A0A3Q0KKW4_SCHMA Loading...

F8A1-like protein

AlphaFold DB , UniProt , Accession A0A3Q0KKW4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 319 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
1M61Low72.9Confident140 Ų14089.7 Ų89.769%0.6948%0.477SS*.  0129.10-87.7-150.9-90.400108.9P3 Y7 C47 L50M1-P3 VanDerWaalsContact O-CD 3.23Å; M1-P3 WeakPolarHBondContact O-CD 3.43Å; M1-Y7 HydrophobicContact CG-CE2 4.39Å; M1-Y7 HydrophobicContact SD-CD2 3.96Å; M1-Y7 HydrophobicContact SD-CE2 4.02Å; M1-C47 VanDerWaalsContact CG-SG 3.55Å; M1-L50 HydrophobicContact CE-CD1 4.26Å; M1-L50 HydrophobicContact SD-CD1 3.76Å
2D62.4Low73.5Confident72 Ų7294.8 Ų94.839%0.38549%0.492SS..  trans-64.5111.7170.1-67.6-40.6000110S4 L5 Q45D2-S4 PolarHBondContact O-N 3.21Å; D2-S4 VanDerWaalsContact O-N 3.09Å; D2-L5 HydrophobicContact CB-CD1 3.98Å; D2-L5 PolarHBondContact O-N 3.14Å; D2-Q45 PolarHBondContact OD2-NE2 2.82Å
3P65.6Low74Confident136 Ų13691.2 Ų91.288%0.88349%0.485SS*.THydrogen-bonded Turntrans-68-12.1-17427.2-33.7000113.2M1M1-P3 VanDerWaalsContact O-CD 3.23Å; M1-P3 WeakPolarHBondContact O-CD 3.43Å
4S70Confident74.1Confident106 Ų10686.3 Ų86.374%0.74146%0.459SS*.THydrogen-bonded Turntrans-79.5-19.5177.355.20000113.7D2D2-S4 PolarHBondContact O-N 3.21Å; D2-S4 VanDerWaalsContact O-N 3.09Å
5L71.7Confident74.2Confident80 Ų8082.1 Ų82.142%0.41944%0.439SS..  trans-100.6117.6-173.7-77.5159.3000111.2D2 Y7 I10D2-L5 HydrophobicContact CB-CD1 3.98Å; D2-L5 PolarHBondContact O-N 3.14Å; L5-Y7 HydrophobicContact CB-CE1 4.43Å; L5-Y7 HydrophobicContact CB-CE2 4.08Å; L5-Y7 WeakPolarHBondContact O-CD2 3.39Å; L5-Y7 PolarHBondContact O-N 3.01Å; L5-Y7 VanDerWaalsContact O-N 3.11Å; L5-I10 HydrophobicContact CB-CD1 4.45Å; L5-I10 HydrophobicContact CD2-CD1 3.83Å
6N80.2Confident74.5Confident76 Ų7681.3 Ų81.341%0.40644%0.438SS..  trans-85.580.2175.1-167-44.1000110.3P8 R9 I10N6-P8 VanDerWaalsContact C-CD 3.46Å; N6-P8 VanDerWaalsContact C-N 3.31Å; N6-P8 VanDerWaalsContact OD1-CD 3.31Å; N6-P8 WeakPolarHBondContact OD1-CD 3.43Å; N6-R9 HydrophobicContact CB-CB 4.1Å; N6-R9 HydrophobicContact CB-CG 4.23Å; N6-R9 WeakPolarHBondContact O-CA 3.29Å; N6-R9 WeakPolarHBondContact O-CB 3.3Å; N6-R9 PolarHBondContact O-N 2.75Å; N6-R9 WeakPolarHBondContact OD1-CG 3.5Å; N6-R9 PolarHBondContact OD1-N 3.16Å; N6-R9 VanDerWaalsContact OD1-N 3.08Å; N6-I10 WeakPolarHBondContact O-CG1 3.35Å; N6-I10 PolarHBondContact O-N 3.35Å
7Y78.7Confident74.3Confident12 Ų1280.1 Ų80.15%0.04743%0.432CS..Hα-helixtrans-50.9-40179.4-64.7-74.9000114.4M1 L5 R9 I10 Y11 V38 L42 F54M1-Y7 HydrophobicContact CG-CE2 4.39Å; M1-Y7 HydrophobicContact SD-CD2 3.96Å; M1-Y7 HydrophobicContact SD-CE2 4.02Å; L5-Y7 HydrophobicContact CB-CE1 4.43Å; L5-Y7 HydrophobicContact CB-CE2 4.08Å; L5-Y7 WeakPolarHBondContact O-CD2 3.39Å; L5-Y7 PolarHBondContact O-N 3.01Å; L5-Y7 VanDerWaalsContact O-N 3.11Å; Y7-R9 VanDerWaalsContact C-N 3.33Å; Y7-R9 PolarHBondContact O-N 2.62Å; Y7-I10 HydrophobicContact CD1-CD1 4.35Å; Y7-I10 PolarHBondContact O-N 3.02Å; Y7-Y11 WeakPolarHBondContact O-CB 3.4Å; Y7-Y11 PolarHBondContact O-N 3.46Å; Y7-V38 HydrophobicContact CD1-CG1 4.38Å; Y7-V38 HydrophobicContact CE1-CG1 4.42Å; Y7-L42 HydrophobicContact CD1-CD1 4.25Å; Y7-L42 HydrophobicContact CD1-CD2 3.92Å; Y7-L42 HydrophobicContact CD1-CG 4.38Å; Y7-L42 HydrophobicContact CD2-CD2 4.45Å; Y7-L42 HydrophobicContact CE1-CD1 4.36Å; Y7-L42 HydrophobicContact CE1-CD2 3.51Å; Y7-L42 HydrophobicContact CE1-CG 4.01Å; Y7-L42 HydrophobicContact CE2-CD2 4.09Å; Y7-L42 HydrophobicContact CG-CD2 4.37Å; Y7-F54 HydrophobicContact CD1-CE2 4.49Å; Y7-F54 HydrophobicContact CD1-CZ 4.47Å
8P79.1Confident73.6Confident84 Ų8476.4 Ų76.455%0.54541%0.412SS..Hα-helixtrans-59-39.2172.9-27.134.9000114N6 K12N6-P8 VanDerWaalsContact C-CD 3.46Å; N6-P8 VanDerWaalsContact C-N 3.31Å; N6-P8 VanDerWaalsContact OD1-CD 3.31Å; N6-P8 WeakPolarHBondContact OD1-CD 3.43Å; P8-K12 WeakPolarHBondContact O-CB 3.39Å; P8-K12 VanDerWaalsContact O-CG 3.31Å; P8-K12 WeakPolarHBondContact O-CG 3.47Å; P8-K12 PolarHBondContact O-N 3.19Å
9R78.8Confident73.4Confident184 Ų18481 Ų8169%0.69443%0.428SS*.Hα-helixtrans-69.2-41.4175.3-74.7-179.1-177.7179.70.8111.6N6 Y7 K12 A13N6-R9 HydrophobicContact CB-CB 4.1Å; N6-R9 HydrophobicContact CB-CG 4.23Å; N6-R9 WeakPolarHBondContact O-CA 3.29Å; N6-R9 WeakPolarHBondContact O-CB 3.3Å; N6-R9 PolarHBondContact O-N 2.75Å; N6-R9 WeakPolarHBondContact OD1-CG 3.5Å; N6-R9 PolarHBondContact OD1-N 3.16Å; N6-R9 VanDerWaalsContact OD1-N 3.08Å; Y7-R9 VanDerWaalsContact C-N 3.33Å; Y7-R9 PolarHBondContact O-N 2.62Å; R9-K12 PolarHBondContact O-N 3.03Å; R9-A13 WeakPolarHBondContact O-CB 3.32Å; R9-A13 PolarHBondContact O-N 3.31Å
10I78.2Confident73Confident49 Ų4985.4 Ų85.425%0.25144%0.443SS..Hα-helixtrans-60.2-49176.6-62.2168.9000109.8L5 N6 Y7 K12 A13 L14 F54L5-I10 HydrophobicContact CB-CD1 4.45Å; L5-I10 HydrophobicContact CD2-CD1 3.83Å; N6-I10 WeakPolarHBondContact O-CG1 3.35Å; N6-I10 PolarHBondContact O-N 3.35Å; Y7-I10 HydrophobicContact CD1-CD1 4.35Å; Y7-I10 PolarHBondContact O-N 3.02Å; I10-K12 PolarHBondContact O-N 3.45Å; I10-A13 PolarHBondContact O-N 3.13Å; I10-L14 HydrophobicContact CG2-CD1 4.06Å; I10-L14 WeakPolarHBondContact O-CG 3.4Å; I10-L14 PolarHBondContact O-N 3.35Å; I10-F54 HydrophobicContact CG2-CE1 4.17Å; I10-F54 HydrophobicContact CG2-CZ 4.38Å
11Y76.1Confident72.6Confident48 Ų4885.3 Ų85.319%0.18844%0.44CS..Hα-helixtrans-61-43.8177.4-174.9-90.8000111.9Y7 L14 S15 F35 V53 F54Y7-Y11 WeakPolarHBondContact O-CB 3.4Å; Y7-Y11 PolarHBondContact O-N 3.46Å; Y11-L14 PolarHBondContact O-N 3.1Å; Y11-S15 WeakPolarHBondContact O-CB 3.24Å; Y11-S15 PolarHBondContact O-N 3.16Å; Y11-F35 HydrophobicContact CD2-CE1 4.14Å; Y11-F35 HydrophobicContact CE2-CE1 4.1Å; Y11-V53 HydrophobicContact CD2-CG1 4.12Å; Y11-V53 HydrophobicContact CE2-CG1 3.69Å; Y11-F54 HydrophobicContact CD2-CD1 4.32Å; Y11-F54 HydrophobicContact CD2-CE1 4.2Å; Y11-F54 HydrophobicContact CD2-CE2 4.44Å; Y11-F54 HydrophobicContact CD2-CG 4.47Å; Y11-F54 HydrophobicContact CD2-CZ 4.27Å
12K80.6Confident72.5Confident150 Ų15083.4 Ų83.465%0.65243%0.431SS*.Hα-helixtrans-60.1-45.4176.1-80.2-179.8179.8-177.30111.7P8 R9 I10 S15 T16P8-K12 WeakPolarHBondContact O-CB 3.39Å; P8-K12 VanDerWaalsContact O-CG 3.31Å; P8-K12 WeakPolarHBondContact O-CG 3.47Å; P8-K12 PolarHBondContact O-N 3.19Å; R9-K12 PolarHBondContact O-N 3.03Å; I10-K12 PolarHBondContact O-N 3.45Å; K12-S15 PolarHBondContact O-N 3.18Å; K12-T16 WeakPolarHBondContact O-CG2 3.31Å; K12-T16 PolarHBondContact O-N 3.09Å; K12-T16 PolarHBondContact O-OG1 2.91Å
13A79.9Confident72.3Confident49 Ų4987.2 Ų87.241%0.40545%0.452SS..Hα-helixtrans-60-52.7178.400000111.3R9 I10 S15 T16 D17R9-A13 WeakPolarHBondContact O-CB 3.32Å; R9-A13 PolarHBondContact O-N 3.31Å; I10-A13 PolarHBondContact O-N 3.13Å; A13-S15 VanDerWaalsContact C-N 3.33Å; A13-S15 PolarHBondContact O-N 3.43Å; A13-T16 WeakPolarHBondContact CA-OG1 3.16Å; A13-T16 PolarHBondContact O-N 3.46Å; A13-T16 PolarHBondContact O-OG1 3.01Å; A13-D17 VanDerWaalsContact O-CG 3.26Å; A13-D17 PolarHBondContact O-N 3.29Å
14L75.7Confident72Confident22 Ų2286.1 Ų86.112%0.11544%0.435CS..Hα-helixtrans-59.3-43.8177.8-67.2172.6000111.7I10 Y11 D17 V18 D34 F35 F54I10-L14 HydrophobicContact CG2-CD1 4.06Å; I10-L14 WeakPolarHBondContact O-CG 3.4Å; I10-L14 PolarHBondContact O-N 3.35Å; Y11-L14 PolarHBondContact O-N 3.1Å; L14-D17 PolarHBondContact O-N 3.4Å; L14-V18 WeakPolarHBondContact O-CG2 2.99Å; L14-V18 PolarHBondContact O-N 2.82Å; L14-D34 HydrophobicContact CD2-CB 3.94Å; L14-F35 HydrophobicContact CB-CE1 3.72Å; L14-F35 HydrophobicContact CB-CE2 3.92Å; L14-F35 HydrophobicContact CB-CZ 3.36Å; L14-F35 HydrophobicContact CD1-CD1 3.96Å; L14-F35 HydrophobicContact CD1-CE1 3.88Å; L14-F35 HydrophobicContact CD1-CG 4.41Å; L14-F35 HydrophobicContact CD1-CZ 4.27Å; L14-F35 HydrophobicContact CG-CE1 4.46Å; L14-F35 HydrophobicContact CG-CZ 4.41Å; L14-F54 HydrophobicContact CD1-CD1 4.35Å; L14-F54 HydrophobicContact CD1-CE1 3.99Å
15S75.6Confident71.4Confident24 Ų2487 Ų8717%0.16843%0.43CS..Hα-helixtrans-66.1-38.7179.3-174.30000113Y11 K12 A13 D17 V18 K19Y11-S15 WeakPolarHBondContact O-CB 3.24Å; Y11-S15 PolarHBondContact O-N 3.16Å; K12-S15 PolarHBondContact O-N 3.18Å; A13-S15 VanDerWaalsContact C-N 3.33Å; A13-S15 PolarHBondContact O-N 3.43Å; S15-D17 VanDerWaalsContact C-N 3.28Å; S15-D17 PolarHBondContact O-N 3.34Å; S15-V18 PolarHBondContact O-N 2.93Å; S15-K19 WeakPolarHBondContact O-CG 3.22Å; S15-K19 PolarHBondContact O-N 3.5Å; S15-K19 VanDerWaalsContact O-N 3.1Å
16T78.4Confident70.7Confident68 Ų6889.4 Ų89.442%0.41744%0.444SS..Hα-helixtrans-65.7-35.1173.848.90000112K12 A13 K19 K20K12-T16 WeakPolarHBondContact O-CG2 3.31Å; K12-T16 PolarHBondContact O-N 3.09Å; K12-T16 PolarHBondContact O-OG1 2.91Å; A13-T16 WeakPolarHBondContact CA-OG1 3.16Å; A13-T16 PolarHBondContact O-N 3.46Å; A13-T16 PolarHBondContact O-OG1 3.01Å; T16-K19 PolarHBondContact O-N 2.8Å; T16-K20 WeakPolarHBondContact O-CG 3.45Å; T16-K20 PolarHBondContact O-N 3.01Å; T16-K20 VanDerWaalsContact O-N 3.08Å
17D72.3Confident69.6Low62 Ų6288.3 Ų88.333%0.33244%0.437SS..Hα-helixtrans-71.2-37.8178.3-68.3-20.3000111.8A13 L14 S15 K20 K21 Q31A13-D17 VanDerWaalsContact O-CG 3.26Å; A13-D17 PolarHBondContact O-N 3.29Å; L14-D17 PolarHBondContact O-N 3.4Å; S15-D17 VanDerWaalsContact C-N 3.28Å; S15-D17 PolarHBondContact O-N 3.34Å; D17-K20 PolarHBondContact O-N 3.47Å; D17-K21 WeakPolarHBondContact O-CB 3.43Å; D17-K21 WeakPolarHBondContact O-CG 3.19Å; D17-K21 PolarHBondContact O-N 2.9Å; D17-K21 VanDerWaalsContact O-N 3.12Å; D17-Q31 VanDerWaalsContact C-NE2 3.34Å; D17-Q31 PolarHBondContact O-NE2 3.35Å
18V61.4Low69.1Low13 Ų1388 Ų888%0.07944%0.436CS..Hα-helixtrans-60.1-47.6171.3173.80000110.8L14 S15 K20 K21 L22 F35L14-V18 WeakPolarHBondContact O-CG2 2.99Å; L14-V18 PolarHBondContact O-N 2.82Å; S15-V18 PolarHBondContact O-N 2.93Å; V18-K20 VanDerWaalsContact C-N 3.32Å; V18-K20 PolarHBondContact O-N 3.31Å; V18-K21 PolarHBondContact O-N 2.97Å; V18-L22 HydrophobicContact CG1-CD1 4.23Å; V18-L22 PolarHBondContact O-N 3.06Å; V18-L22 VanDerWaalsContact O-N 3.1Å; V18-F35 HydrophobicContact CG2-CE2 3.69Å; V18-F35 HydrophobicContact CG2-CZ 4.29Å
19K68.4Low69Low164 Ų16488.2 Ų88.271%0.71343%0.432SS*.Hα-helixtrans-62.1-38.7-179.4-75-176.5-179.2-1740112.7S15 T16S15-K19 WeakPolarHBondContact O-CG 3.22Å; S15-K19 PolarHBondContact O-N 3.5Å; S15-K19 VanDerWaalsContact O-N 3.1Å; T16-K19 PolarHBondContact O-N 2.8Å
20K66.9Low69Low168 Ų16885 Ų8573%0.7343%0.426SS*.Hα-helixtrans-72.6-31.2-179.7-75.2177.6-179.7178.60112.8T16 D17 V18T16-K20 WeakPolarHBondContact O-CG 3.45Å; T16-K20 PolarHBondContact O-N 3.01Å; T16-K20 VanDerWaalsContact O-N 3.08Å; D17-K20 PolarHBondContact O-N 3.47Å; V18-K20 VanDerWaalsContact C-N 3.32Å; V18-K20 PolarHBondContact O-N 3.31Å
21K63.8Low69.2Low85 Ų8583.5 Ų83.537%0.3742%0.417SS..Hα-helixtrans-113.214.9-167.8-60.1-176178.9-1780114D17 V18 N23 E24D17-K21 WeakPolarHBondContact O-CB 3.43Å; D17-K21 WeakPolarHBondContact O-CG 3.19Å; D17-K21 PolarHBondContact O-N 2.9Å; D17-K21 VanDerWaalsContact O-N 3.12Å; V18-K21 PolarHBondContact O-N 2.97Å; K21-N23 PolarHBondContact O-N 3.3Å; K21-E24 PolarHBondContact O-N 3.47Å
22L58.7Low69.6Low99 Ų9981.3 Ų81.352%0.51841%0.409SS..THydrogen-bonded Turntrans-54.2-18.9-179.7-154.484.5000113.9V18 A64V18-L22 HydrophobicContact CG1-CD1 4.23Å; V18-L22 PolarHBondContact O-N 3.06Å; V18-L22 VanDerWaalsContact O-N 3.1Å; L22-A64 HydrophobicContact CD1-CB 3.79Å; L22-A64 HydrophobicContact CG-CB 4.29Å
23N58.7Low70Confident153 Ų15378.8 Ų78.882%0.81840%0.403SS*.THydrogen-bonded Turntrans-91.9-7.1-178.2-63.9-13.4000114.3K21K21-N23 PolarHBondContact O-N 3.3Å
24E59.9Low70.5Confident113 Ų11380.3 Ų80.353%0.52840%0.404SS..  trans-10997.9-176.5-69.3178.3-172.800111.2K21 N26 M27K21-E24 PolarHBondContact O-N 3.47Å; E24-N26 PolarHBondContact O-N 3.49Å; E24-N26 VanDerWaalsContact O-N 3.13Å; E24-M27 HydrophobicContact CB-CB 4.42Å; E24-M27 HydrophobicContact CB-CG 4.33Å; E24-M27 PolarHBondContact O-N 2.71Å; E24-M27 VanDerWaalsContact O-N 3.1Å
25I55.9Low71.1Confident125 Ų12579.4 Ų79.464%0.64140%0.399SS*.Hα-helixtrans-51.4-41.2-174.4-61.1171.6000112.5M27 C28I25-M27 VanDerWaalsContact C-N 3.29Å; I25-M27 PolarHBondContact O-N 3.22Å; I25-C28 PolarHBondContact O-N 2.87Å
26N56.8Low71.9Confident130 Ų13078.9 Ų78.970%0.69540%0.397SS*.Hα-helixtrans-72.2-20-173.9-64.2-15.2000113.9E24E24-N26 PolarHBondContact O-N 3.49Å; E24-N26 VanDerWaalsContact O-N 3.13Å
27M58.7Low72.5Confident53 Ų5379.7 Ų79.726%0.26140%0.404SS..Hα-helixtrans-89.9-17.3-177.5-67.5-64.499.100112.5E24 I25 D29 Q30 Q31E24-M27 HydrophobicContact CB-CB 4.42Å; E24-M27 HydrophobicContact CB-CG 4.33Å; E24-M27 PolarHBondContact O-N 2.71Å; E24-M27 VanDerWaalsContact O-N 3.1Å; I25-M27 VanDerWaalsContact C-N 3.29Å; I25-M27 PolarHBondContact O-N 3.22Å; M27-D29 VanDerWaalsContact C-N 3.32Å; M27-D29 PolarHBondContact O-N 3.14Å; M27-Q30 PolarHBondContact O-N 2.93Å; M27-Q31 WeakPolarHBondContact O-CG 3.5Å; M27-Q31 PolarHBondContact O-N 3.05Å
28C67.9Low73.3Confident4 Ų478.1 Ų78.13%0.02740%0.397CS..Hα-helixtrans-62.9-37.5177.7-66.30000112.2I25 Q31 A32 A65I25-C28 PolarHBondContact O-N 2.87Å; C28-Q31 PolarHBondContact O-N 3.43Å; C28-A32 VanDerWaalsContact O-CB 3.26Å; C28-A32 WeakPolarHBondContact O-CB 3.48Å; C28-A32 PolarHBondContact O-N 2.87Å; C28-A65 HydrophobicContact CB-CB 4.14Å
29D76.6Confident74.7Confident89 Ų8977.6 Ų77.648%0.47639%0.394SS..Hα-helixtrans-67.3-42.1-179.6-71.2-16.9000112.7M27 A32 N33M27-D29 VanDerWaalsContact C-N 3.32Å; M27-D29 PolarHBondContact O-N 3.14Å; D29-A32 PolarHBondContact O-N 3.4Å; D29-N33 VanDerWaalsContact O-CG 3.29Å; D29-N33 PolarHBondContact O-N 3.18Å; D29-N33 PolarHBondContact O-ND2 3.18Å; D29-N33 VanDerWaalsContact O-ND2 3.14Å
30Q79.7Confident75.9Confident118 Ų11876.7 Ų76.755%0.55139%0.39SS*.Hα-helixtrans-63.5-46.4176.7-69.7-177-1100110.7M27 A32 N33 D34M27-Q30 PolarHBondContact O-N 2.93Å; Q30-A32 PolarHBondContact O-N 3.44Å; Q30-N33 WeakPolarHBondContact O-CB 3.35Å; Q30-N33 PolarHBondContact O-N 3.44Å; Q30-N33 VanDerWaalsContact O-N 3.15Å; Q30-D34 PolarHBondContact O-N 3.28Å
31Q81.7Confident77.1Confident16 Ų1671.1 Ų71.18%0.07537%0.372CS..Hα-helixtrans-63.3-41.4177.1-69.3177.9-1500112.1D17 M27 C28 N33 D34 F35D17-Q31 VanDerWaalsContact C-NE2 3.34Å; D17-Q31 PolarHBondContact O-NE2 3.35Å; M27-Q31 WeakPolarHBondContact O-CG 3.5Å; M27-Q31 PolarHBondContact O-N 3.05Å; C28-Q31 PolarHBondContact O-N 3.43Å; Q31-N33 PolarHBondContact O-N 2.98Å; Q31-D34 PolarHBondContact O-N 3.43Å; Q31-F35 WeakPolarHBondContact O-CD2 3.37Å; Q31-F35 PolarHBondContact O-N 3.11Å
32A84.8Confident78.4Confident3 Ų367 Ų673%0.02535%0.354CS..Hα-helixtrans-58.8-39.3174.900000111.5C28 D29 Q30 A36 K58 C61C28-A32 VanDerWaalsContact O-CB 3.26Å; C28-A32 WeakPolarHBondContact O-CB 3.48Å; C28-A32 PolarHBondContact O-N 2.87Å; D29-A32 PolarHBondContact O-N 3.4Å; Q30-A32 PolarHBondContact O-N 3.44Å; A32-A36 WeakPolarHBondContact O-CB 3.42Å; A32-A36 PolarHBondContact O-N 3.5Å; A32-K58 HydrophobicContact CB-CG 4.03Å; A32-C61 HydrophobicContact CB-CB 3.85Å
33N88.6Confident79.9Confident96 Ų9663.2 Ų63.251%0.51334%0.337SS..Hα-helixtrans-68.1-39.7174.9-72.5-33.6000112.5D29 Q30 Q31 A36 C37D29-N33 VanDerWaalsContact O-CG 3.29Å; D29-N33 PolarHBondContact O-N 3.18Å; D29-N33 PolarHBondContact O-ND2 3.18Å; D29-N33 VanDerWaalsContact O-ND2 3.14Å; Q30-N33 WeakPolarHBondContact O-CB 3.35Å; Q30-N33 PolarHBondContact O-N 3.44Å; Q30-N33 VanDerWaalsContact O-N 3.15Å; Q31-N33 PolarHBondContact O-N 2.98Å; N33-A36 WeakPolarHBondContact O-CB 3.35Å; N33-A36 PolarHBondContact O-N 3.45Å; N33-C37 WeakPolarHBondContact O-CB 3.25Å; N33-C37 PolarHBondContact O-N 3.46Å; N33-C37 PolarHBondContact O-SG 3.28Å
34D89.2Confident81.5Confident82 Ų8262 Ų6244%0.43933%0.334SS..Hα-helixtrans-61.4-47.5175.3-67.6-23.7000111.4L14 Q30 Q31 A36 C37 V38L14-D34 HydrophobicContact CD2-CB 3.94Å; Q30-D34 PolarHBondContact O-N 3.28Å; Q31-D34 PolarHBondContact O-N 3.43Å; D34-A36 VanDerWaalsContact C-N 3.31Å; D34-A36 PolarHBondContact O-N 3.44Å; D34-C37 PolarHBondContact O-N 2.92Å; D34-V38 WeakPolarHBondContact O-CG2 3.45Å; D34-V38 PolarHBondContact O-N 3.3Å; D34-V38 VanDerWaalsContact O-N 3.13Å
35F90.2Very high82.9Confident3 Ų359.3 Ų59.31%0.01332%0.322CS..Hα-helixtrans-58.3-43172.7-80.8-70.3000111.7Y11 L14 V18 Q31 V38 A39 F54 K58Y11-F35 HydrophobicContact CD2-CE1 4.14Å; Y11-F35 HydrophobicContact CE2-CE1 4.1Å; L14-F35 HydrophobicContact CB-CE1 3.72Å; L14-F35 HydrophobicContact CB-CE2 3.92Å; L14-F35 HydrophobicContact CB-CZ 3.36Å; L14-F35 HydrophobicContact CD1-CD1 3.96Å; L14-F35 HydrophobicContact CD1-CE1 3.88Å; L14-F35 HydrophobicContact CD1-CG 4.41Å; L14-F35 HydrophobicContact CD1-CZ 4.27Å; L14-F35 HydrophobicContact CG-CE1 4.46Å; L14-F35 HydrophobicContact CG-CZ 4.41Å; V18-F35 HydrophobicContact CG2-CE2 3.69Å; V18-F35 HydrophobicContact CG2-CZ 4.29Å; Q31-F35 WeakPolarHBondContact O-CD2 3.37Å; Q31-F35 PolarHBondContact O-N 3.11Å; F35-V38 PolarHBondContact O-N 3.01Å; F35-A39 VanDerWaalsContact O-CB 3.31Å; F35-A39 WeakPolarHBondContact O-CB 3.38Å; F35-A39 PolarHBondContact O-N 2.76Å; F35-F54 HydrophobicContact CD1-CB 4.44Å; F35-F54 AromaticContact CD1-CD1 3.78Å; F35-F54 HydrophobicContact CD1-CD1 3.78Å; F35-F54 WeakPolarHBondContact CD1-O 3.38Å; F35-F54 HydrophobicContact CE1-CD1 4.3Å; F35-K58 HydrophobicContact CB-CB 3.96Å
36A90.9Very high84.5Confident13 Ų1358.9 Ų58.911%0.10732%0.317CS..Hα-helixtrans-64.6-40.6179.400000112.7A32 N33 D34 A39 K40 K58A32-A36 WeakPolarHBondContact O-CB 3.42Å; A32-A36 PolarHBondContact O-N 3.5Å; N33-A36 WeakPolarHBondContact O-CB 3.35Å; N33-A36 PolarHBondContact O-N 3.45Å; D34-A36 VanDerWaalsContact C-N 3.31Å; D34-A36 PolarHBondContact O-N 3.44Å; A36-A39 PolarHBondContact O-N 3.29Å; A36-K40 WeakPolarHBondContact O-CB 3.16Å; A36-K40 WeakPolarHBondContact O-CG 3.37Å; A36-K40 PolarHBondContact O-N 2.98Å; A36-K58 HydrophobicContact CB-CD 4.11Å
37C90.5Very high86.1Confident85 Ų8554 Ų5457%0.57429%0.293SS*.Hα-helixtrans-63.3-46.6178.3-75.60000111.2N33 D34 K40 S41N33-C37 WeakPolarHBondContact O-CB 3.25Å; N33-C37 PolarHBondContact O-N 3.46Å; N33-C37 PolarHBondContact O-SG 3.28Å; D34-C37 PolarHBondContact O-N 2.92Å; C37-K40 PolarHBondContact O-N 3.45Å; C37-S41 PolarHBondContact O-N 2.98Å
38V90.3Very high87.7Confident29 Ų2953 Ų5318%0.17629%0.288CS..Hα-helixtrans-67.8-39177.4-1780000111.4Y7 D34 F35 K40 S41 L42 F54Y7-V38 HydrophobicContact CD1-CG1 4.38Å; Y7-V38 HydrophobicContact CE1-CG1 4.42Å; D34-V38 WeakPolarHBondContact O-CG2 3.45Å; D34-V38 PolarHBondContact O-N 3.3Å; D34-V38 VanDerWaalsContact O-N 3.13Å; F35-V38 PolarHBondContact O-N 3.01Å; V38-K40 VanDerWaalsContact C-N 3.33Å; V38-K40 PolarHBondContact O-N 3.38Å; V38-S41 PolarHBondContact O-N 3.37Å; V38-S41 PolarHBondContact O-OG 3.45Å; V38-L42 HydrophobicContact CG1-CD1 3.89Å; V38-L42 HydrophobicContact CG1-CG 4.34Å; V38-L42 WeakPolarHBondContact O-CB 3.45Å; V38-L42 VanDerWaalsContact O-CG 3.32Å; V38-L42 WeakPolarHBondContact O-CG 3.42Å; V38-L42 PolarHBondContact O-N 2.91Å; V38-F54 HydrophobicContact CB-CD1 3.75Å; V38-F54 HydrophobicContact CB-CE1 3.92Å; V38-F54 HydrophobicContact CB-CG 4.33Å; V38-F54 HydrophobicContact CG1-CD1 3.59Å; V38-F54 HydrophobicContact CG1-CD2 4.14Å; V38-F54 HydrophobicContact CG1-CE1 3.42Å; V38-F54 VanDerWaalsContact CG1-CE1 3.42Å; V38-F54 HydrophobicContact CG1-CE2 3.99Å; V38-F54 HydrophobicContact CG1-CG 3.98Å; V38-F54 HydrophobicContact CG1-CZ 3.63Å; V38-F54 HydrophobicContact CG2-CE1 4.4Å
39A91.2Very high88.9Confident2 Ų257.8 Ų57.82%0.01731%0.309CS..Hα-helixtrans-60.8-42.4175.200000112F35 A36 L42 A43 A51 F54 L55F35-A39 VanDerWaalsContact O-CB 3.31Å; F35-A39 WeakPolarHBondContact O-CB 3.38Å; F35-A39 PolarHBondContact O-N 2.76Å; A36-A39 PolarHBondContact O-N 3.29Å; A39-L42 PolarHBondContact O-N 2.83Å; A39-A43 WeakPolarHBondContact O-CB 3.47Å; A39-A43 PolarHBondContact O-N 3.21Å; A39-A51 WeakPolarHBondContact O-CB 3.42Å; A39-F54 HydrophobicContact CB-CB 3.91Å; A39-L55 HydrophobicContact CB-CD2 3.84Å; A39-L55 HydrophobicContact CB-CG 3.88Å
40K92.8Very high89.6Confident145 Ų14556.2 Ų56.263%0.6330%0.301SS*.Hα-helixtrans-64.6-43.6177-76.1176.2-179.9179.90112.2A36 C37 V38 L42 A43 V44A36-K40 WeakPolarHBondContact O-CB 3.16Å; A36-K40 WeakPolarHBondContact O-CG 3.37Å; A36-K40 PolarHBondContact O-N 2.98Å; C37-K40 PolarHBondContact O-N 3.45Å; V38-K40 VanDerWaalsContact C-N 3.33Å; V38-K40 PolarHBondContact O-N 3.38Å; K40-L42 VanDerWaalsContact C-N 3.34Å; K40-L42 PolarHBondContact O-N 3.37Å; K40-A43 PolarHBondContact O-N 3.25Å; K40-V44 WeakPolarHBondContact O-CG2 3.46Å; K40-V44 PolarHBondContact O-N 3.09Å; K40-V44 VanDerWaalsContact O-N 3.07Å
41S91.9Very high90.3Very high50 Ų5050.6 Ų50.635%0.3528%0.275SS..Hα-helixtrans-64.3-40.8177.9650000111.7C37 V38 V44 Q45C37-S41 PolarHBondContact O-N 2.98Å; V38-S41 PolarHBondContact O-N 3.37Å; V38-S41 PolarHBondContact O-OG 3.45Å; S41-V44 PolarHBondContact O-N 2.87Å; S41-Q45 WeakPolarHBondContact O-CG 3.37Å; S41-Q45 PolarHBondContact O-N 2.92Å; S41-Q45 VanDerWaalsContact O-N 3.15Å
42L90.6Very high90.9Very high0 Ų049.9 Ų49.90%027%0.271CS..Hα-helixtrans-65.1-37.8175.3-74.2170.3000112.9Y7 V38 A39 K40 Q45 E46 C47 L50 A51 F54Y7-L42 HydrophobicContact CD1-CD1 4.25Å; Y7-L42 HydrophobicContact CD1-CD2 3.92Å; Y7-L42 HydrophobicContact CD1-CG 4.38Å; Y7-L42 HydrophobicContact CD2-CD2 4.45Å; Y7-L42 HydrophobicContact CE1-CD1 4.36Å; Y7-L42 HydrophobicContact CE1-CD2 3.51Å; Y7-L42 HydrophobicContact CE1-CG 4.01Å; Y7-L42 HydrophobicContact CE2-CD2 4.09Å; Y7-L42 HydrophobicContact CG-CD2 4.37Å; V38-L42 HydrophobicContact CG1-CD1 3.89Å; V38-L42 HydrophobicContact CG1-CG 4.34Å; V38-L42 WeakPolarHBondContact O-CB 3.45Å; V38-L42 VanDerWaalsContact O-CG 3.32Å; V38-L42 WeakPolarHBondContact O-CG 3.42Å; V38-L42 PolarHBondContact O-N 2.91Å; A39-L42 PolarHBondContact O-N 2.83Å; K40-L42 VanDerWaalsContact C-N 3.34Å; K40-L42 PolarHBondContact O-N 3.37Å; L42-Q45 CarbonylContact O-C 3.45Å; L42-Q45 PolarHBondContact O-N 2.63Å; L42-E46 PolarHBondContact O-N 3.35Å; L42-C47 HydrophobicContact CD2-CB 4.21Å; L42-C47 PolarHBondContact O-N 3.25Å; L42-L50 HydrophobicContact CD1-CB 3.93Å; L42-L50 HydrophobicContact CD2-CB 4.36Å; L42-L50 HydrophobicContact CD2-CD1 4.48Å; L42-A51 HydrophobicContact CB-CB 3.88Å; L42-F54 HydrophobicContact CD1-CD2 3.4Å; L42-F54 HydrophobicContact CD1-CE2 3.58Å; L42-F54 HydrophobicContact CD1-CG 4.24Å
43A90.9Very high91.3Very high19 Ų1951.9 Ų51.916%0.15728%0.283CS..Hα-helixtrans-64.8-40.3175.700000111.7A39 K40 Q45 E46 A51 Y81A39-A43 WeakPolarHBondContact O-CB 3.47Å; A39-A43 PolarHBondContact O-N 3.21Å; K40-A43 PolarHBondContact O-N 3.25Å; A43-Q45 PolarHBondContact O-N 3.22Å; A43-E46 WeakPolarHBondContact O-CA 3.38Å; A43-E46 PolarHBondContact O-N 2.71Å; A43-A51 HydrophobicContact CB-CB 4.22Å; A43-Y81 HydrophobicContact CB-CE1 4.17Å; A43-Y81 HydrophobicContact CB-CE2 4.19Å
44V91.8Very high91.5Very high126 Ų12647.5 Ų47.576%0.76426%0.26SS*.Hα-helixtrans-63.2-32.3174173.50000111.6K40 S41 E46K40-V44 WeakPolarHBondContact O-CG2 3.46Å; K40-V44 PolarHBondContact O-N 3.09Å; K40-V44 VanDerWaalsContact O-N 3.07Å; S41-V44 PolarHBondContact O-N 2.87Å; V44-E46 PolarHBondContact O-N 2.9Å
45Q90.1Very high91.8Very high57 Ų5744.3 Ų44.327%0.26624%0.242SC..THydrogen-bonded Turntrans-81.811.8173.9-63.6-176.111.500113.6D2 S41 L42 A43 C47D2-Q45 PolarHBondContact OD2-NE2 2.82Å; S41-Q45 WeakPolarHBondContact O-CG 3.37Å; S41-Q45 PolarHBondContact O-N 2.92Å; S41-Q45 VanDerWaalsContact O-N 3.15Å; L42-Q45 CarbonylContact O-C 3.45Å; L42-Q45 PolarHBondContact O-N 2.63Å; A43-Q45 PolarHBondContact O-N 3.22Å; Q45-C47 PolarHBondContact O-N 3.09Å; Q45-C47 VanDerWaalsContact O-N 3.08Å; Q45-C47 PolarHBondContact O-SG 3.49Å; Q45-C47 VanDerWaalsContact O-SG 3.33Å
46E88.7Confident92Very high117 Ų11746.4 Ų46.455%0.54725%0.253SS..THydrogen-bonded Turntrans53.823-175.6-55.1-171.5168.800115.4L42 A43 V44 H48 K88L42-E46 PolarHBondContact O-N 3.35Å; A43-E46 WeakPolarHBondContact O-CA 3.38Å; A43-E46 PolarHBondContact O-N 2.71Å; V44-E46 PolarHBondContact O-N 2.9Å; E46-H48 VanDerWaalsContact C-N 3.27Å; E46-H48 PolarHBondContact O-N 2.87Å; E46-H48 PolarHBondContact O-ND1 3.09Å; E46-K88 IonicContact OE2-NZ 2.87Å; E46-K88 PolarHBondContact OE2-NZ 3.18Å
47C90.3Very high92Very high27 Ų2745.9 Ų45.918%0.18225%0.25CC..  trans-91.960.8177.5-650000109.7M1 L42 Q45 E49 L50 A51M1-C47 VanDerWaalsContact CG-SG 3.55Å; L42-C47 HydrophobicContact CD2-CB 4.21Å; L42-C47 PolarHBondContact O-N 3.25Å; Q45-C47 PolarHBondContact O-N 3.09Å; Q45-C47 VanDerWaalsContact O-N 3.08Å; Q45-C47 PolarHBondContact O-SG 3.49Å; Q45-C47 VanDerWaalsContact O-SG 3.33Å; C47-E49 PolarHBondContact O-N 3.41Å; C47-L50 PolarHBondContact O-N 3.09Å; C47-A51 PolarHBondContact O-N 3.46Å
48H93.2Very high92.1Very high33 Ų3344 Ų4415%0.15323%0.231CC..Hα-helixtrans-59.7-40-169.1-60.194.4000113.7E46 L50 A51 A52 Y81 Q84 A85E46-H48 VanDerWaalsContact C-N 3.27Å; E46-H48 PolarHBondContact O-N 2.87Å; E46-H48 PolarHBondContact O-ND1 3.09Å; H48-L50 PolarHBondContact O-N 3.25Å; H48-A51 WeakPolarHBondContact O-CB 3.46Å; H48-A51 PolarHBondContact O-N 3.31Å; H48-A52 WeakPolarHBondContact O-CB 3.36Å; H48-A52 PolarHBondContact O-N 2.96Å; H48-Y81 WeakPolarHBondContact CB-O 3.48Å; H48-Y81 AromaticContact CD2-CD1 3.99Å; H48-Q84 HydrophobicContact CB-CB 4.34Å; H48-Q84 PolarHBondContact CD2-OE1 3.45Å; H48-A85 HydrophobicContact CB-CB 4.01Å
49E92.6Very high92.2Very high103 Ų10342.8 Ų42.848%0.48123%0.225SC..Hα-helixtrans-58.5-49.7177.5179-178.9165.100111.5C47 A52 V53 A85 N100C47-E49 PolarHBondContact O-N 3.41Å; E49-A52 WeakPolarHBondContact O-CB 3.45Å; E49-A52 PolarHBondContact O-N 3.45Å; E49-V53 WeakPolarHBondContact O-CG2 3.46Å; E49-V53 PolarHBondContact O-N 2.95Å; E49-V53 VanDerWaalsContact O-N 3.12Å; E49-A85 HydrophobicContact CB-CB 3.98Å; E49-N100 WeakPolarHBondContact CG-OD1 3.38Å
50L92.2Very high92.2Very high57 Ų5749.1 Ų49.130%0.29825%0.248SC..Hα-helixtrans-65-42.4177-68.4175.5000111.1M1 L42 C47 H48 A52 V53 F54M1-L50 HydrophobicContact CE-CD1 4.26Å; M1-L50 HydrophobicContact SD-CD1 3.76Å; L42-L50 HydrophobicContact CD1-CB 3.93Å; L42-L50 HydrophobicContact CD2-CB 4.36Å; L42-L50 HydrophobicContact CD2-CD1 4.48Å; C47-L50 PolarHBondContact O-N 3.09Å; H48-L50 PolarHBondContact O-N 3.25Å; L50-A52 VanDerWaalsContact C-N 3.27Å; L50-A52 PolarHBondContact O-N 3.29Å; L50-V53 WeakPolarHBondContact O-CB 3.17Å; L50-V53 PolarHBondContact O-N 2.94Å; L50-V53 VanDerWaalsContact O-N 3.11Å; L50-F54 WeakPolarHBondContact O-CD2 3.47Å; L50-F54 PolarHBondContact O-N 3.33Å; L50-F54 VanDerWaalsContact O-N 3.07Å
51A93.7Very high92Very high0 Ų042.3 Ų42.30%022%0.219CC..Hα-helixtrans-56.5-42.5176.200000111.7A39 L42 A43 C47 H48 F54 L55 Y81A39-A51 WeakPolarHBondContact O-CB 3.42Å; L42-A51 HydrophobicContact CB-CB 3.88Å; A43-A51 HydrophobicContact CB-CB 4.22Å; C47-A51 PolarHBondContact O-N 3.46Å; H48-A51 WeakPolarHBondContact O-CB 3.46Å; H48-A51 PolarHBondContact O-N 3.31Å; A51-F54 PolarHBondContact O-N 2.9Å; A51-L55 PolarHBondContact O-N 2.98Å; A51-Y81 HydrophobicContact CB-CD2 3.85Å; A51-Y81 HydrophobicContact CB-CE2 4.12Å; A51-Y81 HydrophobicContact CB-CG 4.48Å
52A94.8Very high92Very high0 Ų040.8 Ų40.80%021%0.206CC..Hα-helixtrans-61.5-43.2175.800000111.9H48 E49 L50 F54 L55 L56 F82H48-A52 WeakPolarHBondContact O-CB 3.36Å; H48-A52 PolarHBondContact O-N 2.96Å; E49-A52 WeakPolarHBondContact O-CB 3.45Å; E49-A52 PolarHBondContact O-N 3.45Å; L50-A52 VanDerWaalsContact C-N 3.27Å; L50-A52 PolarHBondContact O-N 3.29Å; A52-F54 VanDerWaalsContact C-N 3.34Å; A52-F54 PolarHBondContact O-N 3.46Å; A52-L55 WeakPolarHBondContact O-CB 3.29Å; A52-L55 PolarHBondContact O-N 3.41Å; A52-L55 VanDerWaalsContact O-N 3.1Å; A52-L56 WeakPolarHBondContact O-CG 3.38Å; A52-L56 PolarHBondContact O-N 2.91Å; A52-F82 HydrophobicContact CB-CD1 3.7Å; A52-F82 HydrophobicContact CB-CD2 3.68Å; A52-F82 HydrophobicContact CB-CE1 3.59Å; A52-F82 HydrophobicContact CB-CE2 3.57Å; A52-F82 HydrophobicContact CB-CG 3.73Å; A52-F82 HydrophobicContact CB-CZ 3.52Å
53V93.4Very high91.9Very high46 Ų4646.8 Ų46.828%0.27923%0.233SC..Hα-helixtrans-61.1-39.9176.9173.60000112.2Y11 E49 L50 L56 G57 F82Y11-V53 HydrophobicContact CD2-CG1 4.12Å; Y11-V53 HydrophobicContact CE2-CG1 3.69Å; E49-V53 WeakPolarHBondContact O-CG2 3.46Å; E49-V53 PolarHBondContact O-N 2.95Å; E49-V53 VanDerWaalsContact O-N 3.12Å; L50-V53 WeakPolarHBondContact O-CB 3.17Å; L50-V53 PolarHBondContact O-N 2.94Å; L50-V53 VanDerWaalsContact O-N 3.11Å; V53-L56 WeakPolarHBondContact O-CB 3.28Å; V53-L56 PolarHBondContact O-N 3.39Å; V53-G57 PolarHBondContact O-N 3.48Å; V53-F82 HydrophobicContact CG2-CE1 4.41Å; V53-F82 HydrophobicContact CG2-CZ 4.3Å
54F92.6Very high91.8Very high4 Ų447.1 Ų47.12%0.01824%0.235CC..Hα-helixtrans-67-36.6173.9-82.8-94000111.9Y7 I10 Y11 L14 F35 V38 A39 L42 L50 A51 A52 L56 G57 K58Y7-F54 HydrophobicContact CD1-CE2 4.49Å; Y7-F54 HydrophobicContact CD1-CZ 4.47Å; I10-F54 HydrophobicContact CG2-CE1 4.17Å; I10-F54 HydrophobicContact CG2-CZ 4.38Å; Y11-F54 HydrophobicContact CD2-CD1 4.32Å; Y11-F54 HydrophobicContact CD2-CE1 4.2Å; Y11-F54 HydrophobicContact CD2-CE2 4.44Å; Y11-F54 HydrophobicContact CD2-CG 4.47Å; Y11-F54 HydrophobicContact CD2-CZ 4.27Å; L14-F54 HydrophobicContact CD1-CD1 4.35Å; L14-F54 HydrophobicContact CD1-CE1 3.99Å; F35-F54 HydrophobicContact CD1-CB 4.44Å; F35-F54 AromaticContact CD1-CD1 3.78Å; F35-F54 HydrophobicContact CD1-CD1 3.78Å; F35-F54 WeakPolarHBondContact CD1-O 3.38Å; F35-F54 HydrophobicContact CE1-CD1 4.3Å; V38-F54 HydrophobicContact CB-CD1 3.75Å; V38-F54 HydrophobicContact CB-CE1 3.92Å; V38-F54 HydrophobicContact CB-CG 4.33Å; V38-F54 HydrophobicContact CG1-CD1 3.59Å; V38-F54 HydrophobicContact CG1-CD2 4.14Å; V38-F54 HydrophobicContact CG1-CE1 3.42Å; V38-F54 VanDerWaalsContact CG1-CE1 3.42Å; V38-F54 HydrophobicContact CG1-CE2 3.99Å; V38-F54 HydrophobicContact CG1-CG 3.98Å; V38-F54 HydrophobicContact CG1-CZ 3.63Å; V38-F54 HydrophobicContact CG2-CE1 4.4Å; A39-F54 HydrophobicContact CB-CB 3.91Å; L42-F54 HydrophobicContact CD1-CD2 3.4Å; L42-F54 HydrophobicContact CD1-CE2 3.58Å; L42-F54 HydrophobicContact CD1-CG 4.24Å; L50-F54 WeakPolarHBondContact O-CD2 3.47Å; L50-F54 PolarHBondContact O-N 3.33Å; L50-F54 VanDerWaalsContact O-N 3.07Å; A51-F54 PolarHBondContact O-N 2.9Å; A52-F54 VanDerWaalsContact C-N 3.34Å; A52-F54 PolarHBondContact O-N 3.46Å; F54-L56 VanDerWaalsContact C-N 3.32Å; F54-L56 PolarHBondContact O-N 3.04Å; F54-G57 WeakPolarHBondContact O-CA 3.16Å; F54-G57 PolarHBondContact O-N 2.99Å; F54-K58 PolarHBondContact O-N 3.18Å
55L94.8Very high91.6Very high15 Ų1542.5 Ų42.58%0.07921%0.21CC..Hα-helixtrans-64.8-32.8172.6-71.5-178.8000113.1A39 A51 A52 G57 K58 A59 A78 Y81A39-L55 HydrophobicContact CB-CD2 3.84Å; A39-L55 HydrophobicContact CB-CG 3.88Å; A51-L55 PolarHBondContact O-N 2.98Å; A52-L55 WeakPolarHBondContact O-CB 3.29Å; A52-L55 PolarHBondContact O-N 3.41Å; A52-L55 VanDerWaalsContact O-N 3.1Å; L55-G57 PolarHBondContact O-N 2.95Å; L55-K58 HydrophobicContact CD2-CD 4.46Å; L55-K58 WeakPolarHBondContact O-CB 3.37Å; L55-K58 PolarHBondContact O-N 3.35Å; L55-K58 VanDerWaalsContact O-N 3.16Å; L55-A59 PolarHBondContact O-N 2.99Å; L55-A78 HydrophobicContact CB-CB 3.79Å; L55-A78 HydrophobicContact CD1-CB 4.29Å; L55-Y81 HydrophobicContact CD1-CD2 3.45Å; L55-Y81 VanDerWaalsContact CD1-CD2 3.45Å; L55-Y81 HydrophobicContact CD1-CE2 3.53Å; L55-Y81 HydrophobicContact CG-CD2 4.41Å; L55-Y81 HydrophobicContact CG-CE2 4.42Å
56L94.4Very high91.5Very high46 Ų4648.6 Ų48.624%0.24124%0.236CC..Hα-helixtrans-62.7-34.7170-63.3-179.2000111.8A52 V53 F54 A59 R60 L75 A78 F82A52-L56 WeakPolarHBondContact O-CG 3.38Å; A52-L56 PolarHBondContact O-N 2.91Å; V53-L56 WeakPolarHBondContact O-CB 3.28Å; V53-L56 PolarHBondContact O-N 3.39Å; F54-L56 VanDerWaalsContact C-N 3.32Å; F54-L56 PolarHBondContact O-N 3.04Å; L56-A59 PolarHBondContact O-N 3.38Å; L56-R60 WeakPolarHBondContact O-CG 3.43Å; L56-R60 PolarHBondContact O-N 3.18Å; L56-L75 HydrophobicContact CD2-CD2 3.87Å; L56-A78 HydrophobicContact CD2-CB 4.08Å; L56-F82 HydrophobicContact CD1-CE2 4.03Å; L56-F82 HydrophobicContact CD1-CZ 3.97Å; L56-F82 HydrophobicContact CG-CE2 4.33Å
57G90.6Very high91.5Very high3 Ų346.3 Ų46.33%0.03123%0.227CC..Hα-helixtrans-60.8-47.3170.400000111.7V53 F54 L55 A59 R60 C61V53-G57 PolarHBondContact O-N 3.48Å; F54-G57 WeakPolarHBondContact O-CA 3.16Å; F54-G57 PolarHBondContact O-N 2.99Å; L55-G57 PolarHBondContact O-N 2.95Å; G57-A59 PolarHBondContact O-N 3.49Å; G57-R60 WeakPolarHBondContact O-CB 3.33Å; G57-R60 PolarHBondContact O-N 2.94Å; G57-C61 PolarHBondContact O-N 2.98Å
58K92.5Very high91.6Very high44 Ų4447.3 Ų47.319%0.19123%0.232CC..Hα-helixtrans-57.6-48174.2-173.4-174.6178.1-1690112.1A32 F35 A36 F54 L55 R60 C61 E62 T74A32-K58 HydrophobicContact CB-CG 4.03Å; F35-K58 HydrophobicContact CB-CB 3.96Å; A36-K58 HydrophobicContact CB-CD 4.11Å; F54-K58 PolarHBondContact O-N 3.18Å; L55-K58 HydrophobicContact CD2-CD 4.46Å; L55-K58 WeakPolarHBondContact O-CB 3.37Å; L55-K58 PolarHBondContact O-N 3.35Å; L55-K58 VanDerWaalsContact O-N 3.16Å; K58-R60 PolarHBondContact O-N 3.45Å; K58-C61 WeakPolarHBondContact O-CA 3.35Å; K58-C61 WeakPolarHBondContact O-CB 3.47Å; K58-C61 PolarHBondContact O-N 3.39Å; K58-E62 WeakPolarHBondContact CE-OE1 3.25Å; K58-E62 HydrophobicContact CG-CG 4.44Å; K58-E62 IonicContact NZ-OE1 3.93Å; K58-E62 WeakPolarHBondContact O-CG 3.15Å; K58-E62 PolarHBondContact O-N 3.26Å; K58-T74 HydrophobicContact CD-CG2 3.56Å; K58-T74 HydrophobicContact CG-CG2 4.13Å
59A92.8Very high91.5Very high4 Ų449.7 Ų49.73%0.03325%0.249CC..Hα-helixtrans-58.4-33.8179.600000112.4L55 L56 G57 E62 F63 E71 L75L55-A59 PolarHBondContact O-N 2.99Å; L56-A59 PolarHBondContact O-N 3.38Å; G57-A59 PolarHBondContact O-N 3.49Å; A59-E62 PolarHBondContact O-N 3.31Å; A59-F63 WeakPolarHBondContact O-CB 3.5Å; A59-F63 PolarHBondContact O-N 3.44Å; A59-E71 HydrophobicContact CB-CG 4.47Å; A59-L75 HydrophobicContact CB-CD2 3.74Å; A59-L75 HydrophobicContact CB-CG 3.84Å
60R91.1Very high91.6Very high136 Ų13645.7 Ų45.751%0.51323%0.233SC..Hα-helixtrans-67-36.7173.6-70.9173.4176.8173.81.7112.8L56 G57 K58 A64L56-R60 WeakPolarHBondContact O-CG 3.43Å; L56-R60 PolarHBondContact O-N 3.18Å; G57-R60 WeakPolarHBondContact O-CB 3.33Å; G57-R60 PolarHBondContact O-N 2.94Å; K58-R60 PolarHBondContact O-N 3.45Å; R60-A64 PolarHBondContact O-N 2.77Å
61C89.8Confident91.7Very high2 Ų243.4 Ų43.41%0.01422%0.221CC..Hα-helixtrans-65.9-43.6173.9-59.40000111.2A32 G57 K58 F63 A64 A65A32-C61 HydrophobicContact CB-CB 3.85Å; G57-C61 PolarHBondContact O-N 2.98Å; K58-C61 WeakPolarHBondContact O-CA 3.35Å; K58-C61 WeakPolarHBondContact O-CB 3.47Å; K58-C61 PolarHBondContact O-N 3.39Å; C61-F63 PolarHBondContact O-N 3.14Å; C61-A64 WeakPolarHBondContact O-CB 3.43Å; C61-A64 PolarHBondContact O-N 3.18Å; C61-A65 WeakPolarHBondContact O-CB 3.31Å; C61-A65 PolarHBondContact O-N 3.36Å
62E90.6Very high91.8Very high18 Ų1843.4 Ų43.48%0.08422%0.221CC..Hα-helixtrans-63.5-41177.6-61.4-75.4-172.700111.6K58 A59 A64 A65 K66 N67 S70 E71 T74K58-E62 WeakPolarHBondContact CE-OE1 3.25Å; K58-E62 HydrophobicContact CG-CG 4.44Å; K58-E62 IonicContact NZ-OE1 3.93Å; K58-E62 WeakPolarHBondContact O-CG 3.15Å; K58-E62 PolarHBondContact O-N 3.26Å; A59-E62 PolarHBondContact O-N 3.31Å; E62-A64 PolarHBondContact O-N 2.95Å; E62-A65 CarbonylContact O-C 3.5Å; E62-A65 PolarHBondContact O-N 2.85Å; E62-K66 PolarHBondContact O-N 3.33Å; E62-K66 VanDerWaalsContact O-N 3.08Å; E62-N67 PolarHBondContact O-N 3.05Å; E62-N67 WeakPolarHBondContact OE2-CB 3.29Å; E62-N67 PolarHBondContact OE2-ND2 3.48Å; E62-S70 VanDerWaalsContact CD-CB 3.45Å; E62-S70 VanDerWaalsContact OE2-CB 3.26Å; E62-S70 WeakPolarHBondContact OE2-CB 3.23Å; E62-S70 PolarHBondContact OE2-OG 3.05Å; E62-E71 HydrophobicContact CB-CB 4.02Å; E62-T74 HydrophobicContact CG-CG2 4.48Å
63F89.7Confident91.8Very high126 Ų12646.4 Ų46.455%0.55324%0.242SC*.Hα-helixtrans-58.6-45.6171.7175.3-99.5000111.7A59 C61 A65 K66 E71A59-F63 WeakPolarHBondContact O-CB 3.5Å; A59-F63 PolarHBondContact O-N 3.44Å; C61-F63 PolarHBondContact O-N 3.14Å; F63-A65 VanDerWaalsContact C-N 3.34Å; F63-A65 PolarHBondContact O-N 2.91Å; F63-K66 PolarHBondContact O-N 3.47Å; F63-E71 HydrophobicContact CB-CG 4.47Å; F63-E71 WeakPolarHBondContact CD2-OE2 3.23Å
64A88.3Confident91.9Very high26 Ų2644.5 Ų44.522%0.21523%0.23CC..Hα-helixtrans-64.9-37.4177.900000112.3L22 R60 C61 E62 K66L22-A64 HydrophobicContact CD1-CB 3.79Å; L22-A64 HydrophobicContact CG-CB 4.29Å; R60-A64 PolarHBondContact O-N 2.77Å; C61-A64 WeakPolarHBondContact O-CB 3.43Å; C61-A64 PolarHBondContact O-N 3.18Å; E62-A64 PolarHBondContact O-N 2.95Å; A64-K66 PolarHBondContact O-N 2.99Å
65A87.6Confident92.2Very high29 Ų2944.7 Ų44.724%0.2423%0.231CC..THydrogen-bonded Turntrans-73.2-3.5173.500000113.6C28 C61 E62 F63 N67C28-A65 HydrophobicContact CB-CB 4.14Å; C61-A65 WeakPolarHBondContact O-CB 3.31Å; C61-A65 PolarHBondContact O-N 3.36Å; E62-A65 CarbonylContact O-C 3.5Å; E62-A65 PolarHBondContact O-N 2.85Å; F63-A65 VanDerWaalsContact C-N 3.34Å; F63-A65 PolarHBondContact O-N 2.91Å; A65-N67 PolarHBondContact O-N 3.39Å
66K87.5Confident92.3Very high184 Ų18445.9 Ų45.980%0.824%0.236SC*.THydrogen-bonded Turntrans57.527.9-173.8-56.2179.4179.5177.60113.3E62 F63 A64 V68E62-K66 PolarHBondContact O-N 3.33Å; E62-K66 VanDerWaalsContact O-N 3.08Å; F63-K66 PolarHBondContact O-N 3.47Å; A64-K66 PolarHBondContact O-N 2.99Å; K66-V68 PolarHBondContact O-N 2.99Å
67N89.5Confident92.4Very high69 Ų6946.2 Ų46.237%0.36924%0.24SC..  trans-91.893.2176.9-167.4-0.1000109.4E62 A65 S70 E71E62-N67 PolarHBondContact O-N 3.05Å; E62-N67 WeakPolarHBondContact OE2-CB 3.29Å; E62-N67 PolarHBondContact OE2-ND2 3.48Å; A65-N67 PolarHBondContact O-N 3.39Å; N67-S70 WeakPolarHBondContact CB-OG 3.49Å; N67-S70 WeakPolarHBondContact ND2-CB 3.44Å; N67-S70 PolarHBondContact ND2-OG 3.26Å; N67-S70 PolarHBondContact O-OG 3.41Å; N67-S70 PolarHBondContact OD1-OG 3.07Å; N67-E71 WeakPolarHBondContact O-CB 3.35Å; N67-E71 PolarHBondContact O-N 3.43Å
68V91.6Very high92.7Very high48 Ų4846 Ų4629%0.29124%0.238SC..Hα-helixtrans-77.2-36.8-164.4-1700000112.7K66 A72 I114 N118K66-V68 PolarHBondContact O-N 2.99Å; V68-A72 WeakPolarHBondContact O-CB 3.41Å; V68-A72 PolarHBondContact O-N 3.21Å; V68-I114 HydrophobicContact CG1-CG2 3.2Å; V68-N118 WeakPolarHBondContact CG1-ND2 3.08Å
69T92.5Very high92.9Very high83 Ų8344 Ų4451%0.50923%0.229SC..Hα-helixtrans-71.6-36.5179.353.50000111.7S73 L120T69-S73 WeakPolarHBondContact O-CB 3.37Å; T69-S73 PolarHBondContact O-N 2.95Å; T69-L120 HydrophobicContact CG2-CD1 4.34Å
70S93.3Very high93.1Very high20 Ų2047.8 Ų47.814%0.1425%0.245CC..Hα-helixtrans-71.8-38.8174.263.20000111.8E62 N67 A72 S73 T74E62-S70 VanDerWaalsContact CD-CB 3.45Å; E62-S70 VanDerWaalsContact OE2-CB 3.26Å; E62-S70 WeakPolarHBondContact OE2-CB 3.23Å; E62-S70 PolarHBondContact OE2-OG 3.05Å; N67-S70 WeakPolarHBondContact CB-OG 3.49Å; N67-S70 WeakPolarHBondContact ND2-CB 3.44Å; N67-S70 PolarHBondContact ND2-OG 3.26Å; N67-S70 PolarHBondContact O-OG 3.41Å; N67-S70 PolarHBondContact OD1-OG 3.07Å; S70-A72 VanDerWaalsContact C-N 3.34Å; S70-A72 PolarHBondContact O-N 3.4Å; S70-S73 PolarHBondContact O-N 2.84Å; S70-T74 WeakPolarHBondContact O-CB 3.36Å; S70-T74 WeakPolarHBondContact O-CG2 3.43Å; S70-T74 PolarHBondContact O-N 3.29Å; S70-T74 PolarHBondContact O-OG1 3.31Å
71E94.5Very high93.3Very high9 Ų944.2 Ų44.24%0.04223%0.232CC..Hα-helixtrans-56-51.6171.9-177.4-172.1175.800109.9A59 E62 F63 N67 S73 T74 L75 R110 I114A59-E71 HydrophobicContact CB-CG 4.47Å; E62-E71 HydrophobicContact CB-CB 4.02Å; F63-E71 HydrophobicContact CB-CG 4.47Å; F63-E71 WeakPolarHBondContact CD2-OE2 3.23Å; N67-E71 WeakPolarHBondContact O-CB 3.35Å; N67-E71 PolarHBondContact O-N 3.43Å; E71-S73 PolarHBondContact O-N 2.68Å; E71-T74 WeakPolarHBondContact CA-OG1 3.46Å; E71-T74 PolarHBondContact O-N 3.01Å; E71-T74 PolarHBondContact O-OG1 2.93Å; E71-L75 HydrophobicContact CG-CD1 3.94Å; E71-L75 HydrophobicContact CG-CG 4.47Å; E71-L75 WeakPolarHBondContact O-CB 3.31Å; E71-L75 WeakPolarHBondContact O-CG 3.47Å; E71-L75 PolarHBondContact O-N 3.37Å; E71-R110 IonicContact OE1-CZ 2.68Å; E71-R110 IonicContact OE1-NE 3.73Å; E71-R110 PolarHBondContact OE1-NE 3.33Å; E71-R110 IonicContact OE1-NH2 2.84Å; E71-R110 PolarHBondContact OE1-NH2 2.85Å; E71-I114 HydrophobicContact CG-CD1 3.91Å
72A95.7Very high93.6Very high0 Ų044.4 Ų44.40%023%0.233CC..Hα-helixtrans-60.7-45.3-18000000112.3V68 S70 T74 L75 F76 T111 I114 Y115V68-A72 WeakPolarHBondContact O-CB 3.41Å; V68-A72 PolarHBondContact O-N 3.21Å; S70-A72 VanDerWaalsContact C-N 3.34Å; S70-A72 PolarHBondContact O-N 3.4Å; A72-T74 PolarHBondContact O-N 3.02Å; A72-L75 PolarHBondContact O-N 3.3Å; A72-F76 WeakPolarHBondContact O-CB 3.36Å; A72-F76 PolarHBondContact O-N 3.38Å; A72-T111 HydrophobicContact CB-CG2 4.07Å; A72-T111 WeakPolarHBondContact O-CG2 3.22Å; A72-T111 PolarHBondContact O-OG1 2.83Å; A72-I114 HydrophobicContact CB-CB 4.31Å; A72-I114 HydrophobicContact CB-CG2 3.9Å; A72-Y115 HydrophobicContact CB-CD1 4.1Å; A72-Y115 HydrophobicContact CB-CE1 3.48Å; A72-Y115 VanDerWaalsContact CB-CE1 3.48Å; A72-Y115 HydrophobicContact CB-CE2 4Å; A72-Y115 VanDerWaalsContact CB-CZ 3.41Å
73S95.7Very high93.9Very high62 Ų6243.7 Ų43.743%0.43423%0.23SC..Hα-helixtrans-62.6-41.5177.3-177.30000112.5T69 S70 E71 F76 T77T69-S73 WeakPolarHBondContact O-CB 3.37Å; T69-S73 PolarHBondContact O-N 2.95Å; S70-S73 PolarHBondContact O-N 2.84Å; E71-S73 PolarHBondContact O-N 2.68Å; S73-F76 PolarHBondContact O-N 3.38Å; S73-T77 WeakPolarHBondContact O-CG2 3.36Å; S73-T77 PolarHBondContact O-N 3.46Å; S73-T77 PolarHBondContact O-OG1 2.99Å
74T95.8Very high94.1Very high7 Ų741.8 Ų41.84%0.04322%0.222CC..Hα-helixtrans-70.7-35.8178.854.10000112.9K58 E62 S70 E71 A72 T77 A78K58-T74 HydrophobicContact CD-CG2 3.56Å; K58-T74 HydrophobicContact CG-CG2 4.13Å; E62-T74 HydrophobicContact CG-CG2 4.48Å; S70-T74 WeakPolarHBondContact O-CB 3.36Å; S70-T74 WeakPolarHBondContact O-CG2 3.43Å; S70-T74 PolarHBondContact O-N 3.29Å; S70-T74 PolarHBondContact O-OG1 3.31Å; E71-T74 WeakPolarHBondContact CA-OG1 3.46Å; E71-T74 PolarHBondContact O-N 3.01Å; E71-T74 PolarHBondContact O-OG1 2.93Å; A72-T74 PolarHBondContact O-N 3.02Å; T74-T77 WeakPolarHBondContact CA-OG1 3.48Å; T74-T77 PolarHBondContact O-N 3.38Å; T74-T77 PolarHBondContact O-OG1 2.96Å; T74-A78 WeakPolarHBondContact O-CB 3.24Å; T74-A78 PolarHBondContact O-N 3.44Å
75L97.4Very high94.3Very high7 Ų741 Ų414%0.03722%0.216CC..Hα-helixtrans-66.4-38.8171-72.5170.7000111.8L56 A59 E71 A72 A78 A79 R110 T111 I114L56-L75 HydrophobicContact CD2-CD2 3.87Å; A59-L75 HydrophobicContact CB-CD2 3.74Å; A59-L75 HydrophobicContact CB-CG 3.84Å; E71-L75 HydrophobicContact CG-CD1 3.94Å; E71-L75 HydrophobicContact CG-CG 4.47Å; E71-L75 WeakPolarHBondContact O-CB 3.31Å; E71-L75 WeakPolarHBondContact O-CG 3.47Å; E71-L75 PolarHBondContact O-N 3.37Å; A72-L75 PolarHBondContact O-N 3.3Å; L75-A78 WeakPolarHBondContact O-CB 3.2Å; L75-A78 PolarHBondContact O-N 2.97Å; L75-A79 PolarHBondContact O-N 3.19Å; L75-R110 HydrophobicContact CD1-CB 4.27Å; L75-R110 HydrophobicContact CD1-CG 3.71Å; L75-T111 WeakPolarHBondContact CB-OG1 3.39Å; L75-I114 HydrophobicContact CD1-CD1 3.67Å
76F97.2Very high94.5Very high41 Ų4139.8 Ų39.818%0.1821%0.205CC..Hα-helixtrans-64.9-40.3176.8-168.7-99.5000111.9A72 S73 A79 K80 L108 T111 V127 Y130A72-F76 WeakPolarHBondContact O-CB 3.36Å; A72-F76 PolarHBondContact O-N 3.38Å; S73-F76 PolarHBondContact O-N 3.38Å; F76-A79 WeakPolarHBondContact O-CB 3.29Å; F76-A79 PolarHBondContact O-N 3.13Å; F76-K80 HydrophobicContact CD1-CD 4.46Å; F76-K80 HydrophobicContact CE1-CD 4.29Å; F76-K80 PolarHBondContact O-N 3.12Å; F76-L108 HydrophobicContact CD2-CD2 3.51Å; F76-L108 HydrophobicContact CE2-CD2 3.59Å; F76-T111 HydrophobicContact CB-CG2 4.11Å; F76-T111 HydrophobicContact CD2-CG2 4.31Å; F76-T111 PolarHBondContact N-OG1 3.33Å; F76-V127 HydrophobicContact CD2-CG1 4.24Å; F76-V127 HydrophobicContact CD2-CG2 3.91Å; F76-V127 HydrophobicContact CE2-CB 4.42Å; F76-V127 HydrophobicContact CE2-CG1 4.29Å; F76-V127 HydrophobicContact CE2-CG2 3.97Å; F76-Y130 AromaticContact CE2-CD1 3.87Å; F76-Y130 HydrophobicContact CE2-CD1 3.87Å; F76-Y130 HydrophobicContact CE2-CG 4.11Å; F76-Y130 AromaticContact CZ-CD1 3.89Å; F76-Y130 HydrophobicContact CZ-CD1 3.89Å; F76-Y130 HydrophobicContact CZ-CD2 4.28Å; F76-Y130 HydrophobicContact CZ-CE1 4.33Å; F76-Y130 AromaticContact CZ-CG 3.86Å; F76-Y130 HydrophobicContact CZ-CG 3.86Å
77T96.3Very high94.8Very high52 Ų5233.9 Ų33.932%0.31918%0.183SC..Hα-helixtrans-69.9-36.1174.6550000112.3S73 T74 A79 K80 Y81S73-T77 WeakPolarHBondContact O-CG2 3.36Å; S73-T77 PolarHBondContact O-N 3.46Å; S73-T77 PolarHBondContact O-OG1 2.99Å; T74-T77 WeakPolarHBondContact CA-OG1 3.48Å; T74-T77 PolarHBondContact O-N 3.38Å; T74-T77 PolarHBondContact O-OG1 2.96Å; T77-A79 VanDerWaalsContact C-N 3.33Å; T77-A79 PolarHBondContact O-N 2.68Å; T77-K80 WeakPolarHBondContact O-CB 3.12Å; T77-K80 PolarHBondContact O-N 3.4Å; T77-Y81 PolarHBondContact O-N 3.48Å
78A97Very high94.9Very high0 Ų034.7 Ų34.70%018%0.183CC..Hα-helixtrans-59.3-44.2171.400000111.5L55 L56 T74 L75 K80 Y81 F82L55-A78 HydrophobicContact CB-CB 3.79Å; L55-A78 HydrophobicContact CD1-CB 4.29Å; L56-A78 HydrophobicContact CD2-CB 4.08Å; T74-A78 WeakPolarHBondContact O-CB 3.24Å; T74-A78 PolarHBondContact O-N 3.44Å; L75-A78 WeakPolarHBondContact O-CB 3.2Å; L75-A78 PolarHBondContact O-N 2.97Å; A78-K80 VanDerWaalsContact C-N 3.32Å; A78-K80 PolarHBondContact O-N 2.95Å; A78-Y81 PolarHBondContact O-N 3.19Å; A78-F82 VanDerWaalsContact O-CD2 3.27Å; A78-F82 WeakPolarHBondContact O-CD2 3.34Å; A78-F82 PolarHBondContact O-N 2.9Å
79A97.3Very high94.8Very high0 Ų034.8 Ų34.80%018%0.182CC..Hα-helixtrans-58.6-41.9176.100000112.7L75 F76 T77 Y81 F82 I83 A104 C107 L108L75-A79 PolarHBondContact O-N 3.19Å; F76-A79 WeakPolarHBondContact O-CB 3.29Å; F76-A79 PolarHBondContact O-N 3.13Å; T77-A79 VanDerWaalsContact C-N 3.33Å; T77-A79 PolarHBondContact O-N 2.68Å; A79-Y81 VanDerWaalsContact C-N 3.33Å; A79-Y81 PolarHBondContact O-N 3.46Å; A79-F82 PolarHBondContact O-N 3.14Å; A79-I83 VanDerWaalsContact O-CG1 3.32Å; A79-I83 WeakPolarHBondContact O-CG1 3.12Å; A79-I83 PolarHBondContact O-N 3.3Å; A79-A104 HydrophobicContact CB-CB 4.43Å; A79-C107 HydrophobicContact CB-CB 3.8Å; A79-L108 HydrophobicContact CB-CD1 4.32Å; A79-L108 HydrophobicContact CB-CD2 3.74Å; A79-L108 HydrophobicContact CB-CG 3.62Å
80K96.4Very high94.7Very high85 Ų8534.7 Ų34.737%0.3718%0.177SC..Hα-helixtrans-59.4-42.4175.8-74.4-179.2169.6177.80112.4F76 T77 A78 I83 Q84 Y130F76-K80 HydrophobicContact CD1-CD 4.46Å; F76-K80 HydrophobicContact CE1-CD 4.29Å; F76-K80 PolarHBondContact O-N 3.12Å; T77-K80 WeakPolarHBondContact O-CB 3.12Å; T77-K80 PolarHBondContact O-N 3.4Å; A78-K80 VanDerWaalsContact C-N 3.32Å; A78-K80 PolarHBondContact O-N 2.95Å; K80-I83 PolarHBondContact O-N 3.3Å; K80-Q84 WeakPolarHBondContact O-CG 3.49Å; K80-Q84 PolarHBondContact O-N 3.36Å; K80-Y130 HydrophobicContact CG-CE1 4.5Å
81Y96.2Very high94.5Very high60 Ų6038.1 Ų38.124%0.23520%0.201CC..Hα-helixtrans-68.6-38177.1-73-24.1000112.7A43 H48 A51 L55 T77 A78 A79 I83 Q84 A85A43-Y81 HydrophobicContact CB-CE1 4.17Å; A43-Y81 HydrophobicContact CB-CE2 4.19Å; H48-Y81 WeakPolarHBondContact CB-O 3.48Å; H48-Y81 AromaticContact CD2-CD1 3.99Å; A51-Y81 HydrophobicContact CB-CD2 3.85Å; A51-Y81 HydrophobicContact CB-CE2 4.12Å; A51-Y81 HydrophobicContact CB-CG 4.48Å; L55-Y81 HydrophobicContact CD1-CD2 3.45Å; L55-Y81 VanDerWaalsContact CD1-CD2 3.45Å; L55-Y81 HydrophobicContact CD1-CE2 3.53Å; L55-Y81 HydrophobicContact CG-CD2 4.41Å; L55-Y81 HydrophobicContact CG-CE2 4.42Å; T77-Y81 PolarHBondContact O-N 3.48Å; A78-Y81 PolarHBondContact O-N 3.19Å; A79-Y81 VanDerWaalsContact C-N 3.33Å; A79-Y81 PolarHBondContact O-N 3.46Å; Y81-I83 VanDerWaalsContact C-N 3.34Å; Y81-I83 PolarHBondContact O-N 2.83Å; Y81-Q84 VanDerWaalsContact CD1-OE1 3.3Å; Y81-Q84 PolarHBondContact O-N 3.45Å; Y81-A85 WeakPolarHBondContact O-CB 3.37Å; Y81-A85 PolarHBondContact O-N 3.3Å
82F96.5Very high94.4Very high6 Ų641.4 Ų41.43%0.02622%0.222CC..Hα-helixtrans-61.2-41.9171.2-76.7-55.2000112.2A52 V53 L56 A78 A79 A85 D86 N100 C103 A104A52-F82 HydrophobicContact CB-CD1 3.7Å; A52-F82 HydrophobicContact CB-CD2 3.68Å; A52-F82 HydrophobicContact CB-CE1 3.59Å; A52-F82 HydrophobicContact CB-CE2 3.57Å; A52-F82 HydrophobicContact CB-CG 3.73Å; A52-F82 HydrophobicContact CB-CZ 3.52Å; V53-F82 HydrophobicContact CG2-CE1 4.41Å; V53-F82 HydrophobicContact CG2-CZ 4.3Å; L56-F82 HydrophobicContact CD1-CE2 4.03Å; L56-F82 HydrophobicContact CD1-CZ 3.97Å; L56-F82 HydrophobicContact CG-CE2 4.33Å; A78-F82 VanDerWaalsContact O-CD2 3.27Å; A78-F82 WeakPolarHBondContact O-CD2 3.34Å; A78-F82 PolarHBondContact O-N 2.9Å; A79-F82 PolarHBondContact O-N 3.14Å; F82-A85 WeakPolarHBondContact O-CB 3.47Å; F82-A85 PolarHBondContact O-N 3.33Å; F82-D86 WeakPolarHBondContact O-CB 3.49Å; F82-D86 PolarHBondContact O-N 3.22Å; F82-N100 WeakPolarHBondContact CB-O 3.43Å; F82-C103 HydrophobicContact CD1-CB 3.91Å; F82-C103 HydrophobicContact CD2-CB 3.9Å; F82-C103 HydrophobicContact CE1-CB 3.92Å; F82-C103 HydrophobicContact CE2-CB 3.91Å; F82-C103 HydrophobicContact CG-CB 3.92Å; F82-C103 HydrophobicContact CZ-CB 3.92Å; F82-A104 HydrophobicContact CB-CB 3.77Å
83I95.3Very high94Very high4 Ų448.8 Ų48.82%0.02126%0.261CS..Hα-helixtrans-62.8-43.1175.4-69.4161.8000111.2A79 K80 Y81 A85 D86 D87 A104 L108 Y130 T134A79-I83 VanDerWaalsContact O-CG1 3.32Å; A79-I83 WeakPolarHBondContact O-CG1 3.12Å; A79-I83 PolarHBondContact O-N 3.3Å; K80-I83 PolarHBondContact O-N 3.3Å; Y81-I83 VanDerWaalsContact C-N 3.34Å; Y81-I83 PolarHBondContact O-N 2.83Å; I83-A85 VanDerWaalsContact C-N 3.33Å; I83-A85 PolarHBondContact O-N 3.37Å; I83-D86 WeakPolarHBondContact O-CB 3.39Å; I83-D86 PolarHBondContact O-N 3.04Å; I83-D87 WeakPolarHBondContact O-CB 3.12Å; I83-D87 PolarHBondContact O-N 3.46Å; I83-A104 HydrophobicContact CD1-CB 4.23Å; I83-A104 HydrophobicContact CG1-CB 3.68Å; I83-L108 HydrophobicContact CD1-CD1 4.43Å; I83-Y130 HydrophobicContact CD1-CE1 3.71Å; I83-T134 HydrophobicContact CD1-CG2 3.7Å
84Q94.3Very high93.5Very high86 Ų8648.5 Ų48.540%0.40226%0.259SS..Hα-helixtrans-65.7-35176.9-74.2176.4-23.500112.7H48 K80 Y81 K88H48-Q84 HydrophobicContact CB-CB 4.34Å; H48-Q84 PolarHBondContact CD2-OE1 3.45Å; K80-Q84 WeakPolarHBondContact O-CG 3.49Å; K80-Q84 PolarHBondContact O-N 3.36Å; Y81-Q84 VanDerWaalsContact CD1-OE1 3.3Å; Y81-Q84 PolarHBondContact O-N 3.45Å; Q84-K88 WeakPolarHBondContact O-CB 3.43Å; Q84-K88 PolarHBondContact O-N 3.13Å
85A92.8Very high93.1Very high10 Ų1054.5 Ų54.58%0.08329%0.29CS..Hα-helixtrans-64.1-43.9172.900000111.3H48 E49 Y81 F82 I83 K88 L89 N100H48-A85 HydrophobicContact CB-CB 4.01Å; E49-A85 HydrophobicContact CB-CB 3.98Å; Y81-A85 WeakPolarHBondContact O-CB 3.37Å; Y81-A85 PolarHBondContact O-N 3.3Å; F82-A85 WeakPolarHBondContact O-CB 3.47Å; F82-A85 PolarHBondContact O-N 3.33Å; I83-A85 VanDerWaalsContact C-N 3.33Å; I83-A85 PolarHBondContact O-N 3.37Å; A85-K88 PolarHBondContact O-N 3.09Å; A85-L89 PolarHBondContact O-N 3.28Å; A85-L89 VanDerWaalsContact O-N 3.11Å; A85-N100 HydrophobicContact CB-CB 4.48Å
86D92.8Very high92.5Very high2 Ų256.5 Ų56.51%0.01130%0.3CS..Hα-helixtrans-63.5-45.8175.7-171.170.6000111.9F82 I83 K88 L89 I90 N96 N100 R138F82-D86 WeakPolarHBondContact O-CB 3.49Å; F82-D86 PolarHBondContact O-N 3.22Å; I83-D86 WeakPolarHBondContact O-CB 3.39Å; I83-D86 PolarHBondContact O-N 3.04Å; D86-K88 VanDerWaalsContact C-N 3.26Å; D86-K88 PolarHBondContact O-N 3.49Å; D86-L89 WeakPolarHBondContact O-CB 3.26Å; D86-L89 PolarHBondContact O-N 3.27Å; D86-L89 VanDerWaalsContact O-N 3.1Å; D86-I90 WeakPolarHBondContact O-CG1 3.48Å; D86-I90 PolarHBondContact O-N 2.9Å; D86-N96 PolarHBondContact OD1-ND2 2.65Å; D86-N96 PolarHBondContact OD1-OD1 2.92Å; D86-N100 HydrophobicContact CB-CB 3.94Å; D86-R138 IonicContact OD2-CZ 3.98Å; D86-R138 VanDerWaalsContact OD2-CZ 3.3Å; D86-R138 IonicContact OD2-NE 3.3Å; D86-R138 PolarHBondContact OD2-NE 2.97Å; D86-R138 IonicContact OD2-NH2 2.92Å; D86-R138 PolarHBondContact OD2-NH2 3.35Å
87D92.2Very high92.1Very high61 Ų6162.7 Ų62.733%0.32632%0.324SS..Hα-helixtrans-59-37.6175.6-69.8-19.9000111.3I83 I90 S91 R138I83-D87 WeakPolarHBondContact O-CB 3.12Å; I83-D87 PolarHBondContact O-N 3.46Å; D87-I90 PolarHBondContact O-N 3.39Å; D87-S91 WeakPolarHBondContact O-CB 3.23Å; D87-S91 PolarHBondContact O-N 3.29Å; D87-S91 PolarHBondContact O-OG 3.48Å; D87-R138 IonicContact OD1-CZ 3.62Å; D87-R138 IonicContact OD1-NH1 3.46Å; D87-R138 IonicContact OD1-NH2 2.66Å; D87-R138 PolarHBondContact OD1-NH2 3.03Å
88K91.4Very high91.7Very high85 Ų8563.8 Ų63.837%0.3733%0.325SS..Hα-helixtrans-66.2-41.4175.6-173168179.7165.80111.7E46 Q84 A85 D86 S91 T92E46-K88 IonicContact OE2-NZ 2.87Å; E46-K88 PolarHBondContact OE2-NZ 3.18Å; Q84-K88 WeakPolarHBondContact O-CB 3.43Å; Q84-K88 PolarHBondContact O-N 3.13Å; A85-K88 PolarHBondContact O-N 3.09Å; D86-K88 VanDerWaalsContact C-N 3.26Å; D86-K88 PolarHBondContact O-N 3.49Å; K88-S91 WeakPolarHBondContact CA-OG 3.07Å; K88-S91 PolarHBondContact O-N 2.98Å; K88-S91 PolarHBondContact O-OG 3.18Å; K88-T92 WeakPolarHBondContact O-CG2 3.45Å; K88-T92 PolarHBondContact O-N 3.5Å; K88-T92 VanDerWaalsContact O-N 3.12Å; K88-T92 PolarHBondContact O-OG1 2.94Å
89L90.9Very high91.5Very high51 Ų5168.6 Ų68.627%0.26735%0.351SS..Hα-helixtrans-62.5-43.3174.3-68174.2000111.6A85 D86 T92 N93 S94 N96A85-L89 PolarHBondContact O-N 3.28Å; A85-L89 VanDerWaalsContact O-N 3.11Å; D86-L89 WeakPolarHBondContact O-CB 3.26Å; D86-L89 PolarHBondContact O-N 3.27Å; D86-L89 VanDerWaalsContact O-N 3.1Å; L89-T92 PolarHBondContact O-N 3.07Å; L89-T92 PolarHBondContact O-OG1 3.3Å; L89-T92 VanDerWaalsContact O-OG1 3.04Å; L89-N93 PolarHBondContact O-N 3.49Å; L89-S94 PolarHBondContact O-N 3.12Å; L89-N96 HydrophobicContact CB-CB 4.46Å
90I89.3Confident91.3Very high80 Ų8069 Ų6941%0.4135%0.353SS..Hα-helixtrans-62.4-48.1176.5-64.7166.5000110.5D86 D87 T92 N93D86-I90 WeakPolarHBondContact O-CG1 3.48Å; D86-I90 PolarHBondContact O-N 2.9Å; D87-I90 PolarHBondContact O-N 3.39Å; I90-T92 PolarHBondContact O-N 3.36Å; I90-N93 PolarHBondContact O-N 3.15Å; I90-N93 PolarHBondContact O-OD1 2.65Å
91S90.6Very high91.2Very high92 Ų9265 Ų6564%0.64334%0.336SS*.Hα-helixtrans-62.6-27-179.271.70000114.1D87 K88 N93D87-S91 WeakPolarHBondContact O-CB 3.23Å; D87-S91 PolarHBondContact O-N 3.29Å; D87-S91 PolarHBondContact O-OG 3.48Å; K88-S91 WeakPolarHBondContact CA-OG 3.07Å; K88-S91 PolarHBondContact O-N 2.98Å; K88-S91 PolarHBondContact O-OG 3.18Å; S91-N93 VanDerWaalsContact C-N 3.35Å
92T91Very high91.1Very high79 Ų7965.5 Ų65.549%0.48534%0.343SS..THydrogen-bonded Turntrans-92.42.6179.6530000112.7K88 L89 I90 S94K88-T92 WeakPolarHBondContact O-CG2 3.45Å; K88-T92 PolarHBondContact O-N 3.5Å; K88-T92 VanDerWaalsContact O-N 3.12Å; K88-T92 PolarHBondContact O-OG1 2.94Å; L89-T92 PolarHBondContact O-N 3.07Å; L89-T92 PolarHBondContact O-OG1 3.3Å; L89-T92 VanDerWaalsContact O-OG1 3.04Å; I90-T92 PolarHBondContact O-N 3.36Å; T92-S94 PolarHBondContact O-N 3.42Å; T92-S94 VanDerWaalsContact O-N 3.13Å; T92-S94 PolarHBondContact OG1-OG 2.95Å
93N86.8Confident91.1Very high155 Ų15567.6 Ų67.683%0.82936%0.357SS*.THydrogen-bonded Turntrans48.933.1-170.8-68.4-26.9000112.5L89 I90 S91L89-N93 PolarHBondContact O-N 3.49Å; I90-N93 PolarHBondContact O-N 3.15Å; I90-N93 PolarHBondContact O-OD1 2.65Å; S91-N93 VanDerWaalsContact C-N 3.35Å
94S87.1Confident91.1Very high56 Ų5667.4 Ų67.439%0.39236%0.357SS..  trans-76.4155.4176.6-64.40000109.9L89 T92 N96L89-S94 PolarHBondContact O-N 3.12Å; T92-S94 PolarHBondContact O-N 3.42Å; T92-S94 VanDerWaalsContact O-N 3.13Å; T92-S94 PolarHBondContact OG1-OG 2.95Å; S94-N96 PolarHBondContact O-N 3.32Å; S94-N96 VanDerWaalsContact O-N 3.09Å
95I85.4Confident91.2Very high133 Ų13363.9 Ų63.968%0.68234%0.34SS*.  trans-59.3118.6172.8-59.4169.9000108.1Y97I95-Y97 HydrophobicContact CG2-CD2 4.25Å; I95-Y97 HydrophobicContact CG2-CE1 4.11Å; I95-Y97 HydrophobicContact CG2-CE2 3.64Å
96N85.9Confident91.4Very high48 Ų4869.1 Ų69.126%0.25737%0.366SS..  trans-114.3113.3179.7-171.56.6000109.9D86 L89 S94 E98D86-N96 PolarHBondContact OD1-ND2 2.65Å; D86-N96 PolarHBondContact OD1-OD1 2.92Å; L89-N96 HydrophobicContact CB-CB 4.46Å; S94-N96 PolarHBondContact O-N 3.32Å; S94-N96 VanDerWaalsContact O-N 3.09Å; N96-E98 VanDerWaalsContact C-N 3.26Å; N96-E98 WeakPolarHBondContact OD1-CA 2.93Å; N96-E98 PolarHBondContact OD1-N 3.25Å
97Y87.9Confident91.6Very high171 Ų17169.5 Ų69.567%0.67137%0.369SS*.  trans-87.84.7173.7-63-72.5000112.9I95 D99I95-Y97 HydrophobicContact CG2-CD2 4.25Å; I95-Y97 HydrophobicContact CG2-CE1 4.11Å; I95-Y97 HydrophobicContact CG2-CE2 3.64Å; Y97-D99 PolarHBondContact O-N 3.26Å
98E89.5Confident91.9Very high75 Ų7566.6 Ų66.635%0.3535%0.353SS..SBendtrans63.816.2179.6-45.3-174.2134.200114N96 N100 L101 N102 K140N96-E98 VanDerWaalsContact C-N 3.26Å; N96-E98 WeakPolarHBondContact OD1-CA 2.93Å; N96-E98 PolarHBondContact OD1-N 3.25Å; E98-N100 VanDerWaalsContact C-N 3.31Å; E98-N100 PolarHBondContact O-N 3.14Å; E98-L101 HydrophobicContact CB-CB 4.3Å; E98-L101 HydrophobicContact CB-CD2 4.49Å; E98-L101 PolarHBondContact O-N 3.36Å; E98-N102 WeakPolarHBondContact O-CB 2.97Å; E98-N102 VanDerWaalsContact O-CG 3.28Å; E98-N102 PolarHBondContact O-N 3.39Å; E98-N102 PolarHBondContact O-ND2 3.25Å; E98-N102 VanDerWaalsContact O-ND2 3.11Å; E98-K140 WeakPolarHBondContact OE1-CE 3.29Å; E98-K140 IonicContact OE1-NZ 2.92Å; E98-K140 PolarHBondContact OE1-NZ 2.98Å; E98-K140 IonicContact OE2-NZ 3.4Å; E98-K140 PolarHBondContact OE2-NZ 3.09Å
99D92.3Very high92.1Very high101 Ų10164.7 Ų64.754%0.5435%0.347SS..Hα-helixtrans-58.8-44.1178.2-68.9-37000111.6Y97 N102 C103Y97-D99 PolarHBondContact O-N 3.26Å; D99-N102 PolarHBondContact O-N 2.96Å; D99-C103 WeakPolarHBondContact O-CB 3.41Å; D99-C103 PolarHBondContact O-N 2.94Å; D99-C103 PolarHBondContact O-SG 2.67Å
100N92.8Very high92.4Very high9 Ų968 Ų685%0.04836%0.356CS..Hα-helixtrans-62-45.9176.1-78-40.3000111E49 F82 A85 D86 E98 C103 A104E49-N100 WeakPolarHBondContact CG-OD1 3.38Å; F82-N100 WeakPolarHBondContact CB-O 3.43Å; A85-N100 HydrophobicContact CB-CB 4.48Å; D86-N100 HydrophobicContact CB-CB 3.94Å; E98-N100 VanDerWaalsContact C-N 3.31Å; E98-N100 PolarHBondContact O-N 3.14Å; N100-C103 PolarHBondContact O-N 3.21Å; N100-A104 PolarHBondContact O-N 3.34Å
101L93.8Very high92.7Very high2 Ų264.2 Ų64.21%0.0134%0.337CS..Hα-helixtrans-62.4-44.9176.717960.8000112.2E98 C103 A104 I105 K140E98-L101 HydrophobicContact CB-CB 4.3Å; E98-L101 HydrophobicContact CB-CD2 4.49Å; E98-L101 PolarHBondContact O-N 3.36Å; L101-C103 VanDerWaalsContact C-N 3.32Å; L101-C103 PolarHBondContact O-N 3.38Å; L101-A104 WeakPolarHBondContact O-CB 3.09Å; L101-A104 PolarHBondContact O-N 3.32Å; L101-A104 VanDerWaalsContact O-N 3.13Å; L101-I105 HydrophobicContact CD1-CD1 4.32Å; L101-I105 HydrophobicContact CD1-CG1 4.38Å; L101-I105 HydrophobicContact CG-CD1 4.06Å; L101-I105 VanDerWaalsContact O-CG1 3.29Å; L101-I105 WeakPolarHBondContact O-CG1 3.36Å; L101-I105 PolarHBondContact O-N 2.98Å; L101-K140 HydrophobicContact CD2-CD 4.07Å
102N95.1Very high93Very high70 Ų7059.9 Ų59.937%0.37431%0.306SS..Hα-helixtrans-60.4-42.1176.4-72.1-37.6000111.3E98 D99 A104 I105 L106E98-N102 WeakPolarHBondContact O-CB 2.97Å; E98-N102 VanDerWaalsContact O-CG 3.28Å; E98-N102 PolarHBondContact O-N 3.39Å; E98-N102 PolarHBondContact O-ND2 3.25Å; E98-N102 VanDerWaalsContact O-ND2 3.11Å; D99-N102 PolarHBondContact O-N 2.96Å; N102-A104 PolarHBondContact O-N 3.45Å; N102-I105 PolarHBondContact O-N 3.21Å; N102-L106 VanDerWaalsContact O-CG 3.32Å; N102-L106 WeakPolarHBondContact O-CG 3.36Å; N102-L106 PolarHBondContact O-N 3.35Å
103C95.1Very high93.2Very high49 Ų4962.1 Ų62.133%0.33131%0.306SS..Hα-helixtrans-61.9-42.1173.5-69.40000111.9F82 D99 N100 L101 L106 C107F82-C103 HydrophobicContact CD1-CB 3.91Å; F82-C103 HydrophobicContact CD2-CB 3.9Å; F82-C103 HydrophobicContact CE1-CB 3.92Å; F82-C103 HydrophobicContact CE2-CB 3.91Å; F82-C103 HydrophobicContact CG-CB 3.92Å; F82-C103 HydrophobicContact CZ-CB 3.92Å; D99-C103 WeakPolarHBondContact O-CB 3.41Å; D99-C103 PolarHBondContact O-N 2.94Å; D99-C103 PolarHBondContact O-SG 2.67Å; N100-C103 PolarHBondContact O-N 3.21Å; L101-C103 VanDerWaalsContact C-N 3.32Å; L101-C103 PolarHBondContact O-N 3.38Å; C103-L106 PolarHBondContact O-N 3.39Å; C103-C107 PolarHBondContact O-N 2.93Å; C103-C107 PolarHBondContact O-SG 2.94Å
104A96.6Very high93.6Very high1 Ų155.5 Ų55.51%0.00827%0.27CS..Hα-helixtrans-61.6-46.5176.100000112.1A79 F82 I83 N100 L101 N102 L106 C107 L108A79-A104 HydrophobicContact CB-CB 4.43Å; F82-A104 HydrophobicContact CB-CB 3.77Å; I83-A104 HydrophobicContact CD1-CB 4.23Å; I83-A104 HydrophobicContact CG1-CB 3.68Å; N100-A104 PolarHBondContact O-N 3.34Å; L101-A104 WeakPolarHBondContact O-CB 3.09Å; L101-A104 PolarHBondContact O-N 3.32Å; L101-A104 VanDerWaalsContact O-N 3.13Å; N102-A104 PolarHBondContact O-N 3.45Å; A104-L106 PolarHBondContact O-N 3.04Å; A104-C107 WeakPolarHBondContact O-CB 3.3Å; A104-C107 PolarHBondContact O-N 2.9Å; A104-L108 WeakPolarHBondContact O-CG 3.37Å; A104-L108 PolarHBondContact O-N 3.26Å
105I96.4Very high94Very high12 Ų1254 Ų546%0.06226%0.256CS..Hα-helixtrans-58.1-49.1177.6-65.7165.5000109.8L101 N102 C107 L108 L109 L131 L135L101-I105 HydrophobicContact CD1-CD1 4.32Å; L101-I105 HydrophobicContact CD1-CG1 4.38Å; L101-I105 HydrophobicContact CG-CD1 4.06Å; L101-I105 VanDerWaalsContact O-CG1 3.29Å; L101-I105 WeakPolarHBondContact O-CG1 3.36Å; L101-I105 PolarHBondContact O-N 2.98Å; N102-I105 PolarHBondContact O-N 3.21Å; I105-C107 VanDerWaalsContact C-N 3.31Å; I105-C107 PolarHBondContact O-N 3.24Å; I105-L108 PolarHBondContact O-N 2.95Å; I105-L109 HydrophobicContact CG2-CD1 3.78Å; I105-L109 HydrophobicContact CG2-CG 4.19Å; I105-L109 WeakPolarHBondContact O-CB 3.41Å; I105-L109 VanDerWaalsContact O-CG 3.27Å; I105-L109 WeakPolarHBondContact O-CG 3.29Å; I105-L109 PolarHBondContact O-N 3.4Å; I105-L131 HydrophobicContact CB-CD1 4.31Å; I105-L131 HydrophobicContact CG1-CD1 3.91Å; I105-L131 HydrophobicContact CG2-CD1 4.24Å; I105-L135 HydrophobicContact CD1-CD2 3.93Å; I105-L135 HydrophobicContact CG1-CD2 4.42Å
106L96.5Very high94.4Very high120 Ų12048.5 Ų48.563%0.62823%0.228SC*.Hα-helixtrans-59.8-40.7178.2-70.6172.9000112.4N102 C103 A104 R110N102-L106 VanDerWaalsContact O-CG 3.32Å; N102-L106 WeakPolarHBondContact O-CG 3.36Å; N102-L106 PolarHBondContact O-N 3.35Å; C103-L106 PolarHBondContact O-N 3.39Å; A104-L106 PolarHBondContact O-N 3.04Å; L106-R110 WeakPolarHBondContact O-CB 3.49Å; L106-R110 PolarHBondContact O-N 3.18Å
107C97Very high94.8Very high9 Ų951.5 Ų51.56%0.06124%0.243CC..Hα-helixtrans-63.4-47.9175.8-67.80000111.5A79 C103 A104 I105 R110 T111A79-C107 HydrophobicContact CB-CB 3.8Å; C103-C107 PolarHBondContact O-N 2.93Å; C103-C107 PolarHBondContact O-SG 2.94Å; A104-C107 WeakPolarHBondContact O-CB 3.3Å; A104-C107 PolarHBondContact O-N 2.9Å; I105-C107 VanDerWaalsContact C-N 3.31Å; I105-C107 PolarHBondContact O-N 3.24Å; C107-R110 PolarHBondContact O-N 2.9Å; C107-T111 PolarHBondContact O-N 2.7Å; C107-T111 PolarHBondContact O-OG1 3.4Å; C107-T111 VanDerWaalsContact O-OG1 3.05Å
108L97.5Very high95.1Very high1 Ų147 Ų471%0.00523%0.23CC..Hα-helixtrans-63.5-43.1179.5-69.8169.5000112F76 A79 I83 A104 I105 R110 T111 A112 V127 Y130 L131F76-L108 HydrophobicContact CD2-CD2 3.51Å; F76-L108 HydrophobicContact CE2-CD2 3.59Å; A79-L108 HydrophobicContact CB-CD1 4.32Å; A79-L108 HydrophobicContact CB-CD2 3.74Å; A79-L108 HydrophobicContact CB-CG 3.62Å; I83-L108 HydrophobicContact CD1-CD1 4.43Å; A104-L108 WeakPolarHBondContact O-CG 3.37Å; A104-L108 PolarHBondContact O-N 3.26Å; I105-L108 PolarHBondContact O-N 2.95Å; L108-R110 VanDerWaalsContact C-N 3.33Å; L108-R110 PolarHBondContact O-N 3.43Å; L108-T111 WeakPolarHBondContact O-CB 3.26Å; L108-T111 PolarHBondContact O-N 3.48Å; L108-A112 WeakPolarHBondContact O-CB 3.43Å; L108-A112 PolarHBondContact O-N 3.04Å; L108-V127 HydrophobicContact CB-CG1 4.18Å; L108-V127 HydrophobicContact CD2-CG1 4.01Å; L108-V127 VanDerWaalsContact O-CG1 3.25Å; L108-V127 WeakPolarHBondContact O-CG1 3.24Å; L108-Y130 HydrophobicContact CD1-CD1 3.99Å; L108-Y130 HydrophobicContact CD1-CE1 4.24Å; L108-Y130 HydrophobicContact CD2-CD1 3.82Å; L108-Y130 HydrophobicContact CD2-CE1 4.25Å; L108-L131 HydrophobicContact CB-CB 4.44Å; L108-L131 HydrophobicContact CB-CD1 4.35Å; L108-L131 HydrophobicContact CD1-CB 4.02Å; L108-L131 HydrophobicContact CD1-CD1 3.75Å; L108-L131 HydrophobicContact CD1-CG 4.48Å
109L96.9Very high95.2Very high45 Ų4550.8 Ų50.824%0.23625%0.248CC..Hα-helixtrans-63.7-40.4176.9-68.8177.6000111.8I105 A112 R113 Y128 L131 Y147I105-L109 HydrophobicContact CG2-CD1 3.78Å; I105-L109 HydrophobicContact CG2-CG 4.19Å; I105-L109 WeakPolarHBondContact O-CB 3.41Å; I105-L109 VanDerWaalsContact O-CG 3.27Å; I105-L109 WeakPolarHBondContact O-CG 3.29Å; I105-L109 PolarHBondContact O-N 3.4Å; L109-A112 PolarHBondContact O-N 3.49Å; L109-R113 VanDerWaalsContact O-CB 3.3Å; L109-R113 WeakPolarHBondContact O-CB 3.5Å; L109-R113 PolarHBondContact O-N 2.99Å; L109-Y128 HydrophobicContact CD2-CE1 4.07Å; L109-L131 HydrophobicContact CD2-CD2 3.6Å; L109-L131 HydrophobicContact CG-CD2 4.16Å; L109-Y147 HydrophobicContact CD1-CE1 4.09Å; L109-Y147 HydrophobicContact CD2-CD1 3.76Å; L109-Y147 HydrophobicContact CD2-CE1 3.4Å; L109-Y147 VanDerWaalsContact CD2-CE1 3.4Å; L109-Y147 HydrophobicContact CG-CE1 4.33Å
110R96.2Very high95.2Very high121 Ų12148.9 Ų48.946%0.45724%0.238SC..Hα-helixtrans-64.1-44.9173.5-175.1177.4172.5139.8-0.6111.2E71 L75 L106 C107 L108 R113 I114E71-R110 IonicContact OE1-CZ 2.68Å; E71-R110 IonicContact OE1-NE 3.73Å; E71-R110 PolarHBondContact OE1-NE 3.33Å; E71-R110 IonicContact OE1-NH2 2.84Å; E71-R110 PolarHBondContact OE1-NH2 2.85Å; L75-R110 HydrophobicContact CD1-CB 4.27Å; L75-R110 HydrophobicContact CD1-CG 3.71Å; L106-R110 WeakPolarHBondContact O-CB 3.49Å; L106-R110 PolarHBondContact O-N 3.18Å; C107-R110 PolarHBondContact O-N 2.9Å; L108-R110 VanDerWaalsContact C-N 3.33Å; L108-R110 PolarHBondContact O-N 3.43Å; R110-R113 PolarHBondContact O-N 3.19Å; R110-I114 HydrophobicContact CG-CD1 4.06Å; R110-I114 VanDerWaalsContact O-CG1 3.27Å; R110-I114 WeakPolarHBondContact O-CG1 3.44Å; R110-I114 PolarHBondContact O-N 3.21Å
111T97.1Very high95.2Very high0 Ų053.3 Ų53.30%026%0.256CS..Hα-helixtrans-56.9-50.6175-630000111.3A72 L75 F76 C107 L108 R113 I114 Y115 V127A72-T111 HydrophobicContact CB-CG2 4.07Å; A72-T111 WeakPolarHBondContact O-CG2 3.22Å; A72-T111 PolarHBondContact O-OG1 2.83Å; L75-T111 WeakPolarHBondContact CB-OG1 3.39Å; F76-T111 HydrophobicContact CB-CG2 4.11Å; F76-T111 HydrophobicContact CD2-CG2 4.31Å; F76-T111 PolarHBondContact N-OG1 3.33Å; C107-T111 PolarHBondContact O-N 2.7Å; C107-T111 PolarHBondContact O-OG1 3.4Å; C107-T111 VanDerWaalsContact O-OG1 3.05Å; L108-T111 WeakPolarHBondContact O-CB 3.26Å; L108-T111 PolarHBondContact O-N 3.48Å; T111-R113 VanDerWaalsContact C-N 3.31Å; T111-R113 PolarHBondContact O-N 2.66Å; T111-I114 PolarHBondContact O-N 2.84Å; T111-Y115 HydrophobicContact CG2-CD2 3.88Å; T111-Y115 HydrophobicContact CG2-CE2 3.43Å; T111-Y115 VanDerWaalsContact CG2-CE2 3.43Å; T111-Y115 WeakPolarHBondContact O-CD2 3.41Å; T111-Y115 PolarHBondContact O-N 3.14Å; T111-V127 HydrophobicContact CG2-CG1 4.16Å; T111-V127 HydrophobicContact CG2-CG2 3.72Å
112A96.2Very high95.2Very high0 Ų058.2 Ų58.20%029%0.287CS..Hα-helixtrans-60.2-43.8179.800000111L108 L109 I114 Y115 E116 V127 Y128L108-A112 WeakPolarHBondContact O-CB 3.43Å; L108-A112 PolarHBondContact O-N 3.04Å; L109-A112 PolarHBondContact O-N 3.49Å; A112-I114 VanDerWaalsContact C-N 3.33Å; A112-I114 PolarHBondContact O-N 2.64Å; A112-Y115 PolarHBondContact O-N 3.24Å; A112-Y115 VanDerWaalsContact O-N 3.16Å; A112-E116 WeakPolarHBondContact O-CG 3.28Å; A112-E116 PolarHBondContact O-N 3.22Å; A112-V127 HydrophobicContact CB-CB 4.15Å; A112-V127 HydrophobicContact CB-CG1 3.86Å; A112-Y128 HydrophobicContact CB-CD1 4.23Å; A112-Y128 HydrophobicContact CB-CD2 4.18Å; A112-Y128 HydrophobicContact CB-CE1 3.81Å; A112-Y128 HydrophobicContact CB-CE2 3.75Å; A112-Y128 HydrophobicContact CB-CG 4.39Å
113R95.5Very high95.1Very high126 Ų12658.3 Ų58.348%0.47529%0.287SS..Hα-helixtrans-61.5-40.2177.3-174.857.4174.7167.31.9112.6L109 R110 T111 E116 L117L109-R113 VanDerWaalsContact O-CB 3.3Å; L109-R113 WeakPolarHBondContact O-CB 3.5Å; L109-R113 PolarHBondContact O-N 2.99Å; R110-R113 PolarHBondContact O-N 3.19Å; T111-R113 VanDerWaalsContact C-N 3.31Å; T111-R113 PolarHBondContact O-N 2.66Å; R113-E116 IonicContact NH1-OE2 2.75Å; R113-E116 PolarHBondContact NH1-OE2 3.2Å; R113-E116 VanDerWaalsContact NH1-OE2 3.15Å; R113-E116 PolarHBondContact O-N 2.9Å; R113-L117 HydrophobicContact CG-CD1 4.15Å; R113-L117 WeakPolarHBondContact O-CB 3.23Å; R113-L117 VanDerWaalsContact O-CG 3.26Å; R113-L117 WeakPolarHBondContact O-CG 3.4Å; R113-L117 PolarHBondContact O-N 2.99Å
114I95Very high95.1Very high17 Ų1756 Ų569%0.08727%0.271CS..Hα-helixtrans-61.3-46.5174.8-70164.1000110.1V68 E71 A72 L75 R110 T111 A112 L117 N118V68-I114 HydrophobicContact CG1-CG2 3.2Å; E71-I114 HydrophobicContact CG-CD1 3.91Å; A72-I114 HydrophobicContact CB-CB 4.31Å; A72-I114 HydrophobicContact CB-CG2 3.9Å; L75-I114 HydrophobicContact CD1-CD1 3.67Å; R110-I114 HydrophobicContact CG-CD1 4.06Å; R110-I114 VanDerWaalsContact O-CG1 3.27Å; R110-I114 WeakPolarHBondContact O-CG1 3.44Å; R110-I114 PolarHBondContact O-N 3.21Å; T111-I114 PolarHBondContact O-N 2.84Å; A112-I114 VanDerWaalsContact C-N 3.33Å; A112-I114 PolarHBondContact O-N 2.64Å; I114-L117 PolarHBondContact O-N 3.01Å; I114-N118 PolarHBondContact O-N 3.17Å; I114-N118 PolarHBondContact O-ND2 3.47Å
115Y95.7Very high95Very high25 Ų2556.1 Ų56.110%0.09827%0.272CS..Hα-helixtrans-64.4-41.1177.9-69.9-44.8000112.9A72 T111 A112 L117 N118 E119 L120 L123 V127A72-Y115 HydrophobicContact CB-CD1 4.1Å; A72-Y115 HydrophobicContact CB-CE1 3.48Å; A72-Y115 VanDerWaalsContact CB-CE1 3.48Å; A72-Y115 HydrophobicContact CB-CE2 4Å; A72-Y115 VanDerWaalsContact CB-CZ 3.41Å; T111-Y115 HydrophobicContact CG2-CD2 3.88Å; T111-Y115 HydrophobicContact CG2-CE2 3.43Å; T111-Y115 VanDerWaalsContact CG2-CE2 3.43Å; T111-Y115 WeakPolarHBondContact O-CD2 3.41Å; T111-Y115 PolarHBondContact O-N 3.14Å; A112-Y115 PolarHBondContact O-N 3.24Å; A112-Y115 VanDerWaalsContact O-N 3.16Å; Y115-L117 PolarHBondContact O-N 3.49Å; Y115-N118 PolarHBondContact O-N 3.43Å; Y115-E119 PolarHBondContact O-N 3.43Å; Y115-L120 HydrophobicContact CD1-CB 4.17Å; Y115-L120 HydrophobicContact CD1-CD1 3.96Å; Y115-L120 HydrophobicContact CE1-CD1 4.45Å; Y115-L120 PolarHBondContact O-N 3.26Å; Y115-L123 HydrophobicContact CD1-CB 3.98Å; Y115-L123 HydrophobicContact CD1-CD1 4.07Å; Y115-L123 HydrophobicContact CD2-CB 3.8Å; Y115-L123 HydrophobicContact CE1-CB 4.2Å; Y115-L123 HydrophobicContact CE1-CD1 3.81Å; Y115-L123 HydrophobicContact CE2-CB 4.02Å; Y115-L123 HydrophobicContact CG-CB 3.8Å; Y115-V127 HydrophobicContact CD2-CG2 3.84Å; Y115-V127 HydrophobicContact CE2-CG2 3.73Å
116E93.7Very high94.9Very high17 Ų1760 Ų608%0.07929%0.293CS..Hα-helixtrans-59-45.1174.5-73.5-170.3170.600112.2A112 R113 N118 E119 A124 Y128 R150 I154A112-E116 WeakPolarHBondContact O-CG 3.28Å; A112-E116 PolarHBondContact O-N 3.22Å; R113-E116 IonicContact NH1-OE2 2.75Å; R113-E116 PolarHBondContact NH1-OE2 3.2Å; R113-E116 VanDerWaalsContact NH1-OE2 3.15Å; R113-E116 PolarHBondContact O-N 2.9Å; E116-N118 PolarHBondContact O-N 2.88Å; E116-E119 PolarHBondContact O-N 2.95Å; E116-E119 VanDerWaalsContact O-N 3.14Å; E116-A124 HydrophobicContact CG-CB 3.88Å; E116-Y128 WeakPolarHBondContact OE1-CE2 3.39Å; E116-Y128 PolarHBondContact OE1-OH 3.32Å; E116-R150 VanDerWaalsContact CD-NH2 3.31Å; E116-R150 IonicContact OE1-CZ 3.1Å; E116-R150 IonicContact OE1-NE 3.93Å; E116-R150 PolarHBondContact OE1-NE 3.38Å; E116-R150 IonicContact OE1-NH2 2.96Å; E116-R150 PolarHBondContact OE1-NH2 3.47Å; E116-R150 VanDerWaalsContact OE1-NH2 3.07Å; E116-R150 IonicContact OE2-CZ 3.4Å; E116-R150 IonicContact OE2-NE 2.87Å; E116-R150 IonicContact OE2-NH2 3.99Å; E116-R150 PolarHBondContact OE2-NH2 3Å; E116-I154 HydrophobicContact CG-CD1 4.38Å; E116-I154 WeakPolarHBondContact OE1-CD1 3.09Å
117L94.3Very high94.9Very high111 Ų11154.5 Ų54.558%0.58126%0.264SS*.Hα-helixtrans-66.2-21.1-178.3-73.4172.6000113.4R113 I114 Y115R113-L117 HydrophobicContact CG-CD1 4.15Å; R113-L117 WeakPolarHBondContact O-CB 3.23Å; R113-L117 VanDerWaalsContact O-CG 3.26Å; R113-L117 WeakPolarHBondContact O-CG 3.4Å; R113-L117 PolarHBondContact O-N 2.99Å; I114-L117 PolarHBondContact O-N 3.01Å; Y115-L117 PolarHBondContact O-N 3.49Å
118N93.2Very high94.9Very high75 Ų7555 Ų5540%0.40127%0.265SS..THydrogen-bonded Turntrans-10517.9176.4-60.6-73.2000112.8V68 I114 Y115 E116 L120V68-N118 WeakPolarHBondContact CG1-ND2 3.08Å; I114-N118 PolarHBondContact O-N 3.17Å; I114-N118 PolarHBondContact O-ND2 3.47Å; Y115-N118 PolarHBondContact O-N 3.43Å; E116-N118 PolarHBondContact O-N 2.88Å; N118-L120 HydrophobicContact CB-CD1 4.39Å; N118-L120 HydrophobicContact CB-CG 4.39Å; N118-L120 PolarHBondContact O-N 3.4Å; N118-L120 VanDerWaalsContact O-N 3.09Å
119E92.6Very high94.8Very high155 Ų15556 Ų5672%0.72427%0.27SS*.THydrogen-bonded Turntrans61.118.7177.8-52.7-178.4161.600114.3Y115 E116 F121Y115-E119 PolarHBondContact O-N 3.43Å; E116-E119 PolarHBondContact O-N 2.95Å; E116-E119 VanDerWaalsContact O-N 3.14Å; E119-F121 HydrophobicContact CB-CE2 3.98Å; E119-F121 HydrophobicContact CB-CZ 4.35Å; E119-F121 HydrophobicContact CG-CE2 4.48Å; E119-F121 WeakPolarHBondContact O-CD2 3.31Å; E119-F121 PolarHBondContact O-N 3.31Å
120L93.2Very high94.7Very high62 Ų6256.6 Ų56.633%0.32527%0.27SS..  trans-87.858.4176.7-62.5174.3000110.4T69 Y115 N118 T122 L123 A124T69-L120 HydrophobicContact CG2-CD1 4.34Å; Y115-L120 HydrophobicContact CD1-CB 4.17Å; Y115-L120 HydrophobicContact CD1-CD1 3.96Å; Y115-L120 HydrophobicContact CE1-CD1 4.45Å; Y115-L120 PolarHBondContact O-N 3.26Å; N118-L120 HydrophobicContact CB-CD1 4.39Å; N118-L120 HydrophobicContact CB-CG 4.39Å; N118-L120 PolarHBondContact O-N 3.4Å; N118-L120 VanDerWaalsContact O-N 3.09Å; L120-T122 VanDerWaalsContact C-N 3.33Å; L120-T122 PolarHBondContact O-N 3.31Å; L120-L123 HydrophobicContact CB-CB 4.38Å; L120-L123 HydrophobicContact CB-CD1 4.24Å; L120-L123 HydrophobicContact CD1-CD1 4.21Å; L120-L123 PolarHBondContact O-N 3.31Å; L120-L123 VanDerWaalsContact O-N 3.12Å; L120-A124 PolarHBondContact O-N 3.47Å
121F92.7Very high94.8Very high101 Ų10150.9 Ų50.944%0.44325%0.248SC..Hα-helixtrans-58.8-38.5-170.8-64.4-62.1000114E119 L123 A124 T125 I154E119-F121 HydrophobicContact CB-CE2 3.98Å; E119-F121 HydrophobicContact CB-CZ 4.35Å; E119-F121 HydrophobicContact CG-CE2 4.48Å; E119-F121 WeakPolarHBondContact O-CD2 3.31Å; E119-F121 PolarHBondContact O-N 3.31Å; F121-L123 VanDerWaalsContact C-N 3.33Å; F121-L123 PolarHBondContact O-N 2.97Å; F121-A124 WeakPolarHBondContact O-CB 3.45Å; F121-A124 PolarHBondContact O-N 3.19Å; F121-T125 WeakPolarHBondContact O-CB 3.01Å; F121-T125 PolarHBondContact O-N 3.29Å; F121-T125 PolarHBondContact O-OG1 3.39Å; F121-I154 HydrophobicContact CB-CG2 3.65Å; F121-I154 HydrophobicContact CD1-CG2 3.87Å; F121-I154 HydrophobicContact CG-CG2 4.11Å
122T92.3Very high94.7Very high106 Ų10650.9 Ų50.965%0.6525%0.248SC*.Hα-helixtrans-62.2-40.7177.752.90000112.1L120 N126L120-T122 VanDerWaalsContact C-N 3.33Å; L120-T122 PolarHBondContact O-N 3.31Å; T122-N126 VanDerWaalsContact O-CG 3.3Å; T122-N126 PolarHBondContact O-N 3.07Å; T122-N126 VanDerWaalsContact O-N 3.08Å; T122-N126 PolarHBondContact O-ND2 3.15Å
123L93.9Very high94.7Very high71 Ų7153.4 Ų53.437%0.37226%0.262SS..Hα-helixtrans-70.2-40.8175.6-65.6178.5000111.3Y115 L120 F121 T125 N126 V127Y115-L123 HydrophobicContact CD1-CB 3.98Å; Y115-L123 HydrophobicContact CD1-CD1 4.07Å; Y115-L123 HydrophobicContact CD2-CB 3.8Å; Y115-L123 HydrophobicContact CE1-CB 4.2Å; Y115-L123 HydrophobicContact CE1-CD1 3.81Å; Y115-L123 HydrophobicContact CE2-CB 4.02Å; Y115-L123 HydrophobicContact CG-CB 3.8Å; L120-L123 HydrophobicContact CB-CB 4.38Å; L120-L123 HydrophobicContact CB-CD1 4.24Å; L120-L123 HydrophobicContact CD1-CD1 4.21Å; L120-L123 PolarHBondContact O-N 3.31Å; L120-L123 VanDerWaalsContact O-N 3.12Å; F121-L123 VanDerWaalsContact C-N 3.33Å; F121-L123 PolarHBondContact O-N 2.97Å; L123-T125 PolarHBondContact O-N 3.27Å; L123-N126 PolarHBondContact O-N 3.37Å; L123-V127 WeakPolarHBondContact O-CG2 3.49Å; L123-V127 PolarHBondContact O-N 3.15Å; L123-V127 VanDerWaalsContact O-N 3.09Å
124A94.9Very high94.6Very high0 Ų047.5 Ų47.50%024%0.24CC..Hα-helixtrans-57.9-48.4174.700000111.3E116 L120 F121 N126 V127 Y128E116-A124 HydrophobicContact CG-CB 3.88Å; L120-A124 PolarHBondContact O-N 3.47Å; F121-A124 WeakPolarHBondContact O-CB 3.45Å; F121-A124 PolarHBondContact O-N 3.19Å; A124-N126 PolarHBondContact O-N 3.01Å; A124-V127 WeakPolarHBondContact O-CB 3.3Å; A124-V127 PolarHBondContact O-N 3.18Å; A124-V127 VanDerWaalsContact O-N 3.14Å; A124-Y128 VanDerWaalsContact O-CD2 3.23Å; A124-Y128 WeakPolarHBondContact O-CD2 3.43Å; A124-Y128 PolarHBondContact O-N 2.66Å
125T93.7Very high94.7Very high4 Ų446.7 Ų46.73%0.02524%0.235CC..Hα-helixtrans-57.5-46.5175.9-60.60000111.6F121 L123 V127 Y128 I129 I154 V155 L161F121-T125 WeakPolarHBondContact O-CB 3.01Å; F121-T125 PolarHBondContact O-N 3.29Å; F121-T125 PolarHBondContact O-OG1 3.39Å; L123-T125 PolarHBondContact O-N 3.27Å; T125-V127 PolarHBondContact O-N 3.37Å; T125-Y128 PolarHBondContact O-N 3.39Å; T125-Y128 VanDerWaalsContact O-N 3.12Å; T125-I129 HydrophobicContact CG2-CD1 3.74Å; T125-I129 HydrophobicContact CG2-CG1 4.21Å; T125-I129 WeakPolarHBondContact O-CB 3.18Å; T125-I129 WeakPolarHBondContact O-CG1 3.32Å; T125-I129 PolarHBondContact O-N 3.43Å; T125-I154 WeakPolarHBondContact OG1-CG2 3.05Å; T125-V155 HydrophobicContact CG2-CG2 3.26Å; T125-V155 WeakPolarHBondContact OG1-CG2 3.35Å; T125-L161 HydrophobicContact CG2-CD2 4.2Å
126N94.6Very high94.6Very high94 Ų9447.3 Ų47.350%0.50324%0.24SC..Hα-helixtrans-59.9-35.5178.4-74.9-23.4000112.6T122 L123 A124 Y130T122-N126 VanDerWaalsContact O-CG 3.3Å; T122-N126 PolarHBondContact O-N 3.07Å; T122-N126 VanDerWaalsContact O-N 3.08Å; T122-N126 PolarHBondContact O-ND2 3.15Å; L123-N126 PolarHBondContact O-N 3.37Å; A124-N126 PolarHBondContact O-N 3.01Å; N126-Y130 WeakPolarHBondContact O-CB 3.12Å; N126-Y130 PolarHBondContact O-N 3.21Å
127V96.6Very high94.5Very high5 Ų554 Ų543%0.0326%0.264CS..Hα-helixtrans-69-42.9175.6177.50000111.2F76 L108 T111 A112 Y115 L123 A124 T125 Y130 L131F76-V127 HydrophobicContact CD2-CG1 4.24Å; F76-V127 HydrophobicContact CD2-CG2 3.91Å; F76-V127 HydrophobicContact CE2-CB 4.42Å; F76-V127 HydrophobicContact CE2-CG1 4.29Å; F76-V127 HydrophobicContact CE2-CG2 3.97Å; L108-V127 HydrophobicContact CB-CG1 4.18Å; L108-V127 HydrophobicContact CD2-CG1 4.01Å; L108-V127 VanDerWaalsContact O-CG1 3.25Å; L108-V127 WeakPolarHBondContact O-CG1 3.24Å; T111-V127 HydrophobicContact CG2-CG1 4.16Å; T111-V127 HydrophobicContact CG2-CG2 3.72Å; A112-V127 HydrophobicContact CB-CB 4.15Å; A112-V127 HydrophobicContact CB-CG1 3.86Å; Y115-V127 HydrophobicContact CD2-CG2 3.84Å; Y115-V127 HydrophobicContact CE2-CG2 3.73Å; L123-V127 WeakPolarHBondContact O-CG2 3.49Å; L123-V127 PolarHBondContact O-N 3.15Å; L123-V127 VanDerWaalsContact O-N 3.09Å; A124-V127 WeakPolarHBondContact O-CB 3.3Å; A124-V127 PolarHBondContact O-N 3.18Å; A124-V127 VanDerWaalsContact O-N 3.14Å; T125-V127 PolarHBondContact O-N 3.37Å; V127-Y130 PolarHBondContact O-N 3.15Å; V127-L131 WeakPolarHBondContact O-CB 3.36Å; V127-L131 PolarHBondContact O-N 2.86Å
128Y96.3Very high94.4Very high18 Ų1850.6 Ų50.67%0.07124%0.244CC..Hα-helixtrans-64.8-42.2175.5-72.8-60.9000112.5L109 A112 E116 A124 T125 Y130 L131 V132 Y147 R150 S151 I154L109-Y128 HydrophobicContact CD2-CE1 4.07Å; A112-Y128 HydrophobicContact CB-CD1 4.23Å; A112-Y128 HydrophobicContact CB-CD2 4.18Å; A112-Y128 HydrophobicContact CB-CE1 3.81Å; A112-Y128 HydrophobicContact CB-CE2 3.75Å; A112-Y128 HydrophobicContact CB-CG 4.39Å; E116-Y128 WeakPolarHBondContact OE1-CE2 3.39Å; E116-Y128 PolarHBondContact OE1-OH 3.32Å; A124-Y128 VanDerWaalsContact O-CD2 3.23Å; A124-Y128 WeakPolarHBondContact O-CD2 3.43Å; A124-Y128 PolarHBondContact O-N 2.66Å; T125-Y128 PolarHBondContact O-N 3.39Å; T125-Y128 VanDerWaalsContact O-N 3.12Å; Y128-Y130 VanDerWaalsContact C-N 3.32Å; Y128-Y130 PolarHBondContact O-N 2.9Å; Y128-L131 WeakPolarHBondContact O-CB 3.39Å; Y128-L131 PolarHBondContact O-N 3.42Å; Y128-V132 WeakPolarHBondContact O-CB 3.43Å; Y128-V132 VanDerWaalsContact O-CG2 3.26Å; Y128-V132 WeakPolarHBondContact O-CG2 3.36Å; Y128-V132 PolarHBondContact O-N 2.87Å; Y128-Y147 HydrophobicContact CE1-CD1 4.48Å; Y128-R150 HydrophobicContact CE1-CG 4.41Å; Y128-R150 HydrophobicContact CE2-CG 3.99Å; Y128-S151 WeakPolarHBondContact CB-OG 3.49Å; Y128-I154 HydrophobicContact CD2-CD1 3.96Å; Y128-I154 HydrophobicContact CE2-CD1 3.66Å
129I95.5Very high94.3Very high23 Ų2351.1 Ų51.112%0.11825%0.254CS..Hα-helixtrans-56.6-48.4173.7-73.2173.3000110.1T125 L131 V132 D133 L161 L165T125-I129 HydrophobicContact CG2-CD1 3.74Å; T125-I129 HydrophobicContact CG2-CG1 4.21Å; T125-I129 WeakPolarHBondContact O-CB 3.18Å; T125-I129 WeakPolarHBondContact O-CG1 3.32Å; T125-I129 PolarHBondContact O-N 3.43Å; I129-L131 VanDerWaalsContact C-N 3.35Å; I129-L131 PolarHBondContact O-N 2.9Å; I129-V132 PolarHBondContact O-N 3.35Å; I129-D133 WeakPolarHBondContact O-CB 3.36Å; I129-D133 VanDerWaalsContact O-CG 3.28Å; I129-D133 PolarHBondContact O-N 3.36Å; I129-L161 HydrophobicContact CD1-CD1 4.15Å; I129-L165 HydrophobicContact CD1-CD2 4.11Å; I129-L165 HydrophobicContact CG1-CD2 3.77Å
130Y96.4Very high94.3Very high57 Ų5745.1 Ų45.122%0.22423%0.225CC..Hα-helixtrans-60.5-43.9177.5-176.7-97.5000112.2F76 K80 I83 L108 N126 V127 Y128 D133 T134F76-Y130 AromaticContact CE2-CD1 3.87Å; F76-Y130 HydrophobicContact CE2-CD1 3.87Å; F76-Y130 HydrophobicContact CE2-CG 4.11Å; F76-Y130 AromaticContact CZ-CD1 3.89Å; F76-Y130 HydrophobicContact CZ-CD1 3.89Å; F76-Y130 HydrophobicContact CZ-CD2 4.28Å; F76-Y130 HydrophobicContact CZ-CE1 4.33Å; F76-Y130 AromaticContact CZ-CG 3.86Å; F76-Y130 HydrophobicContact CZ-CG 3.86Å; K80-Y130 HydrophobicContact CG-CE1 4.5Å; I83-Y130 HydrophobicContact CD1-CE1 3.71Å; L108-Y130 HydrophobicContact CD1-CD1 3.99Å; L108-Y130 HydrophobicContact CD1-CE1 4.24Å; L108-Y130 HydrophobicContact CD2-CD1 3.82Å; L108-Y130 HydrophobicContact CD2-CE1 4.25Å; N126-Y130 WeakPolarHBondContact O-CB 3.12Å; N126-Y130 PolarHBondContact O-N 3.21Å; V127-Y130 PolarHBondContact O-N 3.15Å; Y128-Y130 VanDerWaalsContact C-N 3.32Å; Y128-Y130 PolarHBondContact O-N 2.9Å; Y130-D133 PolarHBondContact O-N 3.45Å; Y130-T134 HydrophobicContact CD1-CG2 4.13Å; Y130-T134 HydrophobicContact CE1-CG2 3.77Å; Y130-T134 HydrophobicContact CE2-CG2 4.41Å; Y130-T134 WeakPolarHBondContact O-CG2 3.48Å; Y130-T134 PolarHBondContact O-N 3.24Å; Y130-T134 PolarHBondContact O-OG1 3.14Å
131L96.5Very high94.4Very high1 Ų143.5 Ų43.51%0.00522%0.215CC..Hα-helixtrans-58.7-48.6175.2174.362.5000111.1I105 L108 L109 V127 Y128 I129 D133 T134 L135 Y147I105-L131 HydrophobicContact CB-CD1 4.31Å; I105-L131 HydrophobicContact CG1-CD1 3.91Å; I105-L131 HydrophobicContact CG2-CD1 4.24Å; L108-L131 HydrophobicContact CB-CB 4.44Å; L108-L131 HydrophobicContact CB-CD1 4.35Å; L108-L131 HydrophobicContact CD1-CB 4.02Å; L108-L131 HydrophobicContact CD1-CD1 3.75Å; L108-L131 HydrophobicContact CD1-CG 4.48Å; L109-L131 HydrophobicContact CD2-CD2 3.6Å; L109-L131 HydrophobicContact CG-CD2 4.16Å; V127-L131 WeakPolarHBondContact O-CB 3.36Å; V127-L131 PolarHBondContact O-N 2.86Å; Y128-L131 WeakPolarHBondContact O-CB 3.39Å; Y128-L131 PolarHBondContact O-N 3.42Å; I129-L131 VanDerWaalsContact C-N 3.35Å; I129-L131 PolarHBondContact O-N 2.9Å; L131-D133 PolarHBondContact O-N 3.29Å; L131-T134 PolarHBondContact O-N 3.04Å; L131-T134 PolarHBondContact O-OG1 3.3Å; L131-L135 HydrophobicContact CD1-CD1 4.1Å; L131-L135 HydrophobicContact CD1-CG 4.31Å; L131-L135 HydrophobicContact CG-CD1 4.1Å; L131-L135 WeakPolarHBondContact O-CG 3.46Å; L131-L135 PolarHBondContact O-N 3.1Å; L131-Y147 HydrophobicContact CD2-CD1 4.06Å; L131-Y147 HydrophobicContact CD2-CD2 3.67Å; L131-Y147 HydrophobicContact CD2-CE1 4.31Å; L131-Y147 HydrophobicContact CD2-CE2 3.92Å; L131-Y147 HydrophobicContact CD2-CG 3.75Å; L131-Y147 HydrophobicContact CG-CD2 4.15Å; L131-Y147 HydrophobicContact CG-CE2 4.5Å
132V96.1Very high94.4Very high0 Ų045.6 Ų45.60%023%0.226CC..Hα-helixtrans-59.4-47.6178.2167.20000111Y128 I129 T134 L135 M136 A144 L148Y128-V132 WeakPolarHBondContact O-CB 3.43Å; Y128-V132 VanDerWaalsContact O-CG2 3.26Å; Y128-V132 WeakPolarHBondContact O-CG2 3.36Å; Y128-V132 PolarHBondContact O-N 2.87Å; I129-V132 PolarHBondContact O-N 3.35Å; V132-T134 PolarHBondContact O-N 3.09Å; V132-L135 PolarHBondContact O-N 3.46Å; V132-L135 VanDerWaalsContact O-N 3.08Å; V132-M136 HydrophobicContact CG1-CG 4.1Å; V132-M136 HydrophobicContact CG1-SD 3.69Å; V132-M136 WeakPolarHBondContact O-CB 3.41Å; V132-M136 WeakPolarHBondContact O-CG 3.33Å; V132-M136 PolarHBondContact O-N 3.17Å; V132-A144 HydrophobicContact CG1-CB 4.33Å; V132-L148 HydrophobicContact CB-CD2 4.37Å; V132-L148 HydrophobicContact CB-CG 4.3Å; V132-L148 HydrophobicContact CG1-CD1 3.87Å; V132-L148 HydrophobicContact CG1-CD2 3.72Å; V132-L148 HydrophobicContact CG1-CG 3.65Å; V132-L148 HydrophobicContact CG2-CD2 4.04Å; V132-L148 HydrophobicContact CG2-CG 3.69Å
133D95.5Very high94.5Very high53 Ų5344.2 Ų44.228%0.28321%0.212SC..Hα-helixtrans-63.5-32.1179.5-69.2-15.4000112I129 Y130 L131 R137 R168I129-D133 WeakPolarHBondContact O-CB 3.36Å; I129-D133 VanDerWaalsContact O-CG 3.28Å; I129-D133 PolarHBondContact O-N 3.36Å; Y130-D133 PolarHBondContact O-N 3.45Å; L131-D133 PolarHBondContact O-N 3.29Å; D133-R137 WeakPolarHBondContact O-CB 3.45Å; D133-R137 VanDerWaalsContact O-CG 3.28Å; D133-R137 WeakPolarHBondContact O-CG 3.18Å; D133-R137 PolarHBondContact O-N 3.47Å; D133-R137 PolarHBondContact O-NE 2.98Å; D133-R168 IonicContact OD1-CZ 2.96Å; D133-R168 IonicContact OD1-NH1 2.77Å; D133-R168 PolarHBondContact OD1-NH1 2.85Å; D133-R168 IonicContact OD2-CZ 3.79Å; D133-R168 IonicContact OD2-NH1 2.64Å; D133-R168 PolarHBondContact OD2-NH1 3.25Å
134T94.8Very high94.5Very high2 Ų240.8 Ų40.81%0.01220%0.195CC..Hα-helixtrans-71.3-35.9173.963.10000112.9I83 Y130 L131 V132 R138I83-T134 HydrophobicContact CD1-CG2 3.7Å; Y130-T134 HydrophobicContact CD1-CG2 4.13Å; Y130-T134 HydrophobicContact CE1-CG2 3.77Å; Y130-T134 HydrophobicContact CE2-CG2 4.41Å; Y130-T134 WeakPolarHBondContact O-CG2 3.48Å; Y130-T134 PolarHBondContact O-N 3.24Å; Y130-T134 PolarHBondContact O-OG1 3.14Å; L131-T134 PolarHBondContact O-N 3.04Å; L131-T134 PolarHBondContact O-OG1 3.3Å; V132-T134 PolarHBondContact O-N 3.09Å; T134-R138 WeakPolarHBondContact O-CG 3.46Å; T134-R138 PolarHBondContact O-NH1 3.26Å
135L95.3Very high94.5Very high0 Ų041.9 Ų41.90%020%0.2CC..Hα-helixtrans-73.9-43.7177.3-69.9171.2000111.6I105 L131 V132 R138 S139 K140 Q143 A144 Y147I105-L135 HydrophobicContact CD1-CD2 3.93Å; I105-L135 HydrophobicContact CG1-CD2 4.42Å; L131-L135 HydrophobicContact CD1-CD1 4.1Å; L131-L135 HydrophobicContact CD1-CG 4.31Å; L131-L135 HydrophobicContact CG-CD1 4.1Å; L131-L135 WeakPolarHBondContact O-CG 3.46Å; L131-L135 PolarHBondContact O-N 3.1Å; V132-L135 PolarHBondContact O-N 3.46Å; V132-L135 VanDerWaalsContact O-N 3.08Å; L135-R138 CarbonylContact O-C 3.59Å; L135-R138 PolarHBondContact O-N 3.38Å; L135-R138 VanDerWaalsContact O-N 3.1Å; L135-S139 PolarHBondContact O-N 2.82Å; L135-K140 HydrophobicContact CB-CB 4.33Å; L135-K140 HydrophobicContact CD2-CB 4.14Å; L135-K140 HydrophobicContact CD2-CD 4.18Å; L135-K140 PolarHBondContact O-N 2.87Å; L135-Q143 HydrophobicContact CD1-CB 4.28Å; L135-Q143 HydrophobicContact CD2-CB 4.44Å; L135-A144 HydrophobicContact CB-CB 4.06Å; L135-A144 HydrophobicContact CD1-CB 4.25Å; L135-Y147 HydrophobicContact CD1-CD2 3.73Å; L135-Y147 HydrophobicContact CD1-CE2 3.78Å
136M94.1Very high94.6Very high39 Ų3945 Ų4519%0.19222%0.221CC..Hα-helixtrans-61.9-42.8177.2-72-178.475.700111.7V132 R138 S139 F141 A144 R168V132-M136 HydrophobicContact CG1-CG 4.1Å; V132-M136 HydrophobicContact CG1-SD 3.69Å; V132-M136 WeakPolarHBondContact O-CB 3.41Å; V132-M136 WeakPolarHBondContact O-CG 3.33Å; V132-M136 PolarHBondContact O-N 3.17Å; M136-R138 PolarHBondContact O-N 3.46Å; M136-R138 VanDerWaalsContact O-N 3.16Å; M136-S139 PolarHBondContact O-N 3.07Å; M136-F141 HydrophobicContact CB-CE1 4.34Å; M136-F141 HydrophobicContact CE-CE1 4.47Å; M136-F141 HydrophobicContact CG-CD1 4.27Å; M136-F141 HydrophobicContact CG-CE1 4.39Å; M136-A144 HydrophobicContact CG-CB 4.39Å; M136-R168 HydrophobicContact SD-CB 4.32Å
137R92.8Very high94.6Very high156 Ų15643.1 Ų43.159%0.58921%0.207SC*.THydrogen-bonded Turntrans-60.9-22.5174.7-78.6-172.7-65.9147.7-3114D133D133-R137 WeakPolarHBondContact O-CB 3.45Å; D133-R137 VanDerWaalsContact O-CG 3.28Å; D133-R137 WeakPolarHBondContact O-CG 3.18Å; D133-R137 PolarHBondContact O-N 3.47Å; D133-R137 PolarHBondContact O-NE 2.98Å
138R90.6Very high94.5Very high40 Ų4042.9 Ų42.915%0.15121%0.205CC..THydrogen-bonded Turntrans-10013.4177-68.1172.1165.966.94.3112.4D86 D87 T134 L135 M136 K140D86-R138 IonicContact OD2-CZ 3.98Å; D86-R138 VanDerWaalsContact OD2-CZ 3.3Å; D86-R138 IonicContact OD2-NE 3.3Å; D86-R138 PolarHBondContact OD2-NE 2.97Å; D86-R138 IonicContact OD2-NH2 2.92Å; D86-R138 PolarHBondContact OD2-NH2 3.35Å; D87-R138 IonicContact OD1-CZ 3.62Å; D87-R138 IonicContact OD1-NH1 3.46Å; D87-R138 IonicContact OD1-NH2 2.66Å; D87-R138 PolarHBondContact OD1-NH2 3.03Å; T134-R138 WeakPolarHBondContact O-CG 3.46Å; T134-R138 PolarHBondContact O-NH1 3.26Å; L135-R138 CarbonylContact O-C 3.59Å; L135-R138 PolarHBondContact O-N 3.38Å; L135-R138 VanDerWaalsContact O-N 3.1Å; M136-R138 PolarHBondContact O-N 3.46Å; M136-R138 VanDerWaalsContact O-N 3.16Å; R138-K140 HydrophobicContact CB-CG 4.35Å; R138-K140 PolarHBondContact O-N 3.46Å; R138-K140 VanDerWaalsContact O-N 3.15Å
139S91.9Very high94.4Very high87 Ų8747.2 Ų47.261%0.60823%0.225SC*.THydrogen-bonded Turntrans58.422.2-178-50.90000114.9L135 M136 F141L135-S139 PolarHBondContact O-N 2.82Å; M136-S139 PolarHBondContact O-N 3.07Å; S139-F141 VanDerWaalsContact C-N 3.28Å; S139-F141 WeakPolarHBondContact O-CD2 3.07Å; S139-F141 PolarHBondContact O-N 3.25Å
140K92.8Very high94.3Very high28 Ų2850.4 Ų50.412%0.12224%0.235CC..  trans-90.854179.3-64.8-167.4174.8-165.10112.3E98 L101 L135 R138 H142 Q143 A144E98-K140 WeakPolarHBondContact OE1-CE 3.29Å; E98-K140 IonicContact OE1-NZ 2.92Å; E98-K140 PolarHBondContact OE1-NZ 2.98Å; E98-K140 IonicContact OE2-NZ 3.4Å; E98-K140 PolarHBondContact OE2-NZ 3.09Å; L101-K140 HydrophobicContact CD2-CD 4.07Å; L135-K140 HydrophobicContact CB-CB 4.33Å; L135-K140 HydrophobicContact CD2-CB 4.14Å; L135-K140 HydrophobicContact CD2-CD 4.18Å; L135-K140 PolarHBondContact O-N 2.87Å; R138-K140 HydrophobicContact CB-CG 4.35Å; R138-K140 PolarHBondContact O-N 3.46Å; R138-K140 VanDerWaalsContact O-N 3.15Å; K140-H142 VanDerWaalsContact C-N 3.32Å; K140-H142 PolarHBondContact O-N 3Å; K140-Q143 PolarHBondContact O-N 3.38Å; K140-A144 PolarHBondContact O-N 2.91Å
141F94.2Very high94.1Very high29 Ų2947.7 Ų47.713%0.12722%0.224CC..Hα-helixtrans-58.8-40.5-173-57.4-69.3000113M136 S139 Q143 A144 I145 C172 Y175 I176M136-F141 HydrophobicContact CB-CE1 4.34Å; M136-F141 HydrophobicContact CE-CE1 4.47Å; M136-F141 HydrophobicContact CG-CD1 4.27Å; M136-F141 HydrophobicContact CG-CE1 4.39Å; S139-F141 VanDerWaalsContact C-N 3.28Å; S139-F141 WeakPolarHBondContact O-CD2 3.07Å; S139-F141 PolarHBondContact O-N 3.25Å; F141-Q143 VanDerWaalsContact C-N 3.3Å; F141-Q143 PolarHBondContact O-N 3.22Å; F141-A144 WeakPolarHBondContact O-CB 3.36Å; F141-A144 PolarHBondContact O-N 3.26Å; F141-A144 VanDerWaalsContact O-N 3.08Å; F141-I145 PolarHBondContact O-N 3.09Å; F141-C172 HydrophobicContact CB-CB 4.18Å; F141-C172 HydrophobicContact CD1-CB 4.41Å; F141-Y175 HydrophobicContact CD1-CD2 4.02Å; F141-Y175 HydrophobicContact CD1-CG 4.41Å; F141-Y175 VanDerWaalsContact CD2-CB 3.44Å; F141-Y175 HydrophobicContact CD2-CD2 4.48Å; F141-Y175 HydrophobicContact CD2-CG 4.08Å; F141-Y175 AromaticContact CE1-CD2 3.51Å; F141-Y175 HydrophobicContact CE1-CD2 3.51Å; F141-Y175 HydrophobicContact CE1-CE2 4.09Å; F141-Y175 HydrophobicContact CE1-CG 4.02Å; F141-Y175 HydrophobicContact CE2-CD1 4.14Å; F141-Y175 HydrophobicContact CE2-CD2 4.02Å; F141-Y175 AromaticContact CE2-CG 3.64Å; F141-Y175 HydrophobicContact CE2-CG 3.64Å; F141-Y175 HydrophobicContact CG-CD2 4.48Å; F141-Y175 HydrophobicContact CG-CG 4.44Å; F141-Y175 HydrophobicContact CZ-CD1 4.16Å; F141-Y175 AromaticContact CZ-CD2 3.5Å; F141-Y175 HydrophobicContact CZ-CD2 3.5Å; F141-Y175 VanDerWaalsContact CZ-CD2 3.5Å; F141-Y175 HydrophobicContact CZ-CE2 4.02Å; F141-Y175 AromaticContact CZ-CG 3.6Å; F141-Y175 HydrophobicContact CZ-CG 3.6Å; F141-I176 HydrophobicContact CB-CD1 3.78Å; F141-I176 HydrophobicContact CB-CG1 3.7Å
142H93.9Very high93.9Very high145 Ų14548.3 Ų48.367%0.67123%0.228SC*.Hα-helixtrans-60.8-39.1-179.5-179.974.2000112.7K140 A144 I176K140-H142 VanDerWaalsContact C-N 3.32Å; K140-H142 PolarHBondContact O-N 3Å; H142-A144 VanDerWaalsContact C-N 3.33Å; H142-I176 VanDerWaalsContact CA-CD1 3.48Å; H142-I176 HydrophobicContact CB-CD1 3.95Å
143Q94Very high93.7Very high76 Ų7653.9 Ų53.936%0.35525%0.254SS..Hα-helixtrans-73.6-26.4178.1-62.7-175.810.400112.2L135 K140 F141 P146 Y147L135-Q143 HydrophobicContact CD1-CB 4.28Å; L135-Q143 HydrophobicContact CD2-CB 4.44Å; K140-Q143 PolarHBondContact O-N 3.38Å; F141-Q143 VanDerWaalsContact C-N 3.3Å; F141-Q143 PolarHBondContact O-N 3.22Å; Q143-P146 WeakPolarHBondContact O-CD 3.49Å; Q143-P146 WeakPolarHBondContact O-CG 3.5Å; Q143-Y147 WeakPolarHBondContact O-CD2 3.26Å; Q143-Y147 WeakPolarHBondContact O-CE2 3.43Å
144A95.1Very high93.5Very high0 Ų052.9 Ų52.90%025%0.248CC..Hα-helixtrans-73.9-34.1-178.800000113.3V132 L135 M136 K140 F141 H142 Y147 L148V132-A144 HydrophobicContact CG1-CB 4.33Å; L135-A144 HydrophobicContact CB-CB 4.06Å; L135-A144 HydrophobicContact CD1-CB 4.25Å; M136-A144 HydrophobicContact CG-CB 4.39Å; K140-A144 PolarHBondContact O-N 2.91Å; F141-A144 WeakPolarHBondContact O-CB 3.36Å; F141-A144 PolarHBondContact O-N 3.26Å; F141-A144 VanDerWaalsContact O-N 3.08Å; H142-A144 VanDerWaalsContact C-N 3.33Å; A144-Y147 PolarHBondContact O-N 3.09Å; A144-Y147 VanDerWaalsContact O-N 3.15Å; A144-L148 PolarHBondContact O-N 3.33Å
145I94.5Very high93.3Very high22 Ų2253.4 Ų53.411%0.11325%0.251CS..Hα-helixtrans-50-52.1-177.3-71.1174.5000114.5F141 Y147 L148 K149 L169 C172 Q173 I176F141-I145 PolarHBondContact O-N 3.09Å; I145-Y147 VanDerWaalsContact C-N 3.27Å; I145-Y147 PolarHBondContact O-N 3.44Å; I145-L148 WeakPolarHBondContact O-CB 3.45Å; I145-L148 PolarHBondContact O-N 3.15Å; I145-K149 HydrophobicContact CG2-CD 4.24Å; I145-K149 PolarHBondContact O-N 3.24Å; I145-L169 HydrophobicContact CB-CD1 4.34Å; I145-L169 HydrophobicContact CG1-CD1 4.04Å; I145-L169 HydrophobicContact CG2-CD1 3.98Å; I145-C172 HydrophobicContact CD1-CB 4.43Å; I145-C172 HydrophobicContact CG1-CB 3.94Å; I145-Q173 HydrophobicContact CD1-CG 4.26Å; I145-I176 HydrophobicContact CD1-CD1 3.47Å; I145-I176 VanDerWaalsContact CD1-CD1 3.47Å; I145-I176 HydrophobicContact CG1-CD1 4.46Å
146P94.7Very high92.6Very high71 Ų7157.5 Ų57.546%0.46128%0.28SS..Hα-helixtrans-61.5-35.9-178.822.2-34.1000112.7Q143 R150Q143-P146 WeakPolarHBondContact O-CD 3.49Å; Q143-P146 WeakPolarHBondContact O-CG 3.5Å; P146-R150 WeakPolarHBondContact O-CB 3.47Å; P146-R150 PolarHBondContact O-N 3.39Å
147Y94.4Very high92Very high54 Ų5465.3 Ų65.321%0.21231%0.313CS..Hα-helixtrans-73.6-34.7179-51.3-51.4000112L109 Y128 L131 L135 Q143 A144 I145 R150 S151L109-Y147 HydrophobicContact CD1-CE1 4.09Å; L109-Y147 HydrophobicContact CD2-CD1 3.76Å; L109-Y147 HydrophobicContact CD2-CE1 3.4Å; L109-Y147 VanDerWaalsContact CD2-CE1 3.4Å; L109-Y147 HydrophobicContact CG-CE1 4.33Å; Y128-Y147 HydrophobicContact CE1-CD1 4.48Å; L131-Y147 HydrophobicContact CD2-CD1 4.06Å; L131-Y147 HydrophobicContact CD2-CD2 3.67Å; L131-Y147 HydrophobicContact CD2-CE1 4.31Å; L131-Y147 HydrophobicContact CD2-CE2 3.92Å; L131-Y147 HydrophobicContact CD2-CG 3.75Å; L131-Y147 HydrophobicContact CG-CD2 4.15Å; L131-Y147 HydrophobicContact CG-CE2 4.5Å; L135-Y147 HydrophobicContact CD1-CD2 3.73Å; L135-Y147 HydrophobicContact CD1-CE2 3.78Å; Q143-Y147 WeakPolarHBondContact O-CD2 3.26Å; Q143-Y147 WeakPolarHBondContact O-CE2 3.43Å; A144-Y147 PolarHBondContact O-N 3.09Å; A144-Y147 VanDerWaalsContact O-N 3.15Å; I145-Y147 VanDerWaalsContact C-N 3.27Å; I145-Y147 PolarHBondContact O-N 3.44Å; Y147-R150 PolarHBondContact O-N 3.41Å; Y147-S151 PolarHBondContact O-N 3.33Å; Y147-S151 PolarHBondContact O-OG 2.7Å
148L94.6Very high91.7Very high0 Ų061.8 Ų61.80%031%0.305CS..Hα-helixtrans-62-50.3171.2-84.2169.9000111.5V132 A144 I145 R150 S151 I152 L165 R168 L169V132-L148 HydrophobicContact CB-CD2 4.37Å; V132-L148 HydrophobicContact CB-CG 4.3Å; V132-L148 HydrophobicContact CG1-CD1 3.87Å; V132-L148 HydrophobicContact CG1-CD2 3.72Å; V132-L148 HydrophobicContact CG1-CG 3.65Å; V132-L148 HydrophobicContact CG2-CD2 4.04Å; V132-L148 HydrophobicContact CG2-CG 3.69Å; A144-L148 PolarHBondContact O-N 3.33Å; I145-L148 WeakPolarHBondContact O-CB 3.45Å; I145-L148 PolarHBondContact O-N 3.15Å; L148-R150 VanDerWaalsContact C-N 3.29Å; L148-R150 PolarHBondContact O-N 3.46Å; L148-S151 WeakPolarHBondContact O-CB 3.41Å; L148-S151 PolarHBondContact O-N 3.32Å; L148-S151 VanDerWaalsContact O-N 3.09Å; L148-I152 VanDerWaalsContact O-CG1 3.29Å; L148-I152 WeakPolarHBondContact O-CG1 3.12Å; L148-I152 PolarHBondContact O-N 3.42Å; L148-L165 HydrophobicContact CD2-CD2 4.04Å; L148-R168 HydrophobicContact CD1-CB 4.27Å; L148-R168 HydrophobicContact CD2-CB 4.03Å; L148-L169 HydrophobicContact CB-CD1 4.31Å; L148-L169 HydrophobicContact CD1-CB 4.2Å; L148-L169 HydrophobicContact CD1-CD1 4.36Å
149K93.6Very high91.6Very high109 Ų10961.4 Ų61.447%0.47431%0.308SS..Hα-helixtrans-56.9-43.9176.6-71.6-177.8176.8-176.90111.5I145 S151 I152 E153 L169I145-K149 HydrophobicContact CG2-CD 4.24Å; I145-K149 PolarHBondContact O-N 3.24Å; K149-S151 PolarHBondContact O-N 3.01Å; K149-I152 PolarHBondContact O-N 3.08Å; K149-E153 WeakPolarHBondContact O-CG 3.48Å; K149-E153 PolarHBondContact O-N 3.21Å; K149-E153 VanDerWaalsContact O-N 3.09Å; K149-L169 HydrophobicContact CG-CD2 4.46Å
150R93.4Very high91.4Very high89 Ų8960.6 Ų60.634%0.33630%0.296SS..Hα-helixtrans-61.1-42.6175.3-177.555.9174.6179.8-0.2112.7E116 Y128 P146 Y147 L148 I152 E153 I154E116-R150 VanDerWaalsContact CD-NH2 3.31Å; E116-R150 IonicContact OE1-CZ 3.1Å; E116-R150 IonicContact OE1-NE 3.93Å; E116-R150 PolarHBondContact OE1-NE 3.38Å; E116-R150 IonicContact OE1-NH2 2.96Å; E116-R150 PolarHBondContact OE1-NH2 3.47Å; E116-R150 VanDerWaalsContact OE1-NH2 3.07Å; E116-R150 IonicContact OE2-CZ 3.4Å; E116-R150 IonicContact OE2-NE 2.87Å; E116-R150 IonicContact OE2-NH2 3.99Å; E116-R150 PolarHBondContact OE2-NH2 3Å; Y128-R150 HydrophobicContact CE1-CG 4.41Å; Y128-R150 HydrophobicContact CE2-CG 3.99Å; P146-R150 WeakPolarHBondContact O-CB 3.47Å; P146-R150 PolarHBondContact O-N 3.39Å; Y147-R150 PolarHBondContact O-N 3.41Å; L148-R150 VanDerWaalsContact C-N 3.29Å; L148-R150 PolarHBondContact O-N 3.46Å; R150-I152 VanDerWaalsContact C-N 3.31Å; R150-I152 PolarHBondContact O-N 3.29Å; R150-E153 IonicContact NH1-OE2 3.43Å; R150-E153 PolarHBondContact NH1-OE2 3.15Å; R150-E153 VanDerWaalsContact NH1-OE2 3.1Å; R150-E153 PolarHBondContact O-N 3.17Å; R150-I154 HydrophobicContact CG-CD1 4.25Å; R150-I154 WeakPolarHBondContact O-CG1 3.41Å; R150-I154 PolarHBondContact O-N 3.01Å
151S93.3Very high91.2Very high0 Ų061.7 Ų61.70%030%0.303CS..Hα-helixtrans-62.1-41.4178.2-55.90000111.6Y128 Y147 L148 K149 I154 V155Y128-S151 WeakPolarHBondContact CB-OG 3.49Å; Y147-S151 PolarHBondContact O-N 3.33Å; Y147-S151 PolarHBondContact O-OG 2.7Å; L148-S151 WeakPolarHBondContact O-CB 3.41Å; L148-S151 PolarHBondContact O-N 3.32Å; L148-S151 VanDerWaalsContact O-N 3.09Å; K149-S151 PolarHBondContact O-N 3.01Å; S151-I154 PolarHBondContact O-N 2.9Å; S151-V155 WeakPolarHBondContact O-CB 3.44Å; S151-V155 WeakPolarHBondContact O-CG2 3.38Å; S151-V155 PolarHBondContact O-N 2.62Å
152I93.2Very high91.1Very high14 Ų1460.7 Ų60.77%0.07230%0.299CS..Hα-helixtrans-63.5-43.2178.5-68.7163.5000111L148 K149 R150 I154 V155 S156 L165 Y166 L169L148-I152 VanDerWaalsContact O-CG1 3.29Å; L148-I152 WeakPolarHBondContact O-CG1 3.12Å; L148-I152 PolarHBondContact O-N 3.42Å; K149-I152 PolarHBondContact O-N 3.08Å; R150-I152 VanDerWaalsContact C-N 3.31Å; R150-I152 PolarHBondContact O-N 3.29Å; I152-I154 VanDerWaalsContact C-N 3.29Å; I152-I154 PolarHBondContact O-N 3.33Å; I152-V155 PolarHBondContact O-N 3.49Å; I152-S156 PolarHBondContact O-N 3.12Å; I152-S156 VanDerWaalsContact O-N 3.12Å; I152-L165 HydrophobicContact CD1-CB 4.11Å; I152-L165 HydrophobicContact CG1-CB 3.57Å; I152-L165 HydrophobicContact CG1-CD1 3.97Å; I152-L165 HydrophobicContact CG1-CG 4.41Å; I152-Y166 HydrophobicContact CD1-CD1 3.81Å; I152-Y166 HydrophobicContact CD1-CD2 4.5Å; I152-Y166 HydrophobicContact CD1-CE1 3.84Å; I152-Y166 HydrophobicContact CD1-CE2 4.45Å; I152-Y166 HydrophobicContact CD1-CG 4.17Å; I152-Y166 HydrophobicContact CG2-CE1 4.14Å; I152-Y166 HydrophobicContact CG2-CE2 3.63Å; I152-Y166 VanDerWaalsContact CG2-CZ 3.42Å; I152-Y166 VanDerWaalsContact CG2-OH 3.26Å; I152-Y166 WeakPolarHBondContact CG2-OH 3.14Å; I152-L169 HydrophobicContact CD1-CD2 4.2Å
153E91.8Very high91Very high118 Ų11853.8 Ų53.855%0.55127%0.267SS*.Hα-helixtrans-56.6-43.6175.6-70.4169.1-172.300112K149 R150 S156K149-E153 WeakPolarHBondContact O-CG 3.48Å; K149-E153 PolarHBondContact O-N 3.21Å; K149-E153 VanDerWaalsContact O-N 3.09Å; R150-E153 IonicContact NH1-OE2 3.43Å; R150-E153 PolarHBondContact NH1-OE2 3.15Å; R150-E153 VanDerWaalsContact NH1-OE2 3.1Å; R150-E153 PolarHBondContact O-N 3.17Å; E153-S156 PolarHBondContact O-OG 3.26Å
154I91.1Very high90.9Very high32 Ų3252.3 Ų52.316%0.16426%0.261CS..Hα-helixtrans-68.4-41-179.5-62.6165.8000111.1E116 F121 T125 Y128 R150 S151 I152 S156E116-I154 HydrophobicContact CG-CD1 4.38Å; E116-I154 WeakPolarHBondContact OE1-CD1 3.09Å; F121-I154 HydrophobicContact CB-CG2 3.65Å; F121-I154 HydrophobicContact CD1-CG2 3.87Å; F121-I154 HydrophobicContact CG-CG2 4.11Å; T125-I154 WeakPolarHBondContact OG1-CG2 3.05Å; Y128-I154 HydrophobicContact CD2-CD1 3.96Å; Y128-I154 HydrophobicContact CE2-CD1 3.66Å; R150-I154 HydrophobicContact CG-CD1 4.25Å; R150-I154 WeakPolarHBondContact O-CG1 3.41Å; R150-I154 PolarHBondContact O-N 3.01Å; S151-I154 PolarHBondContact O-N 2.9Å; I152-I154 VanDerWaalsContact C-N 3.29Å; I152-I154 PolarHBondContact O-N 3.33Å; I154-S156 VanDerWaalsContact C-N 3.33Å; I154-S156 PolarHBondContact O-N 3Å
155V89.6Confident90.9Very high12 Ų1252.4 Ų52.47%0.07326%0.261CS..Hα-helixtrans-82.2-7.7-172.7171.60000113.5T125 S151 I152 K157 D158 L161 L165T125-V155 HydrophobicContact CG2-CG2 3.26Å; T125-V155 WeakPolarHBondContact OG1-CG2 3.35Å; S151-V155 WeakPolarHBondContact O-CB 3.44Å; S151-V155 WeakPolarHBondContact O-CG2 3.38Å; S151-V155 PolarHBondContact O-N 2.62Å; I152-V155 PolarHBondContact O-N 3.49Å; V155-K157 CarbonylContact O-C 3.52Å; V155-K157 PolarHBondContact O-N 2.94Å; V155-D158 HydrophobicContact CG1-CB 4.04Å; V155-D158 PolarHBondContact O-N 3.44Å; V155-L161 HydrophobicContact CB-CD2 4.43Å; V155-L161 HydrophobicContact CG1-CB 3.67Å; V155-L161 HydrophobicContact CG1-CD2 3.64Å; V155-L161 HydrophobicContact CG1-CG 3.66Å; V155-L161 HydrophobicContact CG2-CD2 3.79Å; V155-L161 HydrophobicContact CG2-CG 4.35Å; V155-L165 HydrophobicContact CB-CD1 4.26Å; V155-L165 HydrophobicContact CG1-CD1 4.43Å; V155-L165 HydrophobicContact CG2-CD1 4.1Å
156S80.2Confident90.9Very high87 Ų8753.2 Ų53.261%0.60826%0.263SS*.THydrogen-bonded Turntrans-35.6-19.9-171.352.40000119.7I152 E153 I154I152-S156 PolarHBondContact O-N 3.12Å; I152-S156 VanDerWaalsContact O-N 3.12Å; E153-S156 PolarHBondContact O-OG 3.26Å; I154-S156 VanDerWaalsContact C-N 3.33Å; I154-S156 PolarHBondContact O-N 3Å
157K83.4Confident90.8Very high202 Ų20253.1 Ų53.188%0.87826%0.255SS*.THydrogen-bonded Turntrans-86.7-27.1173.6-61.3-177.2179.4179.50115.3V155V155-K157 CarbonylContact O-C 3.52Å; V155-K157 PolarHBondContact O-N 2.94Å
158D86.2Confident90.8Very high82 Ų8253 Ų5344%0.43926%0.255SS..  trans-96.896.7179.6-177.9-11.3000109.3V155 L160 L161 S162V155-D158 HydrophobicContact CG1-CB 4.04Å; V155-D158 PolarHBondContact O-N 3.44Å; D158-L160 PolarHBondContact O-N 3.47Å; D158-L160 PolarHBondContact OD1-N 2.87Å; D158-L161 HydrophobicContact CB-CB 4.18Å; D158-L161 PolarHBondContact O-N 2.79Å; D158-L161 PolarHBondContact OD1-N 3.16Å; D158-L161 VanDerWaalsContact OD1-N 3.16Å; D158-S162 WeakPolarHBondContact O-CB 3.44Å; D158-S162 PolarHBondContact O-N 3.46Å
159V86.9Confident90.8Very high32 Ų3253.2 Ų53.219%0.19426%0.256CS..Hα-helixtrans-65.5-39.9-173.6-178.70000111.4L161 S162 L163 D196 Y205V159-L161 PolarHBondContact O-N 3.43Å; V159-S162 WeakPolarHBondContact CA-OG 3.36Å; V159-S162 WeakPolarHBondContact O-CB 3.25Å; V159-S162 PolarHBondContact O-N 3.16Å; V159-S162 VanDerWaalsContact O-N 3.16Å; V159-S162 PolarHBondContact O-OG 2.96Å; V159-L163 HydrophobicContact CG1-CD1 4.22Å; V159-L163 HydrophobicContact CG1-CG 4.28Å; V159-L163 WeakPolarHBondContact O-CG 3.1Å; V159-L163 PolarHBondContact O-N 3.32Å; V159-D196 WeakPolarHBondContact CB-OD2 3.43Å; V159-D196 WeakPolarHBondContact CG1-OD2 3.47Å; V159-D196 WeakPolarHBondContact CG2-OD2 3.44Å; V159-Y205 HydrophobicContact CG1-CE1 4.32Å
160L88.1Confident90.8Very high70 Ų7048 Ų4837%0.36623%0.233SC..Hα-helixtrans-63.7-44.7-179.5-176.464.9000111.4D158 S162 L163 E164 L204 Y208D158-L160 PolarHBondContact O-N 3.47Å; D158-L160 PolarHBondContact OD1-N 2.87Å; L160-S162 VanDerWaalsContact C-N 3.31Å; L160-L163 PolarHBondContact O-N 3.07Å; L160-E164 PolarHBondContact O-N 3.3Å; L160-L204 HydrophobicContact CD1-CD1 4.36Å; L160-Y208 HydrophobicContact CD1-CE2 4.4Å
161L89.7Confident90.8Very high52 Ų5245.5 Ų45.527%0.27222%0.224SC..Hα-helixtrans-66.4-37175.6-175.159.4000111.2T125 I129 V155 D158 V159 L163 E164 L165T125-L161 HydrophobicContact CG2-CD2 4.2Å; I129-L161 HydrophobicContact CD1-CD1 4.15Å; V155-L161 HydrophobicContact CB-CD2 4.43Å; V155-L161 HydrophobicContact CG1-CB 3.67Å; V155-L161 HydrophobicContact CG1-CD2 3.64Å; V155-L161 HydrophobicContact CG1-CG 3.66Å; V155-L161 HydrophobicContact CG2-CD2 3.79Å; V155-L161 HydrophobicContact CG2-CG 4.35Å; D158-L161 HydrophobicContact CB-CB 4.18Å; D158-L161 PolarHBondContact O-N 2.79Å; D158-L161 PolarHBondContact OD1-N 3.16Å; D158-L161 VanDerWaalsContact OD1-N 3.16Å; V159-L161 PolarHBondContact O-N 3.43Å; L161-L163 PolarHBondContact O-N 3.15Å; L161-E164 PolarHBondContact O-N 3.03Å; L161-L165 HydrophobicContact CG-CD1 4.46Å; L161-L165 VanDerWaalsContact O-CG 3.32Å; L161-L165 WeakPolarHBondContact O-CG 3.03Å; L161-L165 PolarHBondContact O-N 3.2Å
162S91.8Very high90.8Very high7 Ų745.5 Ų45.55%0.04922%0.224CC..Hα-helixtrans-61.1-42.9174.883.40000112D158 V159 L160 E164 L165 Y166D158-S162 WeakPolarHBondContact O-CB 3.44Å; D158-S162 PolarHBondContact O-N 3.46Å; V159-S162 WeakPolarHBondContact CA-OG 3.36Å; V159-S162 WeakPolarHBondContact O-CB 3.25Å; V159-S162 PolarHBondContact O-N 3.16Å; V159-S162 VanDerWaalsContact O-N 3.16Å; V159-S162 PolarHBondContact O-OG 2.96Å; L160-S162 VanDerWaalsContact C-N 3.31Å; S162-E164 PolarHBondContact O-N 3.02Å; S162-L165 WeakPolarHBondContact O-CB 3.47Å; S162-L165 PolarHBondContact O-N 3.41Å; S162-L165 VanDerWaalsContact O-N 3.17Å; S162-Y166 WeakPolarHBondContact O-CD2 3.14Å; S162-Y166 PolarHBondContact O-N 3.49Å
163L92Very high90.8Very high0 Ų045.2 Ų45.20%022%0.222CC..Hα-helixtrans-61.8-42.8178.2-72.9172.5000111.8V159 L160 L161 Y166 K167 I189 L192 Y205 Y208V159-L163 HydrophobicContact CG1-CD1 4.22Å; V159-L163 HydrophobicContact CG1-CG 4.28Å; V159-L163 WeakPolarHBondContact O-CG 3.1Å; V159-L163 PolarHBondContact O-N 3.32Å; L160-L163 PolarHBondContact O-N 3.07Å; L161-L163 PolarHBondContact O-N 3.15Å; L163-Y166 PolarHBondContact O-N 3.35Å; L163-K167 WeakPolarHBondContact O-CB 3.04Å; L163-K167 PolarHBondContact O-N 3.16Å; L163-I189 HydrophobicContact CD2-CG2 4.03Å; L163-L192 HydrophobicContact CD2-CB 3.88Å; L163-L192 HydrophobicContact CD2-CD1 4.12Å; L163-Y205 HydrophobicContact CD1-CD1 3.7Å; L163-Y205 HydrophobicContact CD1-CE1 3.56Å; L163-Y208 HydrophobicContact CB-CD1 4.36Å; L163-Y208 HydrophobicContact CB-CD2 4.36Å; L163-Y208 HydrophobicContact CB-CE1 4.24Å; L163-Y208 HydrophobicContact CB-CE2 4.26Å; L163-Y208 HydrophobicContact CB-CG 4.43Å; L163-Y208 HydrophobicContact CD1-CD2 4.2Å
164E92Very high90.8Very high46 Ų4640.4 Ų40.422%0.21520%0.2CC..Hα-helixtrans-64.1-39.3175174.558-161.100111.7L160 L161 S162 K167 R168 Y208L160-E164 PolarHBondContact O-N 3.3Å; L161-E164 PolarHBondContact O-N 3.03Å; S162-E164 PolarHBondContact O-N 3.02Å; E164-K167 WeakPolarHBondContact O-CB 3.04Å; E164-K167 PolarHBondContact O-N 3.12Å; E164-K167 IonicContact OE2-NZ 3.15Å; E164-R168 WeakPolarHBondContact O-CG 3.17Å; E164-R168 PolarHBondContact O-N 2.94Å; E164-R168 VanDerWaalsContact O-N 3.09Å; E164-R168 IonicContact OE1-CZ 3.26Å; E164-R168 IonicContact OE1-NE 3.07Å; E164-R168 PolarHBondContact OE1-NE 2.96Å; E164-R168 IonicContact OE1-NH2 2.8Å; E164-R168 PolarHBondContact OE1-NH2 3.39Å; E164-Y208 PolarHBondContact OE2-OH 3.23Å; E164-Y208 VanDerWaalsContact OE2-OH 3.12Å
165L93.7Very high90.9Very high1 Ų143.9 Ų43.91%0.00521%0.212CC..Hα-helixtrans-67.3-41.9174.9-69.1174.7000112.5I129 L148 I152 V155 L161 S162 K167 R168 L169I129-L165 HydrophobicContact CD1-CD2 4.11Å; I129-L165 HydrophobicContact CG1-CD2 3.77Å; L148-L165 HydrophobicContact CD2-CD2 4.04Å; I152-L165 HydrophobicContact CD1-CB 4.11Å; I152-L165 HydrophobicContact CG1-CB 3.57Å; I152-L165 HydrophobicContact CG1-CD1 3.97Å; I152-L165 HydrophobicContact CG1-CG 4.41Å; V155-L165 HydrophobicContact CB-CD1 4.26Å; V155-L165 HydrophobicContact CG1-CD1 4.43Å; V155-L165 HydrophobicContact CG2-CD1 4.1Å; L161-L165 HydrophobicContact CG-CD1 4.46Å; L161-L165 VanDerWaalsContact O-CG 3.32Å; L161-L165 WeakPolarHBondContact O-CG 3.03Å; L161-L165 PolarHBondContact O-N 3.2Å; S162-L165 WeakPolarHBondContact O-CB 3.47Å; S162-L165 PolarHBondContact O-N 3.41Å; S162-L165 VanDerWaalsContact O-N 3.17Å; L165-K167 VanDerWaalsContact C-N 3.33Å; L165-R168 PolarHBondContact O-N 2.92Å; L165-L169 PolarHBondContact O-N 3.21Å
166Y94.5Very high91Very high39 Ų3946.3 Ų46.315%0.15322%0.224CC..Hα-helixtrans-64.4-38.2175-81.5-65.2000111.9I152 S162 L163 L169 S170 T185 F188 I189 L192I152-Y166 HydrophobicContact CD1-CD1 3.81Å; I152-Y166 HydrophobicContact CD1-CD2 4.5Å; I152-Y166 HydrophobicContact CD1-CE1 3.84Å; I152-Y166 HydrophobicContact CD1-CE2 4.45Å; I152-Y166 HydrophobicContact CD1-CG 4.17Å; I152-Y166 HydrophobicContact CG2-CE1 4.14Å; I152-Y166 HydrophobicContact CG2-CE2 3.63Å; I152-Y166 VanDerWaalsContact CG2-CZ 3.42Å; I152-Y166 VanDerWaalsContact CG2-OH 3.26Å; I152-Y166 WeakPolarHBondContact CG2-OH 3.14Å; S162-Y166 WeakPolarHBondContact O-CD2 3.14Å; S162-Y166 PolarHBondContact O-N 3.49Å; L163-Y166 PolarHBondContact O-N 3.35Å; Y166-L169 HydrophobicContact CD1-CD2 4.19Å; Y166-L169 WeakPolarHBondContact O-CB 3.35Å; Y166-L169 PolarHBondContact O-N 3.44Å; Y166-S170 PolarHBondContact O-N 2.64Å; Y166-T185 HydrophobicContact CD1-CG2 3.96Å; Y166-T185 WeakPolarHBondContact O-CG2 3.26Å; Y166-F188 HydrophobicContact CD1-CD1 4.19Å; Y166-F188 HydrophobicContact CD2-CD1 4.06Å; Y166-F188 HydrophobicContact CD2-CE1 4.2Å; Y166-F188 AromaticContact CE1-CD1 3.64Å; Y166-F188 HydrophobicContact CE1-CD1 3.64Å; Y166-F188 AromaticContact CE1-CE1 3.97Å; Y166-F188 HydrophobicContact CE1-CE1 3.97Å; Y166-F188 HydrophobicContact CE1-CG 4.46Å; Y166-F188 AromaticContact CE2-CD1 3.56Å; Y166-F188 HydrophobicContact CE2-CD1 3.56Å; Y166-F188 AromaticContact CE2-CE1 3.32Å; Y166-F188 HydrophobicContact CE2-CE1 3.32Å; Y166-F188 HydrophobicContact CG-CD1 4.37Å; Y166-F188 AromaticContact CZ-CD1 3.3Å; Y166-F188 AromaticContact CZ-CE1 3.15Å; Y166-F188 WeakPolarHBondContact OH-CE1 3.46Å; Y166-I189 HydrophobicContact CG-CG1 4.37Å; Y166-L192 HydrophobicContact CD2-CD1 3.84Å; Y166-L192 HydrophobicContact CE2-CD1 3.72Å
167K93.2Very high91.4Very high69 Ų6947.8 Ų47.830%0.322%0.221SC..Hα-helixtrans-57.5-49.6171.5173.1-179.6166.7-165.70110.6L163 E164 L165 L169 S170 Y171 Y208L163-K167 WeakPolarHBondContact O-CB 3.04Å; L163-K167 PolarHBondContact O-N 3.16Å; E164-K167 WeakPolarHBondContact O-CB 3.04Å; E164-K167 PolarHBondContact O-N 3.12Å; E164-K167 IonicContact OE2-NZ 3.15Å; L165-K167 VanDerWaalsContact C-N 3.33Å; K167-L169 VanDerWaalsContact C-N 3.31Å; K167-L169 PolarHBondContact O-N 3.39Å; K167-S170 PolarHBondContact O-N 3.2Å; K167-S170 PolarHBondContact O-OG 2.81Å; K167-Y171 HydrophobicContact CD-CE2 4.25Å; K167-Y171 HydrophobicContact CG-CD2 3.95Å; K167-Y171 HydrophobicContact CG-CE2 3.54Å; K167-Y171 WeakPolarHBondContact O-CD2 3.46Å; K167-Y171 PolarHBondContact O-N 2.76Å; K167-Y171 VanDerWaalsContact O-N 3.09Å; K167-Y208 HydrophobicContact CB-CE1 4.06Å; K167-Y208 HydrophobicContact CD-CE1 3.73Å; K167-Y208 HydrophobicContact CG-CE1 4.49Å
168R93.8Very high91.7Very high52 Ų5241.2 Ų41.220%0.19620%0.196CC..Hα-helixtrans-60.5-38.9175.4-67.3178.5-166.3-1646.2113D133 M136 L148 E164 L165 Y171 C172D133-R168 IonicContact OD1-CZ 2.96Å; D133-R168 IonicContact OD1-NH1 2.77Å; D133-R168 PolarHBondContact OD1-NH1 2.85Å; D133-R168 IonicContact OD2-CZ 3.79Å; D133-R168 IonicContact OD2-NH1 2.64Å; D133-R168 PolarHBondContact OD2-NH1 3.25Å; M136-R168 HydrophobicContact SD-CB 4.32Å; L148-R168 HydrophobicContact CD1-CB 4.27Å; L148-R168 HydrophobicContact CD2-CB 4.03Å; E164-R168 WeakPolarHBondContact O-CG 3.17Å; E164-R168 PolarHBondContact O-N 2.94Å; E164-R168 VanDerWaalsContact O-N 3.09Å; E164-R168 IonicContact OE1-CZ 3.26Å; E164-R168 IonicContact OE1-NE 3.07Å; E164-R168 PolarHBondContact OE1-NE 2.96Å; E164-R168 IonicContact OE1-NH2 2.8Å; E164-R168 PolarHBondContact OE1-NH2 3.39Å; L165-R168 PolarHBondContact O-N 2.92Å; R168-Y171 PolarHBondContact O-N 3.28Å; R168-C172 PolarHBondContact O-N 2.93Å; R168-C172 PolarHBondContact O-SG 3.08Å
169L95.3Very high91.8Very high5 Ų539.5 Ų39.53%0.02618%0.183CC..Hα-helixtrans-61.6-45.5175.317964.1000111.5I145 L148 K149 I152 L165 Y166 K167 Y171 C172 Q173 T185I145-L169 HydrophobicContact CB-CD1 4.34Å; I145-L169 HydrophobicContact CG1-CD1 4.04Å; I145-L169 HydrophobicContact CG2-CD1 3.98Å; L148-L169 HydrophobicContact CB-CD1 4.31Å; L148-L169 HydrophobicContact CD1-CB 4.2Å; L148-L169 HydrophobicContact CD1-CD1 4.36Å; K149-L169 HydrophobicContact CG-CD2 4.46Å; I152-L169 HydrophobicContact CD1-CD2 4.2Å; L165-L169 PolarHBondContact O-N 3.21Å; Y166-L169 HydrophobicContact CD1-CD2 4.19Å; Y166-L169 WeakPolarHBondContact O-CB 3.35Å; Y166-L169 PolarHBondContact O-N 3.44Å; K167-L169 VanDerWaalsContact C-N 3.31Å; K167-L169 PolarHBondContact O-N 3.39Å; L169-Y171 VanDerWaalsContact C-N 3.33Å; L169-Y171 PolarHBondContact O-N 2.88Å; L169-C172 WeakPolarHBondContact O-CB 3.48Å; L169-C172 PolarHBondContact O-N 3.46Å; L169-Q173 WeakPolarHBondContact O-CG 3.21Å; L169-Q173 PolarHBondContact O-N 3.47Å; L169-T185 HydrophobicContact CB-CG2 4.44Å; L169-T185 HydrophobicContact CD2-CG2 4.2Å; L169-T185 HydrophobicContact CG-CG2 4.35Å
170S93.3Very high91.8Very high0 Ų041.9 Ų41.90%020%0.199CC..Hα-helixtrans-60.3-42.917874.30000111.5Y166 K167 C172 Q173 L174 F186Y166-S170 PolarHBondContact O-N 2.64Å; K167-S170 PolarHBondContact O-N 3.2Å; K167-S170 PolarHBondContact O-OG 2.81Å; S170-C172 PolarHBondContact O-N 3Å; S170-Q173 PolarHBondContact O-N 3.29Å; S170-L174 VanDerWaalsContact O-CG 3.31Å; S170-L174 WeakPolarHBondContact O-CG 3.35Å; S170-L174 PolarHBondContact O-N 2.81Å; S170-F186 VanDerWaalsContact CB-CZ 3.41Å; S170-F186 WeakPolarHBondContact OG-CE1 3.48Å; S170-F186 VanDerWaalsContact OG-CZ 3.28Å; S170-F186 WeakPolarHBondContact OG-CZ 3.32Å
171Y92.8Very high91.9Very high35 Ų3539 Ų3914%0.13719%0.186CC..Hα-helixtrans-62.1-44.1174-75.8-64.9000112.4K167 R168 L169 Q173 L174 Y175 F215 E302K167-Y171 HydrophobicContact CD-CE2 4.25Å; K167-Y171 HydrophobicContact CG-CD2 3.95Å; K167-Y171 HydrophobicContact CG-CE2 3.54Å; K167-Y171 WeakPolarHBondContact O-CD2 3.46Å; K167-Y171 PolarHBondContact O-N 2.76Å; K167-Y171 VanDerWaalsContact O-N 3.09Å; R168-Y171 PolarHBondContact O-N 3.28Å; L169-Y171 VanDerWaalsContact C-N 3.33Å; L169-Y171 PolarHBondContact O-N 2.88Å; Y171-Q173 PolarHBondContact O-N 3.18Å; Y171-L174 HydrophobicContact CD1-CD1 4.3Å; Y171-L174 PolarHBondContact O-N 2.77Å; Y171-Y175 WeakPolarHBondContact O-CD2 3.41Å; Y171-Y175 PolarHBondContact O-N 3.1Å; Y171-F215 HydrophobicContact CE1-CZ 4.46Å; Y171-E302 HydrophobicContact CD1-CG 4.17Å; Y171-E302 HydrophobicContact CE1-CB 4.22Å; Y171-E302 HydrophobicContact CE1-CG 3.71Å; Y171-E302 WeakPolarHBondContact CE1-OE1 3.48Å
172C93.8Very high91.9Very high0 Ų036.5 Ų36.50%017%0.173CC..Hα-helixtrans-57.9-40.6175.5-66.50000111.8F141 I145 R168 L169 S170 I176F141-C172 HydrophobicContact CB-CB 4.18Å; F141-C172 HydrophobicContact CD1-CB 4.41Å; I145-C172 HydrophobicContact CD1-CB 4.43Å; I145-C172 HydrophobicContact CG1-CB 3.94Å; R168-C172 PolarHBondContact O-N 2.93Å; R168-C172 PolarHBondContact O-SG 3.08Å; L169-C172 WeakPolarHBondContact O-CB 3.48Å; L169-C172 PolarHBondContact O-N 3.46Å; S170-C172 PolarHBondContact O-N 3Å; C172-I176 VanDerWaalsContact O-CD1 3.3Å; C172-I176 WeakPolarHBondContact O-CD1 3.36Å; C172-I176 VanDerWaalsContact O-CG1 3.24Å; C172-I176 WeakPolarHBondContact O-CG1 3.4Å; C172-I176 PolarHBondContact O-N 2.64Å
173Q93.4Very high91.8Very high9 Ų936.5 Ų36.54%0.04217%0.172CC..Hα-helixtrans-68.9-40.8178-69.2170.2-50.600112I145 L169 S170 Y171 Y175 I176 H177 D178 G181 A182 T185I145-Q173 HydrophobicContact CD1-CG 4.26Å; L169-Q173 WeakPolarHBondContact O-CG 3.21Å; L169-Q173 PolarHBondContact O-N 3.47Å; S170-Q173 PolarHBondContact O-N 3.29Å; Y171-Q173 PolarHBondContact O-N 3.18Å; Q173-Y175 PolarHBondContact O-N 2.98Å; Q173-I176 PolarHBondContact O-N 3.16Å; Q173-H177 PolarHBondContact O-N 3.18Å; Q173-D178 HydrophobicContact CB-CB 4.4Å; Q173-D178 PolarHBondContact O-N 3.39Å; Q173-G181 VanDerWaalsContact CD-C 3.43Å; Q173-G181 PolarHBondContact NE2-O 3.49Å; Q173-G181 PolarHBondContact OE1-O 3.31Å; Q173-A182 HydrophobicContact CB-CB 3.87Å; Q173-T185 PolarHBondContact NE2-OG1 3.39Å; Q173-T185 PolarHBondContact OE1-OG1 3.49Å
174L92.7Very high91.7Very high16 Ų1639.6 Ų39.68%0.08419%0.192CC..Hα-helixtrans-59.1-45.8175.1-71173.3000111.8S170 Y171 I176 H177 W179 A182 F186 F215 L219 L306S170-L174 VanDerWaalsContact O-CG 3.31Å; S170-L174 WeakPolarHBondContact O-CG 3.35Å; S170-L174 PolarHBondContact O-N 2.81Å; Y171-L174 HydrophobicContact CD1-CD1 4.3Å; Y171-L174 PolarHBondContact O-N 2.77Å; L174-I176 VanDerWaalsContact C-N 3.32Å; L174-I176 PolarHBondContact O-N 3.11Å; L174-H177 PolarHBondContact O-N 3.18Å; L174-H177 VanDerWaalsContact O-N 3.07Å; L174-W179 HydrophobicContact CD2-CE3 4.14Å; L174-W179 HydrophobicContact CD2-CZ3 3.92Å; L174-A182 HydrophobicContact CD2-CB 4Å; L174-A182 HydrophobicContact CG-CB 4.27Å; L174-F186 HydrophobicContact CD1-CE2 4.19Å; L174-F186 HydrophobicContact CD1-CZ 4.14Å; L174-F186 HydrophobicContact CG-CE2 4.48Å; L174-F215 HydrophobicContact CD1-CD1 4.14Å; L174-F215 HydrophobicContact CD1-CE1 3.58Å; L174-F215 HydrophobicContact CD1-CZ 3.96Å; L174-L219 HydrophobicContact CD2-CD1 4.42Å; L174-L219 HydrophobicContact CD2-CD2 4Å; L174-L306 HydrophobicContact CD2-CD1 4.1Å; L174-L306 HydrophobicContact CD2-CD2 4.32Å
175Y91.6Very high91.6Very high105 Ų10537.8 Ų37.841%0.41218%0.184SC..Hα-helixtrans-69.5-24.4179.8-76-65.4000114.4F141 Y171 Q173 H177F141-Y175 HydrophobicContact CD1-CD2 4.02Å; F141-Y175 HydrophobicContact CD1-CG 4.41Å; F141-Y175 VanDerWaalsContact CD2-CB 3.44Å; F141-Y175 HydrophobicContact CD2-CD2 4.48Å; F141-Y175 HydrophobicContact CD2-CG 4.08Å; F141-Y175 AromaticContact CE1-CD2 3.51Å; F141-Y175 HydrophobicContact CE1-CD2 3.51Å; F141-Y175 HydrophobicContact CE1-CE2 4.09Å; F141-Y175 HydrophobicContact CE1-CG 4.02Å; F141-Y175 HydrophobicContact CE2-CD1 4.14Å; F141-Y175 HydrophobicContact CE2-CD2 4.02Å; F141-Y175 AromaticContact CE2-CG 3.64Å; F141-Y175 HydrophobicContact CE2-CG 3.64Å; F141-Y175 HydrophobicContact CG-CD2 4.48Å; F141-Y175 HydrophobicContact CG-CG 4.44Å; F141-Y175 HydrophobicContact CZ-CD1 4.16Å; F141-Y175 AromaticContact CZ-CD2 3.5Å; F141-Y175 HydrophobicContact CZ-CD2 3.5Å; F141-Y175 VanDerWaalsContact CZ-CD2 3.5Å; F141-Y175 HydrophobicContact CZ-CE2 4.02Å; F141-Y175 AromaticContact CZ-CG 3.6Å; F141-Y175 HydrophobicContact CZ-CG 3.6Å; Y171-Y175 WeakPolarHBondContact O-CD2 3.41Å; Y171-Y175 PolarHBondContact O-N 3.1Å; Q173-Y175 PolarHBondContact O-N 2.98Å; Y175-H177 VanDerWaalsContact C-N 3.28Å
176I92.3Very high91.5Very high63 Ų6338 Ų3832%0.32318%0.184SC..Hα-helixtrans-85.5-7.1174.3-61.4163.6000111.1F141 H142 I145 C172 Q173 L174 D178F141-I176 HydrophobicContact CB-CD1 3.78Å; F141-I176 HydrophobicContact CB-CG1 3.7Å; H142-I176 VanDerWaalsContact CA-CD1 3.48Å; H142-I176 HydrophobicContact CB-CD1 3.95Å; I145-I176 HydrophobicContact CD1-CD1 3.47Å; I145-I176 VanDerWaalsContact CD1-CD1 3.47Å; I145-I176 HydrophobicContact CG1-CD1 4.46Å; C172-I176 VanDerWaalsContact O-CD1 3.3Å; C172-I176 WeakPolarHBondContact O-CD1 3.36Å; C172-I176 VanDerWaalsContact O-CG1 3.24Å; C172-I176 WeakPolarHBondContact O-CG1 3.4Å; C172-I176 PolarHBondContact O-N 2.64Å; Q173-I176 PolarHBondContact O-N 3.16Å; L174-I176 VanDerWaalsContact C-N 3.32Å; L174-I176 PolarHBondContact O-N 3.11Å; I176-D178 VanDerWaalsContact C-N 3.25Å; I176-D178 PolarHBondContact O-N 2.87Å
177H89.2Confident91.2Very high118 Ų11836.6 Ų36.655%0.54618%0.18SC..THydrogen-bonded Turntrans62.129.4-170.1-52-64.8000113.5Q173 L174 Y175 W179Q173-H177 PolarHBondContact O-N 3.18Å; L174-H177 PolarHBondContact O-N 3.18Å; L174-H177 VanDerWaalsContact O-N 3.07Å; Y175-H177 VanDerWaalsContact C-N 3.28Å; H177-W179 VanDerWaalsContact C-N 3.26Å; H177-W179 HydrophobicContact CB-CH2 4.26Å; H177-W179 HydrophobicContact CB-CZ2 3.74Å; H177-W179 AromaticContact CG-CZ2 3.77Å; H177-W179 AromaticContact ND1-CH2 3.12Å; H177-W179 WeakPolarHBondContact ND1-CH2 3.32Å; H177-W179 AromaticContact ND1-CZ2 3.12Å; H177-W179 WeakPolarHBondContact ND1-CZ2 3.23Å; H177-W179 PolarHBondContact O-N 3.14Å; H177-W179 VanDerWaalsContact O-N 3.09Å
178D90Very high91Very high65 Ų6537.4 Ų37.435%0.34818%0.184SC..  trans-83.473.3169.3-179.917.1000109.7Q173 I176 G181 A182Q173-D178 HydrophobicContact CB-CB 4.4Å; Q173-D178 PolarHBondContact O-N 3.39Å; I176-D178 VanDerWaalsContact C-N 3.25Å; I176-D178 PolarHBondContact O-N 2.87Å; D178-G181 PolarHBondContact O-N 3.25Å; D178-G181 PolarHBondContact OD1-N 3.09Å; D178-G181 VanDerWaalsContact OD1-N 3.13Å; D178-A182 WeakPolarHBondContact O-CB 2.99Å; D178-A182 PolarHBondContact O-N 3.36Å
179W88.4Confident90.9Very high46 Ų4635.1 Ų35.117%0.17418%0.175CC..Hα-helixtrans-62.1-44.2-175.7-42.8126.3000114.2L174 H177 G181 A182 L183 L219 L222 C223 L306 L309L174-W179 HydrophobicContact CD2-CE3 4.14Å; L174-W179 HydrophobicContact CD2-CZ3 3.92Å; H177-W179 VanDerWaalsContact C-N 3.26Å; H177-W179 HydrophobicContact CB-CH2 4.26Å; H177-W179 HydrophobicContact CB-CZ2 3.74Å; H177-W179 AromaticContact CG-CZ2 3.77Å; H177-W179 AromaticContact ND1-CH2 3.12Å; H177-W179 WeakPolarHBondContact ND1-CH2 3.32Å; H177-W179 AromaticContact ND1-CZ2 3.12Å; H177-W179 WeakPolarHBondContact ND1-CZ2 3.23Å; H177-W179 PolarHBondContact O-N 3.14Å; H177-W179 VanDerWaalsContact O-N 3.09Å; W179-G181 VanDerWaalsContact C-N 3.32Å; W179-G181 PolarHBondContact O-N 3.28Å; W179-A182 PolarHBondContact O-N 3.01Å; W179-L183 WeakPolarHBondContact O-CB 3.27Å; W179-L183 PolarHBondContact O-N 3.44Å; W179-L219 HydrophobicContact CB-CD2 4.23Å; W179-L219 HydrophobicContact CD2-CD2 4.48Å; W179-L219 HydrophobicContact CE3-CD2 3.79Å; W179-L222 HydrophobicContact CD2-CD2 3.65Å; W179-L222 HydrophobicContact CE3-CD2 4.1Å; W179-L222 HydrophobicContact CG-CD2 3.97Å; W179-L222 HydrophobicContact CH2-CD2 4.3Å; W179-L222 HydrophobicContact CZ2-CD2 3.89Å; W179-L222 HydrophobicContact CZ3-CD2 4.42Å; W179-C223 WeakPolarHBondContact CB-SG 3.41Å; W179-L306 HydrophobicContact CE3-CD2 4.08Å; W179-L306 HydrophobicContact CH2-CD2 3.84Å; W179-L306 HydrophobicContact CZ3-CD2 3.46Å; W179-L306 VanDerWaalsContact CZ3-CD2 3.46Å; W179-L309 HydrophobicContact CH2-CD1 3.68Å; W179-L309 HydrophobicContact CZ2-CD1 3.81Å
180P87.2Confident90.5Very high81 Ų8135.2 Ų35.253%0.52618%0.175SC..Hα-helixtrans-62.7-40.4176.2-21.434.7000111.7L183 T184P180-L183 PolarHBondContact O-N 3.32Å; P180-T184 WeakPolarHBondContact O-CG2 3.43Å; P180-T184 PolarHBondContact O-N 3.07Å; P180-T184 VanDerWaalsContact O-N 3.09Å
181G88.8Confident90.1Very high10 Ų1037.7 Ų37.710%0.10319%0.189CC..Hα-helixtrans-60.7-48.6174.200000112Q173 D178 W179 L183 T184 T185Q173-G181 VanDerWaalsContact CD-C 3.43Å; Q173-G181 PolarHBondContact NE2-O 3.49Å; Q173-G181 PolarHBondContact OE1-O 3.31Å; D178-G181 PolarHBondContact O-N 3.25Å; D178-G181 PolarHBondContact OD1-N 3.09Å; D178-G181 VanDerWaalsContact OD1-N 3.13Å; W179-G181 VanDerWaalsContact C-N 3.32Å; W179-G181 PolarHBondContact O-N 3.28Å; G181-L183 VanDerWaalsContact C-N 3.32Å; G181-L183 PolarHBondContact O-N 2.89Å; G181-T184 PolarHBondContact O-N 3.24Å; G181-T184 PolarHBondContact O-OG1 3.29Å; G181-T185 PolarHBondContact O-N 3.01Å; G181-T185 VanDerWaalsContact O-N 3.13Å; G181-T185 PolarHBondContact O-OG1 3.47Å
182A91Very high89.8Confident0 Ų037.3 Ų37.30%019%0.189CC..Hα-helixtrans-58.3-44.1177.500000111.7Q173 L174 D178 W179 T184 T185 F186 L219Q173-A182 HydrophobicContact CB-CB 3.87Å; L174-A182 HydrophobicContact CD2-CB 4Å; L174-A182 HydrophobicContact CG-CB 4.27Å; D178-A182 WeakPolarHBondContact O-CB 2.99Å; D178-A182 PolarHBondContact O-N 3.36Å; W179-A182 PolarHBondContact O-N 3.01Å; A182-T184 PolarHBondContact O-N 3.12Å; A182-T185 WeakPolarHBondContact O-CB 3.46Å; A182-T185 PolarHBondContact O-N 2.87Å; A182-F186 HydrophobicContact CB-CE2 4.37Å; A182-F186 WeakPolarHBondContact O-CD2 3.46Å; A182-F186 PolarHBondContact O-N 3.42Å; A182-L219 HydrophobicContact CB-CD1 3.87Å
183L88.7Confident89.4Confident6 Ų637.3 Ų37.33%0.03119%0.189CC..Hα-helixtrans-60.5-45.8178.9179.759.1000111.9W179 P180 G181 T185 F186 I187 R216 L219 I220 Y237W179-L183 WeakPolarHBondContact O-CB 3.27Å; W179-L183 PolarHBondContact O-N 3.44Å; P180-L183 PolarHBondContact O-N 3.32Å; G181-L183 VanDerWaalsContact C-N 3.32Å; G181-L183 PolarHBondContact O-N 2.89Å; L183-T185 VanDerWaalsContact C-N 3.28Å; L183-T185 PolarHBondContact O-N 2.74Å; L183-F186 PolarHBondContact O-N 3Å; L183-I187 HydrophobicContact CD1-CD1 4.12Å; L183-I187 HydrophobicContact CD1-CG1 4.38Å; L183-I187 HydrophobicContact CG-CD1 4.07Å; L183-I187 WeakPolarHBondContact O-CG1 3.37Å; L183-I187 PolarHBondContact O-N 3.16Å; L183-R216 HydrophobicContact CD1-CB 4.35Å; L183-R216 HydrophobicContact CD1-CG 3.75Å; L183-L219 HydrophobicContact CB-CB 4.33Å; L183-L219 HydrophobicContact CB-CD1 4.3Å; L183-L219 HydrophobicContact CD1-CB 4.19Å; L183-I220 HydrophobicContact CD1-CD1 4.35Å; L183-I220 HydrophobicContact CD1-CG1 3.84Å; L183-I220 HydrophobicContact CD2-CG1 3.92Å; L183-Y237 HydrophobicContact CD2-CD1 3.69Å; L183-Y237 HydrophobicContact CD2-CE1 3.65Å; L183-Y237 HydrophobicContact CG-CD1 4.22Å; L183-Y237 HydrophobicContact CG-CE1 3.91Å
184T89.7Confident88.8Confident66 Ų6641 Ų4141%0.40521%0.205SC..Hα-helixtrans-59.8-40.1176.560.20000112P180 G181 A182 F188 Y237P180-T184 WeakPolarHBondContact O-CG2 3.43Å; P180-T184 PolarHBondContact O-N 3.07Å; P180-T184 VanDerWaalsContact O-N 3.09Å; G181-T184 PolarHBondContact O-N 3.24Å; G181-T184 PolarHBondContact O-OG1 3.29Å; A182-T184 PolarHBondContact O-N 3.12Å; T184-F188 PolarHBondContact O-N 3.22Å; T184-Y237 WeakPolarHBondContact CG2-OH 3.45Å
185T91.2Very high88.2Confident8 Ų846.8 Ų46.85%0.04923%0.231CC..Hα-helixtrans-66.2-43.6178-58.70000111.7Y166 L169 Q173 G181 A182 L183 F188 I189Y166-T185 HydrophobicContact CD1-CG2 3.96Å; Y166-T185 WeakPolarHBondContact O-CG2 3.26Å; L169-T185 HydrophobicContact CB-CG2 4.44Å; L169-T185 HydrophobicContact CD2-CG2 4.2Å; L169-T185 HydrophobicContact CG-CG2 4.35Å; Q173-T185 PolarHBondContact NE2-OG1 3.39Å; Q173-T185 PolarHBondContact OE1-OG1 3.49Å; G181-T185 PolarHBondContact O-N 3.01Å; G181-T185 VanDerWaalsContact O-N 3.13Å; G181-T185 PolarHBondContact O-OG1 3.47Å; A182-T185 WeakPolarHBondContact O-CB 3.46Å; A182-T185 PolarHBondContact O-N 2.87Å; L183-T185 VanDerWaalsContact C-N 3.28Å; L183-T185 PolarHBondContact O-N 2.74Å; T185-F188 WeakPolarHBondContact O-CB 3.37Å; T185-F188 PolarHBondContact O-N 2.94Å; T185-I189 HydrophobicContact CG2-CD1 4.27Å; T185-I189 WeakPolarHBondContact O-CG1 3.43Å; T185-I189 PolarHBondContact O-N 2.83Å
186F91.4Very high87.2Confident4 Ų443.6 Ų43.62%0.01822%0.221CC..Hα-helixtrans-66.3-39.6178.1-75.5-60.8000112.9S170 L174 A182 L183 F188 I189 Q190 F215 L219S170-F186 VanDerWaalsContact CB-CZ 3.41Å; S170-F186 WeakPolarHBondContact OG-CE1 3.48Å; S170-F186 VanDerWaalsContact OG-CZ 3.28Å; S170-F186 WeakPolarHBondContact OG-CZ 3.32Å; L174-F186 HydrophobicContact CD1-CE2 4.19Å; L174-F186 HydrophobicContact CD1-CZ 4.14Å; L174-F186 HydrophobicContact CG-CE2 4.48Å; A182-F186 HydrophobicContact CB-CE2 4.37Å; A182-F186 WeakPolarHBondContact O-CD2 3.46Å; A182-F186 PolarHBondContact O-N 3.42Å; L183-F186 PolarHBondContact O-N 3Å; F186-F188 VanDerWaalsContact C-N 3.25Å; F186-F188 PolarHBondContact O-N 3.42Å; F186-I189 HydrophobicContact CD1-CD1 3.99Å; F186-I189 HydrophobicContact CE1-CD1 4.39Å; F186-I189 WeakPolarHBondContact O-CB 3.47Å; F186-I189 PolarHBondContact O-N 3.47Å; F186-Q190 WeakPolarHBondContact O-CG 3.39Å; F186-Q190 PolarHBondContact O-N 3.12Å; F186-F215 HydrophobicContact CD1-CB 4.02Å; F186-F215 HydrophobicContact CD1-CD2 4.2Å; F186-F215 HydrophobicContact CD1-CG 4.42Å; F186-F215 HydrophobicContact CD2-CB 3.62Å; F186-F215 HydrophobicContact CD2-CG 4.23Å; F186-F215 HydrophobicContact CE1-CB 3.93Å; F186-F215 AromaticContact CE1-CD2 3.39Å; F186-F215 HydrophobicContact CE1-CD2 3.39Å; F186-F215 HydrophobicContact CE1-CE2 4.04Å; F186-F215 AromaticContact CE1-CG 3.83Å; F186-F215 HydrophobicContact CE1-CG 3.83Å; F186-F215 HydrophobicContact CE2-CB 3.52Å; F186-F215 AromaticContact CE2-CD1 3.98Å; F186-F215 HydrophobicContact CE2-CD1 3.98Å; F186-F215 HydrophobicContact CE2-CD2 4.01Å; F186-F215 AromaticContact CE2-CG 3.6Å; F186-F215 HydrophobicContact CE2-CG 3.6Å; F186-F215 HydrophobicContact CG-CB 3.88Å; F186-F215 HydrophobicContact CZ-CB 3.67Å; F186-F215 AromaticContact CZ-CD1 3.93Å; F186-F215 HydrophobicContact CZ-CD1 3.93Å; F186-F215 AromaticContact CZ-CD2 3.27Å; F186-F215 HydrophobicContact CZ-CD2 3.27Å; F186-F215 HydrophobicContact CZ-CE1 4.36Å; F186-F215 AromaticContact CZ-CE2 3.76Å; F186-F215 HydrophobicContact CZ-CE2 3.76Å; F186-F215 AromaticContact CZ-CG 3.36Å; F186-F215 HydrophobicContact CZ-CG 3.36Å; F186-F215 HydrophobicContact CZ-CZ 4.27Å; F186-L219 HydrophobicContact CD2-CD1 3.59Å; F186-L219 HydrophobicContact CE2-CD1 3.85Å
187I87.9Confident86Confident11 Ų1141.4 Ų41.46%0.05621%0.21CC..Hα-helixtrans-59.2-41.9172.4-68.9167.5000110.2L183 Q190 N191 R216 D236 Y237L183-I187 HydrophobicContact CD1-CD1 4.12Å; L183-I187 HydrophobicContact CD1-CG1 4.38Å; L183-I187 HydrophobicContact CG-CD1 4.07Å; L183-I187 WeakPolarHBondContact O-CG1 3.37Å; L183-I187 PolarHBondContact O-N 3.16Å; I187-Q190 WeakPolarHBondContact O-CB 3.29Å; I187-Q190 PolarHBondContact O-N 3.06Å; I187-N191 PolarHBondContact O-N 3.41Å; I187-R216 HydrophobicContact CG1-CG 4.23Å; I187-D236 HydrophobicContact CD1-CB 4.44Å; I187-D236 HydrophobicContact CG2-CB 3.8Å; I187-Y237 HydrophobicContact CD1-CD1 3.82Å; I187-Y237 HydrophobicContact CD1-CE1 3.54Å; I187-Y237 HydrophobicContact CD1-CE2 4.28Å; I187-Y237 HydrophobicContact CD1-CG 4.31Å
188F89.6Confident84.7Confident86 Ų8639.9 Ų39.938%0.37722%0.218SC..Hα-helixtrans-63.7-43.4177.3-164.8-94.9000112.7Y166 T184 T185 F186 Q190 N191 L192Y166-F188 HydrophobicContact CD1-CD1 4.19Å; Y166-F188 HydrophobicContact CD2-CD1 4.06Å; Y166-F188 HydrophobicContact CD2-CE1 4.2Å; Y166-F188 AromaticContact CE1-CD1 3.64Å; Y166-F188 HydrophobicContact CE1-CD1 3.64Å; Y166-F188 AromaticContact CE1-CE1 3.97Å; Y166-F188 HydrophobicContact CE1-CE1 3.97Å; Y166-F188 HydrophobicContact CE1-CG 4.46Å; Y166-F188 AromaticContact CE2-CD1 3.56Å; Y166-F188 HydrophobicContact CE2-CD1 3.56Å; Y166-F188 AromaticContact CE2-CE1 3.32Å; Y166-F188 HydrophobicContact CE2-CE1 3.32Å; Y166-F188 HydrophobicContact CG-CD1 4.37Å; Y166-F188 AromaticContact CZ-CD1 3.3Å; Y166-F188 AromaticContact CZ-CE1 3.15Å; Y166-F188 WeakPolarHBondContact OH-CE1 3.46Å; T184-F188 PolarHBondContact O-N 3.22Å; T185-F188 WeakPolarHBondContact O-CB 3.37Å; T185-F188 PolarHBondContact O-N 2.94Å; F186-F188 VanDerWaalsContact C-N 3.25Å; F186-F188 PolarHBondContact O-N 3.42Å; F188-Q190 VanDerWaalsContact C-N 3.27Å; F188-Q190 PolarHBondContact O-N 3.32Å; F188-N191 PolarHBondContact O-N 2.93Å; F188-L192 HydrophobicContact CD1-CD1 3.7Å; F188-L192 HydrophobicContact CD1-CG 3.95Å; F188-L192 HydrophobicContact CE1-CD1 3.34Å; F188-L192 HydrophobicContact CE1-CD2 4.01Å; F188-L192 HydrophobicContact CE1-CG 3.58Å; F188-L192 HydrophobicContact CZ-CD1 4.33Å; F188-L192 HydrophobicContact CZ-CD2 4.21Å; F188-L192 HydrophobicContact CZ-CG 4.19Å; F188-L192 PolarHBondContact O-N 3.14Å
189I90.2Very high83.3Confident3 Ų342 Ų422%0.01523%0.229CC..Hα-helixtrans-55.9-43.3174-70.4168.1000110.7L163 Y166 T185 F186 A193L163-I189 HydrophobicContact CD2-CG2 4.03Å; Y166-I189 HydrophobicContact CG-CG1 4.37Å; T185-I189 HydrophobicContact CG2-CD1 4.27Å; T185-I189 WeakPolarHBondContact O-CG1 3.43Å; T185-I189 PolarHBondContact O-N 2.83Å; F186-I189 HydrophobicContact CD1-CD1 3.99Å; F186-I189 HydrophobicContact CE1-CD1 4.39Å; F186-I189 WeakPolarHBondContact O-CB 3.47Å; F186-I189 PolarHBondContact O-N 3.47Å; I189-A193 VanDerWaalsContact O-CB 3.3Å; I189-A193 WeakPolarHBondContact O-CB 3.43Å; I189-A193 PolarHBondContact O-N 2.82Å
190Q86.9Confident81.7Confident8 Ų846.7 Ų46.74%0.03726%0.257CS..Hα-helixtrans-64.6-42.9178.4-70.7-176.1-29.300112.8F186 I187 F188 A193 K194 S212 E213 R216F186-Q190 WeakPolarHBondContact O-CG 3.39Å; F186-Q190 PolarHBondContact O-N 3.12Å; I187-Q190 WeakPolarHBondContact O-CB 3.29Å; I187-Q190 PolarHBondContact O-N 3.06Å; F188-Q190 VanDerWaalsContact C-N 3.27Å; F188-Q190 PolarHBondContact O-N 3.32Å; Q190-A193 PolarHBondContact O-N 3.02Å; Q190-K194 WeakPolarHBondContact O-CB 3.49Å; Q190-K194 VanDerWaalsContact O-CG 3.23Å; Q190-K194 WeakPolarHBondContact O-CG 3.5Å; Q190-K194 PolarHBondContact O-N 3.09Å; Q190-S212 WeakPolarHBondContact CG-OG 3.26Å; Q190-E213 VanDerWaalsContact NE2-N 3.19Å; Q190-E213 PolarHBondContact NE2-OE2 3.1Å; Q190-R216 VanDerWaalsContact OE1-CD 3.29Å
191N86.4Confident80.4Confident52 Ų5245.6 Ų45.628%0.27825%0.251SS..Hα-helixtrans-65.2-45.8-179.8-70.4-14.9000110.6I187 F188 A193 K194 E195I187-N191 PolarHBondContact O-N 3.41Å; F188-N191 PolarHBondContact O-N 2.93Å; N191-A193 PolarHBondContact O-N 3.27Å; N191-K194 PolarHBondContact O-N 3Å; N191-E195 WeakPolarHBondContact O-CG 3.3Å; N191-E195 PolarHBondContact O-N 3.28Å; N191-E195 VanDerWaalsContact O-N 3.14Å
192L86.3Confident79.6Confident27 Ų2750.7 Ų50.714%0.14127%0.271CS..Hα-helixtrans-58.8-45.9173.4-74.7-177.4000112.5L163 Y166 F188 K194 E195 D196L163-L192 HydrophobicContact CD2-CB 3.88Å; L163-L192 HydrophobicContact CD2-CD1 4.12Å; Y166-L192 HydrophobicContact CD2-CD1 3.84Å; Y166-L192 HydrophobicContact CE2-CD1 3.72Å; F188-L192 HydrophobicContact CD1-CD1 3.7Å; F188-L192 HydrophobicContact CD1-CG 3.95Å; F188-L192 HydrophobicContact CE1-CD1 3.34Å; F188-L192 HydrophobicContact CE1-CD2 4.01Å; F188-L192 HydrophobicContact CE1-CG 3.58Å; F188-L192 HydrophobicContact CZ-CD1 4.33Å; F188-L192 HydrophobicContact CZ-CD2 4.21Å; F188-L192 HydrophobicContact CZ-CG 4.19Å; F188-L192 PolarHBondContact O-N 3.14Å; L192-K194 VanDerWaalsContact C-N 3.29Å; L192-K194 PolarHBondContact O-N 3.43Å; L192-E195 PolarHBondContact O-N 2.66Å; L192-D196 PolarHBondContact O-N 2.92Å
193A84.5Confident79Confident0 Ų056.7 Ų56.70%030%0.303CS..Hα-helixtrans-65.9-32-179.400000112.7I189 Q190 N191 L197 Y205 W209I189-A193 VanDerWaalsContact O-CB 3.3Å; I189-A193 WeakPolarHBondContact O-CB 3.43Å; I189-A193 PolarHBondContact O-N 2.82Å; Q190-A193 PolarHBondContact O-N 3.02Å; N191-A193 PolarHBondContact O-N 3.27Å; A193-L197 WeakPolarHBondContact O-CB 3.47Å; A193-L197 PolarHBondContact O-N 2.87Å; A193-Y205 HydrophobicContact CB-CD1 4.46Å; A193-W209 HydrophobicContact CB-CB 4.37Å
194K81.6Confident78.7Confident86 Ų8660.8 Ų60.837%0.37432%0.324SS..Hα-helixtrans-70.4-39.5176.2-76.1172.8-173.3176.30112.6Q190 N191 L192Q190-K194 WeakPolarHBondContact O-CB 3.49Å; Q190-K194 VanDerWaalsContact O-CG 3.23Å; Q190-K194 WeakPolarHBondContact O-CG 3.5Å; Q190-K194 PolarHBondContact O-N 3.09Å; N191-K194 PolarHBondContact O-N 3Å; L192-K194 VanDerWaalsContact C-N 3.29Å; L192-K194 PolarHBondContact O-N 3.43Å
195E79.6Confident78.4Confident137 Ų13758.6 Ų58.664%0.6431%0.309SS*.Hα-helixtrans-63.8-43.3-179.3-73.1177.6178.900111.6N191 L192N191-E195 WeakPolarHBondContact O-CG 3.3Å; N191-E195 PolarHBondContact O-N 3.28Å; N191-E195 VanDerWaalsContact O-N 3.14Å; L192-E195 PolarHBondContact O-N 2.66Å
196D71Confident78.1Confident38 Ų3860.1 Ų60.120%0.20332%0.316CS..Hα-helixtrans-90-16.1-175.1-88.50.7000115.1V159 L192 A198 L199 Y205V159-D196 WeakPolarHBondContact CB-OD2 3.43Å; V159-D196 WeakPolarHBondContact CG1-OD2 3.47Å; V159-D196 WeakPolarHBondContact CG2-OD2 3.44Å; L192-D196 PolarHBondContact O-N 2.92Å; D196-A198 PolarHBondContact O-N 3.3Å; D196-A198 VanDerWaalsContact O-N 3.15Å; D196-L199 PolarHBondContact O-N 3.02Å; D196-Y205 HydrophobicContact CB-CD1 4.35Å; D196-Y205 HydrophobicContact CB-CE1 3.81Å
197L65.9Low77.8Confident17 Ų1765.1 Ų65.19%0.08934%0.34CS..Hα-helixtrans-60.9-25.2173.3-16192.1000111.6A193 L199 F202 I206 Y264A193-L197 WeakPolarHBondContact O-CB 3.47Å; A193-L197 PolarHBondContact O-N 2.87Å; L197-L199 PolarHBondContact O-N 3.25Å; L197-L199 VanDerWaalsContact O-N 3.15Å; L197-F202 HydrophobicContact CD1-CD1 4.03Å; L197-F202 HydrophobicContact CD2-CD1 4.14Å; L197-F202 HydrophobicContact CD2-CE1 4.18Å; L197-F202 HydrophobicContact CG-CD1 4.04Å; L197-F202 HydrophobicContact CG-CE1 4.19Å; L197-I206 HydrophobicContact CD1-CG1 3.94Å; L197-Y264 HydrophobicContact CD1-CE1 4.11Å; L197-Y264 HydrophobicContact CD2-CE1 3.55Å; L197-Y264 WeakPolarHBondContact CD2-OH 3.43Å; L197-Y264 HydrophobicContact CG-CE1 4.24Å
198A62.5Low77.8Confident86 Ų8666.3 Ų66.371%0.71134%0.344SS*.THydrogen-bonded Turntrans-64.5-13.1173.400000113.7D196D196-A198 PolarHBondContact O-N 3.3Å; D196-A198 VanDerWaalsContact O-N 3.15Å
199L60.6Low77.7Confident111 Ų11162.4 Ų62.458%0.58133%0.327SS*.THydrogen-bonded Turntrans-125.124.8-158.7-71.6162.7000115.9D196 L197D196-L199 PolarHBondContact O-N 3.02Å; L197-L199 PolarHBondContact O-N 3.25Å; L197-L199 VanDerWaalsContact O-N 3.15Å
200N54.3Low77.5Confident144 Ų14463.5 Ų63.577%0.7733%0.334SS*.SBendtrans104.528.9160-45-59.4000119.7
201S61.2Low77.6Confident57 Ų5765.9 Ų65.940%0.39935%0.347SS..  trans-151.7115.9166.326.80000111.5Y205S201-Y205 WeakPolarHBondContact O-CD2 3.37Å; S201-Y205 WeakPolarHBondContact OG-CE2 3.25Å
202F71.7Confident77.7Confident117 Ų11763.4 Ų63.451%0.51333%0.334SS..  trans-94.5-52.1-166.4-70.7-80.9000113.4L197 L204 Y205 I206L197-F202 HydrophobicContact CD1-CD1 4.03Å; L197-F202 HydrophobicContact CD2-CD1 4.14Å; L197-F202 HydrophobicContact CD2-CE1 4.18Å; L197-F202 HydrophobicContact CG-CD1 4.04Å; L197-F202 HydrophobicContact CG-CE1 4.19Å; F202-L204 PolarHBondContact O-N 3.47Å; F202-Y205 PolarHBondContact O-N 2.87Å; F202-I206 HydrophobicContact CB-CD1 4.06Å; F202-I206 WeakPolarHBondContact O-CB 3.45Å; F202-I206 WeakPolarHBondContact O-CD1 3.16Å; F202-I206 WeakPolarHBondContact O-CG1 3.49Å; F202-I206 PolarHBondContact O-N 3.43Å
203D78.6Confident77.7Confident126 Ų12662.3 Ų62.367%0.67433%0.328SS*.Hα-helixtrans-66.8-45.5-161.5-61.3-13.3000114.3Q207D203-Q207 WeakPolarHBondContact O-CG 3.39Å; D203-Q207 PolarHBondContact O-N 3.39Å; D203-Q207 VanDerWaalsContact O-N 3.14Å
204L82.3Confident78Confident92 Ų9262.6 Ų62.648%0.48233%0.329SS..Hα-helixtrans-68.8-40.6-178.1-68.6175.4000112.1L160 F202 Q207 Y208L160-L204 HydrophobicContact CD1-CD1 4.36Å; F202-L204 PolarHBondContact O-N 3.47Å; L204-Q207 WeakPolarHBondContact O-CB 3.33Å; L204-Q207 PolarHBondContact O-N 2.98Å; L204-Y208 WeakPolarHBondContact O-CD2 3.48Å; L204-Y208 PolarHBondContact O-N 3.05Å
205Y83.4Confident78.4Confident21 Ų2158.5 Ų58.58%0.08231%0.312CS..Hα-helixtrans-67.9-39.1-180-69.5-91.1000111.4V159 L163 A193 D196 S201 F202 Q207 Y208 W209V159-Y205 HydrophobicContact CG1-CE1 4.32Å; L163-Y205 HydrophobicContact CD1-CD1 3.7Å; L163-Y205 HydrophobicContact CD1-CE1 3.56Å; A193-Y205 HydrophobicContact CB-CD1 4.46Å; D196-Y205 HydrophobicContact CB-CD1 4.35Å; D196-Y205 HydrophobicContact CB-CE1 3.81Å; S201-Y205 WeakPolarHBondContact O-CD2 3.37Å; S201-Y205 WeakPolarHBondContact OG-CE2 3.25Å; F202-Y205 PolarHBondContact O-N 2.87Å; Y205-Q207 VanDerWaalsContact C-N 3.3Å; Y205-Q207 PolarHBondContact O-N 3.36Å; Y205-Y208 PolarHBondContact O-N 2.92Å; Y205-W209 WeakPolarHBondContact O-CB 3.39Å; Y205-W209 PolarHBondContact O-N 2.9Å
206I83.8Confident78.8Confident40 Ų4052.6 Ų52.621%0.20528%0.283CS..Hα-helixtrans-61.1-39.8173-67.9165.1000110.9L197 F202 W209 S210 Y264L197-I206 HydrophobicContact CD1-CG1 3.94Å; F202-I206 HydrophobicContact CB-CD1 4.06Å; F202-I206 WeakPolarHBondContact O-CB 3.45Å; F202-I206 WeakPolarHBondContact O-CD1 3.16Å; F202-I206 WeakPolarHBondContact O-CG1 3.49Å; F202-I206 PolarHBondContact O-N 3.43Å; I206-W209 PolarHBondContact O-N 3.47Å; I206-S210 WeakPolarHBondContact O-CB 3.46Å; I206-S210 PolarHBondContact O-N 3.36Å; I206-S210 PolarHBondContact O-OG 2.98Å; I206-Y264 HydrophobicContact CB-CD1 4.47Å; I206-Y264 HydrophobicContact CG1-CD1 3.94Å; I206-Y264 HydrophobicContact CG1-CE1 4.29Å
207Q86.5Confident79.6Confident109 Ų10950.8 Ų50.851%0.50927%0.274SS..Hα-helixtrans-63.9-46.4175.2-71.9175.74.800112.3D203 L204 Y205 W209 S210 I211D203-Q207 WeakPolarHBondContact O-CG 3.39Å; D203-Q207 PolarHBondContact O-N 3.39Å; D203-Q207 VanDerWaalsContact O-N 3.14Å; L204-Q207 WeakPolarHBondContact O-CB 3.33Å; L204-Q207 PolarHBondContact O-N 2.98Å; Y205-Q207 VanDerWaalsContact C-N 3.3Å; Y205-Q207 PolarHBondContact O-N 3.36Å; Q207-W209 VanDerWaalsContact C-N 3.3Å; Q207-W209 PolarHBondContact O-N 3.01Å; Q207-S210 WeakPolarHBondContact CA-OG 3.35Å; Q207-S210 PolarHBondContact O-N 2.9Å; Q207-S210 PolarHBondContact O-OG 3.22Å; Q207-I211 WeakPolarHBondContact O-CB 3.49Å; Q207-I211 WeakPolarHBondContact O-CD1 3.28Å; Q207-I211 VanDerWaalsContact O-CG1 3.26Å; Q207-I211 WeakPolarHBondContact O-CG1 3.4Å; Q207-I211 PolarHBondContact O-N 3.38Å
208Y86.6Confident80.7Confident36 Ų3650 Ų5014%0.14127%0.27CS..Hα-helixtrans-60.3-42175.3-81.1-71.8000112.1L160 L163 E164 K167 L204 Y205 S212L160-Y208 HydrophobicContact CD1-CE2 4.4Å; L163-Y208 HydrophobicContact CB-CD1 4.36Å; L163-Y208 HydrophobicContact CB-CD2 4.36Å; L163-Y208 HydrophobicContact CB-CE1 4.24Å; L163-Y208 HydrophobicContact CB-CE2 4.26Å; L163-Y208 HydrophobicContact CB-CG 4.43Å; L163-Y208 HydrophobicContact CD1-CD2 4.2Å; E164-Y208 PolarHBondContact OE2-OH 3.23Å; E164-Y208 VanDerWaalsContact OE2-OH 3.12Å; K167-Y208 HydrophobicContact CB-CE1 4.06Å; K167-Y208 HydrophobicContact CD-CE1 3.73Å; K167-Y208 HydrophobicContact CG-CE1 4.49Å; L204-Y208 WeakPolarHBondContact O-CD2 3.48Å; L204-Y208 PolarHBondContact O-N 3.05Å; Y205-Y208 PolarHBondContact O-N 2.92Å; Y208-S212 VanDerWaalsContact O-CB 3.29Å; Y208-S212 WeakPolarHBondContact O-CB 3.32Å; Y208-S212 PolarHBondContact O-N 3.29Å; Y208-S212 PolarHBondContact O-OG 3.43Å
209W87.6Confident81.8Confident4 Ų445.9 Ų45.92%0.01524%0.236CC..Hα-helixtrans-65.5-48.5179.2-165.9100.8000112.2A193 Y205 I206 Q207 I211 S212 E213 N261 Y264 L265A193-W209 HydrophobicContact CB-CB 4.37Å; Y205-W209 WeakPolarHBondContact O-CB 3.39Å; Y205-W209 PolarHBondContact O-N 2.9Å; I206-W209 PolarHBondContact O-N 3.47Å; Q207-W209 VanDerWaalsContact C-N 3.3Å; Q207-W209 PolarHBondContact O-N 3.01Å; W209-I211 PolarHBondContact O-N 3.42Å; W209-S212 WeakPolarHBondContact CA-OG 3.47Å; W209-S212 PolarHBondContact O-N 3.19Å; W209-S212 PolarHBondContact O-OG 3.3Å; W209-E213 HydrophobicContact CE3-CB 4.02Å; W209-E213 HydrophobicContact CH2-CB 4.22Å; W209-E213 HydrophobicContact CH2-CG 3.99Å; W209-E213 HydrophobicContact CZ3-CB 3.74Å; W209-E213 HydrophobicContact CZ3-CG 3.82Å; W209-E213 WeakPolarHBondContact O-CB 3.47Å; W209-E213 PolarHBondContact O-N 2.92Å; W209-N261 VanDerWaalsContact CH2-OD1 3.23Å; W209-N261 WeakPolarHBondContact CH2-OD1 3.46Å; W209-Y264 HydrophobicContact CB-CD1 3.99Å; W209-Y264 HydrophobicContact CB-CE1 4.48Å; W209-Y264 AromaticContact CD2-CD1 3.99Å; W209-Y264 HydrophobicContact CD2-CD1 3.99Å; W209-Y264 HydrophobicContact CD2-CD2 4.04Å; W209-Y264 AromaticContact CD2-CG 3.64Å; W209-Y264 HydrophobicContact CD2-CG 3.64Å; W209-Y264 AromaticContact CE2-CD2 3.92Å; W209-Y264 HydrophobicContact CE3-CD1 4.34Å; W209-Y264 HydrophobicContact CE3-CD2 4.3Å; W209-Y264 AromaticContact CE3-CG 3.74Å; W209-Y264 HydrophobicContact CE3-CG 3.74Å; W209-Y264 AromaticContact CG-CD1 3.83Å; W209-Y264 HydrophobicContact CG-CD1 3.83Å; W209-Y264 HydrophobicContact CG-CE1 4.25Å; W209-Y264 HydrophobicContact CG-CG 4.01Å; W209-Y264 HydrophobicContact CH2-CD2 4.36Å; W209-Y264 HydrophobicContact CZ2-CD2 4.09Å; W209-Y264 HydrophobicContact CZ2-CG 4.47Å; W209-Y264 VanDerWaalsContact CZ3-CB 3.41Å; W209-Y264 HydrophobicContact CZ3-CD2 4.45Å; W209-Y264 HydrophobicContact CZ3-CG 4.19Å; W209-L265 HydrophobicContact CZ3-CB 4.43Å; W209-L265 HydrophobicContact CZ3-CD1 4.36Å
210S85.8Confident83Confident25 Ų2540.9 Ų40.918%0.17521%0.21CC..Hα-helixtrans-63.1-44.3-179.154.80000112.2I206 Q207 E213 I214 Y264I206-S210 WeakPolarHBondContact O-CB 3.46Å; I206-S210 PolarHBondContact O-N 3.36Å; I206-S210 PolarHBondContact O-OG 2.98Å; Q207-S210 WeakPolarHBondContact CA-OG 3.35Å; Q207-S210 PolarHBondContact O-N 2.9Å; Q207-S210 PolarHBondContact O-OG 3.22Å; S210-E213 PolarHBondContact O-N 2.68Å; S210-I214 WeakPolarHBondContact O-CG1 3.43Å; S210-I214 PolarHBondContact O-N 3.3Å; S210-Y264 WeakPolarHBondContact CB-O 3.44Å
211I89.7Confident84.5Confident58 Ų5834.4 Ų34.430%0.29718%0.175SC..Hα-helixtrans-62.5-46.2176.7-68.2169.1000110.7Q207 W209 E213 I214 F215 Q303Q207-I211 WeakPolarHBondContact O-CB 3.49Å; Q207-I211 WeakPolarHBondContact O-CD1 3.28Å; Q207-I211 VanDerWaalsContact O-CG1 3.26Å; Q207-I211 WeakPolarHBondContact O-CG1 3.4Å; Q207-I211 PolarHBondContact O-N 3.38Å; W209-I211 PolarHBondContact O-N 3.42Å; I211-E213 VanDerWaalsContact C-N 3.29Å; I211-E213 PolarHBondContact O-N 2.84Å; I211-I214 PolarHBondContact O-N 2.96Å; I211-F215 HydrophobicContact CG2-CD2 3.7Å; I211-F215 HydrophobicContact CG2-CE2 3.6Å; I211-F215 VanDerWaalsContact O-CD2 3.23Å; I211-F215 WeakPolarHBondContact O-CD2 3.27Å; I211-F215 PolarHBondContact O-N 3.42Å; I211-F215 VanDerWaalsContact O-N 3.14Å; I211-Q303 PolarHBondContact O-NE2 3.36Å
212S88.3Confident85.6Confident1 Ų132 Ų321%0.00716%0.157CC..Hα-helixtrans-66-31.6179.553.50000112.6Q190 Y208 W209 F215 R216Q190-S212 WeakPolarHBondContact CG-OG 3.26Å; Y208-S212 VanDerWaalsContact O-CB 3.29Å; Y208-S212 WeakPolarHBondContact O-CB 3.32Å; Y208-S212 PolarHBondContact O-N 3.29Å; Y208-S212 PolarHBondContact O-OG 3.43Å; W209-S212 WeakPolarHBondContact CA-OG 3.47Å; W209-S212 PolarHBondContact O-N 3.19Å; W209-S212 PolarHBondContact O-OG 3.3Å; S212-F215 PolarHBondContact O-N 3.13Å; S212-R216 WeakPolarHBondContact O-CB 3.42Å; S212-R216 PolarHBondContact O-N 2.91Å
213E87Confident85.8Confident3 Ų327.3 Ų27.31%0.01414%0.139CC..Hα-helixtrans-66.6-45.2175.3-176.759.5-167.600112.5Q190 W209 S210 I211 F215 R216 V217 Q241 Y242 L265Q190-E213 VanDerWaalsContact NE2-N 3.19Å; Q190-E213 PolarHBondContact NE2-OE2 3.1Å; W209-E213 HydrophobicContact CE3-CB 4.02Å; W209-E213 HydrophobicContact CH2-CB 4.22Å; W209-E213 HydrophobicContact CH2-CG 3.99Å; W209-E213 HydrophobicContact CZ3-CB 3.74Å; W209-E213 HydrophobicContact CZ3-CG 3.82Å; W209-E213 WeakPolarHBondContact O-CB 3.47Å; W209-E213 PolarHBondContact O-N 2.92Å; S210-E213 PolarHBondContact O-N 2.68Å; I211-E213 VanDerWaalsContact C-N 3.29Å; I211-E213 PolarHBondContact O-N 2.84Å; E213-F215 VanDerWaalsContact C-N 3.35Å; E213-F215 PolarHBondContact O-N 2.87Å; E213-R216 PolarHBondContact O-N 2.78Å; E213-R216 IonicContact OE1-CZ 3.65Å; E213-R216 IonicContact OE1-NE 3.74Å; E213-R216 IonicContact OE1-NH2 2.71Å; E213-R216 PolarHBondContact OE1-NH2 3.41Å; E213-R216 IonicContact OE2-CZ 3.45Å; E213-R216 IonicContact OE2-NE 2.84Å; E213-R216 PolarHBondContact OE2-NE 3.06Å; E213-R216 IonicContact OE2-NH2 3.22Å; E213-R216 PolarHBondContact OE2-NH2 3.37Å; E213-V217 WeakPolarHBondContact O-CG2 3.37Å; E213-V217 PolarHBondContact O-N 3.36Å; E213-Q241 PolarHBondContact OE1-NE2 3.48Å; E213-Y242 WeakPolarHBondContact OE1-CE2 3.48Å; E213-Y242 PolarHBondContact OE1-OH 2.98Å; E213-L265 HydrophobicContact CB-CD1 4.28Å; E213-L265 HydrophobicContact CG-CD1 3.99Å
214I90Very high85.2Confident7 Ų724.6 Ų24.64%0.03612%0.123CC..Hα-helixtrans-59-49175.1-59.9162.5000109.9S210 I211 R216 V217 L218 L269 L273 Q303S210-I214 WeakPolarHBondContact O-CG1 3.43Å; S210-I214 PolarHBondContact O-N 3.3Å; I211-I214 PolarHBondContact O-N 2.96Å; I214-R216 PolarHBondContact O-N 3.21Å; I214-V217 PolarHBondContact O-N 3.04Å; I214-L218 HydrophobicContact CG2-CD1 3.86Å; I214-L218 HydrophobicContact CG2-CG 4.4Å; I214-L218 VanDerWaalsContact O-CG 3.29Å; I214-L218 WeakPolarHBondContact O-CG 3.48Å; I214-L218 PolarHBondContact O-N 3.13Å; I214-L269 HydrophobicContact CD1-CD2 3.83Å; I214-L269 HydrophobicContact CG1-CD2 4.11Å; I214-L273 HydrophobicContact CG1-CD1 4.3Å; I214-Q303 HydrophobicContact CG2-CB 4.39Å; I214-Q303 VanDerWaalsContact CG2-CD 3.49Å; I214-Q303 HydrophobicContact CG2-CG 3.92Å
215F90Very high83.8Confident0 Ų025 Ų250%013%0.131CC..Hα-helixtrans-61.6-42.9178.2-82-63.6000112.5Y171 L174 F186 I211 S212 E213 V217 L218 L219 E302 Q303 L306Y171-F215 HydrophobicContact CE1-CZ 4.46Å; L174-F215 HydrophobicContact CD1-CD1 4.14Å; L174-F215 HydrophobicContact CD1-CE1 3.58Å; L174-F215 HydrophobicContact CD1-CZ 3.96Å; F186-F215 HydrophobicContact CD1-CB 4.02Å; F186-F215 HydrophobicContact CD1-CD2 4.2Å; F186-F215 HydrophobicContact CD1-CG 4.42Å; F186-F215 HydrophobicContact CD2-CB 3.62Å; F186-F215 HydrophobicContact CD2-CG 4.23Å; F186-F215 HydrophobicContact CE1-CB 3.93Å; F186-F215 AromaticContact CE1-CD2 3.39Å; F186-F215 HydrophobicContact CE1-CD2 3.39Å; F186-F215 HydrophobicContact CE1-CE2 4.04Å; F186-F215 AromaticContact CE1-CG 3.83Å; F186-F215 HydrophobicContact CE1-CG 3.83Å; F186-F215 HydrophobicContact CE2-CB 3.52Å; F186-F215 AromaticContact CE2-CD1 3.98Å; F186-F215 HydrophobicContact CE2-CD1 3.98Å; F186-F215 HydrophobicContact CE2-CD2 4.01Å; F186-F215 AromaticContact CE2-CG 3.6Å; F186-F215 HydrophobicContact CE2-CG 3.6Å; F186-F215 HydrophobicContact CG-CB 3.88Å; F186-F215 HydrophobicContact CZ-CB 3.67Å; F186-F215 AromaticContact CZ-CD1 3.93Å; F186-F215 HydrophobicContact CZ-CD1 3.93Å; F186-F215 AromaticContact CZ-CD2 3.27Å; F186-F215 HydrophobicContact CZ-CD2 3.27Å; F186-F215 HydrophobicContact CZ-CE1 4.36Å; F186-F215 AromaticContact CZ-CE2 3.76Å; F186-F215 HydrophobicContact CZ-CE2 3.76Å; F186-F215 AromaticContact CZ-CG 3.36Å; F186-F215 HydrophobicContact CZ-CG 3.36Å; F186-F215 HydrophobicContact CZ-CZ 4.27Å; I211-F215 HydrophobicContact CG2-CD2 3.7Å; I211-F215 HydrophobicContact CG2-CE2 3.6Å; I211-F215 VanDerWaalsContact O-CD2 3.23Å; I211-F215 WeakPolarHBondContact O-CD2 3.27Å; I211-F215 PolarHBondContact O-N 3.42Å; I211-F215 VanDerWaalsContact O-N 3.14Å; S212-F215 PolarHBondContact O-N 3.13Å; E213-F215 VanDerWaalsContact C-N 3.35Å; E213-F215 PolarHBondContact O-N 2.87Å; F215-V217 VanDerWaalsContact C-N 3.35Å; F215-V217 PolarHBondContact O-N 3.04Å; F215-L218 PolarHBondContact O-N 3.09Å; F215-L219 HydrophobicContact CB-CD1 4.49Å; F215-L219 VanDerWaalsContact O-CB 3.24Å; F215-L219 WeakPolarHBondContact O-CB 3.42Å; F215-L219 WeakPolarHBondContact O-CG 3.04Å; F215-L219 PolarHBondContact O-N 2.93Å; F215-E302 HydrophobicContact CE1-CB 4.29Å; F215-E302 HydrophobicContact CZ-CB 4.09Å; F215-Q303 HydrophobicContact CD1-CG 3.73Å; F215-Q303 HydrophobicContact CD2-CG 4.17Å; F215-Q303 HydrophobicContact CE1-CB 4.29Å; F215-Q303 HydrophobicContact CE1-CG 3.39Å; F215-Q303 HydrophobicContact CE2-CG 3.88Å; F215-Q303 HydrophobicContact CG-CG 4.11Å; F215-Q303 HydrophobicContact CZ-CG 3.48Å; F215-Q303 VanDerWaalsContact CZ-CG 3.48Å; F215-L306 HydrophobicContact CD1-CD1 3.55Å; F215-L306 HydrophobicContact CE1-CD1 3.81Å
216R88.8Confident82.1Confident12 Ų1229.3 Ų29.35%0.04517%0.165CC..Hα-helixtrans-58.2-47.9178.1-173.4-172.671.991.65.8110.8L183 I187 Q190 S212 E213 I214 I220 D236 S238L183-R216 HydrophobicContact CD1-CB 4.35Å; L183-R216 HydrophobicContact CD1-CG 3.75Å; I187-R216 HydrophobicContact CG1-CG 4.23Å; Q190-R216 VanDerWaalsContact OE1-CD 3.29Å; S212-R216 WeakPolarHBondContact O-CB 3.42Å; S212-R216 PolarHBondContact O-N 2.91Å; E213-R216 PolarHBondContact O-N 2.78Å; E213-R216 IonicContact OE1-CZ 3.65Å; E213-R216 IonicContact OE1-NE 3.74Å; E213-R216 IonicContact OE1-NH2 2.71Å; E213-R216 PolarHBondContact OE1-NH2 3.41Å; E213-R216 IonicContact OE2-CZ 3.45Å; E213-R216 IonicContact OE2-NE 2.84Å; E213-R216 PolarHBondContact OE2-NE 3.06Å; E213-R216 IonicContact OE2-NH2 3.22Å; E213-R216 PolarHBondContact OE2-NH2 3.37Å; I214-R216 PolarHBondContact O-N 3.21Å; R216-I220 HydrophobicContact CG-CD1 3.82Å; R216-I220 WeakPolarHBondContact O-CB 3.18Å; R216-I220 WeakPolarHBondContact O-CD1 3.32Å; R216-I220 WeakPolarHBondContact O-CG1 3.48Å; R216-I220 PolarHBondContact O-N 3.08Å; R216-D236 PolarHBondContact NH1-O 3.17Å; R216-S238 PolarHBondContact NH1-O 3.31Å; R216-S238 VanDerWaalsContact NH1-O 3.09Å
217V86.3Confident80Confident0 Ų030.9 Ų30.90%017%0.168CC..Hα-helixtrans-60.7-51.6178.2174.90000110.9E213 I214 F215 L219 I220 L221 L239 Y242 L273 V277E213-V217 WeakPolarHBondContact O-CG2 3.37Å; E213-V217 PolarHBondContact O-N 3.36Å; I214-V217 PolarHBondContact O-N 3.04Å; F215-V217 VanDerWaalsContact C-N 3.35Å; F215-V217 PolarHBondContact O-N 3.04Å; V217-L219 PolarHBondContact O-N 3.34Å; V217-I220 PolarHBondContact O-N 2.75Å; V217-L221 HydrophobicContact CG1-CD1 4.33Å; V217-L221 WeakPolarHBondContact O-CG 3.49Å; V217-L221 PolarHBondContact O-N 3.29Å; V217-L221 VanDerWaalsContact O-N 3.09Å; V217-L239 HydrophobicContact CB-CD2 4.45Å; V217-L239 HydrophobicContact CG1-CD2 4.37Å; V217-L239 HydrophobicContact CG2-CD2 4.06Å; V217-Y242 HydrophobicContact CG2-CD2 4.14Å; V217-Y242 HydrophobicContact CG2-CE2 3.29Å; V217-L273 HydrophobicContact CG1-CD2 4.37Å; V217-V277 HydrophobicContact CG1-CG2 3.62Å
218L88.9Confident77.9Confident1 Ų133.9 Ų33.91%0.00518%0.175CC..Hα-helixtrans-61.9-43.7-178.6-65.6175.7000112.2I214 F215 L221 L222 F276 Q303 L306 I307 I310I214-L218 HydrophobicContact CG2-CD1 3.86Å; I214-L218 HydrophobicContact CG2-CG 4.4Å; I214-L218 VanDerWaalsContact O-CG 3.29Å; I214-L218 WeakPolarHBondContact O-CG 3.48Å; I214-L218 PolarHBondContact O-N 3.13Å; F215-L218 PolarHBondContact O-N 3.09Å; L218-L221 PolarHBondContact O-N 3.39Å; L218-L222 PolarHBondContact O-N 2.96Å; L218-F276 HydrophobicContact CD2-CD1 4.48Å; L218-F276 HydrophobicContact CD2-CE1 4.04Å; L218-Q303 HydrophobicContact CD1-CB 3.88Å; L218-Q303 HydrophobicContact CD1-CG 4.27Å; L218-L306 HydrophobicContact CB-CB 4.34Å; L218-L306 HydrophobicContact CB-CD1 4.31Å; L218-L306 HydrophobicContact CD1-CB 4.27Å; L218-I307 HydrophobicContact CD1-CD1 4.41Å; L218-I307 HydrophobicContact CD1-CG1 3.96Å; L218-I307 HydrophobicContact CD2-CD1 4.39Å; L218-I307 HydrophobicContact CD2-CG1 3.6Å; L218-I307 HydrophobicContact CG-CG1 4.45Å; L218-I310 HydrophobicContact CB-CD1 4.15Å; L218-I310 HydrophobicContact CD2-CD1 3.86Å; L218-I310 WeakPolarHBondContact O-CD1 3.33Å
219L87.4Confident75.8Confident0 Ų039.7 Ų39.70%021%0.208CC..Hα-helixtrans-67.1-37.6178.8-71.3169.6000112L174 W179 A182 L183 F186 F215 V217 L221 L222 C223 L306L174-L219 HydrophobicContact CD2-CD1 4.42Å; L174-L219 HydrophobicContact CD2-CD2 4Å; W179-L219 HydrophobicContact CB-CD2 4.23Å; W179-L219 HydrophobicContact CD2-CD2 4.48Å; W179-L219 HydrophobicContact CE3-CD2 3.79Å; A182-L219 HydrophobicContact CB-CD1 3.87Å; L183-L219 HydrophobicContact CB-CB 4.33Å; L183-L219 HydrophobicContact CB-CD1 4.3Å; L183-L219 HydrophobicContact CD1-CB 4.19Å; F186-L219 HydrophobicContact CD2-CD1 3.59Å; F186-L219 HydrophobicContact CE2-CD1 3.85Å; F215-L219 HydrophobicContact CB-CD1 4.49Å; F215-L219 VanDerWaalsContact O-CB 3.24Å; F215-L219 WeakPolarHBondContact O-CB 3.42Å; F215-L219 WeakPolarHBondContact O-CG 3.04Å; F215-L219 PolarHBondContact O-N 2.93Å; V217-L219 PolarHBondContact O-N 3.34Å; L219-L221 VanDerWaalsContact C-N 3.29Å; L219-L221 PolarHBondContact O-N 3.43Å; L219-L222 PolarHBondContact O-N 3.33Å; L219-C223 WeakPolarHBondContact O-CB 3.43Å; L219-C223 PolarHBondContact O-N 3.32Å; L219-C223 PolarHBondContact O-SG 3.12Å; L219-L306 HydrophobicContact CD2-CD1 4.15Å; L219-L306 HydrophobicContact CD2-CD2 4.1Å; L219-L306 HydrophobicContact CG-CD1 4.28Å
220I85.4Confident73.5Confident6 Ų647.9 Ų47.93%0.03124%0.239CC..Hα-helixtrans-63.8-38174.6-68.1164.2000110.8L183 R216 V217 M224 Y227 L239L183-I220 HydrophobicContact CD1-CD1 4.35Å; L183-I220 HydrophobicContact CD1-CG1 3.84Å; L183-I220 HydrophobicContact CD2-CG1 3.92Å; R216-I220 HydrophobicContact CG-CD1 3.82Å; R216-I220 WeakPolarHBondContact O-CB 3.18Å; R216-I220 WeakPolarHBondContact O-CD1 3.32Å; R216-I220 WeakPolarHBondContact O-CG1 3.48Å; R216-I220 PolarHBondContact O-N 3.08Å; V217-I220 PolarHBondContact O-N 2.75Å; I220-M224 WeakPolarHBondContact O-CB 3.34Å; I220-M224 WeakPolarHBondContact O-CG 3.44Å; I220-M224 PolarHBondContact O-N 3.26Å; I220-Y227 PolarHBondContact O-OH 3.47Å; I220-L239 HydrophobicContact CB-CD1 4.18Å; I220-L239 HydrophobicContact CB-CD2 4.43Å; I220-L239 HydrophobicContact CB-CG 4.35Å; I220-L239 HydrophobicContact CD1-CD2 3.88Å; I220-L239 HydrophobicContact CD1-CG 4.15Å; I220-L239 HydrophobicContact CG2-CD1 3.54Å; I220-L239 HydrophobicContact CG2-CD2 4.42Å; I220-L239 HydrophobicContact CG2-CG 3.81Å
221L84.4Confident71.2Confident7 Ų752 Ų524%0.03726%0.258CS..Hα-helixtrans-66.7-47.6176.4-65.6175.6000111.3V217 L218 L219 C223 M224 L239 F276 V277 H280 I310V217-L221 HydrophobicContact CG1-CD1 4.33Å; V217-L221 WeakPolarHBondContact O-CG 3.49Å; V217-L221 PolarHBondContact O-N 3.29Å; V217-L221 VanDerWaalsContact O-N 3.09Å; L218-L221 PolarHBondContact O-N 3.39Å; L219-L221 VanDerWaalsContact C-N 3.29Å; L219-L221 PolarHBondContact O-N 3.43Å; L221-C223 PolarHBondContact O-N 3.5Å; L221-M224 PolarHBondContact O-N 3.4Å; L221-L239 HydrophobicContact CD2-CD1 4.08Å; L221-F276 HydrophobicContact CD1-CD1 3.62Å; L221-F276 HydrophobicContact CD1-CE1 3.66Å; L221-V277 HydrophobicContact CD1-CG2 4.13Å; L221-V277 HydrophobicContact CD2-CG1 4.44Å; L221-V277 HydrophobicContact CD2-CG2 4.33Å; L221-H280 HydrophobicContact CD1-CB 4.45Å; L221-H280 HydrophobicContact CD2-CB 4.18Å; L221-I310 HydrophobicContact CB-CD1 4.09Å
222L84.4Confident68.9Low6 Ų654.5 Ų54.53%0.03128%0.278CS..Hα-helixtrans-62.4-44.3-178.8-172.275.3000112.7W179 L218 L219 M224 L306 L309 I310 E313W179-L222 HydrophobicContact CD2-CD2 3.65Å; W179-L222 HydrophobicContact CE3-CD2 4.1Å; W179-L222 HydrophobicContact CG-CD2 3.97Å; W179-L222 HydrophobicContact CH2-CD2 4.3Å; W179-L222 HydrophobicContact CZ2-CD2 3.89Å; W179-L222 HydrophobicContact CZ3-CD2 4.42Å; L218-L222 PolarHBondContact O-N 2.96Å; L219-L222 PolarHBondContact O-N 3.33Å; L222-M224 VanDerWaalsContact C-N 3.27Å; L222-M224 PolarHBondContact O-N 2.93Å; L222-L306 HydrophobicContact CD2-CD2 4.1Å; L222-L309 HydrophobicContact CD1-CB 3.85Å; L222-I310 HydrophobicContact CB-CG1 4Å; L222-I310 HydrophobicContact CD1-CG1 3.85Å; L222-E313 HydrophobicContact CD1-CG 4.5Å; L222-E313 WeakPolarHBondContact CD1-OE2 3.46Å
223C77.6Confident66.8Low19 Ų1961 Ų6113%0.12831%0.313CS..Hα-helixtrans-78.7-15.7-171.9-47.40000111.7W179 L219 L221 Y227W179-C223 WeakPolarHBondContact CB-SG 3.41Å; L219-C223 WeakPolarHBondContact O-CB 3.43Å; L219-C223 PolarHBondContact O-N 3.32Å; L219-C223 PolarHBondContact O-SG 3.12Å; L221-C223 PolarHBondContact O-N 3.5Å; C223-Y227 HydrophobicContact CB-CD1 4.31Å; C223-Y227 HydrophobicContact CB-CE1 3.19Å; C223-Y227 VanDerWaalsContact CB-OH 3.24Å; C223-Y227 WeakPolarHBondContact CB-OH 3.48Å; C223-Y227 WeakPolarHBondContact O-CE1 3.48Å
224M64.7Low65Low69 Ų6965.4 Ų65.434%0.3434%0.337SS..THydrogen-bonded Turntrans-83.892.2178.8-80.1-56.7-150.900111.1I220 L221 L222 Y227 L229I220-M224 WeakPolarHBondContact O-CB 3.34Å; I220-M224 WeakPolarHBondContact O-CG 3.44Å; I220-M224 PolarHBondContact O-N 3.26Å; L221-M224 PolarHBondContact O-N 3.4Å; L222-M224 VanDerWaalsContact C-N 3.27Å; L222-M224 PolarHBondContact O-N 2.93Å; M224-Y227 HydrophobicContact CE-CD2 3.78Å; M224-Y227 HydrophobicContact CE-CE2 3.45Å; M224-Y227 VanDerWaalsContact CE-CE2 3.45Å; M224-Y227 WeakPolarHBondContact CE-O 3.49Å; M224-Y227 HydrophobicContact CG-CE1 4.41Å; M224-Y227 HydrophobicContact CG-CE2 3.69Å; M224-Y227 VanDerWaalsContact CG-OH 3.31Å; M224-Y227 WeakPolarHBondContact CG-OH 3.27Å; M224-Y227 PolarHBondContact N-OH 3.18Å; M224-Y227 HydrophobicContact SD-CD1 4.43Å; M224-Y227 HydrophobicContact SD-CD2 3.52Å; M224-Y227 VanDerWaalsContact SD-CD2 3.52Å; M224-Y227 HydrophobicContact SD-CE1 4.12Å; M224-Y227 HydrophobicContact SD-CE2 3.16Å; M224-Y227 WeakPolarHBondContact SD-CE2 3.44Å; M224-Y227 HydrophobicContact SD-CG 4.13Å; M224-L229 HydrophobicContact CE-CG 4.48Å
225P52.4Low63.2Low100 Ų10070 Ų7065%0.64937%0.365SS*.THydrogen-bonded Turn-135.730.893.932.6-17.9000115.1
226S47.6Very low61.7Low113 Ų11373.1 Ų73.179%0.7938%0.382SS*.SBendtrans-123.3-13.8-176.2-65.60000118
227Y41.3Very low60.1Low73 Ų7376.5 Ų76.529%0.28640%0.395SS..SBendtrans-109.897.1165.950.3-80.1000108.9I220 C223 M224 L229I220-Y227 PolarHBondContact O-OH 3.47Å; C223-Y227 HydrophobicContact CB-CD1 4.31Å; C223-Y227 HydrophobicContact CB-CE1 3.19Å; C223-Y227 VanDerWaalsContact CB-OH 3.24Å; C223-Y227 WeakPolarHBondContact CB-OH 3.48Å; C223-Y227 WeakPolarHBondContact O-CE1 3.48Å; M224-Y227 HydrophobicContact CE-CD2 3.78Å; M224-Y227 HydrophobicContact CE-CE2 3.45Å; M224-Y227 VanDerWaalsContact CE-CE2 3.45Å; M224-Y227 WeakPolarHBondContact CE-O 3.49Å; M224-Y227 HydrophobicContact CG-CE1 4.41Å; M224-Y227 HydrophobicContact CG-CE2 3.69Å; M224-Y227 VanDerWaalsContact CG-OH 3.31Å; M224-Y227 WeakPolarHBondContact CG-OH 3.27Å; M224-Y227 PolarHBondContact N-OH 3.18Å; M224-Y227 HydrophobicContact SD-CD1 4.43Å; M224-Y227 HydrophobicContact SD-CD2 3.52Å; M224-Y227 VanDerWaalsContact SD-CD2 3.52Å; M224-Y227 HydrophobicContact SD-CE1 4.12Å; M224-Y227 HydrophobicContact SD-CE2 3.16Å; M224-Y227 WeakPolarHBondContact SD-CE2 3.44Å; M224-Y227 HydrophobicContact SD-CG 4.13Å; Y227-L229 PolarHBondContact O-N 3.31Å; Y227-L229 VanDerWaalsContact O-N 3.16Å
228R40.7Very low59Low172 Ų17278.6 Ų78.665%0.64941%0.41SS*.  trans-41.9130.9146.9-61.6-176.8-172.2169.3-2.4106.2R230R228-R230 HydrophobicContact CB-CB 4Å; R228-R230 HydrophobicContact CB-CG 3.75Å; R228-R230 PolarHBondContact O-N 3.26Å
229L43.3Very low57.9Low157 Ų15779.3 Ų79.382%0.82241%0.413SS*.SBend37.723.772.1-70160.8000112.4M224 Y227M224-L229 HydrophobicContact CE-CG 4.48Å; Y227-L229 PolarHBondContact O-N 3.31Å; Y227-L229 VanDerWaalsContact O-N 3.16Å
230R38.9Very low56.9Low177 Ų17786.3 Ų86.367%0.66844%0.444SS*.SBendtrans-106.2-12.3179.7-103.2-170.1-110.8-140.61.6112.2R228R228-R230 HydrophobicContact CB-CB 4Å; R228-R230 HydrophobicContact CB-CG 3.75Å; R228-R230 PolarHBondContact O-N 3.26Å
231N38.4Very low56.1Low110 Ų11088 Ų8859%0.58845%0.452SS*.  trans-125.197.8158.1-84-10.1000108.6D233 L234N231-D233 PolarHBondContact O-N 3.38Å; N231-D233 VanDerWaalsContact O-N 3.14Å; N231-L234 HydrophobicContact CB-CD1 4.41Å
232P42Very low55.3Low111 Ų11187.8 Ų87.872%0.72145%0.45SS*.THydrogen-bonded Turntrans-65-3169.327.2-32.3000113.3
233D43Very low54.2Low138 Ų13890 Ų9074%0.73846%0.462SS*.THydrogen-bonded Turntrans-91-4.7-171.6-58.3-23.3000114.8N231N231-D233 PolarHBondContact O-N 3.38Å; N231-D233 VanDerWaalsContact O-N 3.14Å
234L49.6Very low53.3Low96 Ų9693.5 Ų93.550%0.50348%0.479SS..  trans-102.991175.5-70.8154.6000109.5N231 D236 Y237N231-L234 HydrophobicContact CB-CD1 4.41Å; L234-D236 PolarHBondContact O-N 3.27Å; L234-Y237 HydrophobicContact CB-CD2 3.74Å; L234-Y237 HydrophobicContact CB-CE2 4.08Å; L234-Y237 HydrophobicContact CD1-CE2 4.25Å; L234-Y237 PolarHBondContact O-N 3Å
235T52.2Low52.5Low104 Ų10496.8 Ų96.864%0.63849%0.491SS*.G310 helixtrans-51-28.6179.343.20000113.9Y237 S238T235-Y237 VanDerWaalsContact C-N 3.33Å; T235-Y237 PolarHBondContact O-N 3.43Å; T235-S238 WeakPolarHBondContact O-CB 3.47Å; T235-S238 PolarHBondContact O-N 2.93Å; T235-S238 PolarHBondContact O-OG 2.94Å
236D57.3Low51.8Low65 Ų6597.5 Ų97.535%0.34849%0.493SS..G310 helixtrans-78-18.9-164.6-58.4-2.4000113.4I187 R216 L234 S238I187-D236 HydrophobicContact CD1-CB 4.44Å; I187-D236 HydrophobicContact CG2-CB 3.8Å; R216-D236 PolarHBondContact NH1-O 3.17Å; L234-D236 PolarHBondContact O-N 3.27Å; D236-S238 VanDerWaalsContact C-N 3.31Å
237Y56.7Low51.2Low83 Ų8398.2 Ų98.233%0.32549%0.488SS..G310 helixtrans-89.12.4176.4-64.4-86.6000113.3L183 T184 I187 L234 T235L183-Y237 HydrophobicContact CD2-CD1 3.69Å; L183-Y237 HydrophobicContact CD2-CE1 3.65Å; L183-Y237 HydrophobicContact CG-CD1 4.22Å; L183-Y237 HydrophobicContact CG-CE1 3.91Å; T184-Y237 WeakPolarHBondContact CG2-OH 3.45Å; I187-Y237 HydrophobicContact CD1-CD1 3.82Å; I187-Y237 HydrophobicContact CD1-CE1 3.54Å; I187-Y237 HydrophobicContact CD1-CE2 4.28Å; I187-Y237 HydrophobicContact CD1-CG 4.31Å; L234-Y237 HydrophobicContact CB-CD2 3.74Å; L234-Y237 HydrophobicContact CB-CE2 4.08Å; L234-Y237 HydrophobicContact CD1-CE2 4.25Å; L234-Y237 PolarHBondContact O-N 3Å; T235-Y237 VanDerWaalsContact C-N 3.33Å; T235-Y237 PolarHBondContact O-N 3.43Å
238S62Low50.9Low44 Ų44103.9 Ų103.931%0.30852%0.517SS..  trans-81.4133.2-175.573.20000111.7R216 T235 D236 K240R216-S238 PolarHBondContact NH1-O 3.31Å; R216-S238 VanDerWaalsContact NH1-O 3.09Å; T235-S238 WeakPolarHBondContact O-CB 3.47Å; T235-S238 PolarHBondContact O-N 2.93Å; T235-S238 PolarHBondContact O-OG 2.94Å; D236-S238 VanDerWaalsContact C-N 3.31Å; S238-K240 VanDerWaalsContact C-N 3.25Å
239L67.2Low51Low15 Ų15103 Ų1038%0.07952%0.521CS..  trans-9116.9167.4-68.6175.7000111.7V217 I220 L221 Q241 Y242 D243 V277V217-L239 HydrophobicContact CB-CD2 4.45Å; V217-L239 HydrophobicContact CG1-CD2 4.37Å; V217-L239 HydrophobicContact CG2-CD2 4.06Å; I220-L239 HydrophobicContact CB-CD1 4.18Å; I220-L239 HydrophobicContact CB-CD2 4.43Å; I220-L239 HydrophobicContact CB-CG 4.35Å; I220-L239 HydrophobicContact CD1-CD2 3.88Å; I220-L239 HydrophobicContact CD1-CG 4.15Å; I220-L239 HydrophobicContact CG2-CD1 3.54Å; I220-L239 HydrophobicContact CG2-CD2 4.42Å; I220-L239 HydrophobicContact CG2-CG 3.81Å; L221-L239 HydrophobicContact CD2-CD1 4.08Å; L239-Q241 PolarHBondContact O-N 2.81Å; L239-Y242 HydrophobicContact CD2-CD2 3.98Å; L239-Y242 HydrophobicContact CD2-CE2 4.38Å; L239-Y242 PolarHBondContact O-N 2.91Å; L239-D243 PolarHBondContact O-N 3.11Å; L239-V277 HydrophobicContact CD1-CG1 4.25Å
240K66.6Low51Low147 Ų147101.8 Ų101.864%0.63951%0.514SS*.THydrogen-bonded Turntrans-55.4-28-173.2-76.6175.4-178.1177.80113.5S238 Y242 D243S238-K240 VanDerWaalsContact C-N 3.25Å; K240-Y242 VanDerWaalsContact C-N 3.29Å; K240-Y242 PolarHBondContact O-N 3.25Å; K240-D243 WeakPolarHBondContact O-CB 3.36Å; K240-D243 PolarHBondContact O-N 3.47Å
241Q68Low51.2Low43 Ų4396.9 Ų96.920%0.20150%0.501CS..THydrogen-bonded Turntrans-71.5-20.5177.369-175.75.600114.1E213 L239 N261E213-Q241 PolarHBondContact OE1-NE2 3.48Å; L239-Q241 PolarHBondContact O-N 2.81Å; Q241-N261 PolarHBondContact OE1-ND2 3.34Å
242Y66.8Low51.6Low1 Ų198.5 Ų98.50%0.00451%0.505CS..THydrogen-bonded Turntrans-94.3-8.7175-64.7-72.7000111.9E213 V217 L239 K240 I244 F270 L273 Q274 V277E213-Y242 WeakPolarHBondContact OE1-CE2 3.48Å; E213-Y242 PolarHBondContact OE1-OH 2.98Å; V217-Y242 HydrophobicContact CG2-CD2 4.14Å; V217-Y242 HydrophobicContact CG2-CE2 3.29Å; L239-Y242 HydrophobicContact CD2-CD2 3.98Å; L239-Y242 HydrophobicContact CD2-CE2 4.38Å; L239-Y242 PolarHBondContact O-N 2.91Å; K240-Y242 VanDerWaalsContact C-N 3.29Å; K240-Y242 PolarHBondContact O-N 3.25Å; Y242-I244 PolarHBondContact O-N 3.33Å; Y242-F270 HydrophobicContact CD1-CE2 4.04Å; Y242-F270 HydrophobicContact CD1-CZ 4.31Å; Y242-F270 AromaticContact CE1-CD2 3.8Å; Y242-F270 HydrophobicContact CE1-CD2 3.8Å; Y242-F270 AromaticContact CE1-CE2 3.59Å; Y242-F270 HydrophobicContact CE1-CE2 3.59Å; Y242-F270 HydrophobicContact CE1-CZ 4.29Å; Y242-L273 HydrophobicContact CD1-CB 4.45Å; Y242-L273 HydrophobicContact CE1-CB 3.77Å; Y242-Q274 HydrophobicContact CD1-CB 3.94Å; Y242-Q274 WeakPolarHBondContact O-CG 3.37Å; Y242-Q274 PolarHBondContact O-NE2 2.92Å; Y242-V277 HydrophobicContact CG-CG2 4.43Å
243D61.4Low51.9Low52 Ų5298.8 Ų98.828%0.27850%0.5SS..SBendtrans-73.9117.5174.8-62.4-10.3000108.6L239 K240 K245 R281L239-D243 PolarHBondContact O-N 3.11Å; K240-D243 WeakPolarHBondContact O-CB 3.36Å; K240-D243 PolarHBondContact O-N 3.47Å; D243-K245 VanDerWaalsContact C-N 3.33Å; D243-K245 PolarHBondContact O-N 3.03Å; D243-R281 VanDerWaalsContact CG-NH1 3.32Å; D243-R281 IonicContact OD1-CZ 3.02Å; D243-R281 IonicContact OD1-NH1 2.62Å; D243-R281 PolarHBondContact OD1-NH1 3.11Å; D243-R281 IonicContact OD1-NH2 2.71Å; D243-R281 PolarHBondContact OD1-NH2 3.12Å; D243-R281 IonicContact OD2-NH1 3.62Å; D243-R281 IonicContact OD2-NH2 3.78Å
244I58.7Low52.3Low94 Ų9494.8 Ų94.848%0.48248%0.478SS..  trans-68.597.7168.6-52173.8000106.9Y242 V246 L278Y242-I244 PolarHBondContact O-N 3.33Å; I244-V246 HydrophobicContact CB-CG2 4.15Å; I244-V246 HydrophobicContact CG2-CB 4.4Å; I244-V246 HydrophobicContact CG2-CG2 3.33Å; I244-V246 PolarHBondContact O-N 3.29Å; I244-L278 HydrophobicContact CD1-CD1 3.35Å; I244-L278 HydrophobicContact CG1-CD1 3.82Å
245K47.5Very low52Low137 Ų13794.4 Ų94.460%0.59648%0.476SS*.  trans-71.591.3156.7-72.3-169.4179.8-173.20106.9D243 N247 L254D243-K245 VanDerWaalsContact C-N 3.33Å; D243-K245 PolarHBondContact O-N 3.03Å; K245-N247 PolarHBondContact O-N 3.36Å; K245-L254 HydrophobicContact CD-CD1 4.21Å
246V38.5Very low52Low115 Ų11595 Ų9570%0.69747%0.47SS*.  trans-64.5-12.9174.4177.20000111.6I244I244-V246 HydrophobicContact CB-CG2 4.15Å; I244-V246 HydrophobicContact CG2-CB 4.4Å; I244-V246 HydrophobicContact CG2-CG2 3.33Å; I244-V246 PolarHBondContact O-N 3.29Å
247N35.8Very low51.7Low128 Ų12893.5 Ų93.568%0.68447%0.465SS*.SBendtrans-125115.6-173.2-63.9-12.8000112.6K245K245-N247 PolarHBondContact O-N 3.36Å
248E35.4Very low51.3Low192 Ų19292.3 Ų92.390%0.89747%0.468SS*.SBendtrans35.483.4139.3-61.5-178.9169.100117
249E41.4Very low50.8Low155 Ų15593.9 Ų93.972%0.72448%0.476SS*.  trans167.393.9140.6-94.4173.6-165.600105.2N251E249-N251 PolarHBondContact O-N 2.85Å
250I43.4Very low50.1Low130 Ų13096.6 Ų96.667%0.66749%0.49SS*.  trans-69.189.1173.5-58.6175.2000106.4E252 L255I250-E252 PolarHBondContact O-N 2.85Å; I250-L255 HydrophobicContact CG2-CD1 3.4Å; I250-L255 VanDerWaalsContact CG2-CD1 3.4Å; I250-L255 HydrophobicContact CG2-CD2 3.77Å; I250-L255 HydrophobicContact CG2-CG 3.28Å
251N43.3Very low49.6Very low74 Ų7490.1 Ų90.140%0.39646%0.463SS..  trans-56.8128.9169-72.1-9.5000107.5E249 D253 L254 L255E249-N251 PolarHBondContact O-N 2.85Å; N251-D253 PolarHBondContact O-N 3.4Å; N251-L254 HydrophobicContact CB-CD1 4.25Å; N251-L254 HydrophobicContact CB-CG 4.5Å; N251-L254 WeakPolarHBondContact O-CA 3.43Å; N251-L254 WeakPolarHBondContact O-CB 3.39Å; N251-L254 PolarHBondContact O-N 3.12Å; N251-L255 PolarHBondContact O-N 2.82Å
252E46.8Very low49.1Very low144 Ų14492.3 Ų92.367%0.67348%0.483SS*.Hα-helixtrans-51.7-27.6178.8-70.3-173.5163.400112.7I250 L255 K256I250-E252 PolarHBondContact O-N 2.85Å; E252-L255 PolarHBondContact O-N 3.08Å; E252-K256 WeakPolarHBondContact O-CG 3.36Å; E252-K256 PolarHBondContact O-N 2.92Å
253D49.2Very low49Very low117 Ų11796.8 Ų96.863%0.62651%0.506SS*.Hα-helixtrans-68.4-33.5175.8-61.8-27000113.2N251 K256 S257N251-D253 PolarHBondContact O-N 3.4Å; D253-K256 PolarHBondContact O-N 2.87Å; D253-S257 WeakPolarHBondContact O-CB 3.48Å; D253-S257 PolarHBondContact O-N 2.84Å; D253-S257 PolarHBondContact O-OG 3.34Å
254L49.8Very low49.3Very low54 Ų5495.1 Ų95.128%0.28350%0.496SS..Hα-helixtrans-69.2-39.6173.9-77.1164.3000110.6K245 N251 S257 S258K245-L254 HydrophobicContact CD-CD1 4.21Å; N251-L254 HydrophobicContact CB-CD1 4.25Å; N251-L254 HydrophobicContact CB-CG 4.5Å; N251-L254 WeakPolarHBondContact O-CA 3.43Å; N251-L254 WeakPolarHBondContact O-CB 3.39Å; N251-L254 PolarHBondContact O-N 3.12Å; L254-S257 WeakPolarHBondContact CA-OG 3.45Å; L254-S257 PolarHBondContact O-N 3.06Å; L254-S257 PolarHBondContact O-OG 3.06Å; L254-S258 WeakPolarHBondContact O-CB 3.44Å; L254-S258 PolarHBondContact O-N 3.28Å; L254-S258 PolarHBondContact O-OG 3.05Å
255L45.1Very low50.1Low88 Ų8891.3 Ų91.346%0.46148%0.477SS..Hα-helixtrans-62.6-43.9173.2-74.3167.9000111.6I250 N251 E252 S257 S258 T259I250-L255 HydrophobicContact CG2-CD1 3.4Å; I250-L255 VanDerWaalsContact CG2-CD1 3.4Å; I250-L255 HydrophobicContact CG2-CD2 3.77Å; I250-L255 HydrophobicContact CG2-CG 3.28Å; N251-L255 PolarHBondContact O-N 2.82Å; E252-L255 PolarHBondContact O-N 3.08Å; L255-S257 VanDerWaalsContact C-N 3.34Å; L255-S257 PolarHBondContact O-N 3.48Å; L255-S258 WeakPolarHBondContact CA-OG 3.36Å; L255-S258 PolarHBondContact O-N 3.28Å; L255-S258 PolarHBondContact O-OG 2.89Å; L255-T259 WeakPolarHBondContact O-CB 3.32Å; L255-T259 VanDerWaalsContact O-CG2 3.23Å; L255-T259 WeakPolarHBondContact O-CG2 3.49Å; L255-T259 PolarHBondContact O-N 3.48Å; L255-T259 PolarHBondContact O-OG1 3.03Å
256K50.4Low51.7Low118 Ų11888.6 Ų88.651%0.51347%0.469SS..Hα-helixtrans-61-44.4175.2-71.6171.1-171.2164.50110.9E252 D253 T259 L260E252-K256 WeakPolarHBondContact O-CG 3.36Å; E252-K256 PolarHBondContact O-N 2.92Å; D253-K256 PolarHBondContact O-N 2.87Å; K256-T259 WeakPolarHBondContact CA-OG1 3.48Å; K256-T259 PolarHBondContact O-N 3.05Å; K256-T259 PolarHBondContact O-OG1 2.93Å; K256-L260 WeakPolarHBondContact O-CG 3.44Å; K256-L260 PolarHBondContact O-N 3.28Å
257S51.2Low53.8Low32 Ų3289.3 Ų89.322%0.22446%0.464CS..Hα-helixtrans-64.9-39.5176.873.90000113.2D253 L254 L255 L260 N261D253-S257 WeakPolarHBondContact O-CB 3.48Å; D253-S257 PolarHBondContact O-N 2.84Å; D253-S257 PolarHBondContact O-OG 3.34Å; L254-S257 WeakPolarHBondContact CA-OG 3.45Å; L254-S257 PolarHBondContact O-N 3.06Å; L254-S257 PolarHBondContact O-OG 3.06Å; L255-S257 VanDerWaalsContact C-N 3.34Å; L255-S257 PolarHBondContact O-N 3.48Å; S257-L260 PolarHBondContact O-N 2.89Å; S257-N261 PolarHBondContact O-N 3.43Å; S257-N261 PolarHBondContact O-ND2 3.47Å; S257-N261 PolarHBondContact O-OD1 2.99Å
258S49.6Very low56.1Low58 Ų5887.2 Ų87.241%0.40645%0.453SS..Hα-helixtrans-70-36.1176.863.70000111.8L254 L255 N261 S262L254-S258 WeakPolarHBondContact O-CB 3.44Å; L254-S258 PolarHBondContact O-N 3.28Å; L254-S258 PolarHBondContact O-OG 3.05Å; L255-S258 WeakPolarHBondContact CA-OG 3.36Å; L255-S258 PolarHBondContact O-N 3.28Å; L255-S258 PolarHBondContact O-OG 2.89Å; S258-N261 PolarHBondContact O-N 3.36Å; S258-S262 PolarHBondContact O-N 3.18Å
259T49.8Very low58.6Low77 Ų7778.7 Ų78.747%0.47241%0.413SS..Hα-helixtrans-66.4-40.2174.258.80000111.9L255 K256 S262 I263L255-T259 WeakPolarHBondContact O-CB 3.32Å; L255-T259 VanDerWaalsContact O-CG2 3.23Å; L255-T259 WeakPolarHBondContact O-CG2 3.49Å; L255-T259 PolarHBondContact O-N 3.48Å; L255-T259 PolarHBondContact O-OG1 3.03Å; K256-T259 WeakPolarHBondContact CA-OG1 3.48Å; K256-T259 PolarHBondContact O-N 3.05Å; K256-T259 PolarHBondContact O-OG1 2.93Å; T259-S262 PolarHBondContact O-N 3.5Å; T259-S262 PolarHBondContact O-OG 2.93Å; T259-I263 WeakPolarHBondContact O-CG1 3.36Å; T259-I263 PolarHBondContact O-N 3.42Å
260L52.9Low60.7Low72 Ų7273.1 Ų73.138%0.37739%0.387SS..Hα-helixtrans-60.5-50.3172.8-70.6168.4000110.1K256 S257 S262 I263 Y264K256-L260 WeakPolarHBondContact O-CG 3.44Å; K256-L260 PolarHBondContact O-N 3.28Å; S257-L260 PolarHBondContact O-N 2.89Å; L260-S262 PolarHBondContact O-N 2.84Å; L260-I263 WeakPolarHBondContact O-CB 3.19Å; L260-I263 PolarHBondContact O-N 3.29Å; L260-Y264 HydrophobicContact CB-CD2 4.4Å; L260-Y264 HydrophobicContact CB-CE2 4.16Å; L260-Y264 HydrophobicContact CD2-CE2 4.05Å; L260-Y264 WeakPolarHBondContact O-CD2 3.46Å; L260-Y264 PolarHBondContact O-N 2.84Å
261N56.9Low62.7Low12 Ų1270.3 Ų70.36%0.06437%0.372CS..Hα-helixtrans-61.6-32.3-179.5-65.3-9.8000113W209 Q241 S257 S258 I263 Y264 L265 F270W209-N261 VanDerWaalsContact CH2-OD1 3.23Å; W209-N261 WeakPolarHBondContact CH2-OD1 3.46Å; Q241-N261 PolarHBondContact OE1-ND2 3.34Å; S257-N261 PolarHBondContact O-N 3.43Å; S257-N261 PolarHBondContact O-ND2 3.47Å; S257-N261 PolarHBondContact O-OD1 2.99Å; S258-N261 PolarHBondContact O-N 3.36Å; N261-I263 PolarHBondContact O-N 3.31Å; N261-Y264 PolarHBondContact O-N 3Å; N261-L265 PolarHBondContact O-N 3.43Å; N261-F270 HydrophobicContact CB-CD2 4.49Å; N261-F270 HydrophobicContact CB-CE2 4.48Å
262S57.3Low64.8Low89 Ų8968 Ų6862%0.62236%0.36SS*.Hα-helixtrans-65.1-24.4174.775.70000113.8S258 T259 L260S258-S262 PolarHBondContact O-N 3.18Å; T259-S262 PolarHBondContact O-N 3.5Å; T259-S262 PolarHBondContact O-OG 2.93Å; L260-S262 PolarHBondContact O-N 2.84Å
263I63.6Low66.7Low95 Ų9561.1 Ų61.149%0.48733%0.328SS..Hα-helixtrans-81.8-35.6176.3-62.9164.5000110.3T259 L260 N261T259-I263 WeakPolarHBondContact O-CG1 3.36Å; T259-I263 PolarHBondContact O-N 3.42Å; L260-I263 WeakPolarHBondContact O-CB 3.19Å; L260-I263 PolarHBondContact O-N 3.29Å; N261-I263 PolarHBondContact O-N 3.31Å
264Y68.8Low68.5Low17 Ų1757.4 Ų57.47%0.06731%0.307CS..Hα-helixtrans-101.3-18.6-168.8-61.1-75.6000115.5L197 I206 W209 S210 L260 N261L197-Y264 HydrophobicContact CD1-CE1 4.11Å; L197-Y264 HydrophobicContact CD2-CE1 3.55Å; L197-Y264 WeakPolarHBondContact CD2-OH 3.43Å; L197-Y264 HydrophobicContact CG-CE1 4.24Å; I206-Y264 HydrophobicContact CB-CD1 4.47Å; I206-Y264 HydrophobicContact CG1-CD1 3.94Å; I206-Y264 HydrophobicContact CG1-CE1 4.29Å; W209-Y264 HydrophobicContact CB-CD1 3.99Å; W209-Y264 HydrophobicContact CB-CE1 4.48Å; W209-Y264 AromaticContact CD2-CD1 3.99Å; W209-Y264 HydrophobicContact CD2-CD1 3.99Å; W209-Y264 HydrophobicContact CD2-CD2 4.04Å; W209-Y264 AromaticContact CD2-CG 3.64Å; W209-Y264 HydrophobicContact CD2-CG 3.64Å; W209-Y264 AromaticContact CE2-CD2 3.92Å; W209-Y264 HydrophobicContact CE3-CD1 4.34Å; W209-Y264 HydrophobicContact CE3-CD2 4.3Å; W209-Y264 AromaticContact CE3-CG 3.74Å; W209-Y264 HydrophobicContact CE3-CG 3.74Å; W209-Y264 AromaticContact CG-CD1 3.83Å; W209-Y264 HydrophobicContact CG-CD1 3.83Å; W209-Y264 HydrophobicContact CG-CE1 4.25Å; W209-Y264 HydrophobicContact CG-CG 4.01Å; W209-Y264 HydrophobicContact CH2-CD2 4.36Å; W209-Y264 HydrophobicContact CZ2-CD2 4.09Å; W209-Y264 HydrophobicContact CZ2-CG 4.47Å; W209-Y264 VanDerWaalsContact CZ3-CB 3.41Å; W209-Y264 HydrophobicContact CZ3-CD2 4.45Å; W209-Y264 HydrophobicContact CZ3-CG 4.19Å; S210-Y264 WeakPolarHBondContact CB-O 3.44Å; L260-Y264 HydrophobicContact CB-CD2 4.4Å; L260-Y264 HydrophobicContact CB-CE2 4.16Å; L260-Y264 HydrophobicContact CD2-CE2 4.05Å; L260-Y264 WeakPolarHBondContact O-CD2 3.46Å; L260-Y264 PolarHBondContact O-N 2.84Å; N261-Y264 PolarHBondContact O-N 3Å
265L76Confident70.2Confident14 Ų1457 Ų577%0.07331%0.308CS..SBendtrans-135.9134.6-169.8-158.2126.2000111.3W209 E213 N261 H267 L269 F270 L273W209-L265 HydrophobicContact CZ3-CB 4.43Å; W209-L265 HydrophobicContact CZ3-CD1 4.36Å; E213-L265 HydrophobicContact CB-CD1 4.28Å; E213-L265 HydrophobicContact CG-CD1 3.99Å; N261-L265 PolarHBondContact O-N 3.43Å; L265-H267 PolarHBondContact O-N 3.08Å; L265-L269 HydrophobicContact CD1-CD2 4.11Å; L265-L269 HydrophobicContact CD1-CG 4.49Å; L265-L269 HydrophobicContact CD2-CB 3.89Å; L265-L269 HydrophobicContact CD2-CD2 4.17Å; L265-L269 HydrophobicContact CD2-CG 3.86Å; L265-L269 HydrophobicContact CG-CB 4.43Å; L265-L269 HydrophobicContact CG-CD2 3.95Å; L265-L269 HydrophobicContact CG-CG 4.21Å; L265-F270 HydrophobicContact CD2-CB 3.46Å; L265-F270 VanDerWaalsContact CD2-CB 3.46Å; L265-F270 HydrophobicContact CD2-CD2 4.27Å; L265-F270 HydrophobicContact CD2-CG 4.38Å; L265-L273 HydrophobicContact CD1-CD1 4.36Å
266D81.6Confident72.3Confident80 Ų8052.8 Ų52.843%0.42829%0.286SS..  trans-57.8134175.5179.923.4000110.1N268 L269 F270 Y298D266-N268 PolarHBondContact O-N 3.38Å; D266-L269 HydrophobicContact CB-CB 4.21Å; D266-L269 WeakPolarHBondContact O-CA 3.48Å; D266-L269 WeakPolarHBondContact O-CB 3.47Å; D266-L269 PolarHBondContact O-N 3.43Å; D266-F270 PolarHBondContact O-N 3.3Å; D266-Y298 WeakPolarHBondContact OD2-CE1 3.35Å
267H81.4Confident73.9Confident130 Ų13047.1 Ų47.160%0.60226%0.261SS*.Hα-helixtrans-56.8-38.6-175.2-174.766.1000112.1L265 F270 I271L265-H267 PolarHBondContact O-N 3.08Å; H267-F270 PolarHBondContact O-N 2.97Å; H267-I271 WeakPolarHBondContact NE2-CD1 3.37Å; H267-I271 WeakPolarHBondContact O-CG1 3.41Å; H267-I271 PolarHBondContact O-N 3.2Å; H267-I271 VanDerWaalsContact O-N 3.12Å
268N85.2Confident75.5Confident84 Ų8448.3 Ų48.345%0.44927%0.265SS..Hα-helixtrans-64.2-43.8176.5-64.7-42.8000111.7D266 F270 I271 L272D266-N268 PolarHBondContact O-N 3.38Å; N268-F270 VanDerWaalsContact C-N 3.3Å; N268-F270 PolarHBondContact O-N 3.28Å; N268-I271 PolarHBondContact O-N 3.18Å; N268-L272 VanDerWaalsContact O-CG 3.31Å; N268-L272 WeakPolarHBondContact O-CG 3.42Å; N268-L272 PolarHBondContact O-N 3.03Å
269L86.9Confident77.2Confident12 Ų1245.9 Ų45.96%0.06325%0.248CC..Hα-helixtrans-63.3-37.8176.7-179.759.2000111.4I214 L265 D266 L272 L273 L295 Y298I214-L269 HydrophobicContact CD1-CD2 3.83Å; I214-L269 HydrophobicContact CG1-CD2 4.11Å; L265-L269 HydrophobicContact CD1-CD2 4.11Å; L265-L269 HydrophobicContact CD1-CG 4.49Å; L265-L269 HydrophobicContact CD2-CB 3.89Å; L265-L269 HydrophobicContact CD2-CD2 4.17Å; L265-L269 HydrophobicContact CD2-CG 3.86Å; L265-L269 HydrophobicContact CG-CB 4.43Å; L265-L269 HydrophobicContact CG-CD2 3.95Å; L265-L269 HydrophobicContact CG-CG 4.21Å; D266-L269 HydrophobicContact CB-CB 4.21Å; D266-L269 WeakPolarHBondContact O-CA 3.48Å; D266-L269 WeakPolarHBondContact O-CB 3.47Å; D266-L269 PolarHBondContact O-N 3.43Å; L269-L272 PolarHBondContact O-N 3.1Å; L269-L273 HydrophobicContact CD1-CD1 4.34Å; L269-L273 HydrophobicContact CD1-CG 4.19Å; L269-L273 HydrophobicContact CG-CD1 4.21Å; L269-L273 HydrophobicContact CG-CG 4.49Å; L269-L273 WeakPolarHBondContact O-CB 3.46Å; L269-L273 WeakPolarHBondContact O-CG 3.14Å; L269-L273 PolarHBondContact O-N 3.1Å; L269-L295 HydrophobicContact CD1-CD2 3.96Å; L269-Y298 HydrophobicContact CB-CD1 4.26Å; L269-Y298 HydrophobicContact CD1-CG 4.13Å
270F84.8Confident78.8Confident39 Ų3943.8 Ų43.817%0.17123%0.233CC..Hα-helixtrans-62.2-47.9178.3-178.7-98.3000111Y242 N261 L265 D266 H267 N268 L273 Q274Y242-F270 HydrophobicContact CD1-CE2 4.04Å; Y242-F270 HydrophobicContact CD1-CZ 4.31Å; Y242-F270 AromaticContact CE1-CD2 3.8Å; Y242-F270 HydrophobicContact CE1-CD2 3.8Å; Y242-F270 AromaticContact CE1-CE2 3.59Å; Y242-F270 HydrophobicContact CE1-CE2 3.59Å; Y242-F270 HydrophobicContact CE1-CZ 4.29Å; N261-F270 HydrophobicContact CB-CD2 4.49Å; N261-F270 HydrophobicContact CB-CE2 4.48Å; L265-F270 HydrophobicContact CD2-CB 3.46Å; L265-F270 VanDerWaalsContact CD2-CB 3.46Å; L265-F270 HydrophobicContact CD2-CD2 4.27Å; L265-F270 HydrophobicContact CD2-CG 4.38Å; D266-F270 PolarHBondContact O-N 3.3Å; H267-F270 PolarHBondContact O-N 2.97Å; N268-F270 VanDerWaalsContact C-N 3.3Å; N268-F270 PolarHBondContact O-N 3.28Å; F270-L273 PolarHBondContact O-N 3.22Å; F270-Q274 WeakPolarHBondContact O-CB 3.43Å; F270-Q274 PolarHBondContact O-N 3.16Å
271I85.7Confident80.2Confident70 Ų7046.3 Ų46.336%0.35924%0.237SC..Hα-helixtrans-62.3-44.3177.9-67.5169.4000110.4H267 N268 L273 Q274 S275H267-I271 WeakPolarHBondContact NE2-CD1 3.37Å; H267-I271 WeakPolarHBondContact O-CG1 3.41Å; H267-I271 PolarHBondContact O-N 3.2Å; H267-I271 VanDerWaalsContact O-N 3.12Å; N268-I271 PolarHBondContact O-N 3.18Å; I271-L273 PolarHBondContact O-N 3.47Å; I271-Q274 WeakPolarHBondContact O-CB 3.35Å; I271-Q274 PolarHBondContact O-N 2.96Å; I271-S275 WeakPolarHBondContact O-CB 3.37Å; I271-S275 PolarHBondContact O-N 3.47Å; I271-S275 PolarHBondContact O-OG 2.87Å; I271-S275 VanDerWaalsContact O-OG 3.09Å
272L88.5Confident81.5Confident25 Ų2549.5 Ų49.513%0.13126%0.261CS..Hα-helixtrans-62.3-43.8178.7-72.4172.3000112N268 L269 Q274 S275 F276 L291 M294 L295 Y298N268-L272 VanDerWaalsContact O-CG 3.31Å; N268-L272 WeakPolarHBondContact O-CG 3.42Å; N268-L272 PolarHBondContact O-N 3.03Å; L269-L272 PolarHBondContact O-N 3.1Å; L272-Q274 VanDerWaalsContact C-N 3.35Å; L272-S275 PolarHBondContact O-N 3.49Å; L272-F276 VanDerWaalsContact O-CB 3.28Å; L272-F276 WeakPolarHBondContact O-CB 3.45Å; L272-F276 PolarHBondContact O-N 3.41Å; L272-L291 HydrophobicContact CD2-CD2 4.13Å; L272-M294 HydrophobicContact CD2-CB 3.89Å; L272-M294 HydrophobicContact CD2-SD 4.15Å; L272-L295 HydrophobicContact CB-CD2 3.61Å; L272-L295 HydrophobicContact CB-CG 4.24Å; L272-L295 HydrophobicContact CD1-CD2 4.23Å; L272-Y298 HydrophobicContact CD1-CD2 3.86Å; L272-Y298 HydrophobicContact CD1-CE2 3.7Å
273L86.8Confident82.7Confident1 Ų150.6 Ų50.61%0.00525%0.254CS..Hα-helixtrans-63.7-40.6175-72.6174.5000111.7I214 V217 Y242 L265 L269 F270 I271 F276 V277 L295I214-L273 HydrophobicContact CG1-CD1 4.3Å; V217-L273 HydrophobicContact CG1-CD2 4.37Å; Y242-L273 HydrophobicContact CD1-CB 4.45Å; Y242-L273 HydrophobicContact CE1-CB 3.77Å; L265-L273 HydrophobicContact CD1-CD1 4.36Å; L269-L273 HydrophobicContact CD1-CD1 4.34Å; L269-L273 HydrophobicContact CD1-CG 4.19Å; L269-L273 HydrophobicContact CG-CD1 4.21Å; L269-L273 HydrophobicContact CG-CG 4.49Å; L269-L273 WeakPolarHBondContact O-CB 3.46Å; L269-L273 WeakPolarHBondContact O-CG 3.14Å; L269-L273 PolarHBondContact O-N 3.1Å; F270-L273 PolarHBondContact O-N 3.22Å; I271-L273 PolarHBondContact O-N 3.47Å; L273-F276 PolarHBondContact O-N 3.2Å; L273-V277 VanDerWaalsContact O-CG2 3.29Å; L273-V277 WeakPolarHBondContact O-CG2 3.34Å; L273-V277 PolarHBondContact O-N 3.46Å; L273-L295 HydrophobicContact CD2-CD2 4.44Å
274Q85.5Confident83.8Confident39 Ų3949 Ų4918%0.18225%0.247CC..Hα-helixtrans-60.3-51.5175.8-174.1170.833.600111.5Y242 F270 I271 L272 F276 V277 L278Y242-Q274 HydrophobicContact CD1-CB 3.94Å; Y242-Q274 WeakPolarHBondContact O-CG 3.37Å; Y242-Q274 PolarHBondContact O-NE2 2.92Å; F270-Q274 WeakPolarHBondContact O-CB 3.43Å; F270-Q274 PolarHBondContact O-N 3.16Å; I271-Q274 WeakPolarHBondContact O-CB 3.35Å; I271-Q274 PolarHBondContact O-N 2.96Å; L272-Q274 VanDerWaalsContact C-N 3.35Å; Q274-F276 VanDerWaalsContact C-N 3.28Å; Q274-F276 PolarHBondContact O-N 3.25Å; Q274-V277 PolarHBondContact O-N 3.49Å; Q274-L278 HydrophobicContact CG-CD1 4.22Å; Q274-L278 VanDerWaalsContact O-CG 3.32Å; Q274-L278 WeakPolarHBondContact O-CG 3.49Å; Q274-L278 PolarHBondContact O-N 3.25Å
275S86.6Confident84.6Confident44 Ų4450.7 Ų50.731%0.30826%0.256SS..Hα-helixtrans-59.1-40.5176.4-62.50000111.5I271 L272 L278 A279I271-S275 WeakPolarHBondContact O-CB 3.37Å; I271-S275 PolarHBondContact O-N 3.47Å; I271-S275 PolarHBondContact O-OG 2.87Å; I271-S275 VanDerWaalsContact O-OG 3.09Å; L272-S275 PolarHBondContact O-N 3.49Å; S275-L278 PolarHBondContact O-N 3.45Å; S275-A279 WeakPolarHBondContact O-CB 3.39Å; S275-A279 PolarHBondContact O-N 3.32Å
276F88.1Confident85.3Confident0 Ų056.2 Ų56.20%029%0.285CS..Hα-helixtrans-64.4-43.7178.5-169.4-95.9000112.3L218 L221 L272 L273 Q274 L278 A279 H280 L288 L291 L295 I307 I310L218-F276 HydrophobicContact CD2-CD1 4.48Å; L218-F276 HydrophobicContact CD2-CE1 4.04Å; L221-F276 HydrophobicContact CD1-CD1 3.62Å; L221-F276 HydrophobicContact CD1-CE1 3.66Å; L272-F276 VanDerWaalsContact O-CB 3.28Å; L272-F276 WeakPolarHBondContact O-CB 3.45Å; L272-F276 PolarHBondContact O-N 3.41Å; L273-F276 PolarHBondContact O-N 3.2Å; Q274-F276 VanDerWaalsContact C-N 3.28Å; Q274-F276 PolarHBondContact O-N 3.25Å; F276-L278 VanDerWaalsContact C-N 3.31Å; F276-L278 PolarHBondContact O-N 3.3Å; F276-A279 PolarHBondContact O-N 3.07Å; F276-H280 WeakPolarHBondContact O-CB 3.49Å; F276-H280 PolarHBondContact O-N 2.87Å; F276-L288 HydrophobicContact CD2-CD2 3.94Å; F276-L288 HydrophobicContact CE1-CD2 4.48Å; F276-L288 HydrophobicContact CE2-CD2 3.71Å; F276-L288 HydrophobicContact CG-CD2 4.42Å; F276-L288 HydrophobicContact CZ-CD2 4Å; F276-L291 HydrophobicContact CD2-CB 3.97Å; F276-L295 HydrophobicContact CB-CD1 4.19Å; F276-L295 HydrophobicContact CD2-CD1 3.8Å; F276-L295 HydrophobicContact CE2-CD1 4.38Å; F276-L295 HydrophobicContact CG-CD1 4Å; F276-I307 HydrophobicContact CE2-CG2 4.26Å; F276-I307 HydrophobicContact CZ-CG2 4.13Å; F276-I310 HydrophobicContact CE1-CD1 4.28Å; F276-I310 HydrophobicContact CE1-CG2 4.4Å; F276-I310 HydrophobicContact CZ-CG2 4.33Å
277V85.6Confident85.6Confident0 Ų056.8 Ų56.80%029%0.285CS..Hα-helixtrans-61.5-40.2174.8171.10000111.2V217 L221 L239 Y242 L273 Q274 R281V217-V277 HydrophobicContact CG1-CG2 3.62Å; L221-V277 HydrophobicContact CD1-CG2 4.13Å; L221-V277 HydrophobicContact CD2-CG1 4.44Å; L221-V277 HydrophobicContact CD2-CG2 4.33Å; L239-V277 HydrophobicContact CD1-CG1 4.25Å; Y242-V277 HydrophobicContact CG-CG2 4.43Å; L273-V277 VanDerWaalsContact O-CG2 3.29Å; L273-V277 WeakPolarHBondContact O-CG2 3.34Å; L273-V277 PolarHBondContact O-N 3.46Å; Q274-V277 PolarHBondContact O-N 3.49Å; V277-R281 WeakPolarHBondContact O-CG 3.31Å; V277-R281 PolarHBondContact O-N 3.03Å; V277-R281 VanDerWaalsContact O-N 3.11Å
278L83.1Confident85.9Confident57 Ų5750.7 Ų50.730%0.29826%0.256SS..Hα-helixtrans-67.7-46.9178.2-67.4167000111.8I244 Q274 S275 F276 H280 R281 S282I244-L278 HydrophobicContact CD1-CD1 3.35Å; I244-L278 HydrophobicContact CG1-CD1 3.82Å; Q274-L278 HydrophobicContact CG-CD1 4.22Å; Q274-L278 VanDerWaalsContact O-CG 3.32Å; Q274-L278 WeakPolarHBondContact O-CG 3.49Å; Q274-L278 PolarHBondContact O-N 3.25Å; S275-L278 PolarHBondContact O-N 3.45Å; F276-L278 VanDerWaalsContact C-N 3.31Å; F276-L278 PolarHBondContact O-N 3.3Å; L278-H280 VanDerWaalsContact C-N 3.29Å; L278-H280 PolarHBondContact O-N 2.95Å; L278-R281 PolarHBondContact O-N 3.1Å; L278-R281 VanDerWaalsContact O-N 3.14Å; L278-S282 PolarHBondContact O-N 3.05Å; L278-S282 PolarHBondContact O-OG 3.41Å
279A85.2Confident86.1Confident6 Ų651.4 Ų51.45%0.0526%0.257CS..Hα-helixtrans-60.7-38.6177.100000111.8S275 F276 S282 K283 D284 E287 L288 L291S275-A279 WeakPolarHBondContact O-CB 3.39Å; S275-A279 PolarHBondContact O-N 3.32Å; F276-A279 PolarHBondContact O-N 3.07Å; A279-S282 WeakPolarHBondContact CA-OG 3.46Å; A279-S282 PolarHBondContact O-N 2.87Å; A279-S282 PolarHBondContact O-OG 3.33Å; A279-K283 PolarHBondContact O-N 3.29Å; A279-K283 VanDerWaalsContact O-N 3.1Å; A279-D284 PolarHBondContact O-N 2.99Å; A279-E287 HydrophobicContact CB-CB 4.09Å; A279-L288 HydrophobicContact CB-CD2 3.84Å; A279-L288 HydrophobicContact CB-CG 3.87Å; A279-L291 HydrophobicContact CB-CD1 3.85Å
280H85Confident86.3Confident33 Ų3352.9 Ų52.915%0.15327%0.269CS..Hα-helixtrans-62.6-44.1174-176-86.9000111.9L221 F276 L278 K283 L288 I310L221-H280 HydrophobicContact CD1-CB 4.45Å; L221-H280 HydrophobicContact CD2-CB 4.18Å; F276-H280 WeakPolarHBondContact O-CB 3.49Å; F276-H280 PolarHBondContact O-N 2.87Å; L278-H280 VanDerWaalsContact C-N 3.29Å; L278-H280 PolarHBondContact O-N 2.95Å; H280-K283 PolarHBondContact O-N 3.18Å; H280-L288 HydrophobicContact CB-CD2 4.07Å; H280-I310 VanDerWaalsContact CD2-CG2 3.43Å; H280-I310 WeakPolarHBondContact CD2-CG2 3.31Å
281R82.6Confident86.5Confident125 Ų12551.6 Ų51.647%0.47226%0.263SS..Hα-helixtrans-69.2-34.6179.1-74.4-179.4-179.1179.210.6113.4D243 V277 L278 K283D243-R281 VanDerWaalsContact CG-NH1 3.32Å; D243-R281 IonicContact OD1-CZ 3.02Å; D243-R281 IonicContact OD1-NH1 2.62Å; D243-R281 PolarHBondContact OD1-NH1 3.11Å; D243-R281 IonicContact OD1-NH2 2.71Å; D243-R281 PolarHBondContact OD1-NH2 3.12Å; D243-R281 IonicContact OD2-NH1 3.62Å; D243-R281 IonicContact OD2-NH2 3.78Å; V277-R281 WeakPolarHBondContact O-CG 3.31Å; V277-R281 PolarHBondContact O-N 3.03Å; V277-R281 VanDerWaalsContact O-N 3.11Å; L278-R281 PolarHBondContact O-N 3.1Å; L278-R281 VanDerWaalsContact O-N 3.14Å; R281-K283 PolarHBondContact O-N 3.44Å
282S83.6Confident86.6Confident79 Ų7949 Ų4955%0.55225%0.252SS*.Hα-helixtrans-77.1-6.8173.858.70000113.1L278 A279 D284L278-S282 PolarHBondContact O-N 3.05Å; L278-S282 PolarHBondContact O-OG 3.41Å; A279-S282 WeakPolarHBondContact CA-OG 3.46Å; A279-S282 PolarHBondContact O-N 2.87Å; A279-S282 PolarHBondContact O-OG 3.33Å; S282-D284 PolarHBondContact O-N 3.5Å
283K81.6Confident86.7Confident113 Ų11352.3 Ų52.349%0.49127%0.272SS..THydrogen-bonded Turntrans54.335.4-171.9-58.6-170.5172.5-158.80112.5A279 H280 R281 I285 T318A279-K283 PolarHBondContact O-N 3.29Å; A279-K283 VanDerWaalsContact O-N 3.1Å; H280-K283 PolarHBondContact O-N 3.18Å; R281-K283 PolarHBondContact O-N 3.44Å; K283-I285 PolarHBondContact O-N 3.32Å; K283-T318 HydrophobicContact CB-CG2 4.44Å; K283-T318 HydrophobicContact CD-CG2 4.41Å
284D86.9Confident86.8Confident62 Ų6256.6 Ų56.633%0.33229%0.294SS..  trans-86.397.6178.9-168.1-22.7000110.3A279 S282 I286 E287 L288A279-D284 PolarHBondContact O-N 2.99Å; S282-D284 PolarHBondContact O-N 3.5Å; D284-I286 VanDerWaalsContact C-N 3.31Å; D284-I286 PolarHBondContact O-N 2.97Å; D284-I286 PolarHBondContact OD1-N 3.47Å; D284-E287 HydrophobicContact CB-CB 4.26Å; D284-E287 PolarHBondContact OD1-N 3.25Å; D284-E287 WeakPolarHBondContact OD2-CG 3.48Å; D284-L288 WeakPolarHBondContact O-CB 3.16Å; D284-L288 WeakPolarHBondContact O-CD1 3.35Å; D284-L288 WeakPolarHBondContact O-CG 3.26Å; D284-L288 PolarHBondContact O-N 3.19Å
285I87.1Confident86.9Confident52 Ų5254.8 Ų54.827%0.26729%0.285SS..Hα-helixtrans-64-37.8-176.2-57.9164.6000111.2K283 L288 E289 V314 I315 T318K283-I285 PolarHBondContact O-N 3.32Å; I285-L288 PolarHBondContact O-N 2.8Å; I285-E289 HydrophobicContact CG2-CG 4.46Å; I285-E289 WeakPolarHBondContact O-CG 3.47Å; I285-E289 PolarHBondContact O-N 3.25Å; I285-V314 HydrophobicContact CG1-CG1 4.26Å; I285-I315 HydrophobicContact CG2-CG1 4.18Å; I285-T318 HydrophobicContact CD1-CG2 4.28Å; I285-T318 VanDerWaalsContact CD1-OG1 3.3Å; I285-T318 WeakPolarHBondContact CD1-OG1 3.23Å
286I88.8Confident87Confident130 Ų13057.1 Ų57.167%0.66729%0.291SS*.Hα-helixtrans-67.5-46-174.9-60.5172.7000109.5D284 E289 S290D284-I286 VanDerWaalsContact C-N 3.31Å; D284-I286 PolarHBondContact O-N 2.97Å; D284-I286 PolarHBondContact OD1-N 3.47Å; I286-E289 PolarHBondContact O-N 3.27Å; I286-S290 PolarHBondContact O-N 2.99Å
287E87.8Confident86.9Confident92 Ų9261.7 Ų61.743%0.4332%0.323SS..Hα-helixtrans-70-35.2176.8-69.7-59.7159.900112.2A279 D284 E289 S290 L291A279-E287 HydrophobicContact CB-CB 4.09Å; D284-E287 HydrophobicContact CB-CB 4.26Å; D284-E287 PolarHBondContact OD1-N 3.25Å; D284-E287 WeakPolarHBondContact OD2-CG 3.48Å; E287-E289 PolarHBondContact O-N 3.34Å; E287-S290 PolarHBondContact O-N 3.2Å; E287-S290 PolarHBondContact O-OG 3.29Å; E287-S290 PolarHBondContact OE2-OG 3.01Å; E287-L291 VanDerWaalsContact O-CB 3.25Å; E287-L291 WeakPolarHBondContact O-CB 3.46Å; E287-L291 WeakPolarHBondContact O-CD1 3.37Å; E287-L291 WeakPolarHBondContact O-CG 3.45Å; E287-L291 PolarHBondContact O-N 2.9Å
288L87.7Confident86.8Confident1 Ų166 Ų661%0.00534%0.34CS..Hα-helixtrans-62.1-42.8173.8-78.5170.7000112.3F276 A279 H280 D284 I285 S292 L311 V314F276-L288 HydrophobicContact CD2-CD2 3.94Å; F276-L288 HydrophobicContact CE1-CD2 4.48Å; F276-L288 HydrophobicContact CE2-CD2 3.71Å; F276-L288 HydrophobicContact CG-CD2 4.42Å; F276-L288 HydrophobicContact CZ-CD2 4Å; A279-L288 HydrophobicContact CB-CD2 3.84Å; A279-L288 HydrophobicContact CB-CG 3.87Å; H280-L288 HydrophobicContact CB-CD2 4.07Å; D284-L288 WeakPolarHBondContact O-CB 3.16Å; D284-L288 WeakPolarHBondContact O-CD1 3.35Å; D284-L288 WeakPolarHBondContact O-CG 3.26Å; D284-L288 PolarHBondContact O-N 3.19Å; I285-L288 PolarHBondContact O-N 2.8Å; L288-S292 VanDerWaalsContact O-CB 3.31Å; L288-S292 WeakPolarHBondContact O-CB 3.26Å; L288-S292 PolarHBondContact O-N 3.12Å; L288-L311 HydrophobicContact CB-CD2 3.64Å; L288-V314 HydrophobicContact CD1-CB 4.38Å; L288-V314 HydrophobicContact CD1-CG1 3.94Å; L288-V314 HydrophobicContact CD1-CG2 4.23Å
289E89.7Confident86.9Confident100 Ų10063.7 Ų63.747%0.46733%0.328SS..Hα-helixtrans-64.4-45.2175.8-75.4-175.4171.200111.4I285 I286 E287 L291 S292 V293 L311I285-E289 HydrophobicContact CG2-CG 4.46Å; I285-E289 WeakPolarHBondContact O-CG 3.47Å; I285-E289 PolarHBondContact O-N 3.25Å; I286-E289 PolarHBondContact O-N 3.27Å; E287-E289 PolarHBondContact O-N 3.34Å; E289-L291 PolarHBondContact O-N 3.1Å; E289-S292 PolarHBondContact O-N 3.27Å; E289-S292 PolarHBondContact O-OG 3.45Å; E289-V293 PolarHBondContact O-N 3.18Å; E289-L311 HydrophobicContact CG-CD2 4.41Å
290S90.9Very high87.1Confident43 Ų4365.5 Ų65.530%0.30134%0.337SS..Hα-helixtrans-61-46178.685.50000111.7I286 E287 S292 V293 M294I286-S290 PolarHBondContact O-N 2.99Å; E287-S290 PolarHBondContact O-N 3.2Å; E287-S290 PolarHBondContact O-OG 3.29Å; E287-S290 PolarHBondContact OE2-OG 3.01Å; S290-S292 VanDerWaalsContact C-N 3.34Å; S290-S292 PolarHBondContact O-N 2.96Å; S290-V293 PolarHBondContact O-N 2.53Å; S290-M294 PolarHBondContact O-N 3.41Å
291L89.5Confident87.2Confident12 Ų1269.3 Ų69.36%0.06336%0.358CS..Hα-helixtrans-67.1-34.9178.2-69.8166.3000111.9L272 F276 A279 E287 E289 V293 M294 L295L272-L291 HydrophobicContact CD2-CD2 4.13Å; F276-L291 HydrophobicContact CD2-CB 3.97Å; A279-L291 HydrophobicContact CB-CD1 3.85Å; E287-L291 VanDerWaalsContact O-CB 3.25Å; E287-L291 WeakPolarHBondContact O-CB 3.46Å; E287-L291 WeakPolarHBondContact O-CD1 3.37Å; E287-L291 WeakPolarHBondContact O-CG 3.45Å; E287-L291 PolarHBondContact O-N 2.9Å; E289-L291 PolarHBondContact O-N 3.1Å; L291-V293 VanDerWaalsContact C-N 3.29Å; L291-V293 PolarHBondContact O-N 3.46Å; L291-M294 HydrophobicContact CD2-CE 3.76Å; L291-M294 HydrophobicContact CG-CE 4.26Å; L291-M294 PolarHBondContact O-N 2.98Å; L291-L295 WeakPolarHBondContact O-CB 3.33Å; L291-L295 WeakPolarHBondContact O-CG 3.37Å; L291-L295 PolarHBondContact O-N 2.86Å
292S88.3Confident87.5Confident16 Ų1665.4 Ų65.411%0.11235%0.345CS..Hα-helixtrans-60.6-39.1175.580.60000112.1L288 E289 S290 Q296L288-S292 VanDerWaalsContact O-CB 3.31Å; L288-S292 WeakPolarHBondContact O-CB 3.26Å; L288-S292 PolarHBondContact O-N 3.12Å; E289-S292 PolarHBondContact O-N 3.27Å; E289-S292 PolarHBondContact O-OG 3.45Å; S290-S292 VanDerWaalsContact C-N 3.34Å; S290-S292 PolarHBondContact O-N 2.96Å; S292-Q296 VanDerWaalsContact O-CG 3.26Å; S292-Q296 WeakPolarHBondContact O-CG 3.37Å; S292-Q296 PolarHBondContact O-N 2.92Å
293V90.3Very high87.9Confident93 Ų9361.8 Ų61.856%0.56432%0.319SS*.Hα-helixtrans-68.3-43.5177.4175.90000110.6E289 S290 L291 L295 Q296E289-V293 PolarHBondContact O-N 3.18Å; S290-V293 PolarHBondContact O-N 2.53Å; L291-V293 VanDerWaalsContact C-N 3.29Å; L291-V293 PolarHBondContact O-N 3.46Å; V293-L295 VanDerWaalsContact C-N 3.35Å; V293-L295 PolarHBondContact O-N 3.22Å; V293-Q296 PolarHBondContact O-N 3.44Å
294M89.1Confident88.3Confident92 Ų9261.6 Ų61.645%0.45332%0.316SS..Hα-helixtrans-63.1-40.6177.7-69.4-171.4-95.500112.2L272 S290 L291 Q296 S297L272-M294 HydrophobicContact CD2-CB 3.89Å; L272-M294 HydrophobicContact CD2-SD 4.15Å; S290-M294 PolarHBondContact O-N 3.41Å; L291-M294 HydrophobicContact CD2-CE 3.76Å; L291-M294 HydrophobicContact CG-CE 4.26Å; L291-M294 PolarHBondContact O-N 2.98Å; M294-Q296 VanDerWaalsContact C-N 3.27Å; M294-Q296 PolarHBondContact O-N 3.49Å; M294-S297 PolarHBondContact O-OG 3.01Å
295L88.6Confident88.4Confident1 Ų163.3 Ų63.31%0.00532%0.322CS..Hα-helixtrans-65.8-23.4179.3-79.1170.2000113.5L269 L272 L273 F276 L291 V293 S297 Y298 V299 I307L269-L295 HydrophobicContact CD1-CD2 3.96Å; L272-L295 HydrophobicContact CB-CD2 3.61Å; L272-L295 HydrophobicContact CB-CG 4.24Å; L272-L295 HydrophobicContact CD1-CD2 4.23Å; L273-L295 HydrophobicContact CD2-CD2 4.44Å; F276-L295 HydrophobicContact CB-CD1 4.19Å; F276-L295 HydrophobicContact CD2-CD1 3.8Å; F276-L295 HydrophobicContact CE2-CD1 4.38Å; F276-L295 HydrophobicContact CG-CD1 4Å; L291-L295 WeakPolarHBondContact O-CB 3.33Å; L291-L295 WeakPolarHBondContact O-CG 3.37Å; L291-L295 PolarHBondContact O-N 2.86Å; V293-L295 VanDerWaalsContact C-N 3.35Å; V293-L295 PolarHBondContact O-N 3.22Å; L295-S297 PolarHBondContact O-N 2.87Å; L295-Y298 PolarHBondContact O-N 3.36Å; L295-V299 HydrophobicContact CB-CG2 4.16Å; L295-V299 HydrophobicContact CD2-CG2 4.38Å; L295-V299 VanDerWaalsContact O-CB 3.32Å; L295-V299 WeakPolarHBondContact O-CB 3.42Å; L295-V299 WeakPolarHBondContact O-CG2 3.31Å; L295-V299 PolarHBondContact O-N 3.4Å; L295-I307 HydrophobicContact CB-CD1 4.29Å; L295-I307 HydrophobicContact CD1-CD1 4.26Å
296Q87.1Confident88.5Confident92 Ų9261 Ų6143%0.4331%0.31SS..THydrogen-bonded Turntrans-55.6-34.4-175.3-62-174.23.200113.2S292 V293 M294 Y298 R304S292-Q296 VanDerWaalsContact O-CG 3.26Å; S292-Q296 WeakPolarHBondContact O-CG 3.37Å; S292-Q296 PolarHBondContact O-N 2.92Å; V293-Q296 PolarHBondContact O-N 3.44Å; M294-Q296 VanDerWaalsContact C-N 3.27Å; M294-Q296 PolarHBondContact O-N 3.49Å; Q296-Y298 PolarHBondContact O-N 2.75Å; Q296-R304 PolarHBondContact O-NE 2.93Å; Q296-R304 PolarHBondContact O-NH2 3.45Å
297S86.2Confident88.5Confident96 Ų9655.2 Ų55.267%0.67128%0.28SS*.THydrogen-bonded Turntrans-67.8-22.1-179.460.90000114.1M294 L295M294-S297 PolarHBondContact O-OG 3.01Å; L295-S297 PolarHBondContact O-N 2.87Å
298Y83.4Confident88.5Confident92 Ų9252.9 Ų52.936%0.36127%0.274SS..THydrogen-bonded Turntrans-104.3-10.5-176.2-64.6-83.6000113.9D266 L269 L272 L295 Q296D266-Y298 WeakPolarHBondContact OD2-CE1 3.35Å; L269-Y298 HydrophobicContact CB-CD1 4.26Å; L269-Y298 HydrophobicContact CD1-CG 4.13Å; L272-Y298 HydrophobicContact CD1-CD2 3.86Å; L272-Y298 HydrophobicContact CD1-CE2 3.7Å; L295-Y298 PolarHBondContact O-N 3.36Å; Q296-Y298 PolarHBondContact O-N 2.75Å
299V86.3Confident88.6Confident7 Ų755.1 Ų55.14%0.04229%0.286CS..  trans-119.9135.8-159.7176.10000110.4L295 Q303 R304 I307L295-V299 HydrophobicContact CB-CG2 4.16Å; L295-V299 HydrophobicContact CD2-CG2 4.38Å; L295-V299 VanDerWaalsContact O-CB 3.32Å; L295-V299 WeakPolarHBondContact O-CB 3.42Å; L295-V299 WeakPolarHBondContact O-CG2 3.31Å; L295-V299 PolarHBondContact O-N 3.4Å; V299-Q303 HydrophobicContact CB-CB 4.47Å; V299-Q303 HydrophobicContact CG1-CB 3.1Å; V299-Q303 HydrophobicContact CG1-CG 4.15Å; V299-Q303 VanDerWaalsContact CG1-OE1 3.32Å; V299-R304 HydrophobicContact CB-CG 4.44Å; V299-R304 HydrophobicContact CG1-CG 3.98Å; V299-R304 PolarHBondContact O-NE 3.02Å; V299-R304 PolarHBondContact O-NH2 2.99Å; V299-I307 HydrophobicContact CG1-CD1 4Å
300N87.9Confident88.4Confident44 Ų4450.4 Ų50.424%0.23526%0.264CS..  trans-74.7173.9179.270.112.9000112.3E302 Q303 R304N300-E302 VanDerWaalsContact C-N 3.33Å; N300-E302 VanDerWaalsContact CG-OE2 3.29Å; N300-E302 PolarHBondContact O-N 3.26Å; N300-E302 PolarHBondContact OD1-N 2.85Å; N300-E302 PolarHBondContact OD1-OE2 3.36Å; N300-Q303 PolarHBondContact O-N 3Å; N300-Q303 WeakPolarHBondContact OD1-CB 3.44Å; N300-Q303 WeakPolarHBondContact OD1-CG 3.48Å; N300-Q303 PolarHBondContact OD1-N 2.96Å; N300-Q303 PolarHBondContact OD1-OE1 3.01Å; N300-R304 VanDerWaalsContact O-CG 3.25Å; N300-R304 WeakPolarHBondContact O-CG 3.39Å; N300-R304 PolarHBondContact O-N 2.89Å
301L89Confident88.3Confident113 Ų11349.6 Ų49.659%0.59226%0.256SS*.Hα-helixtrans-59.8-43.9-174.8-178.663.4000112R304 E305L301-R304 WeakPolarHBondContact O-CB 3.44Å; L301-R304 PolarHBondContact O-N 3.33Å; L301-E305 PolarHBondContact O-N 3.37Å
302E88.6Confident88.2Confident44 Ų4456.8 Ų56.821%0.20628%0.282CS..Hα-helixtrans-70.2-37.4-175.5-56.890.4158.600111.9Y171 F215 N300 E305 L306Y171-E302 HydrophobicContact CD1-CG 4.17Å; Y171-E302 HydrophobicContact CE1-CB 4.22Å; Y171-E302 HydrophobicContact CE1-CG 3.71Å; Y171-E302 WeakPolarHBondContact CE1-OE1 3.48Å; F215-E302 HydrophobicContact CE1-CB 4.29Å; F215-E302 HydrophobicContact CZ-CB 4.09Å; N300-E302 VanDerWaalsContact C-N 3.33Å; N300-E302 VanDerWaalsContact CG-OE2 3.29Å; N300-E302 PolarHBondContact O-N 3.26Å; N300-E302 PolarHBondContact OD1-N 2.85Å; N300-E302 PolarHBondContact OD1-OE2 3.36Å; E302-E305 WeakPolarHBondContact O-CB 3.32Å; E302-E305 PolarHBondContact O-N 2.92Å; E302-L306 PolarHBondContact O-N 2.94Å; E302-L306 VanDerWaalsContact O-N 3.15Å
303Q90.5Very high88Confident3 Ų360 Ų601%0.01430%0.295CS..Hα-helixtrans-69.2-34.1172.9-68.5160.3-9.400111.5I211 I214 F215 L218 V299 N300 E305 L306 I307I211-Q303 PolarHBondContact O-NE2 3.36Å; I214-Q303 HydrophobicContact CG2-CB 4.39Å; I214-Q303 VanDerWaalsContact CG2-CD 3.49Å; I214-Q303 HydrophobicContact CG2-CG 3.92Å; F215-Q303 HydrophobicContact CD1-CG 3.73Å; F215-Q303 HydrophobicContact CD2-CG 4.17Å; F215-Q303 HydrophobicContact CE1-CB 4.29Å; F215-Q303 HydrophobicContact CE1-CG 3.39Å; F215-Q303 HydrophobicContact CE2-CG 3.88Å; F215-Q303 HydrophobicContact CG-CG 4.11Å; F215-Q303 HydrophobicContact CZ-CG 3.48Å; F215-Q303 VanDerWaalsContact CZ-CG 3.48Å; L218-Q303 HydrophobicContact CD1-CB 3.88Å; L218-Q303 HydrophobicContact CD1-CG 4.27Å; V299-Q303 HydrophobicContact CB-CB 4.47Å; V299-Q303 HydrophobicContact CG1-CB 3.1Å; V299-Q303 HydrophobicContact CG1-CG 4.15Å; V299-Q303 VanDerWaalsContact CG1-OE1 3.32Å; N300-Q303 PolarHBondContact O-N 3Å; N300-Q303 WeakPolarHBondContact OD1-CB 3.44Å; N300-Q303 WeakPolarHBondContact OD1-CG 3.48Å; N300-Q303 PolarHBondContact OD1-N 2.96Å; N300-Q303 PolarHBondContact OD1-OE1 3.01Å; Q303-E305 VanDerWaalsContact C-N 3.32Å; Q303-L306 WeakPolarHBondContact O-CB 3.5Å; Q303-L306 PolarHBondContact O-N 3.08Å; Q303-I307 WeakPolarHBondContact O-CG1 3.4Å; Q303-I307 PolarHBondContact O-N 3.22Å
304R89.9Confident87.6Confident109 Ų10956 Ų5641%0.41127%0.271SS..Hα-helixtrans-63.8-39172.7-70.2170.2-169-168.82111.6Q296 V299 N300 L301 L306 I307 S308Q296-R304 PolarHBondContact O-NE 2.93Å; Q296-R304 PolarHBondContact O-NH2 3.45Å; V299-R304 HydrophobicContact CB-CG 4.44Å; V299-R304 HydrophobicContact CG1-CG 3.98Å; V299-R304 PolarHBondContact O-NE 3.02Å; V299-R304 PolarHBondContact O-NH2 2.99Å; N300-R304 VanDerWaalsContact O-CG 3.25Å; N300-R304 WeakPolarHBondContact O-CG 3.39Å; N300-R304 PolarHBondContact O-N 2.89Å; L301-R304 WeakPolarHBondContact O-CB 3.44Å; L301-R304 PolarHBondContact O-N 3.33Å; R304-L306 VanDerWaalsContact C-N 3.34Å; R304-I307 PolarHBondContact O-N 3.13Å; R304-S308 PolarHBondContact O-N 3.31Å
305E89.8Confident87.3Confident98 Ų9855 Ų5546%0.45827%0.267SS..Hα-helixtrans-60.1-44.7173.4-71.6178.7174.700111L301 E302 Q303 I307 S308 L309L301-E305 PolarHBondContact O-N 3.37Å; E302-E305 WeakPolarHBondContact O-CB 3.32Å; E302-E305 PolarHBondContact O-N 2.92Å; Q303-E305 VanDerWaalsContact C-N 3.32Å; E305-I307 PolarHBondContact O-N 3.24Å; E305-S308 WeakPolarHBondContact O-CB 3.42Å; E305-S308 PolarHBondContact O-N 3.02Å; E305-S308 PolarHBondContact O-OG 3.08Å; E305-L309 WeakPolarHBondContact O-CG 3.48Å; E305-L309 PolarHBondContact O-N 3.39Å
306L89.2Confident86.8Confident4 Ų459.5 Ų59.52%0.02129%0.294CS..Hα-helixtrans-60.8-44.5174.4-69.6175.6000112.8L174 W179 F215 L218 L219 L222 E302 Q303 R304 S308 L309 I310L174-L306 HydrophobicContact CD2-CD1 4.1Å; L174-L306 HydrophobicContact CD2-CD2 4.32Å; W179-L306 HydrophobicContact CE3-CD2 4.08Å; W179-L306 HydrophobicContact CH2-CD2 3.84Å; W179-L306 HydrophobicContact CZ3-CD2 3.46Å; W179-L306 VanDerWaalsContact CZ3-CD2 3.46Å; F215-L306 HydrophobicContact CD1-CD1 3.55Å; F215-L306 HydrophobicContact CE1-CD1 3.81Å; L218-L306 HydrophobicContact CB-CB 4.34Å; L218-L306 HydrophobicContact CB-CD1 4.31Å; L218-L306 HydrophobicContact CD1-CB 4.27Å; L219-L306 HydrophobicContact CD2-CD1 4.15Å; L219-L306 HydrophobicContact CD2-CD2 4.1Å; L219-L306 HydrophobicContact CG-CD1 4.28Å; L222-L306 HydrophobicContact CD2-CD2 4.1Å; E302-L306 PolarHBondContact O-N 2.94Å; E302-L306 VanDerWaalsContact O-N 3.15Å; Q303-L306 WeakPolarHBondContact O-CB 3.5Å; Q303-L306 PolarHBondContact O-N 3.08Å; R304-L306 VanDerWaalsContact C-N 3.34Å; L306-S308 VanDerWaalsContact C-N 3.26Å; L306-S308 PolarHBondContact O-N 3.11Å; L306-L309 HydrophobicContact CD2-CD1 4.43Å; L306-L309 WeakPolarHBondContact O-CB 3.44Å; L306-L309 PolarHBondContact O-N 3.33Å; L306-L309 VanDerWaalsContact O-N 3.12Å; L306-I310 WeakPolarHBondContact O-CG1 3.48Å; L306-I310 PolarHBondContact O-N 3Å
307I88.8Confident86.2Confident8 Ų859.9 Ų59.94%0.04130%0.299CS..Hα-helixtrans-57.7-43.1175.1-68.1167.5000110.3L218 F276 L295 V299 Q303 R304 E305 L309 I310 L311L218-I307 HydrophobicContact CD1-CD1 4.41Å; L218-I307 HydrophobicContact CD1-CG1 3.96Å; L218-I307 HydrophobicContact CD2-CD1 4.39Å; L218-I307 HydrophobicContact CD2-CG1 3.6Å; L218-I307 HydrophobicContact CG-CG1 4.45Å; F276-I307 HydrophobicContact CE2-CG2 4.26Å; F276-I307 HydrophobicContact CZ-CG2 4.13Å; L295-I307 HydrophobicContact CB-CD1 4.29Å; L295-I307 HydrophobicContact CD1-CD1 4.26Å; V299-I307 HydrophobicContact CG1-CD1 4Å; Q303-I307 WeakPolarHBondContact O-CG1 3.4Å; Q303-I307 PolarHBondContact O-N 3.22Å; R304-I307 PolarHBondContact O-N 3.13Å; E305-I307 PolarHBondContact O-N 3.24Å; I307-L309 VanDerWaalsContact C-N 3.31Å; I307-L309 PolarHBondContact O-N 3.44Å; I307-I310 PolarHBondContact O-N 3.4Å; I307-L311 HydrophobicContact CG2-CD1 4.3Å; I307-L311 WeakPolarHBondContact O-CG 3.42Å; I307-L311 PolarHBondContact O-N 3.15Å
308S88.6Confident85.2Confident43 Ų4358.4 Ų58.430%0.30129%0.286SS..Hα-helixtrans-65-34178.281.30000113R304 E305 L306 R312R304-S308 PolarHBondContact O-N 3.31Å; E305-S308 WeakPolarHBondContact O-CB 3.42Å; E305-S308 PolarHBondContact O-N 3.02Å; E305-S308 PolarHBondContact O-OG 3.08Å; L306-S308 VanDerWaalsContact C-N 3.26Å; L306-S308 PolarHBondContact O-N 3.11Å; S308-R312 VanDerWaalsContact O-CG 3.29Å; S308-R312 WeakPolarHBondContact O-CG 3.45Å; S308-R312 PolarHBondContact O-N 3.19Å; S308-R312 VanDerWaalsContact O-N 3.14Å
309L88.5Confident84.1Confident48 Ų4860.9 Ų60.925%0.25132%0.317SS..Hα-helixtrans-68.5-44.4174.6-71.3170.8000111.2W179 L222 E305 L306 I307 L311 R312 E313W179-L309 HydrophobicContact CH2-CD1 3.68Å; W179-L309 HydrophobicContact CZ2-CD1 3.81Å; L222-L309 HydrophobicContact CD1-CB 3.85Å; E305-L309 WeakPolarHBondContact O-CG 3.48Å; E305-L309 PolarHBondContact O-N 3.39Å; L306-L309 HydrophobicContact CD2-CD1 4.43Å; L306-L309 WeakPolarHBondContact O-CB 3.44Å; L306-L309 PolarHBondContact O-N 3.33Å; L306-L309 VanDerWaalsContact O-N 3.12Å; I307-L309 VanDerWaalsContact C-N 3.31Å; I307-L309 PolarHBondContact O-N 3.44Å; L309-L311 PolarHBondContact O-N 3.48Å; L309-R312 WeakPolarHBondContact O-CB 3.49Å; L309-R312 PolarHBondContact O-N 3.44Å; L309-E313 PolarHBondContact O-N 3.14Å
310I86.5Confident83.9Confident1 Ų163.6 Ų63.61%0.00533%0.331CS..Hα-helixtrans-59-46.8176.1-65.4164.3000110.6L218 L221 L222 F276 H280 L306 I307 R312 E313 V314L218-I310 HydrophobicContact CB-CD1 4.15Å; L218-I310 HydrophobicContact CD2-CD1 3.86Å; L218-I310 WeakPolarHBondContact O-CD1 3.33Å; L221-I310 HydrophobicContact CB-CD1 4.09Å; L222-I310 HydrophobicContact CB-CG1 4Å; L222-I310 HydrophobicContact CD1-CG1 3.85Å; F276-I310 HydrophobicContact CE1-CD1 4.28Å; F276-I310 HydrophobicContact CE1-CG2 4.4Å; F276-I310 HydrophobicContact CZ-CG2 4.33Å; H280-I310 VanDerWaalsContact CD2-CG2 3.43Å; H280-I310 WeakPolarHBondContact CD2-CG2 3.31Å; L306-I310 WeakPolarHBondContact O-CG1 3.48Å; L306-I310 PolarHBondContact O-N 3Å; I307-I310 PolarHBondContact O-N 3.4Å; I310-R312 VanDerWaalsContact C-N 3.31Å; I310-R312 PolarHBondContact O-N 3.22Å; I310-E313 PolarHBondContact O-N 2.95Å; I310-V314 HydrophobicContact CG2-CG2 4.45Å; I310-V314 WeakPolarHBondContact O-CG2 3.2Å; I310-V314 PolarHBondContact O-N 3.28Å
311L87.6Confident83.7Confident26 Ų2664.6 Ų64.614%0.13634%0.336CS..Hα-helixtrans-58.3-43.6176.7-73.3172.7000111.8L288 E289 I307 L309 V314 I315L288-L311 HydrophobicContact CB-CD2 3.64Å; E289-L311 HydrophobicContact CG-CD2 4.41Å; I307-L311 HydrophobicContact CG2-CD1 4.3Å; I307-L311 WeakPolarHBondContact O-CG 3.42Å; I307-L311 PolarHBondContact O-N 3.15Å; L309-L311 PolarHBondContact O-N 3.48Å; L311-V314 PolarHBondContact O-N 2.84Å; L311-I315 WeakPolarHBondContact O-CB 3.44Å; L311-I315 WeakPolarHBondContact O-CD1 3.4Å; L311-I315 WeakPolarHBondContact O-CG1 3.33Å; L311-I315 PolarHBondContact O-N 3.38Å
312R87.2Confident83.4Confident162 Ų16261.9 Ų61.961%0.61132%0.322SS*.Hα-helixtrans-63.4-43.3177.7-74.2172.6-176.8173.84.1112.2S308 L309 I310 I315 V316S308-R312 VanDerWaalsContact O-CG 3.29Å; S308-R312 WeakPolarHBondContact O-CG 3.45Å; S308-R312 PolarHBondContact O-N 3.19Å; S308-R312 VanDerWaalsContact O-N 3.14Å; L309-R312 WeakPolarHBondContact O-CB 3.49Å; L309-R312 PolarHBondContact O-N 3.44Å; I310-R312 VanDerWaalsContact C-N 3.31Å; I310-R312 PolarHBondContact O-N 3.22Å; R312-I315 PolarHBondContact O-N 2.99Å; R312-V316 VanDerWaalsContact O-CG2 3.25Å; R312-V316 WeakPolarHBondContact O-CG2 3.48Å; R312-V316 PolarHBondContact O-N 3.36Å
313E84.4Confident83.1Confident84 Ų8463 Ų6339%0.39333%0.328SS..Hα-helixtrans-63.4-45.1177.8-74.1-173.7170.900111.7L222 L309 I310 I315 V316 D317L222-E313 HydrophobicContact CD1-CG 4.5Å; L222-E313 WeakPolarHBondContact CD1-OE2 3.46Å; L309-E313 PolarHBondContact O-N 3.14Å; I310-E313 PolarHBondContact O-N 2.95Å; E313-I315 PolarHBondContact O-N 3.13Å; E313-V316 PolarHBondContact O-N 2.97Å; E313-D317 WeakPolarHBondContact O-CB 3.38Å; E313-D317 PolarHBondContact O-N 3.5Å
314V82.6Confident82.7Confident9 Ų966.8 Ų66.86%0.05535%0.348CS..Hα-helixtrans-63.4-41.6177.5177.10000111.5I285 L288 I310 L311 D317 T318I285-V314 HydrophobicContact CG1-CG1 4.26Å; L288-V314 HydrophobicContact CD1-CB 4.38Å; L288-V314 HydrophobicContact CD1-CG1 3.94Å; L288-V314 HydrophobicContact CD1-CG2 4.23Å; I310-V314 HydrophobicContact CG2-CG2 4.45Å; I310-V314 WeakPolarHBondContact O-CG2 3.2Å; I310-V314 PolarHBondContact O-N 3.28Å; L311-V314 PolarHBondContact O-N 2.84Å; V314-D317 PolarHBondContact O-N 3.07Å; V314-T318 HydrophobicContact CG1-CG2 4.47Å; V314-T318 VanDerWaalsContact O-CG2 3.29Å; V314-T318 WeakPolarHBondContact O-CG2 3.43Å; V314-T318 PolarHBondContact O-N 3.15Å; V314-T318 PolarHBondContact O-OG1 3.18Å
315I81.9Confident82.2Confident71 Ų7163.9 Ų63.936%0.36434%0.344SS..Hα-helixtrans-61.4-46.8176.8-69.1163.5000110.4I285 L311 R312 E313 D317 T318 S319I285-I315 HydrophobicContact CG2-CG1 4.18Å; L311-I315 WeakPolarHBondContact O-CB 3.44Å; L311-I315 WeakPolarHBondContact O-CD1 3.4Å; L311-I315 WeakPolarHBondContact O-CG1 3.33Å; L311-I315 PolarHBondContact O-N 3.38Å; R312-I315 PolarHBondContact O-N 2.99Å; E313-I315 PolarHBondContact O-N 3.13Å; I315-D317 VanDerWaalsContact C-N 3.32Å; I315-D317 PolarHBondContact O-N 3.43Å; I315-T318 PolarHBondContact O-N 3.34Å; I315-T318 VanDerWaalsContact O-N 3.16Å; I315-T318 PolarHBondContact O-OG1 3.32Å; I315-S319 PolarHBondContact O-N 3.09Å; I315-S319 VanDerWaalsContact O-N 3.13Å; I315-S319 PolarHBondContact O-OG 3.07Å
316V79.5Confident81.7Confident96 Ų9661.5 Ų61.558%0.58234%0.336SS*.Hα-helixtrans-63.9-36.7178.8172.30000112R312 E313 T318 S319R312-V316 VanDerWaalsContact O-CG2 3.25Å; R312-V316 WeakPolarHBondContact O-CG2 3.48Å; R312-V316 PolarHBondContact O-N 3.36Å; E313-V316 PolarHBondContact O-N 2.97Å; V316-T318 PolarHBondContact O-N 2.82Å; V316-S319 PolarHBondContact O-OG 3.32Å; V316-S319 VanDerWaalsContact O-OG 3.09Å
317D73.5Confident81.1Confident99 Ų9965.9 Ų65.953%0.52936%0.36SS..Hα-helixtrans-72-14.3177.2-87.52.3000114.1E313 V314 I315E313-D317 WeakPolarHBondContact O-CB 3.38Å; E313-D317 PolarHBondContact O-N 3.5Å; V314-D317 PolarHBondContact O-N 3.07Å; I315-D317 VanDerWaalsContact C-N 3.32Å; I315-D317 PolarHBondContact O-N 3.43Å
318T66.4Low80.4Confident66 Ų6670.8 Ų70.841%0.40539%0.387SS..Hα-helixtrans-107.3-12.1-178.456.70000113.9K283 I285 V314 I315 V316K283-T318 HydrophobicContact CB-CG2 4.44Å; K283-T318 HydrophobicContact CD-CG2 4.41Å; I285-T318 HydrophobicContact CD1-CG2 4.28Å; I285-T318 VanDerWaalsContact CD1-OG1 3.3Å; I285-T318 WeakPolarHBondContact CD1-OG1 3.23Å; V314-T318 HydrophobicContact CG1-CG2 4.47Å; V314-T318 VanDerWaalsContact O-CG2 3.29Å; V314-T318 WeakPolarHBondContact O-CG2 3.43Å; V314-T318 PolarHBondContact O-N 3.15Å; V314-T318 PolarHBondContact O-OG1 3.18Å; I315-T318 PolarHBondContact O-N 3.34Å; I315-T318 VanDerWaalsContact O-N 3.16Å; I315-T318 PolarHBondContact O-OG1 3.32Å; V316-T318 PolarHBondContact O-N 2.82Å
319S58.6Low79.7Confident144 Ų14473.3 Ų73.3100%1.00739%0.394SS*.  trans-89.30173.964.20000112.5I315 V316I315-S319 PolarHBondContact O-N 3.09Å; I315-S319 VanDerWaalsContact O-N 3.13Å; I315-S319 PolarHBondContact O-OG 3.07Å; V316-S319 PolarHBondContact O-OG 3.32Å; V316-S319 VanDerWaalsContact O-OG 3.09Å

Retrieved 319 of 319 residues in 560.8 ms (Link to these results)

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