC..Hα-helixtrans-60.6-44.2177.7-172.760.9000110.5L101 V104 M108 C189 V190 S191 I195 T197L101-N193 WeakPolarHBondContact CD1-O 2.82Å; L101-N193 WeakPolarHBondContact CD1-OD1 3.38Å; V104-N193 HydrophobicContact CG1-CB 3.97Å; M108-N193 HydrophobicContact SD-CB 4.3Å; C189-N193 VanDerWaalsContact O-CB 3.26Å; C189-N193 WeakPolarHBondContact O-CB 3.43Å; C189-N193 PolarHBondContact O-N 3.41Å; V190-N193 WeakPolarHBondContact O-CB 3.07Å; V190-N193 PolarHBondContact O-N 2.81Å; S191-N193 VanDerWaalsContact C-N 3.3Å; S191-N193 PolarHBondContact O-N 3.41Å; N193-I195 VanDerWaalsContact C-N 3.35Å; N193-I195 PolarHBondContact O-N 2.87Å; N193-T197 VanDerWaalsContact O-CB 3.26Å; N193-T197 WeakPolarHBondContact O-CB 3.48Å; N193-T197 PolarHBondContact O-N 3.35Å; N193-T197 PolarHBondContact O-OG1 3.46Å
194A84.8Confident87Confident35 Ų3541.1 Ų41.129%0.28922%0.221SC..Hα-helixtrans-63.3-39.4175.900000112.5V190 S191 L192 K198V190-A194 PolarHBondContact O-N 3.27Å; S191-A194 PolarHBondContact O-N 3.43Å; L192-A194 VanDerWaalsContact C-N 3.33Å; L192-A194 PolarHBondContact O-N 3.36Å; A194-K198 PolarHBondContact O-N 2.93Å
195I85.2Confident86.5Confident2 Ų245.2 Ų45.21%0.0124%0.241CC..Hα-helixtrans-68.7-48.3178.1-69.8167.6000111.1L138 I142 L143 S191 L192 N193 T197 K198 R199L138-I195 HydrophobicContact CB-CD1 3.37Å; I142-I195 HydrophobicContact CD1-CG2 4.5Å; I142-I195 HydrophobicContact CG2-CG2 4.36Å; L143-I195 HydrophobicContact CD1-CG2 3.42Å; L143-I195 VanDerWaalsContact CD1-CG2 3.42Å; S191-I195 WeakPolarHBondContact O-CG1 3.36Å; S191-I195 PolarHBondContact O-N 2.88Å; L192-I195 PolarHBondContact O-N 3.02Å; N193-I195 VanDerWaalsContact C-N 3.35Å; N193-I195 PolarHBondContact O-N 2.87Å; I195-T197 VanDerWaalsContact C-N 3.31Å; I195-T197 PolarHBondContact O-N 2.87Å; I195-K198 WeakPolarHBondContact O-CB 3.47Å; I195-K198 PolarHBondContact O-N 2.98Å; I195-R199 PolarHBondContact O-N 3.41Å
196F86.9Confident85.8Confident40 Ų4044.6 Ų44.618%0.17525%0.248CC..Hα-helixtrans-66.7-33.4177.9-75.4-51.6000112.3L101 V104 L192 K198 R199 V200L101-F196 HydrophobicContact CB-CB 4.28Å; L101-F196 HydrophobicContact CD1-CB 3.89Å; V104-F196 HydrophobicContact CB-CD2 4.36Å; V104-F196 HydrophobicContact CG2-CD2 3.77Å; V104-F196 HydrophobicContact CG2-CE2 3.76Å; L192-F196 HydrophobicContact CB-CD2 4.45Å; L192-F196 HydrophobicContact CB-CE2 4.5Å; L192-F196 HydrophobicContact CD2-CE2 4.38Å; L192-F196 WeakPolarHBondContact O-CD2 3.42Å; L192-F196 PolarHBondContact O-N 2.94Å; F196-K198 VanDerWaalsContact C-N 3.3Å; F196-K198 PolarHBondContact O-N 3.2Å; F196-R199 PolarHBondContact O-N 3.04Å; F196-R199 VanDerWaalsContact O-N 3.14Å; F196-V200 WeakPolarHBondContact O-CB 3.47Å; F196-V200 VanDerWaalsContact O-CG2 3.27Å; F196-V200 WeakPolarHBondContact O-CG2 3.28Å; F196-V200 PolarHBondContact O-N 3.49Å
197T85.9Confident85.4Confident40 Ų4046.8 Ų46.825%0.24526%0.26CS..Hα-helixtrans-56-47.6171.9-64.20000110.2L101 N193 I195 M201 L211L101-T197 WeakPolarHBondContact CD1-OG1 3.49Å; N193-T197 VanDerWaalsContact O-CB 3.26Å; N193-T197 WeakPolarHBondContact O-CB 3.48Å; N193-T197 PolarHBondContact O-N 3.35Å; N193-T197 PolarHBondContact O-OG1 3.46Å; I195-T197 VanDerWaalsContact C-N 3.31Å; I195-T197 PolarHBondContact O-N 2.87Å; T197-M201 WeakPolarHBondContact O-CB 3.29Å; T197-M201 PolarHBondContact O-N 3Å; T197-L211 HydrophobicContact CG2-CD2 3.79Å
198K82.2Confident84.9Confident128 Ų12851 Ų5156%0.55728%0.282SS*.Hα-helixtrans-64.8-40.5176.2-69.6178.8-179.1-179.90112.5A194 I195 F196A194-K198 PolarHBondContact O-N 2.93Å; I195-K198 WeakPolarHBondContact O-CB 3.47Å; I195-K198 PolarHBondContact O-N 2.98Å; F196-K198 VanDerWaalsContact C-N 3.3Å; F196-K198 PolarHBondContact O-N 3.2Å
199R84.3Confident84.3Confident166 Ų16652.8 Ų52.863%0.62628%0.284SS*.Hα-helixtrans-69.3-34.7-178.1-171.9175.6179174-0.8113I195 F196 P202I195-R199 PolarHBondContact O-N 3.41Å; F196-R199 PolarHBondContact O-N 3.04Å; F196-R199 VanDerWaalsContact O-N 3.14Å; R199-P202 WeakPolarHBondContact O-CD 3.38Å
200V86.3Confident84Confident12 Ų1253.9 Ų53.97%0.07329%0.287CS..Hα-helixtrans-90.5-16.5-178.2178.60000111.6V98 F196 P202 A203 L211V98-V200 HydrophobicContact CB-CG1 4.25Å; V98-V200 HydrophobicContact CG2-CG1 3.61Å; F196-V200 WeakPolarHBondContact O-CB 3.47Å; F196-V200 VanDerWaalsContact O-CG2 3.27Å; F196-V200 WeakPolarHBondContact O-CG2 3.28Å; F196-V200 PolarHBondContact O-N 3.49Å; V200-P202 VanDerWaalsContact C-CD 3.42Å; V200-P202 VanDerWaalsContact C-N 3.31Å; V200-A203 HydrophobicContact CG1-CB 4.31Å; V200-A203 VanDerWaalsContact O-CB 3.26Å; V200-A203 WeakPolarHBondContact O-CB 3.49Å; V200-A203 PolarHBondContact O-N 3.49Å; V200-L211 HydrophobicContact CB-CD1 4.3Å; V200-L211 HydrophobicContact CG1-CD1 3.67Å
201M83.8Confident83.9Confident68 Ų6853 Ų5334%0.33528%0.281SS..G310 helixtrans-50.7-39.7177-174.1172.7-69.200114.7T197 A203 V204 G206T197-M201 WeakPolarHBondContact O-CB 3.29Å; T197-M201 PolarHBondContact O-N 3Å; M201-A203 VanDerWaalsContact C-N 3.33Å; M201-A203 PolarHBondContact O-N 3.27Å; M201-V204 WeakPolarHBondContact O-CG2 3.44Å; M201-V204 PolarHBondContact O-N 3.47Å; M201-G206 WeakPolarHBondContact O-CA 3.46Å; M201-G206 PolarHBondContact O-N 3.28Å
202P84.2Confident83.7Confident98 Ų9854.7 Ų54.764%0.63629%0.292SS*.G310 helixtrans-66.4-28.8174.9-22.135.2000114.4R199 V200 V204 D205R199-P202 WeakPolarHBondContact O-CD 3.38Å; V200-P202 VanDerWaalsContact C-CD 3.42Å; V200-P202 VanDerWaalsContact C-N 3.31Å; P202-V204 PolarHBondContact O-N 2.9Å; P202-D205 PolarHBondContact O-N 3Å
203A82.8Confident83.6Confident29 Ų2953.4 Ų53.424%0.2429%0.285CS..G310 helixtrans-68-19.5179.100000113.6E97 V200 M201E97-A203 HydrophobicContact CB-CB 4.25Å; E97-A203 WeakPolarHBondContact OE2-CB 3.13Å; V200-A203 HydrophobicContact CG1-CB 4.31Å; V200-A203 VanDerWaalsContact O-CB 3.26Å; V200-A203 WeakPolarHBondContact O-CB 3.49Å; V200-A203 PolarHBondContact O-N 3.49Å; M201-A203 VanDerWaalsContact C-N 3.33Å; M201-A203 PolarHBondContact O-N 3.27Å
204V81.9Confident83.6Confident0 Ų052.1 Ų52.10%028%0.278CS..G310 helixtrans-112.726.2-179.4-64.80000111.9V94 V98 M201 P202 G206 N207 K210 L211V94-V204 HydrophobicContact CG1-CG1 3.71Å; V98-V204 HydrophobicContact CG2-CG1 4.14Å; M201-V204 WeakPolarHBondContact O-CG2 3.44Å; M201-V204 PolarHBondContact O-N 3.47Å; P202-V204 PolarHBondContact O-N 2.9Å; V204-G206 PolarHBondContact O-N 3.43Å; V204-N207 WeakPolarHBondContact O-CB 3.47Å; V204-N207 PolarHBondContact O-N 3.03Å; V204-K210 HydrophobicContact CB-CB 4.22Å; V204-K210 HydrophobicContact CB-CD 4.16Å; V204-K210 HydrophobicContact CB-CG 4.1Å; V204-K210 HydrophobicContact CG1-CG 4.31Å; V204-L211 HydrophobicContact CG1-CD1 4.13Å; V204-L211 HydrophobicContact CG2-CB 3.98Å; V204-L211 HydrophobicContact CG2-CD1 4.04Å
205D80.8Confident83.8Confident130 Ų13051.1 Ų51.170%0.69527%0.268SS*.THydrogen-bonded Turntrans5929.3178.8-47-62.4000113.2P202 N207 K210P202-D205 PolarHBondContact O-N 3Å; D205-N207 PolarHBondContact O-N 3.47Å; D205-K210 IonicContact OD2-NZ 2.73Å; D205-K210 PolarHBondContact OD2-NZ 2.88Å
206G75.7Confident84.1Confident43 Ų4351.7 Ų51.744%0.44327%0.271SS..THydrogen-bonded Turntrans71.97.3-176.200000114.5M201 V204 I208M201-G206 WeakPolarHBondContact O-CA 3.46Å; M201-G206 PolarHBondContact O-N 3.28Å; V204-G206 PolarHBondContact O-N 3.43Å; G206-I208 PolarHBondContact O-N 3.28Å
207N81.5Confident84.3Confident46 Ų4651 Ų5125%0.24627%0.269CS..  trans-90109.3-174.7-166-44.7000112P86 V204 D205 W209 K210 L211P86-N207 VanDerWaalsContact CB-ND2 3.29Å; P86-N207 WeakPolarHBondContact CB-ND2 3.21Å; P86-N207 VanDerWaalsContact CG-ND2 3.34Å; P86-N207 WeakPolarHBondContact CG-ND2 3.4Å; V204-N207 WeakPolarHBondContact O-CB 3.47Å; V204-N207 PolarHBondContact O-N 3.03Å; D205-N207 PolarHBondContact O-N 3.47Å; N207-W209 VanDerWaalsContact C-N 3.27Å; N207-W209 PolarHBondContact O-N 3.44Å; N207-W209 WeakPolarHBondContact OD1-CA 2.78Å; N207-W209 VanDerWaalsContact OD1-CB 3.25Å; N207-W209 WeakPolarHBondContact OD1-CB 3.5Å; N207-W209 PolarHBondContact OD1-N 3.4Å; N207-K210 HydrophobicContact CB-CB 3.85Å; N207-K210 PolarHBondContact O-N 3.33Å; N207-K210 PolarHBondContact OD1-N 3Å; N207-K210 VanDerWaalsContact OD1-N 3.17Å; N207-L211 PolarHBondContact O-N 2.85Å
208I79.6Confident84.5Confident94 Ų9449.6 Ų49.648%0.48226%0.26SS..Hα-helixtrans-62.7-33.3-179.6-60.9167.1000111.7G206 L211 S212G206-I208 PolarHBondContact O-N 3.28Å; I208-L211 WeakPolarHBondContact O-CB 3.5Å; I208-L211 PolarHBondContact O-N 3.14Å; I208-S212 WeakPolarHBondContact O-CB 3.27Å; I208-S212 PolarHBondContact O-N 3.3Å
209W80Confident84.9Confident57 Ų5743.5 Ų43.522%0.21623%0.233CC..Hα-helixtrans-68.3-44177.4-61.4106.7000111.7F85 P86 N207 S212 F213 F259 Y263F85-W209 HydrophobicContact CE2-CB 4.04Å; F85-W209 AromaticContact CE2-CD2 3.85Å; F85-W209 HydrophobicContact CE2-CD2 3.85Å; F85-W209 AromaticContact CE2-CE3 3.81Å; F85-W209 HydrophobicContact CE2-CE3 3.81Å; F85-W209 AromaticContact CE2-CG 3.97Å; F85-W209 HydrophobicContact CE2-CG 3.97Å; F85-W209 HydrophobicContact CZ-CB 4.05Å; F85-W209 HydrophobicContact CZ-CE3 4.31Å; F85-W209 HydrophobicContact CZ-CG 4.46Å; P86-W209 HydrophobicContact CG-CB 3.99Å; N207-W209 VanDerWaalsContact C-N 3.27Å; N207-W209 PolarHBondContact O-N 3.44Å; N207-W209 WeakPolarHBondContact OD1-CA 2.78Å; N207-W209 VanDerWaalsContact OD1-CB 3.25Å; N207-W209 WeakPolarHBondContact OD1-CB 3.5Å; N207-W209 PolarHBondContact OD1-N 3.4Å; W209-S212 PolarHBondContact O-N 2.96Å; W209-F213 WeakPolarHBondContact O-CB 3.23Å; W209-F213 PolarHBondContact O-N 2.81Å; W209-F259 AromaticContact CE3-CE2 3.89Å; W209-F259 HydrophobicContact CE3-CE2 3.89Å; W209-F259 AromaticContact CE3-CZ 4Å; W209-F259 HydrophobicContact CE3-CZ 4Å; W209-F259 HydrophobicContact CH2-CE1 4.46Å; W209-F259 HydrophobicContact CH2-CE2 4.47Å; W209-F259 HydrophobicContact CH2-CZ 4.03Å; W209-F259 HydrophobicContact CZ3-CD2 4.22Å; W209-F259 HydrophobicContact CZ3-CE1 4.09Å; W209-F259 AromaticContact CZ3-CE2 3.4Å; W209-F259 HydrophobicContact CZ3-CE2 3.4Å; W209-F259 VanDerWaalsContact CZ3-CE2 3.4Å; W209-F259 AromaticContact CZ3-CZ 3.31Å; W209-F259 HydrophobicContact CZ3-CZ 3.31Å; W209-Y263 VanDerWaalsContact CH2-CA 3.45Å; W209-Y263 AromaticContact CH2-CD2 3.8Å; W209-Y263 HydrophobicContact CH2-CD2 3.8Å; W209-Y263 HydrophobicContact CH2-CG 4.2Å; W209-Y263 AromaticContact CZ2-CD2 3.59Å; W209-Y263 HydrophobicContact CZ2-CD2 3.59Å; W209-Y263 HydrophobicContact CZ2-CG 4.3Å
210K83.1Confident85.3Confident42 Ų4236.4 Ų36.418%0.18321%0.209CC..Hα-helixtrans-60.1-48.6173.5-167.7172.2173.1-177.10109.5V204 D205 N207 S212 F213 Y214V204-K210 HydrophobicContact CB-CB 4.22Å; V204-K210 HydrophobicContact CB-CD 4.16Å; V204-K210 HydrophobicContact CB-CG 4.1Å; V204-K210 HydrophobicContact CG1-CG 4.31Å; D205-K210 IonicContact OD2-NZ 2.73Å; D205-K210 PolarHBondContact OD2-NZ 2.88Å; N207-K210 HydrophobicContact CB-CB 3.85Å; N207-K210 PolarHBondContact O-N 3.33Å; N207-K210 PolarHBondContact OD1-N 3Å; N207-K210 VanDerWaalsContact OD1-N 3.17Å; K210-S212 VanDerWaalsContact C-N 3.34Å; K210-S212 PolarHBondContact O-N 3.4Å; K210-F213 PolarHBondContact O-N 3.03Å; K210-Y214 HydrophobicContact CD-CE2 4.28Å; K210-Y214 HydrophobicContact CG-CD2 3.69Å; K210-Y214 HydrophobicContact CG-CE2 3.52Å; K210-Y214 WeakPolarHBondContact O-CD2 3.33Å; K210-Y214 PolarHBondContact O-N 3.38Å
211L85.7Confident85.5Confident11 Ų1140.8 Ų40.86%0.05823%0.231CC..Hα-helixtrans-54.6-49.3175.7-165.761.2000112.4V98 L101 T197 V200 V204 N207 I208 Y214 N215V98-L211 HydrophobicContact CG1-CD1 4.3Å; V98-L211 HydrophobicContact CG2-CD1 4.08Å; L101-L211 HydrophobicContact CD2-CD1 3.88Å; L101-L211 HydrophobicContact CD2-CD2 4.22Å; L101-L211 HydrophobicContact CD2-CG 4.1Å; T197-L211 HydrophobicContact CG2-CD2 3.79Å; V200-L211 HydrophobicContact CB-CD1 4.3Å; V200-L211 HydrophobicContact CG1-CD1 3.67Å; V204-L211 HydrophobicContact CG1-CD1 4.13Å; V204-L211 HydrophobicContact CG2-CB 3.98Å; V204-L211 HydrophobicContact CG2-CD1 4.04Å; N207-L211 PolarHBondContact O-N 2.85Å; I208-L211 WeakPolarHBondContact O-CB 3.5Å; I208-L211 PolarHBondContact O-N 3.14Å; L211-Y214 PolarHBondContact O-N 3.14Å; L211-N215 WeakPolarHBondContact O-CB 3.36Å; L211-N215 PolarHBondContact O-N 2.98Å
212S84.9Confident85.9Confident37 Ų3739.8 Ų39.826%0.25923%0.227SC..Hα-helixtrans-61.6-45.8-179.4-174.20000111.1I208 W209 K210 N215 N216I208-S212 WeakPolarHBondContact O-CB 3.27Å; I208-S212 PolarHBondContact O-N 3.3Å; W209-S212 PolarHBondContact O-N 2.96Å; K210-S212 VanDerWaalsContact C-N 3.34Å; K210-S212 PolarHBondContact O-N 3.4Å; S212-N215 PolarHBondContact O-N 3.48Å; S212-N216 WeakPolarHBondContact O-CB 3.5Å; S212-N216 PolarHBondContact O-N 3.4Å; S212-N216 PolarHBondContact O-ND2 3Å; S212-N216 PolarHBondContact OG-ND2 3.31Å
213F86.8Confident86.1Confident14 Ų1435.1 Ų35.16%0.06120%0.196CC..Hα-helixtrans-58.9-52.6177.4178.2-99.7000112.1V66 C69 V88 W209 K210 N215 N216 I217V66-F213 HydrophobicContact CG1-CD2 4.5Å; V66-F213 HydrophobicContact CG1-CE2 3.97Å; C69-F213 HydrophobicContact CB-CD2 3.56Å; C69-F213 HydrophobicContact CB-CE2 4.2Å; V88-F213 HydrophobicContact CG1-CD1 3.2Å; V88-F213 HydrophobicContact CG1-CD2 4.01Å; V88-F213 HydrophobicContact CG1-CE1 3.03Å; V88-F213 HydrophobicContact CG1-CE2 3.86Å; V88-F213 HydrophobicContact CG1-CG 3.67Å; V88-F213 HydrophobicContact CG1-CZ 3.36Å; W209-F213 WeakPolarHBondContact O-CB 3.23Å; W209-F213 PolarHBondContact O-N 2.81Å; K210-F213 PolarHBondContact O-N 3.03Å; F213-N215 VanDerWaalsContact C-N 3.34Å; F213-N215 PolarHBondContact O-N 2.9Å; F213-N216 PolarHBondContact O-N 3.32Å; F213-I217 HydrophobicContact CD1-CD1 3.78Å; F213-I217 HydrophobicContact CD2-CD1 4.33Å; F213-I217 HydrophobicContact CE1-CD1 3.19Å; F213-I217 HydrophobicContact CE1-CG1 4.39Å; F213-I217 HydrophobicContact CE2-CD1 3.84Å; F213-I217 HydrophobicContact CG-CD1 4.34Å; F213-I217 HydrophobicContact CZ-CD1 3.26Å; F213-I217 HydrophobicContact CZ-CG1 4.36Å; F213-I217 WeakPolarHBondContact O-CG1 3.34Å; F213-I217 PolarHBondContact O-N 2.97Å
214Y88.4Confident86.5Confident2 Ų238.1 Ų38.11%0.00821%0.208CC..Hα-helixtrans-62.2-41.3179.1-82.1-74.6000112.3K89 D91 V94 C95 K210 L211 I217 N218K89-Y214 PolarHBondContact O-OH 3.12Å; D91-Y214 PolarHBondContact N-OH 3.35Å; D91-Y214 WeakPolarHBondContact O-CE1 3.42Å; V94-Y214 HydrophobicContact CB-CD1 4.26Å; V94-Y214 HydrophobicContact CB-CE1 3.79Å; V94-Y214 HydrophobicContact CB-CE2 4.14Å; V94-Y214 HydrophobicContact CG1-CD1 4.01Å; V94-Y214 HydrophobicContact CG1-CD2 3.63Å; V94-Y214 HydrophobicContact CG1-CE1 3.92Å; V94-Y214 HydrophobicContact CG1-CE2 3.59Å; V94-Y214 HydrophobicContact CG1-CG 3.87Å; C95-Y214 HydrophobicContact CB-CD1 4.36Å; C95-Y214 WeakPolarHBondContact SG-CD1 3.36Å; K210-Y214 HydrophobicContact CD-CE2 4.28Å; K210-Y214 HydrophobicContact CG-CD2 3.69Å; K210-Y214 HydrophobicContact CG-CE2 3.52Å; K210-Y214 WeakPolarHBondContact O-CD2 3.33Å; K210-Y214 PolarHBondContact O-N 3.38Å; L211-Y214 PolarHBondContact O-N 3.14Å; Y214-I217 PolarHBondContact O-N 3.06Å; Y214-N218 WeakPolarHBondContact O-CB 3.24Å; Y214-N218 PolarHBondContact O-N 3.27Å
215N90.8Very high86.8Confident14 Ų1441.3 Ų41.38%0.07523%0.228CC..Hα-helixtrans-64.5-43.8177.6-175.762.1000111.9V98 S102 L211 S212 F213 N218 A219V98-N215 HydrophobicContact CG1-CB 3.99Å; S102-N215 WeakPolarHBondContact CA-OD1 3.45Å; S102-N215 WeakPolarHBondContact CB-OD1 3.34Å; S102-N215 PolarHBondContact N-OD1 2.96Å; S102-N215 PolarHBondContact OG-OD1 3.03Å; L211-N215 WeakPolarHBondContact O-CB 3.36Å; L211-N215 PolarHBondContact O-N 2.98Å; S212-N215 PolarHBondContact O-N 3.48Å; F213-N215 VanDerWaalsContact C-N 3.34Å; F213-N215 PolarHBondContact O-N 2.9Å; N215-N218 PolarHBondContact O-N 3.44Å; N215-A219 WeakPolarHBondContact O-CB 3.46Å; N215-A219 PolarHBondContact O-N 3Å
216N90.1Very high87Confident14 Ų1437.4 Ų37.48%0.07521%0.207CC..Hα-helixtrans-70.2-34.1180-78-79000112.3C62 V66 S212 F213 A219 C220C62-N216 WeakPolarHBondContact CA-OD1 3.47Å; C62-N216 HydrophobicContact CB-CB 4.36Å; C62-N216 WeakPolarHBondContact CB-OD1 3.4Å; C62-N216 PolarHBondContact SG-OD1 3.3Å; V66-N216 HydrophobicContact CG2-CB 3.7Å; S212-N216 WeakPolarHBondContact O-CB 3.5Å; S212-N216 PolarHBondContact O-N 3.4Å; S212-N216 PolarHBondContact O-ND2 3Å; S212-N216 PolarHBondContact OG-ND2 3.31Å; F213-N216 PolarHBondContact O-N 3.32Å; N216-A219 PolarHBondContact O-N 3.01Å; N216-C220 PolarHBondContact O-N 3.34Å; N216-C220 PolarHBondContact O-SG 3.29Å
217I90.8Very high87.6Confident26 Ų2635.9 Ų35.913%0.13319%0.189CC..Hα-helixtrans-63.4-52.1171.6-72.6176.1000111V66 F90 F213 Y214 A219 C220 I221V66-I217 HydrophobicContact CG1-CD1 4.47Å; V66-I217 HydrophobicContact CG1-CG1 4.01Å; V66-I217 HydrophobicContact CG2-CG1 3.8Å; F90-I217 HydrophobicContact CD2-CD1 4.14Å; F90-I217 HydrophobicContact CE2-CD1 4.16Å; F90-I217 HydrophobicContact CE2-CG2 4.16Å; F213-I217 HydrophobicContact CD1-CD1 3.78Å; F213-I217 HydrophobicContact CD2-CD1 4.33Å; F213-I217 HydrophobicContact CE1-CD1 3.19Å; F213-I217 HydrophobicContact CE1-CG1 4.39Å; F213-I217 HydrophobicContact CE2-CD1 3.84Å; F213-I217 HydrophobicContact CG-CD1 4.34Å; F213-I217 HydrophobicContact CZ-CD1 3.26Å; F213-I217 HydrophobicContact CZ-CG1 4.36Å; F213-I217 WeakPolarHBondContact O-CG1 3.34Å; F213-I217 PolarHBondContact O-N 2.97Å; Y214-I217 PolarHBondContact O-N 3.06Å; I217-A219 PolarHBondContact O-N 2.8Å; I217-C220 WeakPolarHBondContact O-CB 3.38Å; I217-C220 PolarHBondContact O-N 3.48Å; I217-C220 VanDerWaalsContact O-N 3.13Å; I217-I221 HydrophobicContact CG2-CD1 4.18Å; I217-I221 PolarHBondContact O-N 2.93Å; I217-I221 VanDerWaalsContact O-N 3.14Å
218N91.8Very high87.8Confident10 Ų1039.5 Ų39.55%0.05321%0.208CC..Hα-helixtrans-58-40.9177.5-76.5-12.7000110.7C95 L99 S102 Y214 N215 I221 L222C95-N218 PolarHBondContact O-ND2 3.28Å; L99-N218 PolarHBondContact N-ND2 2.86Å; S102-N218 WeakPolarHBondContact OG-CB 2.9Å; S102-N218 PolarHBondContact OG-ND2 3.42Å; Y214-N218 WeakPolarHBondContact O-CB 3.24Å; Y214-N218 PolarHBondContact O-N 3.27Å; N215-N218 PolarHBondContact O-N 3.44Å; N218-I221 PolarHBondContact O-N 3.29Å; N218-L222 WeakPolarHBondContact O-CB 3.41Å; N218-L222 VanDerWaalsContact O-CG 3.27Å; N218-L222 WeakPolarHBondContact O-CG 3.26Å; N218-L222 PolarHBondContact O-N 2.93Å
219A90.5Very high88Confident0 Ų041 Ų410%022%0.221CC..Hα-helixtrans-61.7-44176.100000112F105 N215 N216 I217 I221 L222 F223F105-A219 HydrophobicContact CD1-CB 4.21Å; F105-A219 HydrophobicContact CE1-CB 4.24Å; N215-A219 WeakPolarHBondContact O-CB 3.46Å; N215-A219 PolarHBondContact O-N 3Å; N216-A219 PolarHBondContact O-N 3.01Å; I217-A219 PolarHBondContact O-N 2.8Å; A219-I221 VanDerWaalsContact C-N 3.29Å; A219-I221 PolarHBondContact O-N 3.5Å; A219-L222 PolarHBondContact O-N 3.36Å; A219-F223 HydrophobicContact CB-CD2 4.06Å; A219-F223 HydrophobicContact CB-CE2 3.94Å; A219-F223 WeakPolarHBondContact O-CB 3.32Å; A219-F223 WeakPolarHBondContact O-CD2 3.29Å; A219-F223 WeakPolarHBondContact O-CG 3.46Å; A219-F223 PolarHBondContact O-N 3.22Å
220C91.3Very high88.1Confident17 Ų1743.3 Ų43.312%0.11523%0.233CC..Hα-helixtrans-56.4-44.5175.8-69.30000111.5F59 N216 I217 L224F59-C220 HydrophobicContact CD2-CB 4.45Å; F59-C220 HydrophobicContact CE2-CB 4.11Å; F59-C220 WeakPolarHBondContact CE2-O 3.22Å; N216-C220 PolarHBondContact O-N 3.34Å; N216-C220 PolarHBondContact O-SG 3.29Å; I217-C220 WeakPolarHBondContact O-CB 3.38Å; I217-C220 PolarHBondContact O-N 3.48Å; I217-C220 VanDerWaalsContact O-N 3.13Å; C220-L224 WeakPolarHBondContact O-CG 3.29Å
221I91.9Very high87.9Confident105 Ų10542.9 Ų42.954%0.53824%0.24SC..Hα-helixtrans-67-44.1179.5-62.5168.3000111.1I217 N218 A219 P225I217-I221 HydrophobicContact CG2-CD1 4.18Å; I217-I221 PolarHBondContact O-N 2.93Å; I217-I221 VanDerWaalsContact O-N 3.14Å; N218-I221 PolarHBondContact O-N 3.29Å; A219-I221 VanDerWaalsContact C-N 3.29Å; A219-I221 PolarHBondContact O-N 3.5Å; I221-P225 WeakPolarHBondContact O-CD 3.47Å
222L91.2Very high87.8Confident46 Ų4642.8 Ų42.824%0.24124%0.24CC..Hα-helixtrans-75.7-27.2-176.4-71.2172.4000113.4L99 I103 I106 N218 A219 P225 L226L99-L222 HydrophobicContact CD1-CD1 3.98Å; I103-L222 HydrophobicContact CG1-CD1 3.97Å; I106-L222 HydrophobicContact CD1-CB 3.15Å; I106-L222 HydrophobicContact CD1-CD1 3.64Å; I106-L222 HydrophobicContact CD1-CG 4.04Å; N218-L222 WeakPolarHBondContact O-CB 3.41Å; N218-L222 VanDerWaalsContact O-CG 3.27Å; N218-L222 WeakPolarHBondContact O-CG 3.26Å; N218-L222 PolarHBondContact O-N 2.93Å; A219-L222 PolarHBondContact O-N 3.36Å; L222-P225 VanDerWaalsContact O-CD 3.29Å; L222-P225 WeakPolarHBondContact O-CD 3.2Å; L222-P225 VanDerWaalsContact O-CG 3.32Å; L222-P225 WeakPolarHBondContact O-CG 3.17Å; L222-L226 WeakPolarHBondContact O-CD1 3.29Å
223F89.5Confident87.5Confident0 Ų044 Ų440%025%0.245CC..Hα-helixtrans-70.6-31.2176.5-84.8-57.7000112.6L55 T58 F59 F105 I106 I109 A219 L226 I227L55-F223 HydrophobicContact CB-CD1 4.33Å; L55-F223 HydrophobicContact CD2-CD1 4.45Å; L55-F223 HydrophobicContact CD2-CE1 4.02Å; T58-F223 HydrophobicContact CG2-CE2 3.88Å; T58-F223 HydrophobicContact CG2-CZ 3.7Å; F59-F223 HydrophobicContact CB-CB 3.96Å; F59-F223 HydrophobicContact CB-CD2 4.26Å; F59-F223 HydrophobicContact CB-CG 4.2Å; F59-F223 HydrophobicContact CD2-CB 3.86Å; F59-F223 HydrophobicContact CG-CB 4.32Å; F105-F223 HydrophobicContact CE1-CE2 4.34Å; I106-F223 HydrophobicContact CB-CE1 4.35Å; I106-F223 HydrophobicContact CB-CZ 4.44Å; I106-F223 HydrophobicContact CG1-CD1 4.39Å; I106-F223 HydrophobicContact CG1-CD2 4.45Å; I106-F223 HydrophobicContact CG1-CE1 3.98Å; I106-F223 HydrophobicContact CG1-CE2 4.05Å; I106-F223 HydrophobicContact CG1-CZ 3.79Å; I106-F223 HydrophobicContact CG2-CD1 4.24Å; I106-F223 HydrophobicContact CG2-CE1 3.87Å; I106-F223 HydrophobicContact CG2-CZ 4.45Å; I109-F223 HydrophobicContact CB-CZ 4.5Å; I109-F223 HydrophobicContact CG2-CZ 4.31Å; A219-F223 HydrophobicContact CB-CD2 4.06Å; A219-F223 HydrophobicContact CB-CE2 3.94Å; A219-F223 WeakPolarHBondContact O-CB 3.32Å; A219-F223 WeakPolarHBondContact O-CD2 3.29Å; A219-F223 WeakPolarHBondContact O-CG 3.46Å; A219-F223 PolarHBondContact O-N 3.22Å; F223-L226 PolarHBondContact O-N 3.13Å; F223-L226 VanDerWaalsContact O-N 3.15Å; F223-I227 HydrophobicContact CB-CD1 4.29Å; F223-I227 WeakPolarHBondContact O-CB 3.49Å; F223-I227 VanDerWaalsContact O-CG1 3.29Å; F223-I227 WeakPolarHBondContact O-CG1 3.26Å; F223-I227 PolarHBondContact O-N 2.79Å
224L89.4Confident86.8Confident92 Ų9245.2 Ų45.248%0.48226%0.262SS..Hα-helixtrans-54.1-54.5179.5-69.7172.6000113.9F59 C220 L226 I227 L228F59-L224 HydrophobicContact CE2-CD2 3.86Å; F59-L224 HydrophobicContact CE2-CG 4.12Å; F59-L224 HydrophobicContact CZ-CD2 3.86Å; C220-L224 WeakPolarHBondContact O-CG 3.29Å; L224-L226 VanDerWaalsContact C-N 3.29Å; L224-L226 PolarHBondContact O-N 3.4Å; L224-I227 PolarHBondContact O-N 2.9Å; L224-L228 WeakPolarHBondContact O-CG 3.41Å; L224-L228 PolarHBondContact O-N 2.87Å
225P88.5Confident86.2Confident67 Ų6749.7 Ų49.744%0.43528%0.283SS..Hα-helixtrans-65.3-32.9177.125.7-34.8000112.2I221 L222 L228 V229I221-P225 WeakPolarHBondContact O-CD 3.47Å; L222-P225 VanDerWaalsContact O-CD 3.29Å; L222-P225 WeakPolarHBondContact O-CD 3.2Å; L222-P225 VanDerWaalsContact O-CG 3.32Å; L222-P225 WeakPolarHBondContact O-CG 3.17Å; P225-L228 PolarHBondContact O-N 2.98Å; P225-V229 VanDerWaalsContact O-CG2 3.27Å; P225-V229 WeakPolarHBondContact O-CG2 3.33Å; P225-V229 PolarHBondContact O-N 3.32Å
226L86.1Confident85.4Confident48 Ų4849.8 Ų49.825%0.25128%0.283SS..Hα-helixtrans-65.9-46.3177.1-95.778.6000111.7L55 I106 L222 F223 L224 L228 V229 F230L55-L226 HydrophobicContact CD1-CB 4.28Å; L55-L226 HydrophobicContact CD1-CD2 4.46Å; I106-L226 HydrophobicContact CG2-CD2 3.46Å; I106-L226 VanDerWaalsContact CG2-CD2 3.46Å; L222-L226 WeakPolarHBondContact O-CD1 3.29Å; F223-L226 PolarHBondContact O-N 3.13Å; F223-L226 VanDerWaalsContact O-N 3.15Å; L224-L226 VanDerWaalsContact C-N 3.29Å; L224-L226 PolarHBondContact O-N 3.4Å; L226-L228 PolarHBondContact O-N 3.26Å; L226-V229 PolarHBondContact O-N 2.62Å; L226-V229 VanDerWaalsContact O-N 3.13Å; L226-F230 HydrophobicContact CB-CD2 4.36Å; L226-F230 HydrophobicContact CD2-CE2 4.27Å; L226-F230 HydrophobicContact CG-CD2 4.44Å; L226-F230 HydrophobicContact CG-CE2 4.28Å; L226-F230 WeakPolarHBondContact O-CB 3.45Å; L226-F230 VanDerWaalsContact O-CD2 3.3Å; L226-F230 WeakPolarHBondContact O-CD2 3.22Å; L226-F230 PolarHBondContact O-N 3.16Å
227I87.1Confident84.6Confident12 Ų1254.2 Ų54.26%0.06231%0.31CS..Hα-helixtrans-56.9-37.5177.2-72.1165.8000110.8L55 F56 F59 F223 L224 G231 E232 V233L55-I227 HydrophobicContact CB-CG1 4.06Å; F56-I227 HydrophobicContact CB-CD1 4.44Å; F59-I227 HydrophobicContact CB-CD1 3.78Å; F59-I227 HydrophobicContact CD1-CD1 4.24Å; F59-I227 HydrophobicContact CD2-CD1 4.49Å; F59-I227 HydrophobicContact CG-CD1 3.92Å; F223-I227 HydrophobicContact CB-CD1 4.29Å; F223-I227 WeakPolarHBondContact O-CB 3.49Å; F223-I227 VanDerWaalsContact O-CG1 3.29Å; F223-I227 WeakPolarHBondContact O-CG1 3.26Å; F223-I227 PolarHBondContact O-N 2.79Å; L224-I227 PolarHBondContact O-N 2.9Å; I227-G231 PolarHBondContact O-N 3.17Å; I227-E232 HydrophobicContact CG2-CB 4.19Å; I227-E232 PolarHBondContact O-N 2.78Å; I227-E232 VanDerWaalsContact O-N 3.15Å; I227-V233 HydrophobicContact CG2-CG2 3.65Å
228L85.8Confident83.7Confident121 Ų12160.8 Ų60.863%0.63434%0.34SS*.Hα-helixtrans-69.1-46.9175.1-67.2171.4000112.5L224 P225 L226 G231 V233L224-L228 WeakPolarHBondContact O-CG 3.41Å; L224-L228 PolarHBondContact O-N 2.87Å; P225-L228 PolarHBondContact O-N 2.98Å; L226-L228 PolarHBondContact O-N 3.26Å; L228-G231 PolarHBondContact O-N 3.29Å; L228-V233 HydrophobicContact CD2-CG2 3.88Å
229V85.4Confident82.9Confident125 Ų12560.8 Ų60.876%0.75834%0.34SS*.Hα-helixtrans-67.8-38.7-178.3170.20000112.2P225 L226 G231P225-V229 VanDerWaalsContact O-CG2 3.27Å; P225-V229 WeakPolarHBondContact O-CG2 3.33Å; P225-V229 PolarHBondContact O-N 3.32Å; L226-V229 PolarHBondContact O-N 2.62Å; L226-V229 VanDerWaalsContact O-N 3.13Å; V229-G231 PolarHBondContact O-N 3.29Å
230F82Confident81.7Confident107 Ų10765.6 Ų65.647%0.46937%0.373SS..THydrogen-bonded Turntrans-77.9-5.4176.3-79.9-87.4000113L55 T110 L226 E232L55-F230 HydrophobicContact CD1-CB 4.17Å; L55-F230 HydrophobicContact CD1-CD2 3.61Å; L55-F230 HydrophobicContact CD1-CE2 4.13Å; L55-F230 HydrophobicContact CD1-CG 3.87Å; T110-F230 HydrophobicContact CG2-CZ 4.06Å; L226-F230 HydrophobicContact CB-CD2 4.36Å; L226-F230 HydrophobicContact CD2-CE2 4.27Å; L226-F230 HydrophobicContact CG-CD2 4.44Å; L226-F230 HydrophobicContact CG-CE2 4.28Å; L226-F230 WeakPolarHBondContact O-CB 3.45Å; L226-F230 VanDerWaalsContact O-CD2 3.3Å; L226-F230 WeakPolarHBondContact O-CD2 3.22Å; L226-F230 PolarHBondContact O-N 3.16Å; F230-E232 HydrophobicContact CB-CG 4.36Å; F230-E232 PolarHBondContact O-N 2.97Å
231G79.1Confident80.7Confident33 Ų3368.6 Ų68.634%0.3438%0.382SS..THydrogen-bonded Turntrans71.113.7175.700000114.6I227 L228 V229 V233 G234I227-G231 PolarHBondContact O-N 3.17Å; L228-G231 PolarHBondContact O-N 3.29Å; V229-G231 PolarHBondContact O-N 3.29Å; G231-V233 PolarHBondContact O-N 3.06Å; G231-V233 VanDerWaalsContact O-N 3.13Å; G231-G234 PolarHBondContact O-N 2.9Å
232E82.4Confident79.8Confident9 Ų966.3 Ų66.34%0.04237%0.371CS..Hα-helixtrans-60.5-26.6-178.7-69.9-168.6175.500111.9A53 P54 L55 F56 I227 F230 G234 H235 L236A53-E232 WeakPolarHBondContact CA-OE2 3.32Å; A53-E232 HydrophobicContact CB-CB 4.02Å; A53-E232 HydrophobicContact CB-CG 4.12Å; P54-E232 WeakPolarHBondContact CD-OE1 3.33Å; L55-E232 WeakPolarHBondContact CB-OE1 3.31Å; L55-E232 WeakPolarHBondContact CB-OE2 3.37Å; L55-E232 WeakPolarHBondContact CG-OE1 3.27Å; L55-E232 PolarHBondContact N-OE1 3.21Å; L55-E232 PolarHBondContact N-OE2 2.84Å; F56-E232 WeakPolarHBondContact CB-OE2 3.39Å; F56-E232 PolarHBondContact N-OE2 3.28Å; I227-E232 HydrophobicContact CG2-CB 4.19Å; I227-E232 PolarHBondContact O-N 2.78Å; I227-E232 VanDerWaalsContact O-N 3.15Å; F230-E232 HydrophobicContact CB-CG 4.36Å; F230-E232 PolarHBondContact O-N 2.97Å; E232-G234 VanDerWaalsContact C-N 3.26Å; E232-G234 PolarHBondContact O-N 2.95Å; E232-H235 PolarHBondContact O-N 3.44Å; E232-H235 VanDerWaalsContact O-N 3.14Å; E232-L236 VanDerWaalsContact O-CG 3.26Å; E232-L236 WeakPolarHBondContact O-CG 3.48Å; E232-L236 PolarHBondContact O-N 3.49Å
233V78.8Confident78.9Confident61 Ų6167.5 Ų67.537%0.3739%0.394SS..Hα-helixtrans-57.2-39.4174.2-174.90000112I227 L228 G231 L236 V237I227-V233 HydrophobicContact CG2-CG2 3.65Å; L228-V233 HydrophobicContact CD2-CG2 3.88Å; G231-V233 PolarHBondContact O-N 3.06Å; G231-V233 VanDerWaalsContact O-N 3.13Å; V233-L236 PolarHBondContact O-N 3.04Å; V233-V237 WeakPolarHBondContact O-CG2 3.2Å; V233-V237 PolarHBondContact O-N 3.03Å
234G72.3Confident78.6Confident40 Ų4069.4 Ų69.441%0.41240%0.404SS..Hα-helixtrans-65.5-41.1177.700000111.9G231 E232 H238G231-G234 PolarHBondContact O-N 2.9Å; E232-G234 VanDerWaalsContact C-N 3.26Å; E232-G234 PolarHBondContact O-N 2.95Å; G234-H238 PolarHBondContact O-N 3.21Å; G234-H238 PolarHBondContact O-ND1 3.25Å
235H75.2Confident78.4Confident97 Ų9770 Ų7045%0.44941%0.414SS..Hα-helixtrans-66.2-40175.7-68-69.1000112E232 H238 F239E232-H235 PolarHBondContact O-N 3.44Å; E232-H235 VanDerWaalsContact O-N 3.14Å; H235-H238 PolarHBondContact O-N 3.29Å; H235-F239 WeakPolarHBondContact O-CB 3.26Å; H235-F239 PolarHBondContact O-N 3.03Å; H235-F239 VanDerWaalsContact O-N 3.09Å
236L74.6Confident78.2Confident16 Ų1670.4 Ų70.48%0.08442%0.415CS..Hα-helixtrans-62.8-47.7176.8-68.7167.2000111.4L51 A53 F56 E232 V233 H238 F239 L242L51-L236 HydrophobicContact CD1-CD2 4.07Å; A53-L236 HydrophobicContact CB-CD2 3.94Å; A53-L236 HydrophobicContact CB-CG 4.17Å; F56-L236 HydrophobicContact CB-CD1 3.94Å; F56-L236 HydrophobicContact CB-CD2 4.41Å; F56-L236 HydrophobicContact CD1-CD1 4.02Å; F56-L236 HydrophobicContact CD1-CD2 3.52Å; F56-L236 HydrophobicContact CD1-CG 4.42Å; F56-L236 HydrophobicContact CD2-CD1 3.45Å; F56-L236 VanDerWaalsContact CD2-CD1 3.45Å; F56-L236 HydrophobicContact CD2-CD2 4.48Å; F56-L236 HydrophobicContact CE1-CD1 4.41Å; F56-L236 HydrophobicContact CE1-CD2 3.82Å; F56-L236 HydrophobicContact CE2-CD1 3.9Å; F56-L236 HydrophobicContact CG-CD1 3.51Å; F56-L236 HydrophobicContact CG-CD2 3.88Å; F56-L236 HydrophobicContact CG-CG 4.31Å; F56-L236 HydrophobicContact CZ-CD1 4.35Å; F56-L236 HydrophobicContact CZ-CD2 4.42Å; E232-L236 VanDerWaalsContact O-CG 3.26Å; E232-L236 WeakPolarHBondContact O-CG 3.48Å; E232-L236 PolarHBondContact O-N 3.49Å; V233-L236 PolarHBondContact O-N 3.04Å; L236-H238 PolarHBondContact O-N 3.49Å; L236-F239 VanDerWaalsContact O-CB 3.22Å; L236-F239 WeakPolarHBondContact O-CB 3.3Å; L236-F239 PolarHBondContact O-N 3.44Å; L236-L242 HydrophobicContact CD2-CD2 4.45Å; L236-L242 WeakPolarHBondContact O-CD1 3.24Å; L236-L242 WeakPolarHBondContact O-CG 3.45Å
237V72.8Confident78Confident107 Ų10768.3 Ų68.365%0.64840%0.404SS*.Hα-helixtrans-60.7-31.9-178.8172.80000112.5V233V233-V237 WeakPolarHBondContact O-CG2 3.2Å; V233-V237 PolarHBondContact O-N 3.03Å
238H71.9Confident78Confident163 Ų16371.7 Ų71.776%0.75542%0.416SS*.THydrogen-bonded Turntrans-88.2-4.5176.9-66.184.1000113.4G234 H235 L236 S240G234-H238 PolarHBondContact O-N 3.21Å; G234-H238 PolarHBondContact O-ND1 3.25Å; H235-H238 PolarHBondContact O-N 3.29Å; L236-H238 PolarHBondContact O-N 3.49Å; H238-S240 PolarHBondContact O-N 2.94Å
239F74.5Confident78.1Confident11 Ų1167.9 Ų67.95%0.04841%0.406CS..  trans-74.7109.2-179.4-177.6-114.5000110.5D50 L51 H235 L236 R241 L242 F247D50-F239 VanDerWaalsContact C-CD2 3.5Å; D50-F239 HydrophobicContact CB-CD2 3.67Å; D50-F239 HydrophobicContact CB-CE2 3.42Å; D50-F239 VanDerWaalsContact CB-CE2 3.42Å; D50-F239 WeakPolarHBondContact O-CD2 3.35Å; L51-F239 HydrophobicContact CB-CD2 4.26Å; L51-F239 HydrophobicContact CB-CE2 3.69Å; L51-F239 HydrophobicContact CB-CZ 3.98Å; L51-F239 HydrophobicContact CD1-CD1 3.7Å; L51-F239 HydrophobicContact CD1-CD2 4Å; L51-F239 HydrophobicContact CD1-CE1 3.56Å; L51-F239 HydrophobicContact CD1-CE2 3.82Å; L51-F239 HydrophobicContact CD1-CG 3.92Å; L51-F239 HydrophobicContact CD1-CZ 3.61Å; L51-F239 HydrophobicContact CG-CE2 4.4Å; L51-F239 HydrophobicContact CG-CZ 4.41Å; H235-F239 WeakPolarHBondContact O-CB 3.26Å; H235-F239 PolarHBondContact O-N 3.03Å; H235-F239 VanDerWaalsContact O-N 3.09Å; L236-F239 VanDerWaalsContact O-CB 3.22Å; L236-F239 WeakPolarHBondContact O-CB 3.3Å; L236-F239 PolarHBondContact O-N 3.44Å; F239-R241 HydrophobicContact CD1-CB 4.21Å; F239-R241 HydrophobicContact CE1-CB 3.56Å; F239-R241 HydrophobicContact CE2-CB 4.43Å; F239-R241 HydrophobicContact CZ-CB 3.71Å; F239-R241 HydrophobicContact CZ-CG 4.45Å; F239-R241 PolarHBondContact O-N 2.87Å; F239-R241 VanDerWaalsContact O-N 3.12Å; F239-L242 HydrophobicContact CB-CG 4.17Å; F239-L242 HydrophobicContact CD1-CB 4.47Å; F239-L242 HydrophobicContact CD1-CD2 4.08Å; F239-L242 HydrophobicContact CD1-CG 3.94Å; F239-L242 PolarHBondContact O-N 3.16Å; F239-L242 VanDerWaalsContact O-N 3.15Å; F239-F247 HydrophobicContact CE1-CD1 4.31Å; F239-F247 AromaticContact CE1-CD2 3.96Å; F239-F247 HydrophobicContact CE1-CD2 3.96Å; F239-F247 HydrophobicContact CE1-CE1 4.22Å; F239-F247 AromaticContact CE1-CE2 3.87Å; F239-F247 HydrophobicContact CE1-CE2 3.87Å; F239-F247 HydrophobicContact CE1-CG 4.18Å; F239-F247 HydrophobicContact CE1-CZ 4.01Å; F239-F247 HydrophobicContact CZ-CD2 4.14Å; F239-F247 HydrophobicContact CZ-CE2 4.05Å
240S67.1Low78Confident101 Ų10164.4 Ų64.471%0.70638%0.382SS*.THydrogen-bonded Turntrans-61.5-20.8-17552.20000114.3H238H238-S240 PolarHBondContact O-N 2.94Å
241R69Low78.2Confident80 Ų8059.3 Ų59.330%0.30236%0.36SS..THydrogen-bonded Turntrans-98.710.6179.9-58.2-176.768-172.91114.2F239 G243 D244F239-R241 HydrophobicContact CD1-CB 4.21Å; F239-R241 HydrophobicContact CE1-CB 3.56Å; F239-R241 HydrophobicContact CE2-CB 4.43Å; F239-R241 HydrophobicContact CZ-CB 3.71Å; F239-R241 HydrophobicContact CZ-CG 4.45Å; F239-R241 PolarHBondContact O-N 2.87Å; F239-R241 VanDerWaalsContact O-N 3.12Å; R241-G243 PolarHBondContact O-N 2.99Å; R241-G243 VanDerWaalsContact O-N 3.17Å; R241-D244 HydrophobicContact CB-CB 4.15Å; R241-D244 IonicContact CZ-OD2 2.75Å; R241-D244 IonicContact NE-OD2 3.57Å; R241-D244 PolarHBondContact NE-OD2 3.42Å; R241-D244 IonicContact NH2-OD2 2.73Å; R241-D244 PolarHBondContact NH2-OD2 3.41Å; R241-D244 WeakPolarHBondContact O-CB 3.3Å; R241-D244 PolarHBondContact O-N 3.13Å
242L72.6Confident78.8Confident56 Ų5660 Ų6029%0.29336%0.358SS..THydrogen-bonded Turntrans-56.9-29.2172.5-84.5-174.3000112.9L236 F239 W248L236-L242 HydrophobicContact CD2-CD2 4.45Å; L236-L242 WeakPolarHBondContact O-CD1 3.24Å; L236-L242 WeakPolarHBondContact O-CG 3.45Å; F239-L242 HydrophobicContact CB-CG 4.17Å; F239-L242 HydrophobicContact CD1-CB 4.47Å; F239-L242 HydrophobicContact CD1-CD2 4.08Å; F239-L242 HydrophobicContact CD1-CG 3.94Å; F239-L242 PolarHBondContact O-N 3.16Å; F239-L242 VanDerWaalsContact O-N 3.15Å; L242-W248 HydrophobicContact CD2-CZ2 4.42Å; L242-W248 PolarHBondContact O-NE1 3.17Å
243G73.5Confident79.1Confident72 Ų7263.5 Ų63.574%0.74238%0.376SS*.THydrogen-bonded Turntrans-85.8-4.8177.100000114.7R241 P245R241-G243 PolarHBondContact O-N 2.99Å; R241-G243 VanDerWaalsContact O-N 3.17Å; G243-P245 WeakPolarHBondContact O-CD 3.44Å
244D82.5Confident79.5Confident39 Ų3960.6 Ų60.621%0.20936%0.359CS..  trans-80.4117-174.1-176.5-0.5000110.8R241 T246 F247 W248R241-D244 HydrophobicContact CB-CB 4.15Å; R241-D244 IonicContact CZ-OD2 2.75Å; R241-D244 IonicContact NE-OD2 3.57Å; R241-D244 PolarHBondContact NE-OD2 3.42Å; R241-D244 IonicContact NH2-OD2 2.73Å; R241-D244 PolarHBondContact NH2-OD2 3.41Å; R241-D244 WeakPolarHBondContact O-CB 3.3Å; R241-D244 PolarHBondContact O-N 3.13Å; D244-T246 PolarHBondContact O-N 3.43Å; D244-T246 VanDerWaalsContact O-N 3.15Å; D244-T246 WeakPolarHBondContact OD1-CB 3.45Å; D244-T246 PolarHBondContact OD1-N 3.06Å; D244-T246 PolarHBondContact OD1-OG1 3.13Å; D244-F247 HydrophobicContact CB-CB 4.22Å; D244-F247 WeakPolarHBondContact O-CB 3.43Å; D244-F247 PolarHBondContact O-N 3.23Å; D244-F247 VanDerWaalsContact O-N 3.11Å; D244-W248 PolarHBondContact O-N 2.89Å
245P85Confident80.2Confident105 Ų10558.7 Ų58.768%0.68234%0.339SS*.Hα-helixtrans-58.7-28.1176.1-22.834.2000112.7G243 W248 G249G243-P245 WeakPolarHBondContact O-CD 3.44Å; P245-W248 PolarHBondContact O-N 3.44Å; P245-G249 PolarHBondContact O-N 3.11Å
246T83.7Confident81Confident75 Ų7556.9 Ų56.946%0.4634%0.335SS..Hα-helixtrans-65.5-40.9178.6-42.80000111.1D244 G249 M250D244-T246 PolarHBondContact O-N 3.43Å; D244-T246 VanDerWaalsContact O-N 3.15Å; D244-T246 WeakPolarHBondContact OD1-CB 3.45Å; D244-T246 PolarHBondContact OD1-N 3.06Å; D244-T246 PolarHBondContact OD1-OG1 3.13Å; T246-G249 PolarHBondContact O-N 3.15Å; T246-M250 HydrophobicContact CG2-CE 3.93Å; T246-M250 HydrophobicContact CG2-SD 4.42Å; T246-M250 WeakPolarHBondContact O-CG 3.35Å; T246-M250 PolarHBondContact O-N 2.94Å
247F83.7Confident81.6Confident5 Ų557.8 Ų57.82%0.02234%0.338CS..Hα-helixtrans-62-50176.8172.1-102.1000110.8L45 L51 F239 D244 G249 M250 M251L45-F247 HydrophobicContact CD2-CE2 4.42Å; L51-F247 HydrophobicContact CD1-CE2 3.9Å; L51-F247 HydrophobicContact CD1-CZ 3.65Å; L51-F247 HydrophobicContact CD2-CE2 4.01Å; L51-F247 HydrophobicContact CD2-CZ 4.08Å; F239-F247 HydrophobicContact CE1-CD1 4.31Å; F239-F247 AromaticContact CE1-CD2 3.96Å; F239-F247 HydrophobicContact CE1-CD2 3.96Å; F239-F247 HydrophobicContact CE1-CE1 4.22Å; F239-F247 AromaticContact CE1-CE2 3.87Å; F239-F247 HydrophobicContact CE1-CE2 3.87Å; F239-F247 HydrophobicContact CE1-CG 4.18Å; F239-F247 HydrophobicContact CE1-CZ 4.01Å; F239-F247 HydrophobicContact CZ-CD2 4.14Å; F239-F247 HydrophobicContact CZ-CE2 4.05Å; D244-F247 HydrophobicContact CB-CB 4.22Å; D244-F247 WeakPolarHBondContact O-CB 3.43Å; D244-F247 PolarHBondContact O-N 3.23Å; D244-F247 VanDerWaalsContact O-N 3.11Å; F247-G249 VanDerWaalsContact C-N 3.3Å; F247-G249 PolarHBondContact O-N 3.11Å; F247-M250 PolarHBondContact O-N 2.83Å; F247-M251 HydrophobicContact CD1-CG 4.2Å; F247-M251 HydrophobicContact CD2-CG 4.32Å; F247-M251 HydrophobicContact CE1-CG 3.82Å; F247-M251 HydrophobicContact CE1-SD 4.44Å; F247-M251 HydrophobicContact CE2-CG 3.94Å; F247-M251 HydrophobicContact CE2-SD 4.09Å; F247-M251 HydrophobicContact CG-CG 4.44Å; F247-M251 HydrophobicContact CZ-CE 4.3Å; F247-M251 HydrophobicContact CZ-CG 3.68Å; F247-M251 HydrophobicContact CZ-SD 3.8Å; F247-M251 WeakPolarHBondContact O-CB 3.43Å; F247-M251 WeakPolarHBondContact O-CG 3.41Å; F247-M251 PolarHBondContact O-N 3.18Å
248W86.4Confident82.2Confident82 Ų8253.7 Ų53.731%0.31132%0.317SS..Hα-helixtrans-64.6-34.2176.9-68.4104.9000113F56 Y60 L242 D244 P245 M251 T252F56-W248 HydrophobicContact CE1-CH2 4.49Å; F56-W248 HydrophobicContact CZ-CH2 4.06Å; F56-W248 HydrophobicContact CZ-CZ3 4.49Å; Y60-W248 HydrophobicContact CD2-CE3 4.39Å; Y60-W248 AromaticContact CD2-CZ3 3.76Å; Y60-W248 HydrophobicContact CD2-CZ3 3.76Å; Y60-W248 HydrophobicContact CE1-CE3 4.48Å; Y60-W248 AromaticContact CE2-CE3 3.79Å; Y60-W248 HydrophobicContact CE2-CE3 3.79Å; Y60-W248 AromaticContact CE2-CZ3 3.51Å; Y60-W248 HydrophobicContact CE2-CZ3 3.51Å; Y60-W248 HydrophobicContact CG-CZ3 4.47Å; Y60-W248 AromaticContact CZ-CE3 3.84Å; L242-W248 HydrophobicContact CD2-CZ2 4.42Å; L242-W248 PolarHBondContact O-NE1 3.17Å; D244-W248 PolarHBondContact O-N 2.89Å; P245-W248 PolarHBondContact O-N 3.44Å; W248-M251 PolarHBondContact O-N 3.15Å; W248-T252 VanDerWaalsContact O-CB 3.27Å; W248-T252 WeakPolarHBondContact O-CB 3.46Å; W248-T252 PolarHBondContact O-N 2.85Å; W248-T252 PolarHBondContact O-OG1 3.46Å
249G87.3Confident82.9Confident41 Ų4146.9 Ų46.942%0.42329%0.285SS..Hα-helixtrans-59.6-48.5171.100000111.8P245 T246 F247 T252 L253P245-G249 PolarHBondContact O-N 3.11Å; T246-G249 PolarHBondContact O-N 3.15Å; F247-G249 VanDerWaalsContact C-N 3.3Å; F247-G249 PolarHBondContact O-N 3.11Å; G249-T252 PolarHBondContact O-N 3.19Å; G249-L253 VanDerWaalsContact O-CB 3.23Å; G249-L253 WeakPolarHBondContact O-CB 3.32Å; G249-L253 PolarHBondContact O-N 3.33Å
250M84.6Confident83.5Confident53 Ų5347.4 Ų47.426%0.26129%0.292SS..Hα-helixtrans-65.6-42177.3-70170.7172.100112.5Y44 L45 T246 F247 T252 L253 G254Y44-M250 HydrophobicContact CD1-SD 4.23Å; Y44-M250 HydrophobicContact CE1-CE 3.85Å; Y44-M250 HydrophobicContact CE1-SD 3.55Å; Y44-M250 VanDerWaalsContact CE1-SD 3.55Å; L45-M250 HydrophobicContact CD2-CB 4.05Å; T246-M250 HydrophobicContact CG2-CE 3.93Å; T246-M250 HydrophobicContact CG2-SD 4.42Å; T246-M250 WeakPolarHBondContact O-CG 3.35Å; T246-M250 PolarHBondContact O-N 2.94Å; F247-M250 PolarHBondContact O-N 2.83Å; M250-T252 VanDerWaalsContact C-N 3.35Å; M250-T252 PolarHBondContact O-N 3.12Å; M250-L253 PolarHBondContact O-N 3.37Å; M250-G254 PolarHBondContact O-N 3Å
251M86Confident84.5Confident0 Ų044.2 Ų44.20%027%0.266CS..Hα-helixtrans-60.4-44.6175.4-70.9-75.7-70.100111.6L45 F56 V57 Y60 F247 W248 G254 G255L45-M251 HydrophobicContact CD1-SD 3.98Å; L45-M251 HydrophobicContact CD2-CG 4.46Å; L45-M251 HydrophobicContact CD2-SD 4.21Å; F56-M251 HydrophobicContact CD1-CE 4.23Å; F56-M251 HydrophobicContact CE1-CE 4.06Å; V57-M251 HydrophobicContact CB-CE 4.23Å; V57-M251 HydrophobicContact CB-SD 4.31Å; V57-M251 HydrophobicContact CG1-CE 4.31Å; V57-M251 HydrophobicContact CG1-SD 3.98Å; V57-M251 HydrophobicContact CG2-CE 4.11Å; V57-M251 HydrophobicContact CG2-SD 3.9Å; Y60-M251 HydrophobicContact CD1-CB 3.71Å; Y60-M251 HydrophobicContact CD1-CE 3.87Å; Y60-M251 HydrophobicContact CE1-CB 3.65Å; Y60-M251 HydrophobicContact CG-CE 3.93Å; F247-M251 HydrophobicContact CD1-CG 4.2Å; F247-M251 HydrophobicContact CD2-CG 4.32Å; F247-M251 HydrophobicContact CE1-CG 3.82Å; F247-M251 HydrophobicContact CE1-SD 4.44Å; F247-M251 HydrophobicContact CE2-CG 3.94Å; F247-M251 HydrophobicContact CE2-SD 4.09Å; F247-M251 HydrophobicContact CG-CG 4.44Å; F247-M251 HydrophobicContact CZ-CE 4.3Å; F247-M251 HydrophobicContact CZ-CG 3.68Å; F247-M251 HydrophobicContact CZ-SD 3.8Å; F247-M251 WeakPolarHBondContact O-CB 3.43Å; F247-M251 WeakPolarHBondContact O-CG 3.41Å; F247-M251 PolarHBondContact O-N 3.18Å; W248-M251 PolarHBondContact O-N 3.15Å; M251-G254 PolarHBondContact O-N 2.92Å; M251-G255 PolarHBondContact O-N 3.27Å
252T90.4Very high85.1Confident48 Ų4841.9 Ų41.929%0.29427%0.267SS..Hα-helixtrans-68.4-42.3178.7-55.30000110.8Y60 V64 W248 G249 M250 G254 G255 V256Y60-T252 PolarHBondContact OH-OG1 3.34Å; V64-T252 HydrophobicContact CG1-CG2 4.46Å; W248-T252 VanDerWaalsContact O-CB 3.27Å; W248-T252 WeakPolarHBondContact O-CB 3.46Å; W248-T252 PolarHBondContact O-N 2.85Å; W248-T252 PolarHBondContact O-OG1 3.46Å; G249-T252 PolarHBondContact O-N 3.19Å; M250-T252 VanDerWaalsContact C-N 3.35Å; M250-T252 PolarHBondContact O-N 3.12Å; T252-G254 VanDerWaalsContact C-N 3.29Å; T252-G254 PolarHBondContact O-N 3.09Å; T252-G255 WeakPolarHBondContact O-CA 3.33Å; T252-G255 PolarHBondContact O-N 2.81Å; T252-G255 VanDerWaalsContact O-N 3.1Å; T252-V256 WeakPolarHBondContact O-CG2 3.48Å; T252-V256 PolarHBondContact O-N 2.95Å
253L89.8Confident85.6Confident82 Ų8244.9 Ų44.943%0.42928%0.276SS..Hα-helixtrans-59.6-41.3174.4-174.162.9000111.5L41 G249 M250 G255 V256 F257L41-L253 HydrophobicContact CD1-CB 4.32Å; L41-L253 HydrophobicContact CD1-CD2 3.95Å; L41-L253 HydrophobicContact CD1-CG 3.97Å; G249-L253 VanDerWaalsContact O-CB 3.23Å; G249-L253 WeakPolarHBondContact O-CB 3.32Å; G249-L253 PolarHBondContact O-N 3.33Å; M250-L253 PolarHBondContact O-N 3.37Å; L253-G255 PolarHBondContact O-N 2.86Å; L253-V256 PolarHBondContact O-N 2.84Å; L253-F257 HydrophobicContact CD1-CD2 3.9Å; L253-F257 HydrophobicContact CD1-CE2 3.47Å; L253-F257 VanDerWaalsContact CD1-CE2 3.47Å; L253-F257 HydrophobicContact CD1-CZ 4.29Å; L253-F257 HydrophobicContact CD2-CE2 4.09Å; L253-F257 HydrophobicContact CG-CD2 3.79Å; L253-F257 HydrophobicContact CG-CE2 3.57Å; L253-F257 VanDerWaalsContact O-CD2 3.24Å; L253-F257 WeakPolarHBondContact O-CD2 3.32Å; L253-F257 PolarHBondContact O-N 3.44Å
254G86.6Confident86.2Confident0 Ų041.6 Ų41.60%024%0.241CC..Hα-helixtrans-58.9-44.4172.100000112.6M250 M251 T252 F257 G258M250-G254 PolarHBondContact O-N 3Å; M251-G254 PolarHBondContact O-N 2.92Å; T252-G254 VanDerWaalsContact C-N 3.29Å; T252-G254 PolarHBondContact O-N 3.09Å; G254-F257 PolarHBondContact O-N 3.46Å; G254-G258 PolarHBondContact O-N 3.24Å
255G87.9Confident86.3Confident0 Ų041.4 Ų41.40%024%0.241CC..Hα-helixtrans-63.3-41.8174.600000113.1M251 T252 L253 G258 F259M251-G255 PolarHBondContact O-N 3.27Å; T252-G255 WeakPolarHBondContact O-CA 3.33Å; T252-G255 PolarHBondContact O-N 2.81Å; T252-G255 VanDerWaalsContact O-N 3.1Å; L253-G255 PolarHBondContact O-N 2.86Å; G255-G258 CarbonylContact O-C 3.5Å; G255-G258 PolarHBondContact O-N 2.89Å; G255-F259 PolarHBondContact O-N 2.9Å
256V90.3Very high86Confident59 Ų5937.8 Ų37.836%0.35822%0.223SC..Hα-helixtrans-62.6-46.7176.1171.60000111.1V64 L68 T252 L253 G258 F259 A260V64-V256 HydrophobicContact CG1-CG2 4.45Å; L68-V256 HydrophobicContact CD1-CG2 4.06Å; T252-V256 WeakPolarHBondContact O-CG2 3.48Å; T252-V256 PolarHBondContact O-N 2.95Å; L253-V256 PolarHBondContact O-N 2.84Å; V256-G258 VanDerWaalsContact C-N 3.32Å; V256-G258 PolarHBondContact O-N 3.39Å; V256-F259 PolarHBondContact O-N 2.91Å; V256-A260 VanDerWaalsContact O-CB 3.29Å; V256-A260 WeakPolarHBondContact O-CB 3.46Å; V256-A260 PolarHBondContact O-N 3Å
257F88.6Confident86Confident35 Ų3536 Ų3615%0.15421%0.211CC..Hα-helixtrans-66.4-34.7175.2-78.3-61.9000112.3F33 I34 T37 M38 L41 L253 G254 F259 A260 I261F33-F257 HydrophobicContact CE1-CE1 4.39Å; F33-F257 HydrophobicContact CE1-CZ 4.49Å; I34-F257 HydrophobicContact CB-CD1 4.31Å; I34-F257 HydrophobicContact CG1-CD1 4.07Å; I34-F257 HydrophobicContact CG1-CE1 4.12Å; I34-F257 HydrophobicContact CG2-CD1 3.95Å; T37-F257 HydrophobicContact CG2-CD2 4.22Å; T37-F257 HydrophobicContact CG2-CE2 3.8Å; T37-F257 HydrophobicContact CG2-CZ 3.99Å; M38-F257 HydrophobicContact CB-CB 4.45Å; L41-F257 HydrophobicContact CD1-CD2 4.34Å; L253-F257 HydrophobicContact CD1-CD2 3.9Å; L253-F257 HydrophobicContact CD1-CE2 3.47Å; L253-F257 VanDerWaalsContact CD1-CE2 3.47Å; L253-F257 HydrophobicContact CD1-CZ 4.29Å; L253-F257 HydrophobicContact CD2-CE2 4.09Å; L253-F257 HydrophobicContact CG-CD2 3.79Å; L253-F257 HydrophobicContact CG-CE2 3.57Å; L253-F257 VanDerWaalsContact O-CD2 3.24Å; L253-F257 WeakPolarHBondContact O-CD2 3.32Å; L253-F257 PolarHBondContact O-N 3.44Å; G254-F257 PolarHBondContact O-N 3.46Å; F257-F259 VanDerWaalsContact C-N 3.32Å; F257-F259 PolarHBondContact O-N 3.47Å; F257-A260 PolarHBondContact O-N 2.79Å; F257-I261 PolarHBondContact O-N 2.92Å
258G85.5Confident86.1Confident20 Ų2035.7 Ų35.721%0.20621%0.21CC..Hα-helixtrans-65.9-29.3173.500000114G254 G255 V256 I261G254-G258 PolarHBondContact O-N 3.24Å; G255-G258 CarbonylContact O-C 3.5Å; G255-G258 PolarHBondContact O-N 2.89Å; V256-G258 VanDerWaalsContact C-N 3.32Å; V256-G258 PolarHBondContact O-N 3.39Å; G258-I261 WeakPolarHBondContact O-CG2 3.34Å
259F85.9Confident85.8Confident21 Ų2134.5 Ų34.59%0.09221%0.209CC..Hα-helixtrans-77.1-46.2167.5176.3-97.5000111.1T65 L68 C69 M72 W209 G255 V256 F257 I261 G262T65-F259 HydrophobicContact CG2-CB 4.26Å; T65-F259 HydrophobicContact CG2-CD2 3.86Å; L68-F259 HydrophobicContact CB-CD1 4.43Å; L68-F259 HydrophobicContact CB-CD2 4.33Å; L68-F259 HydrophobicContact CB-CG 4.25Å; L68-F259 HydrophobicContact CD1-CB 3.78Å; L68-F259 HydrophobicContact CD1-CD1 4.18Å; L68-F259 HydrophobicContact CD1-CG 4Å; C69-F259 VanDerWaalsContact SG-CE2 3.53Å; M72-F259 HydrophobicContact SD-CE1 3.47Å; M72-F259 WeakPolarHBondContact SD-CE1 3.32Å; M72-F259 HydrophobicContact SD-CZ 3.3Å; M72-F259 WeakPolarHBondContact SD-CZ 3.16Å; W209-F259 AromaticContact CE3-CE2 3.89Å; W209-F259 HydrophobicContact CE3-CE2 3.89Å; W209-F259 AromaticContact CE3-CZ 4Å; W209-F259 HydrophobicContact CE3-CZ 4Å; W209-F259 HydrophobicContact CH2-CE1 4.46Å; W209-F259 HydrophobicContact CH2-CE2 4.47Å; W209-F259 HydrophobicContact CH2-CZ 4.03Å; W209-F259 HydrophobicContact CZ3-CD2 4.22Å; W209-F259 HydrophobicContact CZ3-CE1 4.09Å; W209-F259 AromaticContact CZ3-CE2 3.4Å; W209-F259 HydrophobicContact CZ3-CE2 3.4Å; W209-F259 VanDerWaalsContact CZ3-CE2 3.4Å; W209-F259 AromaticContact CZ3-CZ 3.31Å; W209-F259 HydrophobicContact CZ3-CZ 3.31Å; G255-F259 PolarHBondContact O-N 2.9Å; V256-F259 PolarHBondContact O-N 2.91Å; F257-F259 VanDerWaalsContact C-N 3.32Å; F257-F259 PolarHBondContact O-N 3.47Å; F259-I261 VanDerWaalsContact C-N 3.29Å; F259-I261 PolarHBondContact O-N 3.48Å; F259-G262 PolarHBondContact O-N 3.3Å; F259-G262 VanDerWaalsContact O-N 3.1Å
260A87.9Confident85.4Confident22 Ų2240.8 Ų40.818%0.18222%0.224CC..Hα-helixtrans-62.6-32.7-176.200000112.9I34 V256 F257 G262 Y263 V264I34-A260 HydrophobicContact CD1-CB 4Å; I34-A260 HydrophobicContact CG2-CB 4.37Å; V256-A260 VanDerWaalsContact O-CB 3.29Å; V256-A260 WeakPolarHBondContact O-CB 3.46Å; V256-A260 PolarHBondContact O-N 3Å; F257-A260 PolarHBondContact O-N 2.79Å; A260-G262 PolarHBondContact O-N 3.38Å; A260-Y263 WeakPolarHBondContact O-CA 3.21Å; A260-Y263 VanDerWaalsContact O-CB 3.28Å; A260-Y263 WeakPolarHBondContact O-CB 3.48Å; A260-Y263 PolarHBondContact O-N 2.91Å; A260-V264 WeakPolarHBondContact O-CG2 3.48Å; A260-V264 PolarHBondContact O-N 3.48Å
261I86.6Confident85.2Confident33 Ų3342.8 Ų42.817%0.16923%0.232CC..Hα-helixtrans-57.7-37.7175.8-168.761.8000111.7Y31 I34 M38 F257 G258 F259 V264 T265Y31-I261 HydrophobicContact CD2-CD1 3.91Å; Y31-I261 HydrophobicContact CE2-CD1 3.79Å; I34-I261 HydrophobicContact CG2-CB 4.17Å; I34-I261 HydrophobicContact CG2-CD1 4.16Å; M38-I261 HydrophobicContact SD-CB 4.43Å; M38-I261 HydrophobicContact SD-CG2 4.2Å; F257-I261 PolarHBondContact O-N 2.92Å; G258-I261 WeakPolarHBondContact O-CG2 3.34Å; F259-I261 VanDerWaalsContact C-N 3.29Å; F259-I261 PolarHBondContact O-N 3.48Å; I261-V264 HydrophobicContact CD1-CG2 4.27Å; I261-T265 WeakPolarHBondContact O-CB 3.5Å; I261-T265 PolarHBondContact O-N 2.99Å; I261-T265 PolarHBondContact O-OG1 3.08Å
262G82.1Confident85.2Confident32 Ų3244.6 Ų44.633%0.3324%0.243SC..Hα-helixtrans-63.4-43.9174.500000111.6F259 A260 G266F259-G262 PolarHBondContact O-N 3.3Å; F259-G262 VanDerWaalsContact O-N 3.1Å; A260-G262 PolarHBondContact O-N 3.38Å; G262-G266 PolarHBondContact O-N 3.3Å; G262-G266 VanDerWaalsContact O-N 3.15Å
263Y82.9Confident84.5Confident119 Ų11944 Ų4447%0.46724%0.241SC..Hα-helixtrans-59-57.9176-172.5-104000111.8W209 A260 T265 G266 L267W209-Y263 VanDerWaalsContact CH2-CA 3.45Å; W209-Y263 AromaticContact CH2-CD2 3.8Å; W209-Y263 HydrophobicContact CH2-CD2 3.8Å; W209-Y263 HydrophobicContact CH2-CG 4.2Å; W209-Y263 AromaticContact CZ2-CD2 3.59Å; W209-Y263 HydrophobicContact CZ2-CD2 3.59Å; W209-Y263 HydrophobicContact CZ2-CG 4.3Å; A260-Y263 WeakPolarHBondContact O-CA 3.21Å; A260-Y263 VanDerWaalsContact O-CB 3.28Å; A260-Y263 WeakPolarHBondContact O-CB 3.48Å; A260-Y263 PolarHBondContact O-N 2.91Å; Y263-T265 VanDerWaalsContact C-N 3.3Å; Y263-T265 PolarHBondContact O-N 3.47Å; Y263-G266 PolarHBondContact O-N 3.28Å; Y263-G266 VanDerWaalsContact O-N 3.16Å; Y263-L267 HydrophobicContact CE1-CD2 4.12Å; Y263-L267 WeakPolarHBondContact O-CB 3.33Å; Y263-L267 PolarHBondContact O-N 2.85Å
264V87.3Confident83.6Confident3 Ų344 Ų442%0.01825%0.246CC..Hα-helixtrans-71.5-27.5-172.6-62.20000112.6L30 Y31 I34 A260 I261 L267 Q268L30-V264 HydrophobicContact CD2-CG1 3.71Å; L30-V264 HydrophobicContact CG-CG1 3.94Å; Y31-V264 HydrophobicContact CD2-CG2 4.22Å; I34-V264 HydrophobicContact CB-CG2 4.31Å; I34-V264 HydrophobicContact CD1-CB 4.37Å; I34-V264 HydrophobicContact CD1-CG1 3.57Å; I34-V264 HydrophobicContact CD1-CG2 3.96Å; I34-V264 HydrophobicContact CG2-CG2 4.29Å; A260-V264 WeakPolarHBondContact O-CG2 3.48Å; A260-V264 PolarHBondContact O-N 3.48Å; I261-V264 HydrophobicContact CD1-CG2 4.27Å; V264-L267 PolarHBondContact O-N 3.4Å; V264-Q268 VanDerWaalsContact O-CB 3.27Å; V264-Q268 WeakPolarHBondContact O-CB 3.26Å; V264-Q268 PolarHBondContact O-N 2.75Å
265T84.2Confident82.8Confident34 Ų3445.7 Ų45.721%0.20925%0.254CS..Hα-helixtrans-62.3-49.4169.6-63.90000110.5I261 Y263 L267 Q268 I269 H277I261-T265 WeakPolarHBondContact O-CB 3.5Å; I261-T265 PolarHBondContact O-N 2.99Å; I261-T265 PolarHBondContact O-OG1 3.08Å; Y263-T265 VanDerWaalsContact C-N 3.3Å; Y263-T265 PolarHBondContact O-N 3.47Å; T265-L267 VanDerWaalsContact C-N 3.35Å; T265-L267 PolarHBondContact O-N 2.93Å; T265-Q268 PolarHBondContact O-N 2.99Å; T265-I269 HydrophobicContact CG2-CD1 3.95Å; T265-I269 VanDerWaalsContact O-CG1 3.28Å; T265-I269 WeakPolarHBondContact O-CG1 3.2Å; T265-I269 PolarHBondContact O-N 3.04Å; T265-H277 WeakPolarHBondContact CG2-NE2 3.39Å
266G79.2Confident82.4Confident30 Ų3048.7 Ų48.731%0.30927%0.273SS..Hα-helixtrans-61.2-43.1175.600000112.4G262 Y263 I269 K270G262-G266 PolarHBondContact O-N 3.3Å; G262-G266 VanDerWaalsContact O-N 3.15Å; Y263-G266 PolarHBondContact O-N 3.28Å; Y263-G266 VanDerWaalsContact O-N 3.16Å; G266-I269 PolarHBondContact O-N 3.22Å; G266-K270 WeakPolarHBondContact O-CB 3.15Å; G266-K270 PolarHBondContact O-N 3.34Å
267L82.9Confident82Confident36 Ų3647 Ų4719%0.18826%0.261CS..Hα-helixtrans-61.2-46.1177.1-167.569.2000111.7V27 Y263 V264 T265 I269 K270 F271V27-L267 HydrophobicContact CG1-CB 4.27Å; V27-L267 HydrophobicContact CG1-CD2 4.09Å; V27-L267 HydrophobicContact CG1-CG 3.96Å; V27-L267 HydrophobicContact CG2-CD2 4.05Å; V27-L267 HydrophobicContact CG2-CG 4.25Å; Y263-L267 HydrophobicContact CE1-CD2 4.12Å; Y263-L267 WeakPolarHBondContact O-CB 3.33Å; Y263-L267 PolarHBondContact O-N 2.85Å; V264-L267 PolarHBondContact O-N 3.4Å; T265-L267 VanDerWaalsContact C-N 3.35Å; T265-L267 PolarHBondContact O-N 2.93Å; L267-I269 PolarHBondContact O-N 2.97Å; L267-K270 PolarHBondContact O-N 2.68Å; L267-F271 HydrophobicContact CD1-CD2 3.85Å; L267-F271 HydrophobicContact CD1-CE2 3.57Å; L267-F271 HydrophobicContact CG-CD2 3.99Å; L267-F271 HydrophobicContact CG-CE2 4.15Å; L267-F271 WeakPolarHBondContact O-CD2 3.19Å; L267-F271 PolarHBondContact O-N 3.47Å
268Q84.8Confident81.5Confident0 Ų048.8 Ų48.80%027%0.272CS..Hα-helixtrans-62.5-44.4177.9-170.7-179.812.800111.2V27 V28 V264 T265 K270 F271 T272 H277 S280V27-Q268 VanDerWaalsContact CG1-CA 3.42Å; V27-Q268 HydrophobicContact CG1-CB 3.82Å; V27-Q268 HydrophobicContact CG1-CG 4.32Å; V28-Q268 HydrophobicContact CG2-CG 4.44Å; V264-Q268 VanDerWaalsContact O-CB 3.27Å; V264-Q268 WeakPolarHBondContact O-CB 3.26Å; V264-Q268 PolarHBondContact O-N 2.75Å; T265-Q268 PolarHBondContact O-N 2.99Å; Q268-K270 VanDerWaalsContact C-N 3.31Å; Q268-K270 PolarHBondContact O-N 3.34Å; Q268-F271 PolarHBondContact O-N 2.95Å; Q268-T272 WeakPolarHBondContact O-CB 3.37Å; Q268-T272 PolarHBondContact O-N 3.33Å; Q268-T272 PolarHBondContact O-OG1 3.4Å; Q268-H277 PolarHBondContact OE1-CD2 3.05Å; Q268-H277 VanDerWaalsContact OE1-CD2 3.32Å; Q268-S280 VanDerWaalsContact NE2-CB 3.27Å; Q268-S280 PolarHBondContact NE2-OG 3.5Å
269I80.4Confident81.2Confident57 Ų5750.4 Ų50.429%0.29228%0.278SS..Hα-helixtrans-61.1-42.2176.1-68.4167.9000110.6T265 G266 L267 T272 S273 P274 H277T265-I269 HydrophobicContact CG2-CD1 3.95Å; T265-I269 VanDerWaalsContact O-CG1 3.28Å; T265-I269 WeakPolarHBondContact O-CG1 3.2Å; T265-I269 PolarHBondContact O-N 3.04Å; G266-I269 PolarHBondContact O-N 3.22Å; L267-I269 PolarHBondContact O-N 2.97Å; I269-T272 CarbonylContact O-C 3.52Å; I269-T272 PolarHBondContact O-N 2.82Å; I269-S273 PolarHBondContact O-N 3.39Å; I269-P274 HydrophobicContact CG2-CG 3.83Å; I269-H277 HydrophobicContact CD1-CB 4.44Å; I269-H277 HydrophobicContact CG1-CB 3.62Å
270K79Confident81.1Confident173 Ų17350 Ų5075%0.75228%0.277SS*.Hα-helixtrans-62.7-44.8178.8-176.1178.5178.1-179.40112.7G266 L267 Q268G266-K270 WeakPolarHBondContact O-CB 3.15Å; G266-K270 PolarHBondContact O-N 3.34Å; L267-K270 PolarHBondContact O-N 2.68Å; Q268-K270 VanDerWaalsContact C-N 3.31Å; Q268-K270 PolarHBondContact O-N 3.34Å
271F81.2Confident80.9Confident95 Ų9549.6 Ų49.642%0.41728%0.276SS..Hα-helixtrans-81.7-14.7-179.9-83.2-83.5000114V27 L267 Q268V27-F271 HydrophobicContact CG2-CD2 4.16Å; V27-F271 HydrophobicContact CG2-CG 4.39Å; L267-F271 HydrophobicContact CD1-CD2 3.85Å; L267-F271 HydrophobicContact CD1-CE2 3.57Å; L267-F271 HydrophobicContact CG-CD2 3.99Å; L267-F271 HydrophobicContact CG-CE2 4.15Å; L267-F271 WeakPolarHBondContact O-CD2 3.19Å; L267-F271 PolarHBondContact O-N 3.47Å; Q268-F271 PolarHBondContact O-N 2.95Å
272T85.2Confident80.6Confident38 Ų3848.8 Ų48.823%0.23327%0.273CS..SBendtrans-125.3-108-178.867.20000111.1I24 Q268 I269 T276I24-T272 HydrophobicContact CG1-CG2 4.45Å; I24-T272 HydrophobicContact CG2-CG2 3.58Å; Q268-T272 WeakPolarHBondContact O-CB 3.37Å; Q268-T272 PolarHBondContact O-N 3.33Å; Q268-T272 PolarHBondContact O-OG1 3.4Å; I269-T272 CarbonylContact O-C 3.52Å; I269-T272 PolarHBondContact O-N 2.82Å; T272-T276 HydrophobicContact CG2-CG2 4.19Å
273S76.2Confident80.7Confident36 Ų3649.2 Ų49.225%0.25227%0.273SS..  trans-161.1161.8171.471.90000109.3I269 L275 T276 H277I269-S273 PolarHBondContact O-N 3.39Å; S273-L275 PolarHBondContact O-N 2.99Å; S273-L275 PolarHBondContact OG-N 3.3Å; S273-T276 PolarHBondContact O-N 3.25Å; S273-T276 VanDerWaalsContact O-N 3.13Å; S273-T276 WeakPolarHBondContact OG-CB 3.49Å; S273-T276 PolarHBondContact OG-N 2.95Å; S273-T276 PolarHBondContact OG-OG1 3.12Å; S273-H277 PolarHBondContact O-N 3.44Å
274P70.3Confident81Confident82 Ų8244.2 Ų44.253%0.53225%0.254SS..Hα-helixtrans-55.1-34.3171.4-25.333.6000113.2I269 N278I269-P274 HydrophobicContact CG2-CG 3.83Å; P274-N278 VanDerWaalsContact O-CG 3.24Å; P274-N278 PolarHBondContact O-N 3.43Å; P274-N278 VanDerWaalsContact O-N 3.15Å; P274-N278 PolarHBondContact O-ND2 3.27Å
275L70.5Confident80.8Confident34 Ų3445.1 Ų45.118%0.17826%0.261CS..Hα-helixtrans-68-47176.9-179.259.3000111.3S273 H277 N278 V279 T319S273-L275 PolarHBondContact O-N 2.99Å; S273-L275 PolarHBondContact OG-N 3.3Å; L275-H277 VanDerWaalsContact C-N 3.35Å; L275-H277 PolarHBondContact O-N 3.17Å; L275-N278 PolarHBondContact O-N 3.47Å; L275-V279 WeakPolarHBondContact O-CG2 3.31Å; L275-V279 PolarHBondContact O-N 3.06Å; L275-T319 HydrophobicContact CD1-CG2 4.01Å; L275-T319 WeakPolarHBondContact CD1-O 3.2Å
276T79.9Confident80.7Confident63 Ų6345.7 Ų45.739%0.38727%0.266SS..Hα-helixtrans-63.4-40.7178.6-50.90000111.5T272 S273 N278 V279 S280T272-T276 HydrophobicContact CG2-CG2 4.19Å; S273-T276 PolarHBondContact O-N 3.25Å; S273-T276 VanDerWaalsContact O-N 3.13Å; S273-T276 WeakPolarHBondContact OG-CB 3.49Å; S273-T276 PolarHBondContact OG-N 2.95Å; S273-T276 PolarHBondContact OG-OG1 3.12Å; T276-N278 PolarHBondContact O-N 2.82Å; T276-V279 PolarHBondContact O-N 3.25Å; T276-S280 VanDerWaalsContact O-CB 3.22Å; T276-S280 WeakPolarHBondContact O-CB 3.33Å; T276-S280 PolarHBondContact O-N 2.82Å
277H81.5Confident81.1Confident23 Ų2345.5 Ų45.511%0.10626%0.262CS..Hα-helixtrans-56.9-47.5172.6167.4-89.7000111.4Y31 T265 Q268 I269 S273 L275 S280 G281Y31-H277 AromaticContact CE2-NE2 3.76Å; Y31-H277 AromaticContact CZ-NE2 3.8Å; T265-H277 WeakPolarHBondContact CG2-NE2 3.39Å; Q268-H277 PolarHBondContact OE1-CD2 3.05Å; Q268-H277 VanDerWaalsContact OE1-CD2 3.32Å; I269-H277 HydrophobicContact CD1-CB 4.44Å; I269-H277 HydrophobicContact CG1-CB 3.62Å; S273-H277 PolarHBondContact O-N 3.44Å; L275-H277 VanDerWaalsContact C-N 3.35Å; L275-H277 PolarHBondContact O-N 3.17Å; H277-S280 WeakPolarHBondContact O-CB 3.41Å; H277-S280 PolarHBondContact O-N 2.85Å; H277-G281 PolarHBondContact O-N 3.33Å
278N79.1Confident81.2Confident73 Ų7344.2 Ų44.239%0.3926%0.255SS..Hα-helixtrans-66.6-41.1-178.8-67.9-14.7000112.5P274 L275 T276 S280 G281 T282 T319P274-N278 VanDerWaalsContact O-CG 3.24Å; P274-N278 PolarHBondContact O-N 3.43Å; P274-N278 VanDerWaalsContact O-N 3.15Å; P274-N278 PolarHBondContact O-ND2 3.27Å; L275-N278 PolarHBondContact O-N 3.47Å; T276-N278 PolarHBondContact O-N 2.82Å; N278-S280 VanDerWaalsContact C-N 3.34Å; N278-G281 PolarHBondContact O-N 3.35Å; N278-T282 PolarHBondContact O-N 3.04Å; N278-T282 VanDerWaalsContact O-N 3.13Å; N278-T282 PolarHBondContact O-OG1 2.66Å; N278-T319 HydrophobicContact CB-CG2 3.35Å
279V78.3Confident81.1Confident54 Ų5444.3 Ų44.333%0.32726%0.255SS..Hα-helixtrans-62.7-43.5174173.70000110.8L275 T276 G281 T282 A283 T319L275-V279 WeakPolarHBondContact O-CG2 3.31Å; L275-V279 PolarHBondContact O-N 3.06Å; T276-V279 PolarHBondContact O-N 3.25Å; V279-G281 VanDerWaalsContact C-N 3.31Å; V279-G281 PolarHBondContact O-N 3.44Å; V279-T282 PolarHBondContact O-N 3.41Å; V279-A283 PolarHBondContact O-N 2.85Å; V279-T319 HydrophobicContact CG2-CG2 4.17Å
280S84.7Confident81.4Confident12 Ų1244.9 Ų44.98%0.08426%0.261CS..Hα-helixtrans-61.3-39.2175.2-171.60000112.1V28 W32 Q268 T276 H277 N278 T282 A283 K284V28-S280 WeakPolarHBondContact CG1-OG 3.48Å; W32-S280 PolarHBondContact NE1-O 3.12Å; W32-S280 PolarHBondContact NE1-OG 3.07Å; Q268-S280 VanDerWaalsContact NE2-CB 3.27Å; Q268-S280 PolarHBondContact NE2-OG 3.5Å; T276-S280 VanDerWaalsContact O-CB 3.22Å; T276-S280 WeakPolarHBondContact O-CB 3.33Å; T276-S280 PolarHBondContact O-N 2.82Å; H277-S280 WeakPolarHBondContact O-CB 3.41Å; H277-S280 PolarHBondContact O-N 2.85Å; N278-S280 VanDerWaalsContact C-N 3.34Å; S280-T282 VanDerWaalsContact C-N 3.35Å; S280-T282 PolarHBondContact O-N 3.35Å; S280-A283 PolarHBondContact O-N 3.13Å; S280-K284 VanDerWaalsContact O-CB 3.32Å; S280-K284 WeakPolarHBondContact O-CB 3.49Å; S280-K284 PolarHBondContact O-N 2.92Å
281G83.1Confident81.7Confident15 Ų1540.4 Ų40.416%0.15525%0.245CC..Hα-helixtrans-61.6-38.8175.300000113.1H277 N278 V279 K284 A285H277-G281 PolarHBondContact O-N 3.33Å; N278-G281 PolarHBondContact O-N 3.35Å; V279-G281 VanDerWaalsContact C-N 3.31Å; V279-G281 PolarHBondContact O-N 3.44Å; G281-K284 WeakPolarHBondContact O-CB 3.4Å; G281-A285 PolarHBondContact O-N 2.98Å
282T80.4Confident81.8Confident16 Ų1636 Ų3610%0.09823%0.226CC..Hα-helixtrans-70-44.1174.8-50.80000111.8N278 V279 S280 K284 A285 C286 L312 S316N278-T282 PolarHBondContact O-N 3.04Å; N278-T282 VanDerWaalsContact O-N 3.13Å; N278-T282 PolarHBondContact O-OG1 2.66Å; V279-T282 PolarHBondContact O-N 3.41Å; S280-T282 VanDerWaalsContact C-N 3.35Å; S280-T282 PolarHBondContact O-N 3.35Å; T282-K284 VanDerWaalsContact C-N 3.28Å; T282-K284 PolarHBondContact O-N 3.24Å; T282-A285 WeakPolarHBondContact O-CA 3.48Å; T282-A285 WeakPolarHBondContact O-CB 3.46Å; T282-A285 PolarHBondContact O-N 3.46Å; T282-C286 PolarHBondContact O-N 2.9Å; T282-C286 PolarHBondContact O-SG 2.9Å; T282-L312 HydrophobicContact CG2-CB 4.34Å; T282-L312 HydrophobicContact CG2-CD2 4.17Å; T282-L312 WeakPolarHBondContact CG2-O 3.39Å; T282-S316 WeakPolarHBondContact CG2-OG 3.42Å
283A84.5Confident81.6Confident40 Ų4034.9 Ų34.933%0.33122%0.219SC..Hα-helixtrans-61.5-38.3175.400000112W32 V279 S280 A285 C286 A287W32-A283 HydrophobicContact CH2-CB 3.78Å; W32-A283 WeakPolarHBondContact CH2-O 3.2Å; W32-A283 VanDerWaalsContact CZ2-C 3.46Å; W32-A283 HydrophobicContact CZ2-CB 3.54Å; V279-A283 PolarHBondContact O-N 2.85Å; S280-A283 PolarHBondContact O-N 3.13Å; A283-A285 VanDerWaalsContact C-N 3.34Å; A283-A285 PolarHBondContact O-N 2.84Å; A283-C286 WeakPolarHBondContact O-CB 3.26Å; A283-C286 PolarHBondContact O-N 2.82Å; A283-A287 PolarHBondContact O-N 3.4Å
284K88.3Confident82Confident15 Ų1538.3 Ų38.37%0.06524%0.238CC..Hα-helixtrans-59.9-44.5170.9-178-154.27194.50111.1Y31 W32 S35 I36 S280 G281 T282 C286 A287 Q288Y31-K284 HydrophobicContact CE1-CD 3.92Å; W32-K284 HydrophobicContact CB-CG 4.49Å; W32-K284 HydrophobicContact CD2-CB 3.81Å; W32-K284 HydrophobicContact CD2-CG 4.05Å; W32-K284 HydrophobicContact CE3-CB 4.37Å; W32-K284 HydrophobicContact CG-CB 4.12Å; W32-K284 HydrophobicContact CG-CG 4.03Å; W32-K284 HydrophobicContact CZ2-CB 4.06Å; S35-K284 WeakPolarHBondContact OG-CD 3.44Å; S35-K284 VanDerWaalsContact OG-CE 3.29Å; S35-K284 WeakPolarHBondContact OG-CE 3.35Å; S35-K284 PolarHBondContact OG-NZ 2.94Å; I36-K284 HydrophobicContact CD1-CG 4.16Å; I36-K284 HydrophobicContact CG1-CD 4.47Å; I36-K284 HydrophobicContact CG1-CG 3.97Å; S280-K284 VanDerWaalsContact O-CB 3.32Å; S280-K284 WeakPolarHBondContact O-CB 3.49Å; S280-K284 PolarHBondContact O-N 2.92Å; G281-K284 WeakPolarHBondContact O-CB 3.4Å; T282-K284 VanDerWaalsContact C-N 3.28Å; T282-K284 PolarHBondContact O-N 3.24Å; K284-C286 VanDerWaalsContact C-N 3.32Å; K284-C286 PolarHBondContact O-N 3.45Å; K284-A287 PolarHBondContact O-N 3Å; K284-Q288 VanDerWaalsContact O-CB 3.24Å; K284-Q288 WeakPolarHBondContact O-CB 3.47Å; K284-Q288 PolarHBondContact O-N 3.5Å
285A83.2Confident82.6Confident21 Ų2142 Ų4217%0.17424%0.243CC..Hα-helixtrans-61-40.9176.400000111.4G281 T282 A283 Q288 T289 L312G281-A285 PolarHBondContact O-N 2.98Å; T282-A285 WeakPolarHBondContact O-CA 3.48Å; T282-A285 WeakPolarHBondContact O-CB 3.46Å; T282-A285 PolarHBondContact O-N 3.46Å; A283-A285 VanDerWaalsContact C-N 3.34Å; A283-A285 PolarHBondContact O-N 2.84Å; A285-Q288 PolarHBondContact O-N 2.96Å; A285-T289 PolarHBondContact O-N 3.35Å; A285-T289 PolarHBondContact O-OG1 3.26Å; A285-T289 VanDerWaalsContact O-OG1 3.05Å; A285-L312 HydrophobicContact CB-CD2 3.97Å
286C82.4Confident82.8Confident46 Ų4643.8 Ų43.831%0.31125%0.252SS..Hα-helixtrans-56.5-52.3172.4-55.50000111.6T282 A283 K284 Q288 T289 V290 L312T282-C286 PolarHBondContact O-N 2.9Å; T282-C286 PolarHBondContact O-SG 2.9Å; A283-C286 WeakPolarHBondContact O-CB 3.26Å; A283-C286 PolarHBondContact O-N 2.82Å; K284-C286 VanDerWaalsContact C-N 3.32Å; K284-C286 PolarHBondContact O-N 3.45Å; C286-Q288 VanDerWaalsContact C-N 3.34Å; C286-Q288 PolarHBondContact O-N 3.35Å; C286-T289 PolarHBondContact O-N 2.81Å; C286-V290 WeakPolarHBondContact O-CG2 3.32Å; C286-V290 PolarHBondContact O-N 3.45Å; C286-V290 VanDerWaalsContact O-N 3.1Å; C286-L312 HydrophobicContact CB-CD1 4.2Å
287A86.8Confident82.5Confident27 Ų2749.3 Ų49.322%0.22327%0.274CS..Hα-helixtrans-61.8-43-179.900000111.7W32 A283 K284 T289 V290 I291W32-A287 HydrophobicContact CE3-CB 4.13Å; W32-A287 HydrophobicContact CH2-CB 4.25Å; W32-A287 HydrophobicContact CZ3-CB 3.48Å; W32-A287 VanDerWaalsContact CZ3-CB 3.48Å; A283-A287 PolarHBondContact O-N 3.4Å; K284-A287 PolarHBondContact O-N 3Å; A287-T289 VanDerWaalsContact C-N 3.33Å; A287-T289 PolarHBondContact O-N 3.07Å; A287-V290 PolarHBondContact O-N 3.39Å; A287-I291 VanDerWaalsContact O-CG1 3.23Å; A287-I291 WeakPolarHBondContact O-CG1 3.05Å; A287-I291 PolarHBondContact O-N 3.3Å
288Q85.5Confident81.9Confident9 Ų950.6 Ų50.64%0.04229%0.285CS..Hα-helixtrans-59.3-42.1176.6-171.4-172.6-64.800111.8I36 F40 K284 A285 C286 I291 A292I36-Q288 HydrophobicContact CG1-CB 4.4Å; F40-Q288 HydrophobicContact CE2-CG 4.4Å; K284-Q288 VanDerWaalsContact O-CB 3.24Å; K284-Q288 WeakPolarHBondContact O-CB 3.47Å; K284-Q288 PolarHBondContact O-N 3.5Å; A285-Q288 PolarHBondContact O-N 2.96Å; C286-Q288 VanDerWaalsContact C-N 3.34Å; C286-Q288 PolarHBondContact O-N 3.35Å; Q288-I291 PolarHBondContact O-N 2.93Å; Q288-A292 VanDerWaalsContact O-CB 3.3Å; Q288-A292 WeakPolarHBondContact O-CB 3.4Å; Q288-A292 PolarHBondContact O-N 2.84Å
289T83.6Confident81.6Confident1 Ų153.3 Ų53.31%0.00631%0.31CS..Hα-helixtrans-63.1-45.4175.9-57.70000111.6T125 A285 C286 A287 A292 V293 W304T125-T289 WeakPolarHBondContact CG2-OG1 3.27Å; A285-T289 PolarHBondContact O-N 3.35Å; A285-T289 PolarHBondContact O-OG1 3.26Å; A285-T289 VanDerWaalsContact O-OG1 3.05Å; C286-T289 PolarHBondContact O-N 2.81Å; A287-T289 VanDerWaalsContact C-N 3.33Å; A287-T289 PolarHBondContact O-N 3.07Å; T289-A292 PolarHBondContact O-N 2.93Å; T289-V293 HydrophobicContact CG2-CG2 4.45Å; T289-V293 WeakPolarHBondContact O-CG2 3.43Å; T289-V293 PolarHBondContact O-N 2.92Å; T289-W304 HydrophobicContact CG2-CH2 3.68Å; T289-W304 HydrophobicContact CG2-CZ3 4.25Å
290V85.8Confident81.7Confident70 Ų7053.5 Ų53.542%0.42431%0.307SS..Hα-helixtrans-61.1-48177.9174.90000110.7C286 A287 A292 V293 V294 W305C286-V290 WeakPolarHBondContact O-CG2 3.32Å; C286-V290 PolarHBondContact O-N 3.45Å; C286-V290 VanDerWaalsContact O-N 3.1Å; A287-V290 PolarHBondContact O-N 3.39Å; V290-A292 VanDerWaalsContact C-N 3.31Å; V290-A292 PolarHBondContact O-N 2.92Å; V290-V293 PolarHBondContact O-N 2.9Å; V290-V294 HydrophobicContact CG1-CG2 4.46Å; V290-V294 WeakPolarHBondContact O-CG2 3.36Å; V290-V294 PolarHBondContact O-N 3.26Å; V290-W305 HydrophobicContact CG2-CH2 4.07Å; V290-W305 HydrophobicContact CG2-CZ3 4.06Å
291I86.1Confident81.7Confident78 Ų7855.3 Ų55.340%0.432%0.319SS..Hα-helixtrans-59.2-44177.7-65164.2000110.3I36 F40 A287 Q288 V293 V294 Y295I36-I291 HydrophobicContact CD1-CD1 4.35Å; F40-I291 HydrophobicContact CE2-CB 4.48Å; F40-I291 HydrophobicContact CE2-CG2 3.89Å; F40-I291 HydrophobicContact CZ-CB 4.28Å; F40-I291 HydrophobicContact CZ-CG2 3.63Å; A287-I291 VanDerWaalsContact O-CG1 3.23Å; A287-I291 WeakPolarHBondContact O-CG1 3.05Å; A287-I291 PolarHBondContact O-N 3.3Å; Q288-I291 PolarHBondContact O-N 2.93Å; I291-V293 PolarHBondContact O-N 3.48Å; I291-V294 PolarHBondContact O-N 3.47Å; I291-Y295 WeakPolarHBondContact O-CB 3.39Å; I291-Y295 PolarHBondContact O-N 3.37Å
292A81.6Confident81.8Confident4 Ų462.6 Ų62.63%0.03335%0.347CS..Hα-helixtrans-64.4-40.5-179.900000112.8F40 Q288 T289 V290 N296F40-A292 HydrophobicContact CZ-CB 4.07Å; Q288-A292 VanDerWaalsContact O-CB 3.3Å; Q288-A292 WeakPolarHBondContact O-CB 3.4Å; Q288-A292 PolarHBondContact O-N 2.84Å; T289-A292 PolarHBondContact O-N 2.93Å; V290-A292 VanDerWaalsContact C-N 3.31Å; V290-A292 PolarHBondContact O-N 2.92Å; A292-N296 VanDerWaalsContact O-CB 3.28Å; A292-N296 WeakPolarHBondContact O-CB 3.21Å; A292-N296 VanDerWaalsContact O-CG 3.3Å; A292-N296 PolarHBondContact O-N 3.35Å; A292-N296 PolarHBondContact O-ND2 2.75Å
293V82.4Confident82Confident14 Ų1465.6 Ų65.69%0.08536%0.362CS..Hα-helixtrans-66.5-43.5177.8172.90000111.2T289 V290 I291 Q297 S298 K300 W304 W305T289-V293 HydrophobicContact CG2-CG2 4.45Å; T289-V293 WeakPolarHBondContact O-CG2 3.43Å; T289-V293 PolarHBondContact O-N 2.92Å; V290-V293 PolarHBondContact O-N 2.9Å; I291-V293 PolarHBondContact O-N 3.48Å; V293-Q297 PolarHBondContact O-N 2.76Å; V293-S298 VanDerWaalsContact CG1-O 3.28Å; V293-S298 WeakPolarHBondContact CG1-O 3.49Å; V293-S298 PolarHBondContact O-N 3.24Å; V293-K300 HydrophobicContact CG1-CG 4.33Å; V293-K300 HydrophobicContact CG2-CG 4.47Å; V293-W304 HydrophobicContact CG2-CH2 3.97Å; V293-W304 HydrophobicContact CG2-CZ3 4.08Å; V293-W305 HydrophobicContact CB-CH2 4.45Å; V293-W305 HydrophobicContact CB-CZ2 4.39Å; V293-W305 HydrophobicContact CG1-CZ2 3.99Å; V293-W305 HydrophobicContact CG2-CH2 4.34Å; V293-W305 HydrophobicContact CG2-CZ2 4.42Å
294V84.6Confident82.1Confident108 Ų10863.9 Ų63.966%0.65535%0.347SS*.Hα-helixtrans-65.7-45.6177.5173.10000111V290 I291 Q297V290-V294 HydrophobicContact CG1-CG2 4.46Å; V290-V294 WeakPolarHBondContact O-CG2 3.36Å; V290-V294 PolarHBondContact O-N 3.26Å; I291-V294 PolarHBondContact O-N 3.47Å; V294-Q297 PolarHBondContact O-N 2.87Å
295Y81.6Confident82Confident160 Ų16067 Ų6763%0.62736%0.358SS*.Hα-helixtrans-63.5-42.2-179.9-177.1-97.1000112.2F40 I291 Q297F40-Y295 HydrophobicContact CE1-CD1 4.31Å; F40-Y295 HydrophobicContact CE1-CG 4.44Å; I291-Y295 WeakPolarHBondContact O-CB 3.39Å; I291-Y295 PolarHBondContact O-N 3.37Å; Y295-Q297 PolarHBondContact O-N 3.11Å
296N74.6Confident82.3Confident70 Ų7068 Ų6837%0.37436%0.362SS..THydrogen-bonded Turntrans-80.86.8178.6-67.5-19.9000113.7A292 S298A292-N296 VanDerWaalsContact O-CB 3.28Å; A292-N296 WeakPolarHBondContact O-CB 3.21Å; A292-N296 VanDerWaalsContact O-CG 3.3Å; A292-N296 PolarHBondContact O-N 3.35Å; A292-N296 PolarHBondContact O-ND2 2.75Å; N296-S298 PolarHBondContact O-N 3.47Å; N296-S298 PolarHBondContact O-OG 3.19Å
297Q73.7Confident82.5Confident180 Ų18065.8 Ų65.884%0.84135%0.348SS*.THydrogen-bonded Turntrans44.834.7-177.9-61.9-171.2-22.400113.8V293 V294 Y295V293-Q297 PolarHBondContact O-N 2.76Å; V294-Q297 PolarHBondContact O-N 2.87Å; Y295-Q297 PolarHBondContact O-N 3.11Å
298S69.4Low82.4Confident50 Ų5064.7 Ų64.735%0.3534%0.338SS..  trans-96.9115.9-171.7-65.80000110.3V293 N296 K300V293-S298 VanDerWaalsContact CG1-O 3.28Å; V293-S298 WeakPolarHBondContact CG1-O 3.49Å; V293-S298 PolarHBondContact O-N 3.24Å; N296-S298 PolarHBondContact O-N 3.47Å; N296-S298 PolarHBondContact O-OG 3.19Å; S298-K300 PolarHBondContact O-N 2.81Å
299S72.2Confident82.6Confident130 Ų13069.9 Ų69.991%0.90937%0.365SS*.  trans-73.7120.1171.1-690000110.1
300K81Confident82.9Confident58 Ų5873.1 Ų73.125%0.25238%0.381SS..  trans-109.4146.3178-65.9-65.1-175.7176.60110.9E169 V293 S298 W304E169-K300 IonicContact OE1-NZ 3.82Å; E169-K300 PolarHBondContact OE1-NZ 2.81Å; E169-K300 IonicContact OE2-NZ 2.57Å; V293-K300 HydrophobicContact CG1-CG 4.33Å; V293-K300 HydrophobicContact CG2-CG 4.47Å; S298-K300 PolarHBondContact O-N 2.81Å; K300-W304 HydrophobicContact CB-CB 4.29Å; K300-W304 HydrophobicContact CB-CD2 3.88Å; K300-W304 HydrophobicContact CB-CE3 3.64Å; K300-W304 HydrophobicContact CB-CG 4.15Å; K300-W304 HydrophobicContact CB-CZ3 4.33Å; K300-W304 HydrophobicContact CD-CD2 4Å; K300-W304 HydrophobicContact CD-CE3 4.43Å; K300-W304 HydrophobicContact CD-CG 4.19Å; K300-W304 HydrophobicContact CG-CD2 3.92Å; K300-W304 HydrophobicContact CG-CE3 3.84Å; K300-W304 HydrophobicContact CG-CG 4.44Å; K300-W304 HydrophobicContact CG-CZ3 4.16Å
301S84.1Confident83Confident50 Ų5069.8 Ų69.835%0.3536%0.361SS..  trans-66.6158.2-179.774.50000111.7Q168 L303 W304 W305Q168-S301 PolarHBondContact OE1-OG 3.42Å; S301-L303 PolarHBondContact O-N 2.91Å; S301-W304 WeakPolarHBondContact O-CB 3.09Å; S301-W304 PolarHBondContact O-N 3.48Å; S301-W304 VanDerWaalsContact O-N 3.15Å; S301-W304 WeakPolarHBondContact OG-CB 3.05Å; S301-W304 PolarHBondContact OG-N 3.26Å; S301-W304 VanDerWaalsContact OG-N 3.13Å; S301-W305 PolarHBondContact O-N 2.9Å
302F86.4Confident82.9Confident167 Ų16766.6 Ų66.673%0.73235%0.345SS*.Hα-helixtrans-60.5-36.6175.1178.4-99.7000112.4W304 W305 T306F302-W304 VanDerWaalsContact C-N 3.32Å; F302-W304 PolarHBondContact O-N 3.46Å; F302-W305 PolarHBondContact O-N 3.24Å; F302-T306 PolarHBondContact O-N 3.28Å; F302-T306 PolarHBondContact O-OG1 2.94Å
303L85.3Confident83.3Confident80 Ų8068.3 Ų68.342%0.41936%0.363SS..Hα-helixtrans-66.6-34.1176.4-70.6173.2000112Q168 S301 T306 S307Q168-L303 VanDerWaalsContact CD-CB 3.47Å; Q168-L303 HydrophobicContact CG-CB 3.75Å; S301-L303 PolarHBondContact O-N 2.91Å; L303-T306 WeakPolarHBondContact O-CB 3.31Å; L303-T306 PolarHBondContact O-N 3.01Å; L303-S307 PolarHBondContact O-N 3.1Å
304W85.4Confident83.6Confident3 Ų367.8 Ų67.81%0.01136%0.36CS..Hα-helixtrans-63.5-43.6172.9-17295.9000111.8A122 Q168 E169 T289 V293 K300 S301 F302 T306 S307 N308A122-W304 HydrophobicContact CB-CH2 3.96Å; A122-W304 HydrophobicContact CB-CZ2 3.53Å; Q168-W304 HydrophobicContact CB-CB 4.42Å; E169-W304 PolarHBondContact OE1-NE1 3.45Å; T289-W304 HydrophobicContact CG2-CH2 3.68Å; T289-W304 HydrophobicContact CG2-CZ3 4.25Å; V293-W304 HydrophobicContact CG2-CH2 3.97Å; V293-W304 HydrophobicContact CG2-CZ3 4.08Å; K300-W304 HydrophobicContact CB-CB 4.29Å; K300-W304 HydrophobicContact CB-CD2 3.88Å; K300-W304 HydrophobicContact CB-CE3 3.64Å; K300-W304 HydrophobicContact CB-CG 4.15Å; K300-W304 HydrophobicContact CB-CZ3 4.33Å; K300-W304 HydrophobicContact CD-CD2 4Å; K300-W304 HydrophobicContact CD-CE3 4.43Å; K300-W304 HydrophobicContact CD-CG 4.19Å; K300-W304 HydrophobicContact CG-CD2 3.92Å; K300-W304 HydrophobicContact CG-CE3 3.84Å; K300-W304 HydrophobicContact CG-CG 4.44Å; K300-W304 HydrophobicContact CG-CZ3 4.16Å; S301-W304 WeakPolarHBondContact O-CB 3.09Å; S301-W304 PolarHBondContact O-N 3.48Å; S301-W304 VanDerWaalsContact O-N 3.15Å; S301-W304 WeakPolarHBondContact OG-CB 3.05Å; S301-W304 PolarHBondContact OG-N 3.26Å; S301-W304 VanDerWaalsContact OG-N 3.13Å; F302-W304 VanDerWaalsContact C-N 3.32Å; F302-W304 PolarHBondContact O-N 3.46Å; W304-T306 VanDerWaalsContact C-N 3.31Å; W304-T306 PolarHBondContact O-N 2.81Å; W304-S307 WeakPolarHBondContact O-CB 3.4Å; W304-S307 PolarHBondContact O-N 3.36Å; W304-N308 HydrophobicContact CZ3-CB 4.4Å; W304-N308 PolarHBondContact O-N 3.09Å
305W86.8Confident83.6Confident81 Ų8163.1 Ų63.131%0.30733%0.332SS..Hα-helixtrans-62.8-39.3173.6-77.4108.9000112.4V290 V293 S301 F302 N308 L309V290-W305 HydrophobicContact CG2-CH2 4.07Å; V290-W305 HydrophobicContact CG2-CZ3 4.06Å; V293-W305 HydrophobicContact CB-CH2 4.45Å; V293-W305 HydrophobicContact CB-CZ2 4.39Å; V293-W305 HydrophobicContact CG1-CZ2 3.99Å; V293-W305 HydrophobicContact CG2-CH2 4.34Å; V293-W305 HydrophobicContact CG2-CZ2 4.42Å; S301-W305 PolarHBondContact O-N 2.9Å; F302-W305 PolarHBondContact O-N 3.24Å; W305-N308 PolarHBondContact O-N 3.44Å; W305-L309 WeakPolarHBondContact O-CB 3.39Å; W305-L309 VanDerWaalsContact O-CG 3.32Å; W305-L309 WeakPolarHBondContact O-CG 3.4Å; W305-L309 PolarHBondContact O-N 3.09Å
306T88.4Confident83.8Confident42 Ų4257.3 Ų57.326%0.25832%0.315SS..Hα-helixtrans-62.6-44.4175.9-57.70000111.1L164 F302 L303 W304 N308 L309 M310L164-T306 HydrophobicContact CD2-CG2 4.3Å; F302-T306 PolarHBondContact O-N 3.28Å; F302-T306 PolarHBondContact O-OG1 2.94Å; L303-T306 WeakPolarHBondContact O-CB 3.31Å; L303-T306 PolarHBondContact O-N 3.01Å; W304-T306 VanDerWaalsContact C-N 3.31Å; W304-T306 PolarHBondContact O-N 2.81Å; T306-N308 PolarHBondContact O-N 3.02Å; T306-L309 PolarHBondContact O-N 3.38Å; T306-M310 HydrophobicContact CG2-SD 4.36Å; T306-M310 WeakPolarHBondContact O-CG 3.44Å; T306-M310 PolarHBondContact O-N 3.05Å
307S86.9Confident84.4Confident0 Ų055.9 Ų55.90%031%0.313CS..Hα-helixtrans-55.6-51.2172.9161.20000111.6G161 G165 L303 W304 L309 M310 V311G161-S307 WeakPolarHBondContact O-CB 3.36Å; G161-S307 PolarHBondContact O-OG 3.23Å; G165-S307 WeakPolarHBondContact CA-OG 3.49Å; G165-S307 PolarHBondContact N-OG 3.43Å; L303-S307 PolarHBondContact O-N 3.1Å; W304-S307 WeakPolarHBondContact O-CB 3.4Å; W304-S307 PolarHBondContact O-N 3.36Å; S307-L309 VanDerWaalsContact C-N 3.32Å; S307-L309 PolarHBondContact O-N 3.2Å; S307-M310 PolarHBondContact O-N 3.47Å; S307-V311 WeakPolarHBondContact O-CB 3.4Å; S307-V311 WeakPolarHBondContact O-CG2 3.42Å; S307-V311 PolarHBondContact O-N 3.03Å
308N85.3Confident85.1Confident4 Ų448.4 Ų48.42%0.02128%0.277CS..Hα-helixtrans-62.6-38.9-179.5-170.260.3000111.9W304 W305 T306 V311 L312W304-N308 HydrophobicContact CZ3-CB 4.4Å; W304-N308 PolarHBondContact O-N 3.09Å; W305-N308 PolarHBondContact O-N 3.44Å; T306-N308 PolarHBondContact O-N 3.02Å; N308-V311 PolarHBondContact O-N 3.13Å; N308-L312 VanDerWaalsContact ND2-CD1 3.28Å; N308-L312 WeakPolarHBondContact ND2-CD1 3.35Å; N308-L312 WeakPolarHBondContact O-CB 3.38Å; N308-L312 WeakPolarHBondContact O-CD1 3.16Å; N308-L312 WeakPolarHBondContact O-CG 3.45Å; N308-L312 PolarHBondContact O-N 3Å
309L88.8Confident85.7Confident118 Ų11847 Ų4762%0.61827%0.266SS*.Hα-helixtrans-65.5-42.7174-73.5174.5000112.6W305 T306 S307 V311 G313W305-L309 WeakPolarHBondContact O-CB 3.39Å; W305-L309 VanDerWaalsContact O-CG 3.32Å; W305-L309 WeakPolarHBondContact O-CG 3.4Å; W305-L309 PolarHBondContact O-N 3.09Å; T306-L309 PolarHBondContact O-N 3.38Å; S307-L309 VanDerWaalsContact C-N 3.32Å; S307-L309 PolarHBondContact O-N 3.2Å; L309-V311 VanDerWaalsContact C-N 3.35Å; L309-G313 WeakPolarHBondContact O-CA 3.25Å; L309-G313 PolarHBondContact O-N 2.91Å
310M89.9Confident86.3Confident68 Ų6848.1 Ų48.134%0.33525%0.251SS..Hα-helixtrans-61.1-45.9175.7-74178.569.100111.1I157 L164 T306 S307 G314I157-M310 HydrophobicContact CG2-CB 4.26Å; I157-M310 HydrophobicContact CG2-CE 4.47Å; I157-M310 WeakPolarHBondContact CG2-O 3.38Å; L164-M310 HydrophobicContact CD2-SD 4.43Å; T306-M310 HydrophobicContact CG2-SD 4.36Å; T306-M310 WeakPolarHBondContact O-CG 3.44Å; T306-M310 PolarHBondContact O-N 3.05Å; S307-M310 PolarHBondContact O-N 3.47Å; M310-G314 PolarHBondContact O-N 3.38Å
311V87.5Confident86.6Confident0 Ų046.7 Ų46.70%025%0.247CC..Hα-helixtrans-61.6-50.7179.3158.70000112.1V126 S129 S307 N308 L309 S315V126-V311 HydrophobicContact CG1-CG2 4.38Å; S129-V311 WeakPolarHBondContact OG-CG1 3.35Å; S307-V311 WeakPolarHBondContact O-CB 3.4Å; S307-V311 WeakPolarHBondContact O-CG2 3.42Å; S307-V311 PolarHBondContact O-N 3.03Å; N308-V311 PolarHBondContact O-N 3.13Å; L309-V311 VanDerWaalsContact C-N 3.35Å; V311-S315 WeakPolarHBondContact O-CB 3.24Å; V311-S315 PolarHBondContact O-N 3.3Å; V311-S315 PolarHBondContact O-OG 2.92Å
312L86Confident86.4Confident12 Ų1246.1 Ų46.16%0.06324%0.238CC..Hα-helixtrans-73.4-38.3-177-66.9165.7000111.3T282 A285 C286 N308 S315 S316T282-L312 HydrophobicContact CG2-CB 4.34Å; T282-L312 HydrophobicContact CG2-CD2 4.17Å; T282-L312 WeakPolarHBondContact CG2-O 3.39Å; A285-L312 HydrophobicContact CB-CD2 3.97Å; C286-L312 HydrophobicContact CB-CD1 4.2Å; N308-L312 VanDerWaalsContact ND2-CD1 3.28Å; N308-L312 WeakPolarHBondContact ND2-CD1 3.35Å; N308-L312 WeakPolarHBondContact O-CB 3.38Å; N308-L312 WeakPolarHBondContact O-CD1 3.16Å; N308-L312 WeakPolarHBondContact O-CG 3.45Å; N308-L312 PolarHBondContact O-N 3Å; L312-S315 PolarHBondContact O-N 3.49Å; L312-S316 WeakPolarHBondContact O-CB 3.36Å; L312-S316 PolarHBondContact O-N 3.3Å; L312-S316 PolarHBondContact O-OG 2.93Å
313G88.3Confident86.1Confident40 Ų4038.3 Ų38.341%0.41221%0.205SC..Hα-helixtrans-62.6-47.517300000111.8L309 S315 S316 A317L309-G313 WeakPolarHBondContact O-CA 3.25Å; L309-G313 PolarHBondContact O-N 2.91Å; G313-S315 PolarHBondContact O-N 2.97Å; G313-S316 WeakPolarHBondContact O-CB 3.38Å; G313-S316 PolarHBondContact O-N 3.11Å; G313-A317 WeakPolarHBondContact O-CB 3.3Å; G313-A317 PolarHBondContact O-N 2.59Å
314G88.6Confident85.9Confident2 Ų238.8 Ų38.82%0.02121%0.206CC..Hα-helixtrans-61.2-41.4175.600000112.7M310 A317 Y318M310-G314 PolarHBondContact O-N 3.38Å; G314-A317 PolarHBondContact O-N 3.17Å; G314-Y318 VanDerWaalsContact O-CB 3.32Å; G314-Y318 WeakPolarHBondContact O-CB 3.33Å; G314-Y318 PolarHBondContact O-N 3.2Å
315S85.3Confident85.7Confident10 Ų1040.7 Ų40.77%0.0722%0.215CC..Hα-helixtrans-66.3-37.8175.7-60.20000112.5V311 L312 G313 T319V311-S315 WeakPolarHBondContact O-CB 3.24Å; V311-S315 PolarHBondContact O-N 3.3Å; V311-S315 PolarHBondContact O-OG 2.92Å; L312-S315 PolarHBondContact O-N 3.49Å; G313-S315 PolarHBondContact O-N 2.97Å; S315-T319 WeakPolarHBondContact O-CB 3.47Å; S315-T319 PolarHBondContact O-N 2.8Å; S315-T319 PolarHBondContact O-OG1 3.01Å
316S85.6Confident85.1Confident39 Ų3942 Ų4227%0.27323%0.225SC..Hα-helixtrans-66.1-47.6174.3-59.80000111.6T282 L312 G313 Y318 T319 W320T282-S316 WeakPolarHBondContact CG2-OG 3.42Å; L312-S316 WeakPolarHBondContact O-CB 3.36Å; L312-S316 PolarHBondContact O-N 3.3Å; L312-S316 PolarHBondContact O-OG 2.93Å; G313-S316 WeakPolarHBondContact O-CB 3.38Å; G313-S316 PolarHBondContact O-N 3.11Å; S316-Y318 PolarHBondContact O-N 3.46Å; S316-T319 WeakPolarHBondContact O-CB 3.28Å; S316-T319 PolarHBondContact O-N 3.41Å; S316-W320 PolarHBondContact O-N 2.97Å
317A88.5Confident84.5Confident39 Ų3946.2 Ų46.232%0.32224%0.241SC..Hα-helixtrans-61.6-43.7177.600000111.4G313 G314 T319 W320 V321G313-A317 WeakPolarHBondContact O-CB 3.3Å; G313-A317 PolarHBondContact O-N 2.59Å; G314-A317 PolarHBondContact O-N 3.17Å; A317-T319 VanDerWaalsContact C-N 3.35Å; A317-T319 PolarHBondContact O-N 2.88Å; A317-W320 WeakPolarHBondContact O-CB 3.4Å; A317-W320 PolarHBondContact O-N 3.43Å; A317-V321 WeakPolarHBondContact O-CG2 3.19Å; A317-V321 PolarHBondContact O-N 3.36Å
318Y87Confident83.9Confident24 Ų2453.2 Ų53.29%0.09427%0.271CS..Hα-helixtrans-56.9-48.7174.2171.8-96.8000111.8T132 V136 A151 G314 S316 W320 V321 K322T132-Y318 HydrophobicContact CG2-CD1 3.26Å; T132-Y318 HydrophobicContact CG2-CD2 4.23Å; T132-Y318 HydrophobicContact CG2-CE1 3.64Å; T132-Y318 HydrophobicContact CG2-CG 3.58Å; V136-Y318 HydrophobicContact CG2-CD2 4.14Å; V136-Y318 HydrophobicContact CG2-CE2 3.14Å; V136-Y318 VanDerWaalsContact CG2-CZ 3.43Å; V136-Y318 WeakPolarHBondContact CG2-OH 3.47Å; A151-Y318 HydrophobicContact CB-CD2 3.9Å; A151-Y318 HydrophobicContact CB-CE2 3.88Å; G314-Y318 VanDerWaalsContact O-CB 3.32Å; G314-Y318 WeakPolarHBondContact O-CB 3.33Å; G314-Y318 PolarHBondContact O-N 3.2Å; S316-Y318 PolarHBondContact O-N 3.46Å; Y318-W320 VanDerWaalsContact C-N 3.27Å; Y318-W320 PolarHBondContact O-N 3.37Å; Y318-V321 PolarHBondContact O-N 2.94Å; Y318-K322 HydrophobicContact CD2-CG 4.4Å; Y318-K322 HydrophobicContact CE1-CG 3.93Å; Y318-K322 HydrophobicContact CE2-CG 3.77Å; Y318-K322 WeakPolarHBondContact O-CB 3.41Å; Y318-K322 PolarHBondContact O-N 3.49Å
319T82.8Confident83Confident21 Ų2157.5 Ų57.513%0.12930%0.297CS..Hα-helixtrans-59-42.1178.6-63.60000111.1L275 N278 V279 S315 S316 A317 G323L275-T319 HydrophobicContact CD1-CG2 4.01Å; L275-T319 WeakPolarHBondContact CD1-O 3.2Å; N278-T319 HydrophobicContact CB-CG2 3.35Å; V279-T319 HydrophobicContact CG2-CG2 4.17Å; S315-T319 WeakPolarHBondContact O-CB 3.47Å; S315-T319 PolarHBondContact O-N 2.8Å; S315-T319 PolarHBondContact O-OG1 3.01Å; S316-T319 WeakPolarHBondContact O-CB 3.28Å; S316-T319 PolarHBondContact O-N 3.41Å; A317-T319 VanDerWaalsContact C-N 3.35Å; A317-T319 PolarHBondContact O-N 2.88Å; T319-G323 PolarHBondContact O-N 3.4Å
320W84.3Confident81.6Confident152 Ų15257.9 Ų57.958%0.57630%0.295SS*.Hα-helixtrans-63.8-50.1177.3-171.8-85.1000112.3S316 A317 Y318 K322 G323 M324S316-W320 PolarHBondContact O-N 2.97Å; A317-W320 WeakPolarHBondContact O-CB 3.4Å; A317-W320 PolarHBondContact O-N 3.43Å; Y318-W320 VanDerWaalsContact C-N 3.27Å; Y318-W320 PolarHBondContact O-N 3.37Å; W320-K322 PolarHBondContact O-N 2.98Å; W320-G323 WeakPolarHBondContact O-CA 3.49Å; W320-G323 PolarHBondContact O-N 2.84Å; W320-G323 VanDerWaalsContact O-N 3.11Å; W320-M324 VanDerWaalsContact CD1-SD 3.58Å; W320-M324 PolarHBondContact NE1-SD 2.65Å; W320-M324 WeakPolarHBondContact O-CG 3.42Å; W320-M324 PolarHBondContact O-N 3.03Å
321V86.9Confident80Confident29 Ų2959.1 Ų59.118%0.17630%0.302CS..Hα-helixtrans-57.7-49.1178169.50000110.6A151 A317 Y318 G323 M324 E325A151-V321 HydrophobicContact CB-CG1 4.08Å; A317-V321 WeakPolarHBondContact O-CG2 3.19Å; A317-V321 PolarHBondContact O-N 3.36Å; Y318-V321 PolarHBondContact O-N 2.94Å; V321-G323 VanDerWaalsContact C-N 3.3Å; V321-G323 PolarHBondContact O-N 3.42Å; V321-M324 PolarHBondContact O-N 3.33Å; V321-M324 VanDerWaalsContact O-N 3.16Å; V321-E325 WeakPolarHBondContact CG1-OE1 3.39Å; V321-E325 WeakPolarHBondContact O-CG 3.44Å; V321-E325 PolarHBondContact O-N 2.73Å
322K81.3Confident78.4Confident37 Ų3762.1 Ų62.116%0.16132%0.322CS..Hα-helixtrans-61.7-38.2175.8-83.7-52.1-159.2-175.80112.7Y318 W320 M324 E325 M326Y318-K322 HydrophobicContact CD2-CG 4.4Å; Y318-K322 HydrophobicContact CE1-CG 3.93Å; Y318-K322 HydrophobicContact CE2-CG 3.77Å; Y318-K322 WeakPolarHBondContact O-CB 3.41Å; Y318-K322 PolarHBondContact O-N 3.49Å; W320-K322 PolarHBondContact O-N 2.98Å; K322-M324 VanDerWaalsContact C-N 3.34Å; K322-M324 PolarHBondContact O-N 3.3Å; K322-E325 VanDerWaalsContact CD-OE2 3.23Å; K322-E325 WeakPolarHBondContact CD-OE2 3.2Å; K322-E325 IonicContact NZ-OE2 2.68Å; K322-E325 PolarHBondContact NZ-OE2 2.89Å; K322-E325 PolarHBondContact O-N 2.99Å; K322-M326 HydrophobicContact CB-CE 4.24Å; K322-M326 VanDerWaalsContact O-CE 3.29Å; K322-M326 WeakPolarHBondContact O-CE 3.33Å; K322-M326 WeakPolarHBondContact O-CG 3.37Å; K322-M326 PolarHBondContact O-N 3.29Å
323G79.6Confident76.8Confident3 Ų368 Ų683%0.03135%0.349CS..Hα-helixtrans-57-46.2172.600000112.8T319 W320 V321 M326 K327T319-G323 PolarHBondContact O-N 3.4Å; W320-G323 WeakPolarHBondContact O-CA 3.49Å; W320-G323 PolarHBondContact O-N 2.84Å; W320-G323 VanDerWaalsContact O-N 3.11Å; V321-G323 VanDerWaalsContact C-N 3.3Å; V321-G323 PolarHBondContact O-N 3.42Å; G323-M326 PolarHBondContact O-N 3.32Å; G323-K327 PolarHBondContact O-N 3.49Å
324M80.3Confident75.2Confident91 Ų9172.8 Ų72.845%0.44836%0.361SS..Hα-helixtrans-67.2-41.2178-67.4-178.77200112.3W320 V321 K322 M326 K327 K328W320-M324 VanDerWaalsContact CD1-SD 3.58Å; W320-M324 PolarHBondContact NE1-SD 2.65Å; W320-M324 WeakPolarHBondContact O-CG 3.42Å; W320-M324 PolarHBondContact O-N 3.03Å; V321-M324 PolarHBondContact O-N 3.33Å; V321-M324 VanDerWaalsContact O-N 3.16Å; K322-M324 VanDerWaalsContact C-N 3.34Å; K322-M324 PolarHBondContact O-N 3.3Å; M324-M326 PolarHBondContact O-N 3.01Å; M324-K327 PolarHBondContact O-N 3.2Å; M324-K328 WeakPolarHBondContact O-CG 3.22Å; M324-K328 PolarHBondContact O-N 3.3Å
325E82.4Confident73.6Confident43 Ų4377.8 Ų77.820%0.20138%0.383CS..Hα-helixtrans-58.8-46.3174.9-75171.7-158.500111.6S148 V321 K322 K327 K328 V329S148-E325 WeakPolarHBondContact CB-OE1 3.4Å; V321-E325 WeakPolarHBondContact CG1-OE1 3.39Å; V321-E325 WeakPolarHBondContact O-CG 3.44Å; V321-E325 PolarHBondContact O-N 2.73Å; K322-E325 VanDerWaalsContact CD-OE2 3.23Å; K322-E325 WeakPolarHBondContact CD-OE2 3.2Å; K322-E325 IonicContact NZ-OE2 2.68Å; K322-E325 PolarHBondContact NZ-OE2 2.89Å; K322-E325 PolarHBondContact O-N 2.99Å; E325-K327 VanDerWaalsContact C-N 3.31Å; E325-K327 PolarHBondContact O-N 3.28Å; E325-K328 PolarHBondContact O-N 3.45Å; E325-V329 WeakPolarHBondContact O-CG2 3.34Å; E325-V329 PolarHBondContact O-N 3.41Å; E325-V329 VanDerWaalsContact O-N 3.12Å
326M74.3Confident72.2Confident107 Ų10780.4 Ų80.453%0.52740%0.402SS..Hα-helixtrans-61.9-37.9179.4-74.9-176.2-83.500112.4K322 G323 M324 V329 H330K322-M326 HydrophobicContact CB-CE 4.24Å; K322-M326 VanDerWaalsContact O-CE 3.29Å; K322-M326 WeakPolarHBondContact O-CE 3.33Å; K322-M326 WeakPolarHBondContact O-CG 3.37Å; K322-M326 PolarHBondContact O-N 3.29Å; G323-M326 PolarHBondContact O-N 3.32Å; M324-M326 PolarHBondContact O-N 3.01Å; M326-V329 PolarHBondContact O-N 3.3Å; M326-H330 PolarHBondContact O-N 3.42Å; M326-H330 PolarHBondContact O-ND1 2.87Å
327K75.3Confident70.7Confident132 Ų13284.8 Ų84.857%0.57442%0.416SS*.Hα-helixtrans-65.5-43.9174-71.9-177.9178.5-1730112G323 M324 E325 V329 H330 I331G323-K327 PolarHBondContact O-N 3.49Å; M324-K327 PolarHBondContact O-N 3.2Å; E325-K327 VanDerWaalsContact C-N 3.31Å; E325-K327 PolarHBondContact O-N 3.28Å; K327-V329 PolarHBondContact O-N 3.29Å; K327-H330 PolarHBondContact O-N 3.15Å; K327-I331 WeakPolarHBondContact O-CD1 3.48Å; K327-I331 WeakPolarHBondContact O-CG1 3.23Å; K327-I331 PolarHBondContact O-N 3.42Å
328K74.1Confident69.2Low146 Ų14689.7 Ų89.764%0.63543%0.432SS*.Hα-helixtrans-65.4-21.2178.6-74.5-177.3-179.5-175.10114.1M324 E325 P332M324-K328 WeakPolarHBondContact O-CG 3.22Å; M324-K328 PolarHBondContact O-N 3.3Å; E325-K328 PolarHBondContact O-N 3.45Å; K328-P332 WeakPolarHBondContact O-CD 3.34Å; K328-P332 WeakPolarHBondContact O-CG 3.33Å
329V66.3Low67.8Low95 Ų9595.5 Ų95.558%0.57646%0.458SS*.Hα-helixtrans-87.1-29.2176.8174.20000112.4E325 M326 K327 P332E325-V329 WeakPolarHBondContact O-CG2 3.34Å; E325-V329 PolarHBondContact O-N 3.41Å; E325-V329 VanDerWaalsContact O-N 3.12Å; M326-V329 PolarHBondContact O-N 3.3Å; K327-V329 PolarHBondContact O-N 3.29Å; V329-P332 WeakPolarHBondContact O-CD 3.17Å
330H58.8Low66.5Low125 Ų12599.5 Ų99.558%0.57948%0.478SS*.Hα-helixtrans-73.8-39.3177.3-78.574.9000112.5M326 K327 Q333 E334M326-H330 PolarHBondContact O-N 3.42Å; M326-H330 PolarHBondContact O-ND1 2.87Å; K327-H330 PolarHBondContact O-N 3.15Å; H330-Q333 PolarHBondContact O-N 3.38Å; H330-E334 PolarHBondContact O-N 3.29Å
331I56.8Low65.3Low94 Ų9498.1 Ų98.148%0.48248%0.481SS..Hα-helixtrans-59.9-45.1-178.6-61.7162.2000112.7K327 Q333 E334 E335K327-I331 WeakPolarHBondContact O-CD1 3.48Å; K327-I331 WeakPolarHBondContact O-CG1 3.23Å; K327-I331 PolarHBondContact O-N 3.42Å; I331-Q333 VanDerWaalsContact C-N 3.32Å; I331-Q333 PolarHBondContact O-N 2.88Å; I331-E334 PolarHBondContact O-N 2.97Å; I331-E335 PolarHBondContact O-N 3.08Å; I331-E335 VanDerWaalsContact O-N 3.11Å
332P54Low63.6Low64 Ų6498.6 Ų98.642%0.41649%0.492SS..Hα-helixtrans-64.8-29.2177.4-23.532.6000114.5K328 V329 S336K328-P332 WeakPolarHBondContact O-CD 3.34Å; K328-P332 WeakPolarHBondContact O-CG 3.33Å; V329-P332 WeakPolarHBondContact O-CD 3.17Å; P332-S336 VanDerWaalsContact O-CB 3.26Å; P332-S336 WeakPolarHBondContact O-CB 3.28Å; P332-S336 PolarHBondContact O-N 2.89Å; P332-S336 VanDerWaalsContact O-N 3.12Å; P332-S336 PolarHBondContact O-OG 3.48Å
333Q51.8Low62.4Low135 Ų135103.3 Ų103.363%0.63152%0.515SS*.Hα-helixtrans-78.9-34.9-179.7-85-162-32.700112.8H330 I331 K337H330-Q333 PolarHBondContact O-N 3.38Å; I331-Q333 VanDerWaalsContact C-N 3.32Å; I331-Q333 PolarHBondContact O-N 2.88Å; Q333-K337 WeakPolarHBondContact O-CB 3.47Å; Q333-K337 WeakPolarHBondContact O-CG 3.39Å; Q333-K337 PolarHBondContact O-N 3.08Å; Q333-K337 VanDerWaalsContact O-N 3.12Å
334E55Low61.2Low141 Ų141110.9 Ų110.966%0.65955%0.547SS*.Hα-helixtrans-69.9-47.6172.6-80.7-178.9156.600111.1H330 I331 S336 K337 E338H330-E334 PolarHBondContact O-N 3.29Å; I331-E334 PolarHBondContact O-N 2.97Å; E334-S336 VanDerWaalsContact C-N 3.29Å; E334-S336 PolarHBondContact O-N 3.44Å; E334-K337 PolarHBondContact O-N 3.27Å; E334-K337 VanDerWaalsContact O-N 3.14Å; E334-E338 WeakPolarHBondContact O-CB 3.47Å; E334-E338 PolarHBondContact O-N 3.21Å
335E56.4Low59.8Low106 Ų106111 Ų11150%0.49556%0.557SS.*Hα-helixtrans-60.8-35.9176.7-76.6-175.9172.800112.8I331 K339I331-E335 PolarHBondContact O-N 3.08Å; I331-E335 VanDerWaalsContact O-N 3.11Å; E335-K339 WeakPolarHBondContact O-CB 3.48Å; E335-K339 VanDerWaalsContact O-CG 3.29Å; E335-K339 WeakPolarHBondContact O-CG 3.32Å; E335-K339 PolarHBondContact O-N 2.97Å
336S54.9Low58.3Low65 Ų65116 Ų11646%0.45558%0.584SS.*Hα-helixtrans-71.3-38.3176.6-60.70000112.2P332 E334 L340P332-S336 VanDerWaalsContact O-CB 3.26Å; P332-S336 WeakPolarHBondContact O-CB 3.28Å; P332-S336 PolarHBondContact O-N 2.89Å; P332-S336 VanDerWaalsContact O-N 3.12Å; P332-S336 PolarHBondContact O-OG 3.48Å; E334-S336 VanDerWaalsContact C-N 3.29Å; E334-S336 PolarHBondContact O-N 3.44Å; S336-L340 WeakPolarHBondContact O-CB 3.48Å; S336-L340 WeakPolarHBondContact O-CD1 3.28Å; S336-L340 WeakPolarHBondContact O-CG 3.36Å; S336-L340 PolarHBondContact O-N 3.39Å
337K54.3Low57.2Low131 Ų131115 Ų11557%0.5759%0.594SS**Hα-helixtrans-68-38.8175-85.8-176.8175.4178.90112.1Q333 E334 L340 L341Q333-K337 WeakPolarHBondContact O-CB 3.47Å; Q333-K337 WeakPolarHBondContact O-CG 3.39Å; Q333-K337 PolarHBondContact O-N 3.08Å; Q333-K337 VanDerWaalsContact O-N 3.12Å; E334-K337 PolarHBondContact O-N 3.27Å; E334-K337 VanDerWaalsContact O-N 3.14Å; K337-L340 PolarHBondContact O-N 2.93Å; K337-L341 WeakPolarHBondContact O-CB 3.46Å; K337-L341 WeakPolarHBondContact O-CG 3.34Å; K337-L341 PolarHBondContact O-N 3.25Å
338E57.2Low55.9Low143 Ų143111.4 Ų111.467%0.66859%0.593SS**Hα-helixtrans-68.7-40.2178.5-160.8169.8-16600111.2E334 L341 G342E334-E338 WeakPolarHBondContact O-CB 3.47Å; E334-E338 PolarHBondContact O-N 3.21Å; E338-L341 PolarHBondContact O-N 3.31Å; E338-G342 PolarHBondContact O-N 3.31Å
339K56.6Low54.4Low146 Ų146114.2 Ų114.264%0.63562%0.623SS**Hα-helixtrans-62.9-43.1171-75.9176.6-178.61780113.2E335 L341 G342 E343E335-K339 WeakPolarHBondContact O-CB 3.48Å; E335-K339 VanDerWaalsContact O-CG 3.29Å; E335-K339 WeakPolarHBondContact O-CG 3.32Å; E335-K339 PolarHBondContact O-N 2.97Å; K339-L341 VanDerWaalsContact C-N 3.31Å; K339-L341 PolarHBondContact O-N 3.15Å; K339-G342 PolarHBondContact O-N 3.33Å; K339-E343 PolarHBondContact O-N 3.11Å
340L56.3Low53.8Low104 Ų104115.2 Ų115.255%0.54563%0.625SS.*Hα-helixtrans-66.4-29.7176.5-83.7158.9000113.4S336 K337 K344S336-L340 WeakPolarHBondContact O-CB 3.48Å; S336-L340 WeakPolarHBondContact O-CD1 3.28Å; S336-L340 WeakPolarHBondContact O-CG 3.36Å; S336-L340 PolarHBondContact O-N 3.39Å; K337-L340 PolarHBondContact O-N 2.93Å; L340-K344 WeakPolarHBondContact O-CG 3.43Å; L340-K344 PolarHBondContact O-N 3.08Å
341L58.5Low53.6Low124 Ų124114.7 Ų114.765%0.64963%0.627SS**Hα-helixtrans-79.5-36.3174-76.7164.5000111.6K337 E338 K339 K344 S345K337-L341 WeakPolarHBondContact O-CB 3.46Å; K337-L341 WeakPolarHBondContact O-CG 3.34Å; K337-L341 PolarHBondContact O-N 3.25Å; E338-L341 PolarHBondContact O-N 3.31Å; K339-L341 VanDerWaalsContact C-N 3.31Å; K339-L341 PolarHBondContact O-N 3.15Å; L341-K344 PolarHBondContact O-N 3.36Å; L341-S345 PolarHBondContact O-N 2.83Å
342G52.6Low53.4Low38 Ų38115.8 Ų115.839%0.39264%0.635SS.*Hα-helixtrans-63.4-47.217300000112.9E338 K339 K344 S345 D346E338-G342 PolarHBondContact O-N 3.31Å; K339-G342 PolarHBondContact O-N 3.33Å; G342-K344 VanDerWaalsContact C-N 3.31Å; G342-K344 PolarHBondContact O-N 3.42Å; G342-S345 PolarHBondContact O-N 3.13Å; G342-S345 VanDerWaalsContact O-N 3.13Å; G342-D346 PolarHBondContact O-N 3.48Å; G342-D346 VanDerWaalsContact O-N 3.14Å
343E54.8Low53.4Low137 Ų137118.9 Ų118.964%0.6465%0.648SS**Hα-helixtrans-64.3-32.9176.9-84.6-178.1130.100113.1K339 S345 A347K339-E343 PolarHBondContact O-N 3.11Å; E343-S345 VanDerWaalsContact C-N 3.33Å; E343-A347 VanDerWaalsContact O-CB 3.28Å; E343-A347 WeakPolarHBondContact O-CB 3.25Å; E343-A347 PolarHBondContact O-N 2.97Å
344K53.9Low53.4Low162 Ų162117.9 Ų117.970%0.70465%0.65SS**Hα-helixtrans-72.9-25.5174.8-81.2-175.6176.2-175.80113.4L340 L341 G342L340-K344 WeakPolarHBondContact O-CG 3.43Å; L340-K344 PolarHBondContact O-N 3.08Å; L341-K344 PolarHBondContact O-N 3.36Å; G342-K344 VanDerWaalsContact C-N 3.31Å; G342-K344 PolarHBondContact O-N 3.42Å
345S50.8Low53.3Low94 Ų94116.3 Ų116.366%0.65765%0.649SS**Hα-helixtrans-79.6-30.3176-161.80000112.2L341 G342 E343L341-S345 PolarHBondContact O-N 2.83Å; G342-S345 PolarHBondContact O-N 3.13Å; G342-S345 VanDerWaalsContact O-N 3.13Å; E343-S345 VanDerWaalsContact C-N 3.33Å
346D51.9Low53.1Low146 Ų146117.1 Ų117.178%0.78166%0.66SS**Hα-helixtrans-83-24.2174.7-95.5-13.5000113.2G342 G348G342-D346 PolarHBondContact O-N 3.48Å; G342-D346 VanDerWaalsContact O-N 3.14Å; D346-G348 VanDerWaalsContact C-N 3.28Å
347A52.1Low53Low88 Ų88121.1 Ų121.173%0.72768%0.676SS**SBendtrans-83.1-2175.200000113.9E343E343-A347 VanDerWaalsContact O-CB 3.28Å; E343-A347 WeakPolarHBondContact O-CB 3.25Å; E343-A347 PolarHBondContact O-N 2.97Å
348G46.2Very low52.9Low55 Ų55120.3 Ų120.357%0.56768%0.684SS**  trans-106.374.1175.500000111.4D346D346-G348 VanDerWaalsContact C-N 3.28Å
349V43.7Very low52.5Low206 Ų206118.2 Ų118.2100%1.24869%0.686SS**  trans-63.60158.31740000109.8

Retrieved 349 of 349 residues in 1306.5 ms (Link to these results)